# Electronic Supplementary Material (ESI) for CrystEngComm.
# This journal is © The Royal Society of Chemistry 2014

#######################################################################
#
#                 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_ligand

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C60 H48 N18'
_chemical_formula_sum            'C60 H48 N18'
_chemical_formula_weight         1021.16

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'
N N 0.0061 0.0033 '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'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 21/c'

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

_cell_length_a                   10.0150(6)
_cell_length_b                   9.6680(6)
_cell_length_c                   26.3650(16)
_cell_angle_alpha                90.00
_cell_angle_beta                 97.999(5)
_cell_angle_gamma                90.00
_cell_volume                     2528.0(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    2683
_cell_measurement_theta_min      2.9646
_cell_measurement_theta_max      29.2164

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.39
_exptl_crystal_size_mid          0.35
_exptl_crystal_size_min          0.28
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.342
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1068
_exptl_absorpt_coefficient_mu    0.085
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.97728
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            10806
_diffrn_reflns_av_R_equivalents  0.0348
_diffrn_reflns_av_sigmaI/netI    0.0670
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       35
_diffrn_reflns_theta_min         2.97
_diffrn_reflns_theta_max         29.27
_reflns_number_total             5800
_reflns_number_gt                3129
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² 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/[σ²(Fo²)+(0.1267P)²+0.0000P] where P=(Fo²+2Fc²)/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     SHELXL
_refine_ls_extinction_coef       0.0050(17)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         5800
_refine_ls_number_parameters     353
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.1345
_refine_ls_R_factor_gt           0.0743
_refine_ls_wR_factor_ref         0.2410
_refine_ls_wR_factor_gt          0.1935
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_restrained_S_all      1.002
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.0748(2) 0.0315(3) -0.03891(10) 0.0402(6) Uani 1 1 d . . .
C2 C -0.0281(3) 0.1208(3) -0.02852(10) 0.0411(6) Uani 1 1 d . . .
C3 C -0.1027(2) 0.0876(3) 0.01076(11) 0.0429(7) Uani 1 1 d . . .
C4 C 0.1565(3) 0.0688(3) -0.08112(11) 0.0444(6) Uani 1 1 d . . .
H4A H 0.1906 -0.0150 -0.0950 0.053 Uiso 1 1 calc R . .
H4B H 0.0990 0.1154 -0.1085 0.053 Uiso 1 1 calc R . .
C5 C -0.0643(3) 0.2448(3) -0.06224(11) 0.0499(7) Uani 1 1 d . . .
H5A H -0.1113 0.3125 -0.0441 0.060 Uiso 1 1 calc R . .
H5B H 0.0170 0.2874 -0.0711 0.060 Uiso 1 1 calc R . .
C6 C -0.2162(3) 0.1807(3) 0.02157(11) 0.0479(7) Uani 1 1 d . . .
H6A H -0.2536 0.2278 -0.0097 0.057 Uiso 1 1 calc R . .
H6B H -0.2871 0.1253 0.0329 0.057 Uiso 1 1 calc R . .
C7 C 0.3269(3) 0.1792(3) -0.01342(11) 0.0539(7) Uani 1 1 d . . .
H7 H 0.2995 0.1412 0.0158 0.065 Uiso 1 1 calc R . .
C8 C 0.4328(3) 0.2656(3) -0.01503(12) 0.0534(7) Uani 1 1 d . . .
H8 H 0.4922 0.2992 0.0125 0.064 Uiso 1 1 calc R . .
C9 C 0.4335(3) 0.2932(3) -0.06664(11) 0.0450(7) Uani 1 1 d . . .
C10 C 0.5228(3) 0.3878(3) -0.08967(12) 0.0496(7) Uani 1 1 d . . .
C11 C 0.6224(3) 0.4441(3) -0.05784(12) 0.0454(7) Uani 1 1 d . . .
H11 H 0.6351 0.4220 -0.0232 0.054 Uiso 1 1 calc R . .
C12 C 0.7034(3) 0.5328(3) -0.07695(17) 0.0723(10) Uani 1 1 d . . .
H12 H 0.7737 0.5717 -0.0548 0.087 Uiso 1 1 calc R . .
C13 C 0.6895(4) 0.5700(4) -0.12704(19) 0.0805(12) Uani 1 1 d . . .
H13 H 0.7479 0.6330 -0.1390 0.097 Uiso 1 1 calc R . .
C14 C 0.5871(5) 0.5117(4) -0.15899(18) 0.0892(13) Uani 1 1 d . . .
H14 H 0.5746 0.5360 -0.1935 0.107 Uiso 1 1 calc R . .
C15 C -0.1351(3) 0.2226(4) -0.15745(13) 0.0631(9) Uani 1 1 d . . .
H15 H -0.0708 0.2790 -0.1692 0.076 Uiso 1 1 calc R . .
C16 C -0.2309(3) 0.1466(4) -0.18676(13) 0.0656(9) Uani 1 1 d . . .
H16 H -0.2449 0.1394 -0.2223 0.079 Uiso 1 1 calc R . .
C17 C -0.3035(3) 0.0817(3) -0.15199(12) 0.0528(7) Uani 1 1 d . . .
C18 C -0.4155(3) -0.0149(3) -0.16162(12) 0.0538(7) Uani 1 1 d . . .
C19 C -0.4500(3) -0.0547(4) -0.21006(12) 0.0653(9) Uani 1 1 d . . .
H19 H -0.4077 -0.0183 -0.2363 0.078 Uiso 1 1 calc R . .
C20 C -0.5476(5) -0.1487(5) -0.21936(16) 0.0980(14) Uani 1 1 d . . .
H20 H -0.5718 -0.1778 -0.2530 0.118 Uiso 1 1 calc R . .
C21 C -0.6145(4) -0.2053(4) -0.18237(15) 0.0780(10) Uani 1 1 d . . .
H21 H -0.6820 -0.2709 -0.1905 0.094 Uiso 1 1 calc R . .
C22 C -0.5788(3) -0.1622(4) -0.13360(15) 0.0697(9) Uani 1 1 d . . .
H22 H -0.6222 -0.1981 -0.1075 0.084 Uiso 1 1 calc R . .
C23 C -0.2154(3) 0.4126(3) 0.06524(13) 0.0526(7) Uani 1 1 d . . .
H23 H -0.2766 0.4593 0.0415 0.063 Uiso 1 1 calc R . .
C24 C -0.1560(3) 0.4623(3) 0.11068(12) 0.0526(7) Uani 1 1 d . . .
H24 H -0.1671 0.5496 0.1244 0.063 Uiso 1 1 calc R . .
C25 C -0.0740(3) 0.3547(3) 0.13292(11) 0.0452(7) Uani 1 1 d . . .
C26 C 0.0142(3) 0.3501(3) 0.18171(11) 0.0473(7) Uani 1 1 d . . .
C27 C 0.0254(3) 0.4686(3) 0.20867(11) 0.0497(7) Uani 1 1 d . . .
H27 H -0.0231 0.5472 0.1972 0.060 Uiso 1 1 calc R . .
C28 C 0.1088(4) 0.4684(4) 0.25235(15) 0.0815(11) Uani 1 1 d . . .
H28 H 0.1176 0.5500 0.2712 0.098 Uiso 1 1 calc R . .
C29 C 0.1826(4) 0.3569(5) 0.27167(15) 0.0798(11) Uani 1 1 d . . .
H29 H 0.2397 0.3620 0.3026 0.096 Uiso 1 1 calc R . .
C30 C 0.1692(4) 0.2375(4) 0.24365(14) 0.0714(10) Uani 1 1 d . . .
H30 H 0.2178 0.1594 0.2557 0.086 Uiso 1 1 calc R . .
N1 N 0.2691(2) 0.1586(2) -0.06179(8) 0.0434(5) Uani 1 1 d . . .
N2 N 0.3331(2) 0.2286(2) -0.09527(9) 0.0446(6) Uani 1 1 d . . .
N3 N 0.5016(4) 0.4175(3) -0.14150(14) 0.0903(10) Uani 1 1 d . . .
N4 N -0.1506(2) 0.2010(2) -0.10871(9) 0.0507(6) Uani 1 1 d . . .
N5 N -0.2536(2) 0.1139(2) -0.10430(9) 0.0515(6) Uani 1 1 d . . .
N6 N -0.4796(3) -0.0664(4) -0.12260(13) 0.0826(9) Uani 1 1 d . . .
N7 N -0.1698(2) 0.2827(2) 0.06062(9) 0.0448(6) Uani 1 1 d . . .
N8 N -0.0842(2) 0.2451(2) 0.10216(9) 0.0475(6) Uani 1 1 d . . .
N9 N 0.0850(3) 0.2316(3) 0.19811(13) 0.0795(9) Uani 1 1 d . . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 C3 1.377(4) 3 ?
C1 C2 1.401(4) . ?
C1 C4 1.513(4) . ?
C2 C3 1.396(4) . ?
C2 C5 1.506(4) . ?
C3 C1 1.377(4) 3 ?
C3 C6 1.508(4) . ?
C4 N1 1.458(3) . ?
C5 N4 1.460(4) . ?
C6 N7 1.454(4) . ?
C7 N1 1.340(4) . ?
C7 C8 1.356(4) . ?
C8 C9 1.387(4) . ?
C9 N2 1.326(4) . ?
C9 C10 1.468(4) . ?
C10 C11 1.328(4) . ?
C10 N3 1.383(5) . ?
C11 C12 1.327(4) . ?
C12 C13 1.357(6) . ?
C13 C14 1.356(6) . ?
C14 N3 1.373(5) . ?
C15 N4 1.332(4) . ?
C15 C16 1.360(5) . ?
C16 C17 1.396(4) . ?
C17 N5 1.324(4) . ?
C17 C18 1.455(4) . ?
C18 C19 1.333(4) . ?
C18 N6 1.379(4) . ?
C19 C20 1.332(5) . ?
C20 C21 1.372(6) . ?
C21 C22 1.352(5) . ?
C22 N6 1.360(5) . ?
C23 N7 1.348(3) . ?
C23 C24 1.350(4) . ?
C24 C25 1.402(4) . ?
C25 N8 1.330(3) . ?
C25 C26 1.457(4) . ?
C26 C27 1.344(4) . ?
C26 N9 1.385(4) . ?
C27 C28 1.325(5) . ?
C28 C29 1.365(6) . ?
C29 C30 1.367(5) . ?
C30 N9 1.369(5) . ?
N1 N2 1.344(3) . ?
N4 N5 1.349(3) . ?
N7 N8 1.344(3) . ?

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
C3 C1 C2 120.6(2) 3 . ?
C3 C1 C4 120.4(2) 3 . ?
C2 C1 C4 119.0(2) . . ?
C3 C2 C1 119.2(2) . . ?
C3 C2 C5 120.8(2) . . ?
C1 C2 C5 119.9(2) . . ?
C1 C3 C2 120.2(2) 3 . ?
C1 C3 C6 119.9(2) 3 . ?
C2 C3 C6 119.8(2) . . ?
N1 C4 C1 110.8(2) . . ?
N4 C5 C2 109.3(2) . . ?
N7 C6 C3 111.3(2) . . ?
N1 C7 C8 107.4(3) . . ?
C7 C8 C9 105.0(3) . . ?
N2 C9 C8 111.2(2) . . ?
N2 C9 C10 121.0(3) . . ?
C8 C9 C10 127.7(3) . . ?
C11 C10 N3 122.5(3) . . ?
C11 C10 C9 116.2(3) . . ?
N3 C10 C9 121.3(3) . . ?
C12 C11 C10 118.0(3) . . ?
C11 C12 C13 123.7(4) . . ?
C14 C13 C12 117.4(3) . . ?
C13 C14 N3 121.3(4) . . ?
N4 C15 C16 107.2(3) . . ?
C15 C16 C17 105.1(3) . . ?
N5 C17 C16 110.9(3) . . ?
N5 C17 C18 119.8(3) . . ?
C16 C17 C18 129.3(3) . . ?
C19 C18 N6 121.7(3) . . ?
C19 C18 C17 116.3(3) . . ?
N6 C18 C17 122.0(3) . . ?
C20 C19 C18 117.3(3) . . ?
C19 C20 C21 124.0(4) . . ?
C22 C21 C20 117.6(4) . . ?
C21 C22 N6 120.1(3) . . ?
N7 C23 C24 107.4(3) . . ?
C23 C24 C25 105.5(2) . . ?
N8 C25 C24 110.2(3) . . ?
N8 C25 C26 120.0(3) . . ?
C24 C25 C26 129.8(3) . . ?
C27 C26 N9 122.6(3) . . ?
C27 C26 C25 115.9(3) . . ?
N9 C26 C25 121.5(3) . . ?
C28 C27 C26 117.0(3) . . ?
C27 C28 C29 124.7(4) . . ?
C28 C29 C30 117.2(4) . . ?
C29 C30 N9 120.8(3) . . ?
C7 N1 N2 111.5(2) . . ?
C7 N1 C4 129.2(2) . . ?
N2 N1 C4 119.2(2) . . ?
C9 N2 N1 104.9(2) . . ?
C14 N3 C10 116.9(4) . . ?
C15 N4 N5 111.9(2) . . ?
C15 N4 C5 129.0(3) . . ?
N5 N4 C5 118.6(2) . . ?
C17 N5 N4 104.9(2) . . ?
C22 N6 C18 119.3(3) . . ?
N8 N7 C23 111.3(2) . . ?
N8 N7 C6 119.9(2) . . ?
C23 N7 C6 128.1(2) . . ?
C25 N8 N7 105.5(2) . . ?
C30 N9 C26 117.7(3) . . ?

_diffrn_measured_fraction_theta_max 0.841
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.983
_refine_diff_density_max         0.385
_refine_diff_density_min         -0.360
_refine_diff_density_rms         0.053
_database_code_depnum_ccdc_archive 'CCDC 984125'
#######################################################################
#
#                 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_crystal1

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C34 H28 Ag2 N10 O6'
_chemical_formula_sum            'C34 H28 Ag2 N10 O6'
_chemical_formula_weight         888.40

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   11.6530(6)
_cell_length_b                   12.1570(7)
_cell_length_c                   13.8700(8)
_cell_angle_alpha                67.552(5)
_cell_angle_beta                 89.980(6)
_cell_angle_gamma                69.718(5)
_cell_volume                     1683.55(16)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4693
_cell_measurement_theta_min      3.1789
_cell_measurement_theta_max      29.1313

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.19
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.753
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             888
_exptl_absorpt_coefficient_mu    1.226
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.76693
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            12008
_diffrn_reflns_av_R_equivalents  0.0167
_diffrn_reflns_av_sigmaI/netI    0.0319
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_theta_min         3.19
_diffrn_reflns_theta_max         29.19
_reflns_number_total             7666
_reflns_number_gt                5981
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² 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/[σ²(Fo²)+(0.0731P)²+2.7719P] where P=(Fo²+2Fc²)/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         7666
_refine_ls_number_parameters     495
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0638
_refine_ls_R_factor_gt           0.0486
_refine_ls_wR_factor_ref         0.1468
_refine_ls_wR_factor_gt          0.1333
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_restrained_S_all      1.031
_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
Ag1 Ag 0.71700(3) 0.66679(3) 0.55066(3) 0.05155(13) Uani 1 1 d . . .
Ag2 Ag 0.66732(4) 0.84969(4) 0.31780(3) 0.06075(14) Uani 1 1 d . . .
C1 C 0.4216(4) 1.0176(4) 0.4138(3) 0.0417(9) Uani 1 1 d . . .
C2 C 0.5011(4) 0.9126(3) 0.6014(3) 0.0415(9) Uani 1 1 d . . .
C3 C 0.4260(4) 0.9274(4) 0.5154(3) 0.0406(9) Uani 1 1 d . . .
C4 C 0.4865(5) 0.8365(4) 0.7133(4) 0.0538(11) Uani 1 1 d . . .
H4A H 0.5196 0.8642 0.7600 0.054(14) Uiso 1 1 calc R . .
H4B H 0.3987 0.8590 0.7169 0.063(16) Uiso 1 1 calc R . .
C5 C 0.3527(4) 0.8426(4) 0.5318(4) 0.0510(10) Uani 1 1 d . . .
H5A H 0.3651 0.7873 0.6062 0.063(15) Uiso 1 1 calc R . .
H5B H 0.2653 0.8955 0.5100 0.070(17) Uiso 1 1 calc R . .
C6 C 0.3207(4) 1.0567(5) 0.3253(4) 0.0538(11) Uani 1 1 d . . .
H6A H 0.2504 1.0415 0.3570 0.062(15) Uiso 1 1 calc R . .
H6B H 0.2948 1.1486 0.2850 0.046(12) Uiso 1 1 calc R . .
C7 C 0.5137(5) 0.6151(5) 0.8386(4) 0.0593(12) Uani 1 1 d . . .
H7 H 0.4453 0.6361 0.8721 0.076(18) Uiso 1 1 calc R . .
C8 C 0.6029(5) 0.4965(5) 0.8642(4) 0.0590(12) Uani 1 1 d . . .
H8 H 0.6076 0.4202 0.9188 0.054(13) Uiso 1 1 calc R . .
C9 C 0.6856(4) 0.5125(4) 0.7923(3) 0.0464(10) Uani 1 1 d . . .
C10 C 0.7928(4) 0.4130(4) 0.7813(3) 0.0487(10) Uani 1 1 d . . .
C11 C 0.8449(6) 0.2919(5) 0.8632(4) 0.0693(15) Uani 1 1 d . . .
H11 H 0.8161 0.2760 0.9278 0.09(2) Uiso 1 1 calc R . .
C12 C 0.9380(6) 0.1963(5) 0.8495(5) 0.0799(18) Uani 1 1 d . . .
H12 H 0.9729 0.1150 0.9041 0.09(2) Uiso 1 1 calc R . .
C13 C 0.9790(5) 0.2223(5) 0.7538(5) 0.0683(14) Uani 1 1 d . . .
H13 H 1.0419 0.1593 0.7414 0.068(16) Uiso 1 1 calc R . .
C14 C 0.9246(5) 0.3436(5) 0.6774(4) 0.0605(12) Uani 1 1 d . . .
H14 H 0.9526 0.3610 0.6124 0.060(15) Uiso 1 1 calc R . .
C15 C 0.3174(4) 0.7388(5) 0.4147(4) 0.0568(12) Uani 1 1 d . . .
H15 H 0.2314 0.7705 0.4052 0.09(2) Uiso 1 1 calc R . .
C16 C 0.3911(4) 0.6593(5) 0.3738(4) 0.0548(11) Uani 1 1 d . . .
H16 H 0.3667 0.6253 0.3313 0.066(16) Uiso 1 1 calc R . .
C17 C 0.5121(4) 0.6394(4) 0.4094(3) 0.0404(9) Uani 1 1 d . . .
C18 C 0.6286(4) 0.5655(4) 0.3865(3) 0.0420(9) Uani 1 1 d . . .
C19 C 0.6319(5) 0.4927(5) 0.3292(4) 0.0590(12) Uani 1 1 d . . .
H19 H 0.5592 0.4897 0.3048 0.054(14) Uiso 1 1 calc R . .
C20 C 0.7454(6) 0.4243(6) 0.3086(5) 0.0742(16) Uani 1 1 d . . .
H20 H 0.7496 0.3757 0.2697 0.12(3) Uiso 1 1 calc R . .
C21 C 0.8497(6) 0.4300(5) 0.3464(5) 0.0717(15) Uani 1 1 d . . .
H21 H 0.9270 0.3832 0.3358 0.09(2) Uiso 1 1 calc R . .
C22 C 0.8391(5) 0.5053(5) 0.4003(5) 0.0641(13) Uani 1 1 d . . .
H22 H 0.9110 0.5101 0.4244 0.080(19) Uiso 1 1 calc R . .
C23 C 0.2596(5) 1.0040(6) 0.1813(5) 0.0672(14) Uani 1 1 d . . .
H23 H 0.1743 1.0423 0.1766 0.063(15) Uiso 1 1 calc R . .
C24 C 0.3201(5) 0.9454(6) 0.1191(4) 0.0646(14) Uani 1 1 d . . .
H24 H 0.2853 0.9359 0.0640 0.080(18) Uiso 1 1 calc R . .
C25 C 0.4454(4) 0.9032(4) 0.1564(3) 0.0459(10) Uani 1 1 d . . .
C26 C 0.5519(4) 0.8332(4) 0.1193(3) 0.0460(10) Uani 1 1 d . . .
C27 C 0.5372(6) 0.8019(6) 0.0348(4) 0.0682(14) Uani 1 1 d . . .
H27 H 0.4586 0.8242 0.0009 0.08(2) Uiso 1 1 calc R . .
C28 C 0.6410(7) 0.7375(7) 0.0021(5) 0.091(2) Uani 1 1 d . . .
H28 H 0.6330 0.7163 -0.0546 0.09(2) Uiso 1 1 calc R . .
C29 C 0.7550(7) 0.7050(7) 0.0531(5) 0.090(2) Uani 1 1 d . . .
H29 H 0.8262 0.6614 0.0322 0.10(2) Uiso 1 1 calc R . .
C30 C 0.7626(6) 0.7386(6) 0.1377(5) 0.0716(15) Uani 1 1 d . . .
H30 H 0.8404 0.7168 0.1727 0.071(17) Uiso 1 1 calc R . .
C31 C 0.8536(3) 0.8611(4) 0.4705(3) 0.0372(8) Uani 1 1 d . . .
C32 C 0.9330(3) 0.9305(4) 0.4854(3) 0.0334(7) Uani 1 1 d . . .
C33 C 0.9823(3) 0.9059(4) 0.5859(3) 0.0370(8) Uani 1 1 d . . .
H33 H 0.9711 0.8422 0.6444 0.034(10) Uiso 1 1 calc R . .
C34 C 0.9518(3) 1.0244(4) 0.4004(3) 0.0378(8) Uani 1 1 d . . .
H34 H 0.9198 1.0414 0.3326 0.058(14) Uiso 1 1 calc R . .
N1 N 0.5448(4) 0.6965(3) 0.7543(3) 0.0493(9) Uani 1 1 d . . .
N2 N 0.6491(4) 0.6359(3) 0.7250(3) 0.0483(8) Uani 1 1 d . . .
N3 N 0.8341(4) 0.4392(4) 0.6887(3) 0.0509(9) Uani 1 1 d . . .
N4 N 0.3907(3) 0.7639(3) 0.4714(3) 0.0441(8) Uani 1 1 d . . .
N5 N 0.5111(3) 0.7024(3) 0.4704(3) 0.0410(7) Uani 1 1 d . . .
N6 N 0.7311(3) 0.5731(4) 0.4208(3) 0.0490(8) Uani 1 1 d . . .
N7 N 0.3470(3) 0.9959(4) 0.2512(3) 0.0494(9) Uani 1 1 d . . .
N8 N 0.4609(3) 0.9346(3) 0.2367(3) 0.0431(8) Uani 1 1 d . . .
N9 N 0.6642(4) 0.8001(4) 0.1702(3) 0.0524(9) Uani 1 1 d . . .
N10 N 0.7996(9) 1.1532(10) 0.1275(5) 0.140(4) Uani 1 1 d . . .
O1 O 0.8459(3) 0.7716(3) 0.5478(3) 0.0618(9) Uani 1 1 d . . .
O2 O 0.7962(3) 0.9068(4) 0.3789(3) 0.0610(9) Uani 1 1 d . . .
O3 O 0.9102(7) 1.1005(6) 0.1247(5) 0.143(3) Uani 1 1 d . . .
O4 O 0.7770(10) 1.2482(10) 0.1482(8) 0.233(6) Uani 1 1 d . . .
O5 O 0.7228(12) 1.130(2) 0.1039(9) 0.290(10) Uani 1 1 d . . .
O1W O 0.0226(12) 0.3009(17) 0.1445(10) 0.299(8) Uani 1 1 d . . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 O1 2.275(3) . ?
Ag1 N6 2.450(4) . ?
Ag1 N5 2.469(3) . ?
Ag1 N2 2.475(4) . ?
Ag1 N3 2.554(4) . ?
Ag1 Ag2 3.0553(6) . ?
Ag2 O2 2.152(3) . ?
Ag2 N8 2.347(3) . ?
Ag2 N9 2.348(4) . ?
C1 C2 1.403(6) 2_676 ?
C1 C3 1.404(6) . ?
C1 C6 1.511(6) . ?
C2 C3 1.395(6) . ?
C2 C1 1.403(6) 2_676 ?
C2 C4 1.519(6) . ?
C3 C5 1.509(6) . ?
C4 N1 1.463(6) . ?
C4 H4A 0.9700 . ?
C4 H4B 0.9700 . ?
C5 N4 1.460(6) . ?
C5 H5A 0.9700 . ?
C5 H5B 0.9700 . ?
C6 N7 1.456(6) . ?
C6 H6A 0.9700 . ?
C6 H6B 0.9700 . ?
C7 N1 1.358(6) . ?
C7 C8 1.362(7) . ?
C7 H7 0.9300 . ?
C8 C9 1.394(7) . ?
C8 H8 0.9300 . ?
C9 N2 1.339(5) . ?
C9 C10 1.462(7) . ?
C10 N3 1.333(6) . ?
C10 C11 1.389(7) . ?
C11 C12 1.363(8) . ?
C11 H11 0.9300 . ?
C12 C13 1.369(9) . ?
C12 H12 0.9300 . ?
C13 C14 1.364(8) . ?
C13 H13 0.9300 . ?
C14 N3 1.333(7) . ?
C14 H14 0.9300 . ?
C15 N4 1.343(6) . ?
C15 C16 1.356(7) . ?
C15 H15 0.9300 . ?
C16 C17 1.401(6) . ?
C16 H16 0.9300 . ?
C17 N5 1.338(5) . ?
C17 C18 1.457(6) . ?
C18 N6 1.330(5) . ?
C18 C19 1.391(6) . ?
C19 C20 1.393(8) . ?
C19 H19 0.9300 . ?
C20 C21 1.357(9) . ?
C20 H20 0.9300 . ?
C21 C22 1.363(8) . ?
C21 H21 0.9300 . ?
C22 N6 1.343(6) . ?
C22 H22 0.9300 . ?
C23 N7 1.359(6) . ?
C23 C24 1.367(8) . ?
C23 H23 0.9300 . ?
C24 C25 1.392(7) . ?
C24 H24 0.9300 . ?
C25 N8 1.340(5) . ?
C25 C26 1.460(7) . ?
C26 N9 1.338(6) . ?
C26 C27 1.391(6) . ?
C27 C28 1.376(9) . ?
C27 H27 0.9300 . ?
C28 C29 1.359(10) . ?
C28 H28 0.9300 . ?
C29 C30 1.394(8) . ?
C29 H29 0.9300 . ?
C30 N9 1.319(7) . ?
C30 H30 0.9300 . ?
C31 O1 1.232(5) . ?
C31 O2 1.254(5) . ?
C31 C32 1.511(5) . ?
C32 C34 1.374(5) . ?
C32 C33 1.388(5) . ?
C33 C34 1.385(5) 2_776 ?
C33 H33 0.9300 . ?
C34 C33 1.385(5) 2_776 ?
C34 H34 0.9300 . ?
N1 N2 1.339(5) . ?
N4 N5 1.345(5) . ?
N7 N8 1.337(5) . ?
N10 O5 1.108(16) . ?
N10 O3 1.233(10) . ?
N10 O4 1.236(14) . ?

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
O1 Ag1 N6 116.84(14) . . ?
O1 Ag1 N5 141.45(12) . . ?
N6 Ag1 N5 67.87(12) . . ?
O1 Ag1 N2 101.50(13) . . ?
N6 Ag1 N2 138.75(12) . . ?
N5 Ag1 N2 91.95(12) . . ?
O1 Ag1 N3 104.11(12) . . ?
N6 Ag1 N3 87.25(13) . . ?
N5 Ag1 N3 114.42(11) . . ?
N2 Ag1 N3 68.25(13) . . ?
O1 Ag1 Ag2 78.49(9) . . ?
N6 Ag1 Ag2 62.83(9) . . ?
N5 Ag1 Ag2 70.35(8) . . ?
N2 Ag1 Ag2 145.13(9) . . ?
N3 Ag1 Ag2 146.20(9) . . ?
O2 Ag2 N8 139.76(14) . . ?
O2 Ag2 N9 130.34(14) . . ?
N8 Ag2 N9 71.92(13) . . ?
O2 Ag2 Ag1 79.64(9) . . ?
N8 Ag2 Ag1 115.02(9) . . ?
N9 Ag2 Ag1 127.73(10) . . ?
C2 C1 C3 119.2(4) 2_676 . ?
C2 C1 C6 119.1(4) 2_676 . ?
C3 C1 C6 120.8(4) . . ?
C3 C2 C1 120.2(4) . 2_676 ?
C3 C2 C4 120.3(4) . . ?
C1 C2 C4 118.8(4) 2_676 . ?
C2 C3 C1 120.4(4) . . ?
C2 C3 C5 119.5(4) . . ?
C1 C3 C5 120.1(4) . . ?
N1 C4 C2 117.2(4) . . ?
N1 C4 H4A 108.0 . . ?
C2 C4 H4A 108.0 . . ?
N1 C4 H4B 108.0 . . ?
C2 C4 H4B 108.0 . . ?
H4A C4 H4B 107.2 . . ?
N4 C5 C3 111.0(4) . . ?
N4 C5 H5A 109.4 . . ?
C3 C5 H5A 109.4 . . ?
N4 C5 H5B 109.4 . . ?
C3 C5 H5B 109.4 . . ?
H5A C5 H5B 108.0 . . ?
N7 C6 C1 118.9(4) . . ?
N7 C6 H6A 107.6 . . ?
C1 C6 H6A 107.6 . . ?
N7 C6 H6B 107.6 . . ?
C1 C6 H6B 107.6 . . ?
H6A C6 H6B 107.0 . . ?
N1 C7 C8 106.1(4) . . ?
N1 C7 H7 127.0 . . ?
C8 C7 H7 127.0 . . ?
C7 C8 C9 106.2(4) . . ?
C7 C8 H8 126.9 . . ?
C9 C8 H8 126.9 . . ?
N2 C9 C8 110.2(4) . . ?
N2 C9 C10 121.8(4) . . ?
C8 C9 C10 127.8(4) . . ?
N3 C10 C11 121.0(5) . . ?
N3 C10 C9 118.2(4) . . ?
C11 C10 C9 120.7(4) . . ?
C12 C11 C10 120.4(5) . . ?
C12 C11 H11 119.8 . . ?
C10 C11 H11 119.8 . . ?
C11 C12 C13 118.7(5) . . ?
C11 C12 H12 120.7 . . ?
C13 C12 H12 120.7 . . ?
C14 C13 C12 117.8(5) . . ?
C14 C13 H13 121.1 . . ?
C12 C13 H13 121.1 . . ?
N3 C14 C13 124.9(5) . . ?
N3 C14 H14 117.6 . . ?
C13 C14 H14 117.6 . . ?
N4 C15 C16 107.9(4) . . ?
N4 C15 H15 126.0 . . ?
C16 C15 H15 126.0 . . ?
C15 C16 C17 104.9(4) . . ?
C15 C16 H16 127.5 . . ?
C17 C16 H16 127.5 . . ?
N5 C17 C16 110.6(4) . . ?
N5 C17 C18 120.5(4) . . ?
C16 C17 C18 128.9(4) . . ?
N6 C18 C19 121.6(4) . . ?
N6 C18 C17 117.2(4) . . ?
C19 C18 C17 121.2(4) . . ?
C18 C19 C20 119.2(5) . . ?
C18 C19 H19 120.4 . . ?
C20 C19 H19 120.4 . . ?
C21 C20 C19 118.7(5) . . ?
C21 C20 H20 120.6 . . ?
C19 C20 H20 120.6 . . ?
C20 C21 C22 118.8(5) . . ?
C20 C21 H21 120.6 . . ?
C22 C21 H21 120.6 . . ?
N6 C22 C21 123.9(5) . . ?
N6 C22 H22 118.0 . . ?
C21 C22 H22 118.0 . . ?
N7 C23 C24 107.3(5) . . ?
N7 C23 H23 126.3 . . ?
C24 C23 H23 126.3 . . ?
C23 C24 C25 105.0(4) . . ?
C23 C24 H24 127.5 . . ?
C25 C24 H24 127.5 . . ?
N8 C25 C24 110.8(4) . . ?
N8 C25 C26 120.7(4) . . ?
C24 C25 C26 128.5(4) . . ?
N9 C26 C27 121.4(5) . . ?
N9 C26 C25 117.3(4) . . ?
C27 C26 C25 121.3(4) . . ?
C28 C27 C26 118.9(5) . . ?
C28 C27 H27 120.5 . . ?
C26 C27 H27 120.5 . . ?
C29 C28 C27 119.7(6) . . ?
C29 C28 H28 120.1 . . ?
C27 C28 H28 120.1 . . ?
C28 C29 C30 118.2(6) . . ?
C28 C29 H29 120.9 . . ?
C30 C29 H29 120.9 . . ?
N9 C30 C29 122.9(6) . . ?
N9 C30 H30 118.5 . . ?
C29 C30 H30 118.5 . . ?
O1 C31 O2 126.4(4) . . ?
O1 C31 C32 118.6(4) . . ?
O2 C31 C32 114.8(3) . . ?
C34 C32 C33 118.6(3) . . ?
C34 C32 C31 120.8(3) . . ?
C33 C32 C31 120.6(3) . . ?
C34 C33 C32 120.4(4) 2_776 . ?
C34 C33 H33 119.8 2_776 . ?
C32 C33 H33 119.8 . . ?
C32 C34 C33 121.1(4) . 2_776 ?
C32 C34 H34 119.5 . . ?
C33 C34 H34 119.5 2_776 . ?
N2 N1 C7 112.2(4) . . ?
N2 N1 C4 122.8(4) . . ?
C7 N1 C4 123.9(4) . . ?
C9 N2 N1 105.3(4) . . ?
C9 N2 Ag1 113.5(3) . . ?
N1 N2 Ag1 132.6(3) . . ?
C10 N3 C14 117.2(4) . . ?
C10 N3 Ag1 114.4(3) . . ?
C14 N3 Ag1 128.3(3) . . ?
C15 N4 N5 111.5(4) . . ?
C15 N4 C5 127.5(4) . . ?
N5 N4 C5 121.0(3) . . ?
C17 N5 N4 105.1(3) . . ?
C17 N5 Ag1 115.2(3) . . ?
N4 N5 Ag1 139.6(3) . . ?
C18 N6 C22 117.8(4) . . ?
C18 N6 Ag1 117.4(3) . . ?
C22 N6 Ag1 123.2(3) . . ?
N8 N7 C23 111.1(4) . . ?
N8 N7 C6 124.2(4) . . ?
C23 N7 C6 124.4(4) . . ?
N7 N8 C25 105.7(3) . . ?
N7 N8 Ag2 139.9(3) . . ?
C25 N8 Ag2 113.9(3) . . ?
C30 N9 C26 118.8(4) . . ?
C30 N9 Ag2 125.3(4) . . ?
C26 N9 Ag2 115.8(3) . . ?
O5 N10 O3 126.0(15) . . ?
O5 N10 O4 120.1(13) . . ?
O3 N10 O4 113.4(13) . . ?
C31 O1 Ag1 125.6(3) . . ?
C31 O2 Ag2 129.7(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O1 Ag1 Ag2 O2 -2.70(15) . . . . ?
N6 Ag1 Ag2 O2 -131.19(15) . . . . ?
N5 Ag1 Ag2 O2 154.26(14) . . . . ?
N2 Ag1 Ag2 O2 90.94(19) . . . . ?
N3 Ag1 Ag2 O2 -100.92(19) . . . . ?
O1 Ag1 Ag2 N8 -143.14(14) . . . . ?
N6 Ag1 Ag2 N8 88.36(13) . . . . ?
N5 Ag1 Ag2 N8 13.81(12) . . . . ?
N2 Ag1 Ag2 N8 -49.50(18) . . . . ?
N3 Ag1 Ag2 N8 118.64(18) . . . . ?
O1 Ag1 Ag2 N9 130.98(17) . . . . ?
N6 Ag1 Ag2 N9 2.49(15) . . . . ?
N5 Ag1 Ag2 N9 -72.07(15) . . . . ?
N2 Ag1 Ag2 N9 -135.4(2) . . . . ?
N3 Ag1 Ag2 N9 32.8(2) . . . . ?
C1 C2 C3 C1 -3.8(6) 2_676 . . . ?
C4 C2 C3 C1 167.3(4) . . . . ?
C1 C2 C3 C5 174.2(4) 2_676 . . . ?
C4 C2 C3 C5 -14.7(6) . . . . ?
C2 C1 C3 C2 3.7(6) 2_676 . . . ?
C6 C1 C3 C2 -165.8(4) . . . . ?
C2 C1 C3 C5 -174.2(4) 2_676 . . . ?
C6 C1 C3 C5 16.3(6) . . . . ?
C3 C2 C4 N1 80.3(6) . . . . ?
C1 C2 C4 N1 -108.5(5) 2_676 . . . ?
C2 C3 C5 N4 -117.9(4) . . . . ?
C1 C3 C5 N4 60.0(5) . . . . ?
C2 C1 C6 N7 92.5(5) 2_676 . . . ?
C3 C1 C6 N7 -98.0(5) . . . . ?
N1 C7 C8 C9 0.0(6) . . . . ?
C7 C8 C9 N2 0.1(6) . . . . ?
C7 C8 C9 C10 -175.3(5) . . . . ?
N2 C9 C10 N3 -17.9(6) . . . . ?
C8 C9 C10 N3 157.0(5) . . . . ?
N2 C9 C10 C11 166.1(5) . . . . ?
C8 C9 C10 C11 -19.1(8) . . . . ?
N3 C10 C11 C12 -1.5(9) . . . . ?
C9 C10 C11 C12 174.4(6) . . . . ?
C10 C11 C12 C13 0.2(10) . . . . ?
C11 C12 C13 C14 0.5(10) . . . . ?
C12 C13 C14 N3 0.0(9) . . . . ?
N4 C15 C16 C17 -0.2(5) . . . . ?
C15 C16 C17 N5 1.0(5) . . . . ?
C15 C16 C17 C18 -177.6(4) . . . . ?
N5 C17 C18 N6 -5.7(6) . . . . ?
C16 C17 C18 N6 172.7(4) . . . . ?
N5 C17 C18 C19 175.7(4) . . . . ?
C16 C17 C18 C19 -5.8(7) . . . . ?
N6 C18 C19 C20 1.1(7) . . . . ?
C17 C18 C19 C20 179.6(5) . . . . ?
C18 C19 C20 C21 0.7(8) . . . . ?
C19 C20 C21 C22 -1.9(9) . . . . ?
C20 C21 C22 N6 1.6(9) . . . . ?
N7 C23 C24 C25 0.2(6) . . . . ?
C23 C24 C25 N8 -0.2(6) . . . . ?
C23 C24 C25 C26 179.4(5) . . . . ?
N8 C25 C26 N9 1.4(6) . . . . ?
C24 C25 C26 N9 -178.2(5) . . . . ?
N8 C25 C26 C27 -178.9(5) . . . . ?
C24 C25 C26 C27 1.5(7) . . . . ?
N9 C26 C27 C28 -1.2(8) . . . . ?
C25 C26 C27 C28 179.1(5) . . . . ?
C26 C27 C28 C29 0.5(10) . . . . ?
C27 C28 C29 C30 0.0(11) . . . . ?
C28 C29 C30 N9 0.2(11) . . . . ?
O1 C31 C32 C34 175.1(4) . . . . ?
O2 C31 C32 C34 -8.5(5) . . . . ?
O1 C31 C32 C33 -8.7(6) . . . . ?
O2 C31 C32 C33 167.7(4) . . . . ?
C34 C32 C33 C34 0.5(6) . . . 2_776 ?
C31 C32 C33 C34 -175.8(3) . . . 2_776 ?
C33 C32 C34 C33 -0.5(6) . . . 2_776 ?
C31 C32 C34 C33 175.8(4) . . . 2_776 ?
C8 C7 N1 N2 0.0(6) . . . . ?
C8 C7 N1 C4 -168.6(5) . . . . ?
C2 C4 N1 N2 31.3(7) . . . . ?
C2 C4 N1 C7 -161.3(5) . . . . ?
C8 C9 N2 N1 -0.1(5) . . . . ?
C10 C9 N2 N1 175.6(4) . . . . ?
C8 C9 N2 Ag1 -152.2(3) . . . . ?
C10 C9 N2 Ag1 23.5(5) . . . . ?
C7 N1 N2 C9 0.1(5) . . . . ?
C4 N1 N2 C9 168.8(4) . . . . ?
C7 N1 N2 Ag1 144.5(4) . . . . ?
C4 N1 N2 Ag1 -46.8(6) . . . . ?
O1 Ag1 N2 C9 -115.7(3) . . . . ?
N6 Ag1 N2 C9 42.9(4) . . . . ?
N5 Ag1 N2 C9 100.7(3) . . . . ?
N3 Ag1 N2 C9 -14.9(3) . . . . ?
Ag2 Ag1 N2 C9 158.0(2) . . . . ?
O1 Ag1 N2 N1 102.1(4) . . . . ?
N6 Ag1 N2 N1 -99.4(4) . . . . ?
N5 Ag1 N2 N1 -41.6(4) . . . . ?
N3 Ag1 N2 N1 -157.2(4) . . . . ?
Ag2 Ag1 N2 N1 15.8(5) . . . . ?
C11 C10 N3 C14 1.9(7) . . . . ?
C9 C10 N3 C14 -174.1(4) . . . . ?
C11 C10 N3 Ag1 178.1(4) . . . . ?
C9 C10 N3 Ag1 2.1(5) . . . . ?
C13 C14 N3 C10 -1.2(8) . . . . ?
C13 C14 N3 Ag1 -176.8(4) . . . . ?
O1 Ag1 N3 C10 103.4(3) . . . . ?
N6 Ag1 N3 C10 -139.6(3) . . . . ?
N5 Ag1 N3 C10 -75.4(3) . . . . ?
N2 Ag1 N3 C10 6.5(3) . . . . ?
Ag2 Ag1 N3 C10 -166.2(2) . . . . ?
O1 Ag1 N3 C14 -80.8(4) . . . . ?
N6 Ag1 N3 C14 36.2(4) . . . . ?
N5 Ag1 N3 C14 100.3(4) . . . . ?
N2 Ag1 N3 C14 -177.8(4) . . . . ?
Ag2 Ag1 N3 C14 9.5(5) . . . . ?
C16 C15 N4 N5 -0.6(6) . . . . ?
C16 C15 N4 C5 -178.5(4) . . . . ?
C3 C5 N4 C15 -137.2(5) . . . . ?
C3 C5 N4 N5 45.1(5) . . . . ?
C16 C17 N5 N4 -1.3(5) . . . . ?
C18 C17 N5 N4 177.4(3) . . . . ?
C16 C17 N5 Ag1 176.0(3) . . . . ?
C18 C17 N5 Ag1 -5.3(5) . . . . ?
C15 N4 N5 C17 1.2(5) . . . . ?
C5 N4 N5 C17 179.2(4) . . . . ?
C15 N4 N5 Ag1 -175.1(3) . . . . ?
C5 N4 N5 Ag1 3.0(6) . . . . ?
O1 Ag1 N5 C17 114.3(3) . . . . ?
N6 Ag1 N5 C17 8.5(3) . . . . ?
N2 Ag1 N5 C17 -134.4(3) . . . . ?
N3 Ag1 N5 C17 -67.5(3) . . . . ?
Ag2 Ag1 N5 C17 76.3(3) . . . . ?
O1 Ag1 N5 N4 -69.7(5) . . . . ?
N6 Ag1 N5 N4 -175.5(4) . . . . ?
N2 Ag1 N5 N4 41.6(4) . . . . ?
N3 Ag1 N5 N4 108.5(4) . . . . ?
Ag2 Ag1 N5 N4 -107.7(4) . . . . ?
C19 C18 N6 C22 -1.5(7) . . . . ?
C17 C18 N6 C22 179.9(4) . . . . ?
C19 C18 N6 Ag1 -167.5(3) . . . . ?
C17 C18 N6 Ag1 13.9(5) . . . . ?
C21 C22 N6 C18 0.2(8) . . . . ?
C21 C22 N6 Ag1 165.3(5) . . . . ?
O1 Ag1 N6 C18 -149.7(3) . . . . ?
N5 Ag1 N6 C18 -11.9(3) . . . . ?
N2 Ag1 N6 C18 54.0(4) . . . . ?
N3 Ag1 N6 C18 105.9(3) . . . . ?
Ag2 Ag1 N6 C18 -90.4(3) . . . . ?
O1 Ag1 N6 C22 45.1(4) . . . . ?
N5 Ag1 N6 C22 -177.1(4) . . . . ?
N2 Ag1 N6 C22 -111.2(4) . . . . ?
N3 Ag1 N6 C22 -59.3(4) . . . . ?
Ag2 Ag1 N6 C22 104.4(4) . . . . ?
C24 C23 N7 N8 -0.1(6) . . . . ?
C24 C23 N7 C6 174.4(5) . . . . ?
C1 C6 N7 N8 -19.2(7) . . . . ?
C1 C6 N7 C23 167.0(5) . . . . ?
C23 N7 N8 C25 0.0(5) . . . . ?
C6 N7 N8 C25 -174.6(4) . . . . ?
C23 N7 N8 Ag2 -171.1(4) . . . . ?
C6 N7 N8 Ag2 14.3(7) . . . . ?
C24 C25 N8 N7 0.2(5) . . . . ?
C26 C25 N8 N7 -179.5(4) . . . . ?
C24 C25 N8 Ag2 173.9(3) . . . . ?
C26 C25 N8 Ag2 -5.7(5) . . . . ?
O2 Ag2 N8 N7 -52.0(5) . . . . ?
N9 Ag2 N8 N7 176.0(5) . . . . ?
Ag1 Ag2 N8 N7 52.1(4) . . . . ?
O2 Ag2 N8 C25 137.4(3) . . . . ?
N9 Ag2 N8 C25 5.4(3) . . . . ?
Ag1 Ag2 N8 C25 -118.5(3) . . . . ?
C29 C30 N9 C26 -0.9(9) . . . . ?
C29 C30 N9 Ag2 176.1(5) . . . . ?
C27 C26 N9 C30 1.4(7) . . . . ?
C25 C26 N9 C30 -178.9(5) . . . . ?
C27 C26 N9 Ag2 -175.9(4) . . . . ?
C25 C26 N9 Ag2 3.9(5) . . . . ?
O2 Ag2 N9 C30 37.1(5) . . . . ?
N8 Ag2 N9 C30 178.0(5) . . . . ?
Ag1 Ag2 N9 C30 -73.9(5) . . . . ?
O2 Ag2 N9 C26 -145.8(3) . . . . ?
N8 Ag2 N9 C26 -4.9(3) . . . . ?
Ag1 Ag2 N9 C26 103.1(3) . . . . ?
O2 C31 O1 Ag1 -3.2(7) . . . . ?
C32 C31 O1 Ag1 172.7(3) . . . . ?
N6 Ag1 O1 C31 55.4(4) . . . . ?
N5 Ag1 O1 C31 -32.2(5) . . . . ?
N2 Ag1 O1 C31 -140.3(4) . . . . ?
N3 Ag1 O1 C31 149.5(4) . . . . ?
Ag2 Ag1 O1 C31 4.1(4) . . . . ?
O1 C31 O2 Ag2 -1.4(7) . . . . ?
C32 C31 O2 Ag2 -177.4(3) . . . . ?
N8 Ag2 O2 C31 120.1(4) . . . . ?
N9 Ag2 O2 C31 -128.0(4) . . . . ?
Ag1 Ag2 O2 C31 3.4(4) . . . . ?

_diffrn_measured_fraction_theta_max 0.842
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         1.699
_refine_diff_density_min         -1.142
_refine_diff_density_rms         0.098
_database_code_depnum_ccdc_archive 'CCDC 984126'
#######################################################################
#
#                 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_crystal2

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C69 H56 Ag4 N20 O14'
_chemical_formula_sum            'C69 H56 Ag4 N20 O14'
_chemical_formula_weight         1820.82

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   'C 2/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                   20.6570(8)
_cell_length_b                   14.2360(6)
_cell_length_c                   23.3580(9)
_cell_angle_alpha                90.00
_cell_angle_beta                 103.847(4)
_cell_angle_gamma                90.00
_cell_volume                     6669.3(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4346
_cell_measurement_theta_min      2.9935
_cell_measurement_theta_max      29.2401

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.26
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.813
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3640
_exptl_absorpt_coefficient_mu    1.242
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.83994
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            14160
_diffrn_reflns_av_R_equivalents  0.0276
_diffrn_reflns_av_sigmaI/netI    0.0493
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         3.00
_diffrn_reflns_theta_max         29.30
_reflns_number_total             7698
_reflns_number_gt                4792
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² 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/[σ²(Fo²)+(0.0881P)²+9.3848P] where P=(Fo²+2Fc²)/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         7698
_refine_ls_number_parameters     497
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0977
_refine_ls_R_factor_gt           0.0571
_refine_ls_wR_factor_ref         0.1736
_refine_ls_wR_factor_gt          0.1478
_refine_ls_goodness_of_fit_ref   1.010
_refine_ls_restrained_S_all      1.010
_refine_ls_shift/su_max          0.004
_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 0.12475(2) 0.11216(3) 0.60927(2) 0.06334(18) Uani 1 1 d . . .
Ag2 Ag 0.16731(2) -0.07887(4) 0.59003(2) 0.0718(2) Uani 1 1 d . . .
C1 C -0.0053(2) 0.0966(4) 0.4923(2) 0.0476(12) Uani 1 1 d . . .
C2 C 0.0301(2) 0.0428(4) 0.46033(19) 0.0461(12) Uani 1 1 d . . .
C3 C 0.0346(2) -0.0526(4) 0.4673(2) 0.0486(13) Uani 1 1 d . . .
C4 C -0.0206(3) 0.1983(5) 0.4792(3) 0.0763(18) Uani 1 1 d . . .
H4A H -0.0258 0.2080 0.4372 0.092 Uiso 1 1 calc R . .
H4B H -0.0631 0.2124 0.4880 0.092 Uiso 1 1 calc R . .
C5 C 0.0663(3) 0.0915(6) 0.4205(3) 0.074(2) Uani 1 1 d . . .
H5A H 0.0623 0.0547 0.3849 0.089 Uiso 1 1 calc R . .
H5B H 0.0459 0.1523 0.4093 0.089 Uiso 1 1 calc R . .
C6 C 0.0640(3) -0.1120(5) 0.4260(3) 0.078(2) Uani 1 1 d . . .
H6A H 0.0470 -0.1755 0.4264 0.094 Uiso 1 1 calc R . .
H6B H 0.0481 -0.0878 0.3863 0.094 Uiso 1 1 calc R . .
C7 C 0.0335(3) 0.3564(5) 0.4959(3) 0.0685(17) Uani 1 1 d . . .
H7 H 0.0111 0.3846 0.4608 0.082 Uiso 1 1 calc R . .
C8 C 0.0768(3) 0.3987(4) 0.5412(3) 0.0709(18) Uani 1 1 d . . .
H8 H 0.0902 0.4612 0.5436 0.085 Uiso 1 1 calc R . .
C9 C 0.0970(3) 0.3294(4) 0.5831(3) 0.0581(14) Uani 1 1 d . . .
C10 C 0.1467(3) 0.3344(5) 0.6403(3) 0.0685(17) Uani 1 1 d . . .
C11 C 0.1872(4) 0.4135(6) 0.6546(4) 0.099(3) Uani 1 1 d . . .
H11 H 0.1819 0.4654 0.6298 0.118 Uiso 1 1 calc R . .
C12 C 0.2339(5) 0.4121(9) 0.7054(5) 0.119(4) Uani 1 1 d . . .
H12 H 0.2618 0.4638 0.7157 0.142 Uiso 1 1 calc R . .
C13 C 0.2416(4) 0.3368(11) 0.7424(5) 0.135(5) Uani 1 1 d . . .
H13 H 0.2744 0.3363 0.7776 0.162 Uiso 1 1 calc R . .
C14 C 0.2000(5) 0.2626(8) 0.7264(4) 0.120(3) Uani 1 1 d . . .
H14 H 0.2042 0.2110 0.7514 0.144 Uiso 1 1 calc R . .
C15 C 0.1851(3) 0.1193(5) 0.4203(3) 0.0645(16) Uani 1 1 d . . .
H15 H 0.1804 0.1221 0.3798 0.077 Uiso 1 1 calc R . .
C16 C 0.2420(3) 0.1294(5) 0.4621(3) 0.0638(16) Uani 1 1 d . . .
H16 H 0.2845 0.1393 0.4563 0.077 Uiso 1 1 calc R . .
C17 C 0.2244(2) 0.1223(4) 0.5155(2) 0.0459(11) Uani 1 1 d . . .
C18 C 0.2684(2) 0.1244(4) 0.5747(2) 0.0490(12) Uani 1 1 d . . .
C19 C 0.3356(3) 0.1418(5) 0.5824(3) 0.0690(17) Uani 1 1 d . . .
H19 H 0.3531 0.1537 0.5500 0.083 Uiso 1 1 calc R . .
C20 C 0.3761(3) 0.1414(6) 0.6376(3) 0.084(2) Uani 1 1 d . . .
H20 H 0.4217 0.1518 0.6433 0.101 Uiso 1 1 calc R . .
C21 C 0.3491(3) 0.1255(6) 0.6839(3) 0.083(2) Uani 1 1 d . . .
H21 H 0.3755 0.1266 0.7222 0.099 Uiso 1 1 calc R . .
C22 C 0.2823(3) 0.1079(5) 0.6737(3) 0.0744(18) Uani 1 1 d . . .
H22 H 0.2646 0.0951 0.7059 0.089 Uiso 1 1 calc R . .
C23 C 0.1723(3) -0.1309(4) 0.3998(3) 0.0602(15) Uani 1 1 d . . .
H23 H 0.1561 -0.1357 0.3592 0.072 Uiso 1 1 calc R . .
C24 C 0.2361(3) -0.1376(4) 0.4296(2) 0.0568(14) Uani 1 1 d . . .
H24 H 0.2728 -0.1475 0.4138 0.068 Uiso 1 1 calc R . .
C25 C 0.2363(2) -0.1268(3) 0.4884(2) 0.0449(11) Uani 1 1 d . . .
C26 C 0.2924(2) -0.1238(3) 0.5400(2) 0.0450(11) Uani 1 1 d . . .
C27 C 0.3573(2) -0.1305(4) 0.5338(3) 0.0555(13) Uani 1 1 d . . .
H27 H 0.3659 -0.1398 0.4970 0.067 Uiso 1 1 calc R . .
C28 C 0.4083(3) -0.1231(5) 0.5830(3) 0.0702(17) Uani 1 1 d . . .
H28 H 0.4522 -0.1260 0.5795 0.084 Uiso 1 1 calc R . .
C29 C 0.3955(3) -0.1117(5) 0.6366(3) 0.0746(18) Uani 1 1 d . . .
H29 H 0.4298 -0.1071 0.6705 0.090 Uiso 1 1 calc R . .
C30 C 0.3302(3) -0.1072(5) 0.6391(3) 0.0675(16) Uani 1 1 d . . .
H30 H 0.3210 -0.1010 0.6760 0.081 Uiso 1 1 calc R . .
C31 C 0.0000 -0.2368(6) 0.7500 0.061(2) Uani 1 2 d S . .
H31 H 0.0000 -0.3021 0.7500 0.073 Uiso 1 2 calc SR . .
C32 C 0.0380(3) -0.1889(4) 0.7192(2) 0.0536(13) Uani 1 1 d . . .
H32 H 0.0644 -0.2220 0.6989 0.064 Uiso 1 1 calc R . .
C33 C 0.0378(2) -0.0926(3) 0.71779(18) 0.0373(10) Uani 1 1 d . . .
C34 C 0.0764(2) -0.0444(4) 0.67789(19) 0.0463(12) Uani 1 1 d . . .
C35 C 0.0000 -0.0434(5) 0.7500 0.0369(14) Uani 1 2 d S . .
C36 C 0.0155(5) 0.0639(9) 0.7585(8) 0.046(5) Uani 0.50 1 d P . .
N1 N 0.0290(2) 0.2660(3) 0.5110(2) 0.0577(11) Uani 1 1 d . . .
N2 N 0.0666(2) 0.2493(3) 0.5649(2) 0.0584(11) Uani 1 1 d . . .
N3 N 0.1523(3) 0.2612(5) 0.6747(3) 0.0886(18) Uani 1 1 d . . .
N4 N 0.1363(2) 0.1045(3) 0.44865(18) 0.0496(10) Uani 1 1 d . . .
N5 N 0.1591(2) 0.1069(3) 0.50681(18) 0.0518(11) Uani 1 1 d . . .
N6 N 0.2413(2) 0.1079(3) 0.62032(19) 0.0563(11) Uani 1 1 d . . .
N7 N 0.1364(2) -0.1163(3) 0.4393(2) 0.0542(11) Uani 1 1 d . . .
N8 N 0.17428(19) -0.1148(3) 0.49471(19) 0.0503(11) Uani 1 1 d . . .
N9 N 0.2789(2) -0.1111(3) 0.59211(19) 0.0548(11) Uani 1 1 d . . .
N10 N 0.1091(4) 0.6300(5) 0.6433(3) 0.097(2) Uani 1 1 d . . .
O1 O 0.06545(19) 0.0386(3) 0.66652(16) 0.0609(10) Uani 1 1 d . . .
O2 O 0.1124(2) -0.0976(3) 0.6565(2) 0.0855(15) Uani 1 1 d . . .
O3 O 0.0636(5) 0.0910(9) 0.7916(5) 0.061(3) Uani 0.50 1 d P . .
O3' O 0.0321(7) 0.1142(9) 0.7733(5) 0.060(3) Uani 0.50 1 d P . .
O4 O 0.0567(4) 0.6093(6) 0.6544(4) 0.154(3) Uani 1 1 d . . .
O5 O 0.1608(4) 0.6344(7) 0.6814(3) 0.155(3) Uani 1 1 d . . .
O6 O 0.1115(3) 0.6466(7) 0.5950(3) 0.164(4) Uani 1 1 d . . .
O1W O 0.5445(7) -0.0415(10) 0.7200(6) 0.282(7) Uani 1 1 d . . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 O1 2.274(3) . ?
Ag1 N6 2.359(4) . ?
Ag1 N2 2.395(5) . ?
Ag1 N3 2.598(6) . ?
Ag1 Ag2 2.9256(7) . ?
Ag2 O2 2.147(4) . ?
Ag2 N8 2.322(4) . ?
Ag2 N9 2.339(4) . ?
C1 C3 1.386(8) 5_556 ?
C1 C2 1.393(7) . ?
C1 C4 1.497(8) . ?
C2 C3 1.368(8) . ?
C2 C5 1.497(7) . ?
C3 C1 1.386(8) 5_556 ?
C3 C6 1.514(7) . ?
C4 N1 1.472(8) . ?
C4 H4A 0.9700 . ?
C4 H4B 0.9700 . ?
C5 N4 1.449(7) . ?
C5 H5A 0.9700 . ?
C5 H5B 0.9700 . ?
C6 N7 1.455(7) . ?
C6 H6A 0.9700 . ?
C6 H6B 0.9700 . ?
C7 N1 1.344(8) . ?
C7 C8 1.352(9) . ?
C7 H7 0.9300 . ?
C8 C9 1.382(9) . ?
C8 H8 0.9300 . ?
C9 N2 1.323(7) . ?
C9 C10 1.479(9) . ?
C10 N3 1.305(9) . ?
C10 C11 1.394(10) . ?
C11 C12 1.338(14) . ?
C11 H11 0.9300 . ?
C12 C13 1.362(16) . ?
C12 H12 0.9300 . ?
C13 C14 1.357(15) . ?
C13 H13 0.9300 . ?
C14 N3 1.363(9) . ?
C14 H14 0.9300 . ?
C15 C16 1.344(8) . ?
C15 N4 1.349(6) . ?
C15 H15 0.9300 . ?
C16 C17 1.384(7) . ?
C16 H16 0.9300 . ?
C17 N5 1.334(6) . ?
C17 C18 1.462(7) . ?
C18 N6 1.338(7) . ?
C18 C19 1.379(7) . ?
C19 C20 1.358(9) . ?
C19 H19 0.9300 . ?
C20 C21 1.351(10) . ?
C20 H20 0.9300 . ?
C21 C22 1.365(9) . ?
C21 H21 0.9300 . ?
C22 N6 1.329(7) . ?
C22 H22 0.9300 . ?
C23 N7 1.330(6) . ?
C23 C24 1.337(8) . ?
C23 H23 0.9300 . ?
C24 C25 1.381(7) . ?
C24 H24 0.9300 . ?
C25 N8 1.336(6) . ?
C25 C26 1.460(7) . ?
C26 N9 1.325(6) . ?
C26 C27 1.386(7) . ?
C27 C28 1.363(8) . ?
C27 H27 0.9300 . ?
C28 C29 1.350(9) . ?
C28 H28 0.9300 . ?
C29 C30 1.366(9) . ?
C29 H29 0.9300 . ?
C30 N9 1.333(8) . ?
C30 H30 0.9300 . ?
C31 C32 1.369(7) . ?
C31 C32 1.369(7) 2_556 ?
C31 H31 0.9300 . ?
C32 C33 1.371(7) . ?
C32 H32 0.9300 . ?
C33 C35 1.395(6) . ?
C33 C34 1.527(6) . ?
C34 O1 1.220(6) . ?
C34 O2 1.246(6) . ?
C35 C33 1.395(6) 2_556 ?
C35 C36 1.565(15) 2_556 ?
C35 C36 1.565(15) . ?
C36 C36 0.67(2) 2_556 ?
C36 O3' 0.831(13) . ?
C36 O3 1.169(18) . ?
C36 O3' 1.295(18) 2_556 ?
C36 O3 1.809(13) 2_556 ?
N1 N2 1.332(6) . ?
N4 N5 1.327(6) . ?
N7 N8 1.344(6) . ?
N10 O6 1.164(8) . ?
N10 O4 1.208(9) . ?
N10 O5 1.218(9) . ?
O3 O3' 0.764(13) . ?
O3 C36 1.809(13) 2_556 ?
O3' C36 1.295(18) 2_556 ?
O3' O3' 1.50(3) 2_556 ?

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
O1 Ag1 N6 127.08(15) . . ?
O1 Ag1 N2 110.19(16) . . ?
N6 Ag1 N2 117.48(16) . . ?
O1 Ag1 N3 95.9(2) . . ?
N6 Ag1 N3 83.23(18) . . ?
N2 Ag1 N3 66.78(18) . . ?
O1 Ag1 Ag2 83.45(11) . . ?
N6 Ag1 Ag2 69.93(12) . . ?
N2 Ag1 Ag2 146.04(11) . . ?
N3 Ag1 Ag2 144.88(13) . . ?
O2 Ag2 N8 146.14(19) . . ?
O2 Ag2 N9 130.49(17) . . ?
N8 Ag2 N9 71.93(14) . . ?
O2 Ag2 Ag1 76.95(13) . . ?
N8 Ag2 Ag1 116.21(11) . . ?
N9 Ag2 Ag1 120.66(12) . . ?
C3 C1 C2 119.1(5) 5_556 . ?
C3 C1 C4 118.2(5) 5_556 . ?
C2 C1 C4 122.2(6) . . ?
C3 C2 C1 120.7(5) . . ?
C3 C2 C5 120.2(5) . . ?
C1 C2 C5 118.9(6) . . ?
C2 C3 C1 120.1(4) . 5_556 ?
C2 C3 C6 120.3(5) . . ?
C1 C3 C6 119.1(6) 5_556 . ?
N1 C4 C1 116.3(5) . . ?
N1 C4 H4A 108.2 . . ?
C1 C4 H4A 108.2 . . ?
N1 C4 H4B 108.2 . . ?
C1 C4 H4B 108.2 . . ?
H4A C4 H4B 107.4 . . ?
N4 C5 C2 111.7(4) . . ?
N4 C5 H5A 109.3 . . ?
C2 C5 H5A 109.3 . . ?
N4 C5 H5B 109.3 . . ?
C2 C5 H5B 109.3 . . ?
H5A C5 H5B 107.9 . . ?
N7 C6 C3 115.9(4) . . ?
N7 C6 H6A 108.3 . . ?
C3 C6 H6A 108.3 . . ?
N7 C6 H6B 108.3 . . ?
C3 C6 H6B 108.3 . . ?
H6A C6 H6B 107.4 . . ?
N1 C7 C8 107.1(6) . . ?
N1 C7 H7 126.4 . . ?
C8 C7 H7 126.4 . . ?
C7 C8 C9 105.6(6) . . ?
C7 C8 H8 127.2 . . ?
C9 C8 H8 127.2 . . ?
N2 C9 C8 110.3(5) . . ?
N2 C9 C10 120.4(6) . . ?
C8 C9 C10 129.3(6) . . ?
N3 C10 C11 122.5(7) . . ?
N3 C10 C9 117.3(6) . . ?
C11 C10 C9 120.2(7) . . ?
C12 C11 C10 117.7(10) . . ?
C12 C11 H11 121.2 . . ?
C10 C11 H11 121.2 . . ?
C11 C12 C13 121.6(10) . . ?
C11 C12 H12 119.2 . . ?
C13 C12 H12 119.2 . . ?
C14 C13 C12 117.8(9) . . ?
C14 C13 H13 121.1 . . ?
C12 C13 H13 121.1 . . ?
C13 C14 N3 122.1(11) . . ?
C13 C14 H14 118.9 . . ?
N3 C14 H14 118.9 . . ?
C16 C15 N4 106.7(5) . . ?
C16 C15 H15 126.6 . . ?
N4 C15 H15 126.6 . . ?
C15 C16 C17 105.9(5) . . ?
C15 C16 H16 127.1 . . ?
C17 C16 H16 127.1 . . ?
N5 C17 C16 110.4(5) . . ?
N5 C17 C18 121.6(4) . . ?
C16 C17 C18 127.8(5) . . ?
N6 C18 C19 121.8(5) . . ?
N6 C18 C17 117.8(4) . . ?
C19 C18 C17 120.3(5) . . ?
C20 C19 C18 119.7(6) . . ?
C20 C19 H19 120.1 . . ?
C18 C19 H19 120.1 . . ?
C21 C20 C19 118.8(6) . . ?
C21 C20 H20 120.6 . . ?
C19 C20 H20 120.6 . . ?
C20 C21 C22 119.0(6) . . ?
C20 C21 H21 120.5 . . ?
C22 C21 H21 120.5 . . ?
N6 C22 C21 123.7(6) . . ?
N6 C22 H22 118.1 . . ?
C21 C22 H22 118.1 . . ?
N7 C23 C24 107.1(5) . . ?
N7 C23 H23 126.4 . . ?
C24 C23 H23 126.4 . . ?
C23 C24 C25 106.1(5) . . ?
C23 C24 H24 126.9 . . ?
C25 C24 H24 126.9 . . ?
N8 C25 C24 110.4(5) . . ?
N8 C25 C26 119.9(4) . . ?
C24 C25 C26 129.7(5) . . ?
N9 C26 C27 121.8(5) . . ?
N9 C26 C25 117.5(4) . . ?
C27 C26 C25 120.6(5) . . ?
C28 C27 C26 118.6(5) . . ?
C28 C27 H27 120.7 . . ?
C26 C27 H27 120.7 . . ?
C29 C28 C27 120.4(6) . . ?
C29 C28 H28 119.8 . . ?
C27 C28 H28 119.8 . . ?
C28 C29 C30 117.5(6) . . ?
C28 C29 H29 121.3 . . ?
C30 C29 H29 121.3 . . ?
N9 C30 C29 124.1(6) . . ?
N9 C30 H30 117.9 . . ?
C29 C30 H30 117.9 . . ?
C32 C31 C32 120.2(8) . 2_556 ?
C32 C31 H31 119.9 . . ?
C32 C31 H31 119.9 2_556 . ?
C31 C32 C33 120.8(5) . . ?
C31 C32 H32 119.6 . . ?
C33 C32 H32 119.6 . . ?
C32 C33 C35 119.2(4) . . ?
C32 C33 C34 117.6(4) . . ?
C35 C33 C34 123.1(5) . . ?
O1 C34 O2 126.8(5) . . ?
O1 C34 C33 118.1(4) . . ?
O2 C34 C33 114.9(5) . . ?
C33 C35 C33 119.8(6) 2_556 . ?
C33 C35 C36 115.7(7) 2_556 2_556 ?
C33 C35 C36 123.1(7) . 2_556 ?
C33 C35 C36 123.1(7) 2_556 . ?
C33 C35 C36 115.7(7) . . ?
C36 C35 C36 24.7(8) 2_556 . ?
C36 C36 O3' 119.1(15) 2_556 . ?
C36 C36 O3 159.3(19) 2_556 . ?
O3' C36 O3 40.7(12) . . ?
C36 C36 O3' 34.1(10) 2_556 2_556 ?
O3' C36 O3' 86.8(18) . 2_556 ?
O3 C36 O3' 127.3(15) . 2_556 ?
C36 C36 C35 77.7(4) 2_556 . ?
O3' C36 C35 160.8(16) . . ?
O3 C36 C35 121.4(10) . . ?
O3' C36 C35 111.2(9) 2_556 . ?
C36 C36 O3 13.2(13) 2_556 2_556 ?
O3' C36 O3 107.7(16) . 2_556 ?
O3 C36 O3 148.3(17) . 2_556 ?
O3' C36 O3 21.3(7) 2_556 2_556 ?
C35 C36 O3 90.0(9) . 2_556 ?
N2 N1 C7 111.0(5) . . ?
N2 N1 C4 122.6(5) . . ?
C7 N1 C4 125.3(5) . . ?
C9 N2 N1 106.0(5) . . ?
C9 N2 Ag1 114.4(4) . . ?
N1 N2 Ag1 132.3(3) . . ?
C10 N3 C14 118.2(8) . . ?
C10 N3 Ag1 108.4(4) . . ?
C14 N3 Ag1 122.9(6) . . ?
N5 N4 C15 111.9(4) . . ?
N5 N4 C5 122.6(4) . . ?
C15 N4 C5 125.4(5) . . ?
N4 N5 C17 105.0(4) . . ?
C22 N6 C18 116.9(5) . . ?
C22 N6 Ag1 120.5(4) . . ?
C18 N6 Ag1 121.3(3) . . ?
C23 N7 N8 112.2(4) . . ?
C23 N7 C6 125.1(5) . . ?
N8 N7 C6 122.4(4) . . ?
C25 N8 N7 104.1(4) . . ?
C25 N8 Ag2 114.6(3) . . ?
N7 N8 Ag2 140.6(3) . . ?
C26 N9 C30 117.5(5) . . ?
C26 N9 Ag2 115.6(3) . . ?
C30 N9 Ag2 126.5(4) . . ?
O6 N10 O4 120.3(9) . . ?
O6 N10 O5 117.7(10) . . ?
O4 N10 O5 122.0(9) . . ?
C34 O1 Ag1 118.4(3) . . ?
C34 O2 Ag2 133.1(4) . . ?
O3' O3 C36 45.2(14) . . ?
O3' O3 C36 38.0(14) . 2_556 ?
C36 O3 C36 7.5(7) . 2_556 ?
O3 O3' C36 94(2) . . ?
O3 O3' C36 120.7(19) . 2_556 ?
C36 O3' C36 26.8(10) . 2_556 ?
O3 O3' O3' 153.3(18) . 2_556 ?
C36 O3' O3' 59.6(12) . 2_556 ?
C36 O3' O3' 33.6(8) 2_556 2_556 ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O1 Ag1 Ag2 O2 -7.15(18) . . . . ?
N6 Ag1 Ag2 O2 126.3(2) . . . . ?
N2 Ag1 Ag2 O2 -124.0(3) . . . . ?
N3 Ag1 Ag2 O2 83.9(3) . . . . ?
O1 Ag1 Ag2 N8 139.58(15) . . . . ?
N6 Ag1 Ag2 N8 -86.95(16) . . . . ?
N2 Ag1 Ag2 N8 22.8(2) . . . . ?
N3 Ag1 Ag2 N8 -129.4(3) . . . . ?
O1 Ag1 Ag2 N9 -136.74(16) . . . . ?
N6 Ag1 Ag2 N9 -3.27(16) . . . . ?
N2 Ag1 Ag2 N9 106.4(2) . . . . ?
N3 Ag1 Ag2 N9 -45.7(3) . . . . ?
C3 C1 C2 C3 1.8(8) 5_556 . . . ?
C4 C1 C2 C3 -170.1(5) . . . . ?
C3 C1 C2 C5 -174.9(4) 5_556 . . . ?
C4 C1 C2 C5 13.1(7) . . . . ?
C1 C2 C3 C1 -1.9(8) . . . 5_556 ?
C5 C2 C3 C1 174.9(4) . . . 5_556 ?
C1 C2 C3 C6 170.7(4) . . . . ?
C5 C2 C3 C6 -12.6(7) . . . . ?
C3 C1 C4 N1 97.8(7) 5_556 . . . ?
C2 C1 C4 N1 -90.2(7) . . . . ?
C3 C2 C5 N4 -79.6(7) . . . . ?
C1 C2 C5 N4 97.2(6) . . . . ?
C2 C3 C6 N7 81.4(7) . . . . ?
C1 C3 C6 N7 -106.0(7) 5_556 . . . ?
N1 C7 C8 C9 -0.2(7) . . . . ?
C7 C8 C9 N2 -1.2(7) . . . . ?
C7 C8 C9 C10 176.5(6) . . . . ?
N2 C9 C10 N3 -8.9(8) . . . . ?
C8 C9 C10 N3 173.7(6) . . . . ?
N2 C9 C10 C11 168.5(6) . . . . ?
C8 C9 C10 C11 -8.9(9) . . . . ?
N3 C10 C11 C12 1.1(11) . . . . ?
C9 C10 C11 C12 -176.2(7) . . . . ?
C10 C11 C12 C13 -0.7(14) . . . . ?
C11 C12 C13 C14 -0.3(16) . . . . ?
C12 C13 C14 N3 1.0(14) . . . . ?
N4 C15 C16 C17 -1.4(7) . . . . ?
C15 C16 C17 N5 0.9(7) . . . . ?
C15 C16 C17 C18 177.2(6) . . . . ?
N5 C17 C18 N6 1.7(8) . . . . ?
C16 C17 C18 N6 -174.2(6) . . . . ?
N5 C17 C18 C19 -179.1(5) . . . . ?
C16 C17 C18 C19 5.0(9) . . . . ?
N6 C18 C19 C20 0.7(10) . . . . ?
C17 C18 C19 C20 -178.5(6) . . . . ?
C18 C19 C20 C21 -1.2(12) . . . . ?
C19 C20 C21 C22 1.8(12) . . . . ?
C20 C21 C22 N6 -2.0(12) . . . . ?
N7 C23 C24 C25 0.3(7) . . . . ?
C23 C24 C25 N8 0.6(6) . . . . ?
C23 C24 C25 C26 -177.1(5) . . . . ?
N8 C25 C26 N9 1.4(7) . . . . ?
C24 C25 C26 N9 178.9(5) . . . . ?
N8 C25 C26 C27 -176.1(5) . . . . ?
C24 C25 C26 C27 1.4(8) . . . . ?
N9 C26 C27 C28 -0.4(8) . . . . ?
C25 C26 C27 C28 177.1(5) . . . . ?
C26 C27 C28 C29 1.5(10) . . . . ?
C27 C28 C29 C30 -0.5(10) . . . . ?
C28 C29 C30 N9 -1.6(11) . . . . ?
C32 C31 C32 C33 -1.1(3) 2_556 . . . ?
C31 C32 C33 C35 2.2(7) . . . . ?
C31 C32 C33 C34 -174.5(4) . . . . ?
C32 C33 C34 O1 164.8(5) . . . . ?
C35 C33 C34 O1 -11.8(6) . . . . ?
C32 C33 C34 O2 -9.6(7) . . . . ?
C35 C33 C34 O2 173.8(4) . . . . ?
C32 C33 C35 C33 -1.1(3) . . . 2_556 ?
C34 C33 C35 C33 175.4(5) . . . 2_556 ?
C32 C33 C35 C36 -167.1(6) . . . 2_556 ?
C34 C33 C35 C36 9.4(7) . . . 2_556 ?
C32 C33 C35 C36 165.8(7) . . . . ?
C34 C33 C35 C36 -17.6(7) . . . . ?
C33 C35 C36 C36 -80(3) 2_556 . . 2_556 ?
C33 C35 C36 C36 114(3) . . . 2_556 ?
C33 C35 C36 O3' 73(6) 2_556 . . . ?
C33 C35 C36 O3' -94(6) . . . . ?
C36 C35 C36 O3' 152(9) 2_556 . . . ?
C33 C35 C36 O3 91.7(16) 2_556 . . . ?
C33 C35 C36 O3 -74.8(18) . . . . ?
C36 C35 C36 O3 171(5) 2_556 . . . ?
C33 C35 C36 O3' -85.7(15) 2_556 . . 2_556 ?
C33 C35 C36 O3' 107.8(12) . . . 2_556 ?
C36 C35 C36 O3' -6(2) 2_556 . . 2_556 ?
C33 C35 C36 O3 -84.4(9) 2_556 . . 2_556 ?
C33 C35 C36 O3 109.1(6) . . . 2_556 ?
C36 C35 C36 O3 -5(3) 2_556 . . 2_556 ?
C8 C7 N1 N2 1.5(7) . . . . ?
C8 C7 N1 C4 169.3(6) . . . . ?
C1 C4 N1 N2 -30.6(9) . . . . ?
C1 C4 N1 C7 162.9(6) . . . . ?
C8 C9 N2 N1 2.1(6) . . . . ?
C10 C9 N2 N1 -175.8(5) . . . . ?
C8 C9 N2 Ag1 156.0(4) . . . . ?
C10 C9 N2 Ag1 -21.9(6) . . . . ?
C7 N1 N2 C9 -2.2(6) . . . . ?
C4 N1 N2 C9 -170.4(5) . . . . ?
C7 N1 N2 Ag1 -149.4(4) . . . . ?
C4 N1 N2 Ag1 42.4(7) . . . . ?
O1 Ag1 N2 C9 114.0(4) . . . . ?
N6 Ag1 N2 C9 -42.3(4) . . . . ?
N3 Ag1 N2 C9 26.1(4) . . . . ?
Ag2 Ag1 N2 C9 -136.9(3) . . . . ?
O1 Ag1 N2 N1 -100.9(5) . . . . ?
N6 Ag1 N2 N1 102.8(5) . . . . ?
N3 Ag1 N2 N1 171.3(5) . . . . ?
Ag2 Ag1 N2 N1 8.2(6) . . . . ?
C11 C10 N3 C14 -0.4(10) . . . . ?
C9 C10 N3 C14 176.9(6) . . . . ?
C11 C10 N3 Ag1 -146.3(5) . . . . ?
C9 C10 N3 Ag1 31.0(6) . . . . ?
C13 C14 N3 C10 -0.6(12) . . . . ?
C13 C14 N3 Ag1 140.0(7) . . . . ?
O1 Ag1 N3 C10 -139.4(4) . . . . ?
N6 Ag1 N3 C10 93.8(5) . . . . ?
N2 Ag1 N3 C10 -30.0(4) . . . . ?
Ag2 Ag1 N3 C10 133.5(4) . . . . ?
O1 Ag1 N3 C14 76.6(7) . . . . ?
N6 Ag1 N3 C14 -50.1(7) . . . . ?
N2 Ag1 N3 C14 -173.9(8) . . . . ?
Ag2 Ag1 N3 C14 -10.4(9) . . . . ?
C16 C15 N4 N5 1.5(7) . . . . ?
C16 C15 N4 C5 178.9(6) . . . . ?
C2 C5 N4 N5 -23.8(9) . . . . ?
C2 C5 N4 C15 159.1(6) . . . . ?
C15 N4 N5 C17 -0.9(6) . . . . ?
C5 N4 N5 C17 -178.4(5) . . . . ?
C16 C17 N5 N4 0.0(6) . . . . ?
C18 C17 N5 N4 -176.5(5) . . . . ?
C21 C22 N6 C18 1.5(10) . . . . ?
C21 C22 N6 Ag1 -165.5(6) . . . . ?
C19 C18 N6 C22 -0.8(9) . . . . ?
C17 C18 N6 C22 178.4(5) . . . . ?
C19 C18 N6 Ag1 166.1(5) . . . . ?
C17 C18 N6 Ag1 -14.7(6) . . . . ?
O1 Ag1 N6 C22 -37.5(6) . . . . ?
N2 Ag1 N6 C22 114.2(5) . . . . ?
N3 Ag1 N6 C22 54.8(5) . . . . ?
Ag2 Ag1 N6 C22 -102.1(5) . . . . ?
O1 Ag1 N6 C18 156.1(4) . . . . ?
N2 Ag1 N6 C18 -52.2(5) . . . . ?
N3 Ag1 N6 C18 -111.6(4) . . . . ?
Ag2 Ag1 N6 C18 91.4(4) . . . . ?
C24 C23 N7 N8 -1.2(7) . . . . ?
C24 C23 N7 C6 -175.1(6) . . . . ?
C3 C6 N7 C23 -152.4(6) . . . . ?
C3 C6 N7 N8 34.3(9) . . . . ?
C24 C25 N8 N7 -1.3(6) . . . . ?
C26 C25 N8 N7 176.7(4) . . . . ?
C24 C25 N8 Ag2 -173.4(4) . . . . ?
C26 C25 N8 Ag2 4.5(6) . . . . ?
C23 N7 N8 C25 1.5(6) . . . . ?
C6 N7 N8 C25 175.6(5) . . . . ?
C23 N7 N8 Ag2 170.3(4) . . . . ?
C6 N7 N8 Ag2 -15.6(9) . . . . ?
O2 Ag2 N8 C25 -143.2(4) . . . . ?
N9 Ag2 N8 C25 -5.6(3) . . . . ?
Ag1 Ag2 N8 C25 110.4(3) . . . . ?
O2 Ag2 N8 N7 48.8(7) . . . . ?
N9 Ag2 N8 N7 -173.6(6) . . . . ?
Ag1 Ag2 N8 N7 -57.6(6) . . . . ?
C27 C26 N9 C30 -1.7(8) . . . . ?
C25 C26 N9 C30 -179.2(5) . . . . ?
C27 C26 N9 Ag2 170.9(4) . . . . ?
C25 C26 N9 Ag2 -6.6(6) . . . . ?
C29 C30 N9 C26 2.7(9) . . . . ?
C29 C30 N9 Ag2 -168.9(5) . . . . ?
O2 Ag2 N9 C26 156.9(4) . . . . ?
N8 Ag2 N9 C26 6.4(4) . . . . ?
Ag1 Ag2 N9 C26 -103.8(4) . . . . ?
O2 Ag2 N9 C30 -31.3(6) . . . . ?
N8 Ag2 N9 C30 178.3(5) . . . . ?
Ag1 Ag2 N9 C30 68.0(5) . . . . ?
O2 C34 O1 Ag1 -8.1(8) . . . . ?
C33 C34 O1 Ag1 178.3(3) . . . . ?
N6 Ag1 O1 C34 -48.2(4) . . . . ?
N2 Ag1 O1 C34 158.4(4) . . . . ?
N3 Ag1 O1 C34 -134.2(4) . . . . ?
Ag2 Ag1 O1 C34 10.4(4) . . . . ?
O1 C34 O2 Ag2 -3.3(10) . . . . ?
C33 C34 O2 Ag2 170.5(4) . . . . ?
N8 Ag2 O2 C34 -108.8(6) . . . . ?
N9 Ag2 O2 C34 128.5(5) . . . . ?
Ag1 Ag2 O2 C34 9.2(6) . . . . ?
C36 C36 O3 O3' -15(11) 2_556 . . . ?
O3' C36 O3 O3' 6(3) 2_556 . . . ?
C35 C36 O3 O3' -171(3) . . . . ?
O3 C36 O3 O3' 2(3) 2_556 . . . ?
O3' C36 O3 C36 15(11) . . . 2_556 ?
O3' C36 O3 C36 21(9) 2_556 . . 2_556 ?
C35 C36 O3 C36 -155(12) . . . 2_556 ?
O3 C36 O3 C36 17(8) 2_556 . . 2_556 ?
C36 O3 O3' C36 -3(2) 2_556 . . . ?
C36 O3 O3' C36 3(2) . . . 2_556 ?
C36 O3 O3' O3' -10(4) . . . 2_556 ?
C36 O3 O3' O3' -13(4) 2_556 . . 2_556 ?
C36 C36 O3' O3 174(5) 2_556 . . . ?
O3' C36 O3' O3 -175(2) 2_556 . . . ?
C35 C36 O3' O3 25(7) . . . . ?
O3 C36 O3' O3 -178.9(14) 2_556 . . . ?
O3 C36 O3' C36 -174(5) . . . 2_556 ?
O3' C36 O3' C36 11(4) 2_556 . . 2_556 ?
C35 C36 O3' C36 -149(10) . . . 2_556 ?
O3 C36 O3' C36 7(3) 2_556 . . 2_556 ?
C36 C36 O3' O3' -11(4) 2_556 . . 2_556 ?
O3 C36 O3' O3' 175(2) . . . 2_556 ?
C35 C36 O3' O3' -160(7) . . . 2_556 ?
O3 C36 O3' O3' -4.0(12) 2_556 . . 2_556 ?

_diffrn_measured_fraction_theta_max 0.842
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         1.979
_refine_diff_density_min         -0.582
_refine_diff_density_rms         0.099
_database_code_depnum_ccdc_archive 'CCDC 984127'
#######################################################################
#
#                 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_crystal3

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C34 H26 Ag3 N10 O7'
_chemical_formula_sum            'C34 H26 Ag3 N10 O7'
_chemical_formula_weight         1010.26

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   10.9860(4)
_cell_length_b                   12.3070(5)
_cell_length_c                   13.8910(6)
_cell_angle_alpha                82.446(4)
_cell_angle_beta                 68.707(4)
_cell_angle_gamma                71.970(3)
_cell_volume                     1663.60(12)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4662
_cell_measurement_theta_min      3.1158
_cell_measurement_theta_max      29.0727

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.17
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.017
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             994
_exptl_absorpt_coefficient_mu    1.817
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6595
_exptl_absorpt_correction_T_max  0.7476
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            11955
_diffrn_reflns_av_R_equivalents  0.0222
_diffrn_reflns_av_sigmaI/netI    0.0428
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         3.12
_diffrn_reflns_theta_max         29.13
_reflns_number_total             7492
_reflns_number_gt                5678
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

The distances of C32---H32 and C33---H33 were restrained to 
1.0+-0.001 Å. For O5 and N10, some anisotropic displacement 
ellipsoids were rather elongated which led us to use the SIMU restraints
For O5 and O7, some anisotropic displacement 
ellipsoids were rather elongated which led us to use the ISOR restraints
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0334P)²+3.3535P] where P=(Fo²+2Fc²)/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         7492
_refine_ls_number_parameters     514
_refine_ls_number_restraints     20
_refine_ls_R_factor_all          0.0621
_refine_ls_R_factor_gt           0.0435
_refine_ls_wR_factor_ref         0.1032
_refine_ls_wR_factor_gt          0.0920
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_restrained_S_all      1.029
_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
Ag1 Ag 0.52702(4) 0.16507(3) 0.58614(3) 0.04380(11) Uani 1 1 d . . .
Ag2 Ag 0.72861(4) 0.15374(3) 0.68683(3) 0.04788(12) Uani 1 1 d . . .
Ag3 Ag 0.86980(5) -0.08142(4) 0.81786(3) 0.06290(14) Uani 1 1 d . . .
C1 C 0.9359(4) 0.0961(3) 0.4507(3) 0.0281(8) Uani 1 1 d . . .
C2 C 1.0244(4) 0.1051(3) 0.4993(3) 0.0273(8) Uani 1 1 d . . .
C3 C 1.0876(4) 0.0099(3) 0.5493(3) 0.0289(8) Uani 1 1 d . . .
C5 C 1.0594(4) 0.2167(4) 0.4908(3) 0.0337(9) Uani 1 1 d . . .
H5A H 1.1553 0.1996 0.4812 0.040 Uiso 1 1 calc R . .
H5B H 1.0453 0.2585 0.4296 0.040 Uiso 1 1 calc R . .
C7 C 0.7885(5) 0.4080(4) 0.4380(3) 0.0384(10) Uani 1 1 d . . .
H7 H 0.8542 0.4343 0.3848 0.046 Uiso 1 1 calc R . .
C8 C 0.6786(5) 0.4729(4) 0.5108(4) 0.0417(10) Uani 1 1 d . . .
H8 H 0.6543 0.5516 0.5180 0.050 Uiso 1 1 calc R . .
C9 C 0.6101(4) 0.3963(4) 0.5724(3) 0.0323(9) Uani 1 1 d . . .
C10 C 0.4827(4) 0.4164(4) 0.6634(3) 0.0352(9) Uani 1 1 d . . .
C11 C 0.4152(5) 0.5239(4) 0.7046(4) 0.0495(12) Uani 1 1 d . . .
H11 H 0.4490 0.5859 0.6762 0.059 Uiso 1 1 calc R . .
C12 C 0.2962(6) 0.5373(5) 0.7893(4) 0.0599(14) Uani 1 1 d . . .
H12 H 0.2481 0.6089 0.8178 0.072 Uiso 1 1 calc R . .
C13 C 0.2500(5) 0.4442(5) 0.8305(4) 0.0594(14) Uani 1 1 d . . .
H13 H 0.1716 0.4509 0.8884 0.071 Uiso 1 1 calc R . .
C14 C 0.3222(5) 0.3412(5) 0.7844(4) 0.0534(13) Uani 1 1 d . . .
H14 H 0.2905 0.2782 0.8127 0.064 Uiso 1 1 calc R . .
C15 C 1.0066(5) 0.3853(4) 0.5983(4) 0.0448(11) Uani 1 1 d . . .
H15 H 1.0746 0.4171 0.5550 0.054 Uiso 1 1 calc R . .
C16 C 0.9144(5) 0.4253(4) 0.6924(4) 0.0453(11) Uani 1 1 d . . .
H16 H 0.9063 0.4893 0.7257 0.054 Uiso 1 1 calc R . .
C17 C 0.8349(4) 0.3488(4) 0.7277(3) 0.0347(9) Uani 1 1 d . . .
C18 C 0.7263(4) 0.3424(4) 0.8267(3) 0.0369(9) Uani 1 1 d . . .
C19 C 0.7072(5) 0.4004(4) 0.9128(4) 0.0491(12) Uani 1 1 d . . .
H19 H 0.7603 0.4480 0.9085 0.059 Uiso 1 1 calc R . .
C20 C 0.6083(6) 0.3860(5) 1.0042(4) 0.0606(15) Uani 1 1 d . . .
H20 H 0.5936 0.4243 1.0625 0.073 Uiso 1 1 calc R . .
C21 C 0.5318(6) 0.3157(5) 1.0095(4) 0.0625(15) Uani 1 1 d . . .
H21 H 0.4650 0.3048 1.0712 0.075 Uiso 1 1 calc R . .
C22 C 0.5556(5) 0.2616(5) 0.9218(4) 0.0572(14) Uani 1 1 d . . .
H22 H 0.5021 0.2146 0.9253 0.069 Uiso 1 1 calc R . .
C23 C 1.1441(4) 0.1634(4) 0.7297(3) 0.0382(10) Uani 1 1 d . . .
H23 H 1.2082 0.2006 0.6894 0.046 Uiso 1 1 calc R . .
C24 C 1.0621(4) 0.1852(4) 0.8305(3) 0.0396(10) Uani 1 1 d . . .
H24 H 1.0594 0.2395 0.8725 0.048 Uiso 1 1 calc R . .
C25 C 0.9835(4) 0.1086(4) 0.8569(3) 0.0343(9) Uani 1 1 d . . .
C26 C 0.8795(4) 0.0946(4) 0.9570(3) 0.0390(10) Uani 1 1 d . . .
C27 C 0.8588(5) 0.1545(5) 1.0428(3) 0.0495(12) Uani 1 1 d . . .
H27 H 0.9089 0.2051 1.0372 0.059 Uiso 1 1 calc R . .
C28 C 0.7634(6) 0.1376(5) 1.1355(4) 0.0582(15) Uani 1 1 d . . .
H28 H 0.7475 0.1774 1.1934 0.070 Uiso 1 1 calc R . .
C29 C 0.6919(5) 0.0619(5) 1.1419(4) 0.0622(16) Uani 1 1 d . . .
H29 H 0.6275 0.0487 1.2042 0.075 Uiso 1 1 calc R . .
C30 C 0.7176(5) 0.0058(5) 1.0544(4) 0.0574(14) Uani 1 1 d . . .
H30 H 0.6689 -0.0457 1.0590 0.069 Uiso 1 1 calc R . .
C31 C 0.6518(4) -0.0681(4) 0.6922(3) 0.0334(9) Uani 1 1 d . . .
C34 C 0.5577(4) -0.2218(3) 0.5928(3) 0.0329(9) Uani 1 1 d . . .
N1 N 0.7851(3) 0.2982(3) 0.4567(3) 0.0318(7) Uani 1 1 d . . .
N2 N 0.6758(3) 0.2891(3) 0.5388(2) 0.0322(7) Uani 1 1 d . . .
N3 N 0.4359(4) 0.3253(3) 0.7009(3) 0.0420(9) Uani 1 1 d . . .
N4 N 0.9802(3) 0.2907(3) 0.5802(3) 0.0320(7) Uani 1 1 d . . .
N5 N 0.8758(3) 0.2678(3) 0.6587(2) 0.0311(7) Uani 1 1 d . . .
N6 N 0.6516(4) 0.2725(3) 0.8310(3) 0.0431(9) Uani 1 1 d . . .
N7 N 1.1141(3) 0.0779(3) 0.7001(2) 0.0300(7) Uani 1 1 d . . .
N8 N 1.0164(3) 0.0415(3) 0.7766(2) 0.0315(7) Uani 1 1 d . . .
N9 N 0.8095(4) 0.0214(4) 0.9623(3) 0.0455(9) Uani 1 1 d . . .
N10 N 0.8920(7) -0.3294(6) 0.8904(5) 0.0867(12) Uani 1 1 d U . .
O1 O 0.5799(4) -0.0178(3) 0.6387(3) 0.0488(8) Uani 1 1 d . . .
O2 O 0.7188(4) -0.0242(3) 0.7232(3) 0.0517(9) Uani 1 1 d . . .
O3 O 0.6377(3) -0.2211(3) 0.5009(2) 0.0456(8) Uani 1 1 d . . .
O4 O 0.4327(3) -0.2043(3) 0.6189(2) 0.0464(8) Uani 1 1 d . . .
O5 O 0.9302(5) -0.2865(5) 0.8059(4) 0.0920(12) Uani 1 1 d U . .
O6 O 0.9033(6) -0.4308(5) 0.9033(4) 0.1058(18) Uani 1 1 d . . .
O7 O 0.9106(18) -0.2821(15) 0.9508(13) 0.147(6) Uani 0.50 1 d PU . .
O7' O 0.7985(14) -0.2548(8) 0.9581(8) 0.124(5) Uani 0.50 1 d P . .
C4 C 0.8731(5) 0.1998(4) 0.3930(3) 0.0347(9) Uani 1 1 d . . .
H4A H 0.941(5) 0.226(4) 0.342(3) 0.042 Uiso 1 1 d . . .
H4B H 0.825(5) 0.179(4) 0.362(3) 0.042 Uiso 1 1 d . . .
C6 C 1.1846(4) 0.0218(4) 0.5997(3) 0.0314(9) Uani 1 1 d . . .
H6A H 1.245(5) -0.049(4) 0.609(3) 0.038 Uiso 1 1 d . . .
H6B H 1.236(5) 0.067(4) 0.563(3) 0.038 Uiso 1 1 d . . .
C32 C 0.6600(4) -0.1915(4) 0.7200(3) 0.0355(9) Uani 1 1 d D . .
H32 H 0.696(4) -0.225(4) 0.777(2) 0.043 Uiso 1 1 d D . .
C33 C 0.6194(4) -0.2566(4) 0.6758(3) 0.0335(9) Uani 1 1 d D . .
H33 H 0.635(4) -0.3383(11) 0.700(3) 0.040 Uiso 1 1 d D . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 O1 2.237(3) . ?
Ag1 O3 2.411(3) 2_656 ?
Ag1 N3 2.424(4) . ?
Ag1 N2 2.436(3) . ?
Ag1 Ag2 2.9812(5) . ?
Ag2 O2 2.209(3) . ?
Ag2 N5 2.354(3) . ?
Ag2 N6 2.374(4) . ?
Ag2 N2 2.591(3) . ?
Ag3 N9 2.291(4) . ?
Ag3 O2 2.366(3) . ?
Ag3 N8 2.412(3) . ?
Ag3 O5 2.415(5) . ?
C1 C3 1.405(5) 2_756 ?
C1 C2 1.406(5) . ?
C1 C4 1.528(6) . ?
C2 C3 1.404(6) . ?
C2 C5 1.517(5) . ?
C3 C1 1.405(5) 2_756 ?
C3 C6 1.521(5) . ?
C5 N4 1.467(5) . ?
C5 H5A 0.9700 . ?
C5 H5B 0.9700 . ?
C7 N1 1.352(5) . ?
C7 C8 1.359(6) . ?
C7 H7 0.9300 . ?
C8 C9 1.396(6) . ?
C8 H8 0.9300 . ?
C9 N2 1.344(5) . ?
C9 C10 1.483(6) . ?
C10 N3 1.342(5) . ?
C10 C11 1.383(6) . ?
C11 C12 1.386(7) . ?
C11 H11 0.9300 . ?
C12 C13 1.369(8) . ?
C12 H12 0.9300 . ?
C13 C14 1.367(7) . ?
C13 H13 0.9300 . ?
C14 N3 1.342(6) . ?
C14 H14 0.9300 . ?
C15 N4 1.358(5) . ?
C15 C16 1.369(6) . ?
C15 H15 0.9300 . ?
C16 C17 1.403(6) . ?
C16 H16 0.9300 . ?
C17 N5 1.332(5) . ?
C17 C18 1.469(6) . ?
C18 N6 1.345(6) . ?
C18 C19 1.390(6) . ?
C19 C20 1.372(7) . ?
C19 H19 0.9300 . ?
C20 C21 1.359(8) . ?
C20 H20 0.9300 . ?
C21 C22 1.368(8) . ?
C21 H21 0.9300 . ?
C22 N6 1.340(6) . ?
C22 H22 0.9300 . ?
C23 N7 1.347(5) . ?
C23 C24 1.370(6) . ?
C23 H23 0.9300 . ?
C24 C25 1.397(6) . ?
C24 H24 0.9300 . ?
C25 N8 1.350(5) . ?
C25 C26 1.474(6) . ?
C26 N9 1.335(6) . ?
C26 C27 1.394(6) . ?
C27 C28 1.373(7) . ?
C27 H27 0.9300 . ?
C28 C29 1.369(8) . ?
C28 H28 0.9300 . ?
C29 C30 1.374(8) . ?
C29 H29 0.9300 . ?
C30 N9 1.345(6) . ?
C30 H30 0.9300 . ?
C31 O2 1.247(5) . ?
C31 O1 1.249(5) . ?
C31 C32 1.500(6) . ?
C34 O4 1.241(5) . ?
C34 O3 1.260(5) . ?
C34 C33 1.494(6) . ?
N1 N2 1.344(4) . ?
N1 C4 1.457(5) . ?
N4 N5 1.340(4) . ?
N7 N8 1.352(4) . ?
N7 C6 1.468(5) . ?
N10 O7 1.187(16) . ?
N10 O5 1.204(7) . ?
N10 O6 1.211(7) . ?
N10 O7' 1.313(11) . ?
O3 Ag1 2.411(3) 2_656 ?
O7 O7' 1.141(18) . ?
C4 H4A 0.93(5) . ?
C4 H4B 0.89(5) . ?
C6 H6A 0.94(5) . ?
C6 H6B 0.89(4) . ?
C32 C33 1.329(6) . ?
C32 H32 0.9999(10) . ?
C33 H33 1.0000(10) . ?

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
O1 Ag1 O3 116.61(11) . 2_656 ?
O1 Ag1 N3 123.79(13) . . ?
O3 Ag1 N3 98.36(12) 2_656 . ?
O1 Ag1 N2 125.90(12) . . ?
O3 Ag1 N2 112.02(11) 2_656 . ?
N3 Ag1 N2 68.28(11) . . ?
O1 Ag1 Ag2 76.90(8) . . ?
O3 Ag1 Ag2 166.48(8) 2_656 . ?
N3 Ag1 Ag2 71.96(9) . . ?
N2 Ag1 Ag2 56.05(8) . . ?
O2 Ag2 N5 141.56(12) . . ?
O2 Ag2 N6 115.85(13) . . ?
N5 Ag2 N6 70.61(12) . . ?
O2 Ag2 N2 129.12(11) . . ?
N5 Ag2 N2 78.70(11) . . ?
N6 Ag2 N2 105.46(12) . . ?
O2 Ag2 Ag1 83.15(9) . . ?
N5 Ag2 Ag1 129.93(8) . . ?
N6 Ag2 Ag1 116.65(9) . . ?
N2 Ag2 Ag1 51.27(7) . . ?
N9 Ag3 O2 115.90(13) . . ?
N9 Ag3 N8 72.83(12) . . ?
O2 Ag3 N8 110.70(11) . . ?
N9 Ag3 O5 127.38(16) . . ?
O2 Ag3 O5 100.24(15) . . ?
N8 Ag3 O5 129.16(14) . . ?
C3 C1 C2 119.6(4) 2_756 . ?
C3 C1 C4 120.7(3) 2_756 . ?
C2 C1 C4 119.6(4) . . ?
C3 C2 C1 120.7(3) . . ?
C3 C2 C5 119.8(3) . . ?
C1 C2 C5 119.4(4) . . ?
C2 C3 C1 119.7(3) . 2_756 ?
C2 C3 C6 119.5(4) . . ?
C1 C3 C6 120.8(4) 2_756 . ?
N4 C5 C2 114.7(3) . . ?
N4 C5 H5A 108.6 . . ?
C2 C5 H5A 108.6 . . ?
N4 C5 H5B 108.6 . . ?
C2 C5 H5B 108.6 . . ?
H5A C5 H5B 107.6 . . ?
N1 C7 C8 107.6(4) . . ?
N1 C7 H7 126.2 . . ?
C8 C7 H7 126.2 . . ?
C7 C8 C9 105.3(4) . . ?
C7 C8 H8 127.4 . . ?
C9 C8 H8 127.4 . . ?
N2 C9 C8 110.6(4) . . ?
N2 C9 C10 119.0(4) . . ?
C8 C9 C10 130.5(4) . . ?
N3 C10 C11 122.5(4) . . ?
N3 C10 C9 116.1(4) . . ?
C11 C10 C9 121.3(4) . . ?
C10 C11 C12 118.6(5) . . ?
C10 C11 H11 120.7 . . ?
C12 C11 H11 120.7 . . ?
C13 C12 C11 119.5(5) . . ?
C13 C12 H12 120.3 . . ?
C11 C12 H12 120.3 . . ?
C14 C13 C12 118.2(5) . . ?
C14 C13 H13 120.9 . . ?
C12 C13 H13 120.9 . . ?
N3 C14 C13 124.1(5) . . ?
N3 C14 H14 117.9 . . ?
C13 C14 H14 117.9 . . ?
N4 C15 C16 107.2(4) . . ?
N4 C15 H15 126.4 . . ?
C16 C15 H15 126.4 . . ?
C15 C16 C17 105.1(4) . . ?
C15 C16 H16 127.5 . . ?
C17 C16 H16 127.5 . . ?
N5 C17 C16 110.4(4) . . ?
N5 C17 C18 119.1(4) . . ?
C16 C17 C18 130.4(4) . . ?
N6 C18 C19 121.9(4) . . ?
N6 C18 C17 116.3(4) . . ?
C19 C18 C17 121.8(4) . . ?
C20 C19 C18 118.6(5) . . ?
C20 C19 H19 120.7 . . ?
C18 C19 H19 120.7 . . ?
C21 C20 C19 120.1(5) . . ?
C21 C20 H20 119.9 . . ?
C19 C20 H20 119.9 . . ?
C20 C21 C22 118.2(5) . . ?
C20 C21 H21 120.9 . . ?
C22 C21 H21 120.9 . . ?
N6 C22 C21 123.8(5) . . ?
N6 C22 H22 118.1 . . ?
C21 C22 H22 118.1 . . ?
N7 C23 C24 106.9(4) . . ?
N7 C23 H23 126.5 . . ?
C24 C23 H23 126.5 . . ?
C23 C24 C25 105.5(4) . . ?
C23 C24 H24 127.3 . . ?
C25 C24 H24 127.3 . . ?
N8 C25 C24 110.8(3) . . ?
N8 C25 C26 121.1(4) . . ?
C24 C25 C26 128.1(4) . . ?
N9 C26 C27 122.0(4) . . ?
N9 C26 C25 117.6(4) . . ?
C27 C26 C25 120.4(4) . . ?
C28 C27 C26 119.0(5) . . ?
C28 C27 H27 120.5 . . ?
C26 C27 H27 120.5 . . ?
C29 C28 C27 119.4(5) . . ?
C29 C28 H28 120.3 . . ?
C27 C28 H28 120.3 . . ?
C28 C29 C30 118.5(5) . . ?
C28 C29 H29 120.7 . . ?
C30 C29 H29 120.7 . . ?
N9 C30 C29 123.4(5) . . ?
N9 C30 H30 118.3 . . ?
C29 C30 H30 118.3 . . ?
O2 C31 O1 125.1(4) . . ?
O2 C31 C32 117.4(4) . . ?
O1 C31 C32 117.4(4) . . ?
O4 C34 O3 125.0(4) . . ?
O4 C34 C33 117.3(4) . . ?
O3 C34 C33 117.5(4) . . ?
N2 N1 C7 111.3(3) . . ?
N2 N1 C4 120.8(3) . . ?
C7 N1 C4 127.4(4) . . ?
C9 N2 N1 105.2(3) . . ?
C9 N2 Ag1 113.1(2) . . ?
N1 N2 Ag1 134.7(2) . . ?
C9 N2 Ag2 110.7(2) . . ?
N1 N2 Ag2 115.4(2) . . ?
Ag1 N2 Ag2 72.68(9) . . ?
C10 N3 C14 117.1(4) . . ?
C10 N3 Ag1 115.9(3) . . ?
C14 N3 Ag1 124.8(3) . . ?
N5 N4 C15 111.1(3) . . ?
N5 N4 C5 123.1(3) . . ?
C15 N4 C5 125.7(3) . . ?
C17 N5 N4 106.2(3) . . ?
C17 N5 Ag2 115.5(3) . . ?
N4 N5 Ag2 136.7(2) . . ?
C22 N6 C18 117.4(4) . . ?
C22 N6 Ag2 125.2(3) . . ?
C18 N6 Ag2 116.4(3) . . ?
C23 N7 N8 112.4(3) . . ?
C23 N7 C6 125.3(3) . . ?
N8 N7 C6 122.1(3) . . ?
C25 N8 N7 104.4(3) . . ?
C25 N8 Ag3 110.8(2) . . ?
N7 N8 Ag3 144.4(2) . . ?
C26 N9 C30 117.6(4) . . ?
C26 N9 Ag3 117.3(3) . . ?
C30 N9 Ag3 124.7(4) . . ?
O7 N10 O5 109.3(10) . . ?
O7 N10 O6 118.3(11) . . ?
O5 N10 O6 122.3(7) . . ?
O7 N10 O7' 54.0(9) . . ?
O5 N10 O7' 112.1(8) . . ?
O6 N10 O7' 121.5(7) . . ?
C31 O1 Ag1 130.6(3) . . ?
C31 O2 Ag2 123.8(3) . . ?
C31 O2 Ag3 137.8(3) . . ?
Ag2 O2 Ag3 98.28(11) . . ?
C34 O3 Ag1 99.1(3) . 2_656 ?
N10 O5 Ag3 110.3(5) . . ?
O7' O7 N10 68.6(12) . . ?
O7 O7' N10 57.3(9) . . ?
N1 C4 C1 115.0(3) . . ?
N1 C4 H4A 105(3) . . ?
C1 C4 H4A 111(3) . . ?
N1 C4 H4B 109(3) . . ?
C1 C4 H4B 109(3) . . ?
H4A C4 H4B 109(4) . . ?
N7 C6 C3 113.2(3) . . ?
N7 C6 H6A 109(3) . . ?
C3 C6 H6A 112(3) . . ?
N7 C6 H6B 103(3) . . ?
C3 C6 H6B 112(3) . . ?
H6A C6 H6B 107(4) . . ?
C33 C32 C31 124.4(4) . . ?
C33 C32 H32 119(3) . . ?
C31 C32 H32 117(3) . . ?
C32 C33 C34 127.2(4) . . ?
C32 C33 H33 115(3) . . ?
C34 C33 H33 117(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O1 Ag1 Ag2 O2 -3.72(13) . . . . ?
O3 Ag1 Ag2 O2 174.4(3) 2_656 . . . ?
N3 Ag1 Ag2 O2 128.84(13) . . . . ?
N2 Ag1 Ag2 O2 -155.63(14) . . . . ?
O1 Ag1 Ag2 N5 154.44(14) . . . . ?
O3 Ag1 Ag2 N5 -27.5(3) 2_656 . . . ?
N3 Ag1 Ag2 N5 -73.01(14) . . . . ?
N2 Ag1 Ag2 N5 2.52(14) . . . . ?
O1 Ag1 Ag2 N6 -119.25(14) . . . . ?
O3 Ag1 Ag2 N6 58.8(3) 2_656 . . . ?
N3 Ag1 Ag2 N6 13.31(14) . . . . ?
N2 Ag1 Ag2 N6 88.84(14) . . . . ?
O1 Ag1 Ag2 N2 151.91(13) . . . . ?
O3 Ag1 Ag2 N2 -30.0(3) 2_656 . . . ?
N3 Ag1 Ag2 N2 -75.53(13) . . . . ?
C3 C1 C2 C3 -1.1(6) 2_756 . . . ?
C4 C1 C2 C3 -177.4(3) . . . . ?
C3 C1 C2 C5 174.5(3) 2_756 . . . ?
C4 C1 C2 C5 -1.8(5) . . . . ?
C1 C2 C3 C1 1.1(6) . . . 2_756 ?
C5 C2 C3 C1 -174.5(3) . . . 2_756 ?
C1 C2 C3 C6 179.1(3) . . . . ?
C5 C2 C3 C6 3.5(5) . . . . ?
C3 C2 C5 N4 -85.9(4) . . . . ?
C1 C2 C5 N4 98.4(4) . . . . ?
N1 C7 C8 C9 -0.5(5) . . . . ?
C7 C8 C9 N2 0.2(5) . . . . ?
C7 C8 C9 C10 -179.4(4) . . . . ?
N2 C9 C10 N3 -5.3(6) . . . . ?
C8 C9 C10 N3 174.3(4) . . . . ?
N2 C9 C10 C11 176.4(4) . . . . ?
C8 C9 C10 C11 -4.0(7) . . . . ?
N3 C10 C11 C12 1.4(7) . . . . ?
C9 C10 C11 C12 179.6(4) . . . . ?
C10 C11 C12 C13 1.0(8) . . . . ?
C11 C12 C13 C14 -1.7(8) . . . . ?
C12 C13 C14 N3 0.0(9) . . . . ?
N4 C15 C16 C17 0.5(6) . . . . ?
C15 C16 C17 N5 -0.5(5) . . . . ?
C15 C16 C17 C18 175.2(5) . . . . ?
N5 C17 C18 N6 -16.5(6) . . . . ?
C16 C17 C18 N6 168.2(5) . . . . ?
N5 C17 C18 C19 159.9(4) . . . . ?
C16 C17 C18 C19 -15.4(8) . . . . ?
N6 C18 C19 C20 -0.5(7) . . . . ?
C17 C18 C19 C20 -176.7(5) . . . . ?
C18 C19 C20 C21 0.3(8) . . . . ?
C19 C20 C21 C22 -0.5(9) . . . . ?
C20 C21 C22 N6 1.1(9) . . . . ?
N7 C23 C24 C25 -0.3(5) . . . . ?
C23 C24 C25 N8 0.7(5) . . . . ?
C23 C24 C25 C26 179.2(4) . . . . ?
N8 C25 C26 N9 -6.6(6) . . . . ?
C24 C25 C26 N9 175.0(4) . . . . ?
N8 C25 C26 C27 171.9(4) . . . . ?
C24 C25 C26 C27 -6.4(7) . . . . ?
N9 C26 C27 C28 0.0(7) . . . . ?
C25 C26 C27 C28 -178.5(4) . . . . ?
C26 C27 C28 C29 0.7(8) . . . . ?
C27 C28 C29 C30 -0.6(8) . . . . ?
C28 C29 C30 N9 0.0(8) . . . . ?
C8 C7 N1 N2 0.7(5) . . . . ?
C8 C7 N1 C4 172.9(4) . . . . ?
C8 C9 N2 N1 0.2(4) . . . . ?
C10 C9 N2 N1 179.8(3) . . . . ?
C8 C9 N2 Ag1 -155.1(3) . . . . ?
C10 C9 N2 Ag1 24.5(4) . . . . ?
C8 C9 N2 Ag2 125.5(3) . . . . ?
C10 C9 N2 Ag2 -54.8(4) . . . . ?
C7 N1 N2 C9 -0.5(4) . . . . ?
C4 N1 N2 C9 -173.3(3) . . . . ?
C7 N1 N2 Ag1 146.7(3) . . . . ?
C4 N1 N2 Ag1 -26.1(5) . . . . ?
C7 N1 N2 Ag2 -122.9(3) . . . . ?
C4 N1 N2 Ag2 64.3(4) . . . . ?
O1 Ag1 N2 C9 -140.2(3) . . . . ?
O3 Ag1 N2 C9 67.1(3) 2_656 . . . ?
N3 Ag1 N2 C9 -23.4(3) . . . . ?
Ag2 Ag1 N2 C9 -105.7(3) . . . . ?
O1 Ag1 N2 N1 74.4(4) . . . . ?
O3 Ag1 N2 N1 -78.4(4) 2_656 . . . ?
N3 Ag1 N2 N1 -168.8(4) . . . . ?
Ag2 Ag1 N2 N1 108.9(4) . . . . ?
O1 Ag1 N2 Ag2 -34.48(15) . . . . ?
O3 Ag1 N2 Ag2 172.76(8) 2_656 . . . ?
N3 Ag1 N2 Ag2 82.31(12) . . . . ?
O2 Ag2 N2 C9 140.6(3) . . . . ?
N5 Ag2 N2 C9 -69.3(3) . . . . ?
N6 Ag2 N2 C9 -3.3(3) . . . . ?
Ag1 Ag2 N2 C9 108.7(3) . . . . ?
O2 Ag2 N2 N1 -100.0(3) . . . . ?
N5 Ag2 N2 N1 50.1(3) . . . . ?
N6 Ag2 N2 N1 116.1(3) . . . . ?
Ag1 Ag2 N2 N1 -131.9(3) . . . . ?
O2 Ag2 N2 Ag1 31.87(17) . . . . ?
N5 Ag2 N2 Ag1 -178.03(11) . . . . ?
N6 Ag2 N2 Ag1 -112.01(11) . . . . ?
C11 C10 N3 C14 -3.0(7) . . . . ?
C9 C10 N3 C14 178.7(4) . . . . ?
C11 C10 N3 Ag1 161.0(4) . . . . ?
C9 C10 N3 Ag1 -17.3(5) . . . . ?
C13 C14 N3 C10 2.3(8) . . . . ?
C13 C14 N3 Ag1 -160.0(4) . . . . ?
O1 Ag1 N3 C10 141.0(3) . . . . ?
O3 Ag1 N3 C10 -89.0(3) 2_656 . . . ?
N2 Ag1 N3 C10 21.4(3) . . . . ?
Ag2 Ag1 N3 C10 81.3(3) . . . . ?
O1 Ag1 N3 C14 -56.5(4) . . . . ?
O3 Ag1 N3 C14 73.5(4) 2_656 . . . ?
N2 Ag1 N3 C14 -176.0(4) . . . . ?
Ag2 Ag1 N3 C14 -116.2(4) . . . . ?
C16 C15 N4 N5 -0.4(5) . . . . ?
C16 C15 N4 C5 -176.4(4) . . . . ?
C2 C5 N4 N5 -6.5(5) . . . . ?
C2 C5 N4 C15 169.0(4) . . . . ?
C16 C17 N5 N4 0.2(5) . . . . ?
C18 C17 N5 N4 -176.0(4) . . . . ?
C16 C17 N5 Ag2 -167.9(3) . . . . ?
C18 C17 N5 Ag2 15.9(5) . . . . ?
C15 N4 N5 C17 0.1(5) . . . . ?
C5 N4 N5 C17 176.2(4) . . . . ?
C15 N4 N5 Ag2 164.4(3) . . . . ?
C5 N4 N5 Ag2 -19.5(6) . . . . ?
O2 Ag2 N5 C17 -115.6(3) . . . . ?
N6 Ag2 N5 C17 -8.2(3) . . . . ?
N2 Ag2 N5 C17 102.8(3) . . . . ?
Ag1 Ag2 N5 C17 100.8(3) . . . . ?
O2 Ag2 N5 N4 81.1(4) . . . . ?
N6 Ag2 N5 N4 -171.4(4) . . . . ?
N2 Ag2 N5 N4 -60.4(4) . . . . ?
Ag1 Ag2 N5 N4 -62.4(4) . . . . ?
C21 C22 N6 C18 -1.2(8) . . . . ?
C21 C22 N6 Ag2 166.7(4) . . . . ?
C19 C18 N6 C22 0.9(7) . . . . ?
C17 C18 N6 C22 177.3(4) . . . . ?
C19 C18 N6 Ag2 -168.1(4) . . . . ?
C17 C18 N6 Ag2 8.3(5) . . . . ?
O2 Ag2 N6 C22 -29.8(4) . . . . ?
N5 Ag2 N6 C22 -168.5(4) . . . . ?
N2 Ag2 N6 C22 119.7(4) . . . . ?
Ag1 Ag2 N6 C22 65.7(4) . . . . ?
O2 Ag2 N6 C18 138.3(3) . . . . ?
N5 Ag2 N6 C18 -0.5(3) . . . . ?
N2 Ag2 N6 C18 -72.3(3) . . . . ?
Ag1 Ag2 N6 C18 -126.3(3) . . . . ?
C24 C23 N7 N8 -0.2(5) . . . . ?
C24 C23 N7 C6 -175.6(4) . . . . ?
C24 C25 N8 N7 -0.8(5) . . . . ?
C26 C25 N8 N7 -179.5(4) . . . . ?
C24 C25 N8 Ag3 -175.9(3) . . . . ?
C26 C25 N8 Ag3 5.5(5) . . . . ?
C23 N7 N8 C25 0.6(4) . . . . ?
C6 N7 N8 C25 176.2(4) . . . . ?
C23 N7 N8 Ag3 172.7(4) . . . . ?
C6 N7 N8 Ag3 -11.8(6) . . . . ?
N9 Ag3 N8 C25 -2.4(3) . . . . ?
O2 Ag3 N8 C25 109.4(3) . . . . ?
O5 Ag3 N8 C25 -127.1(3) . . . . ?
N9 Ag3 N8 N7 -174.2(5) . . . . ?
O2 Ag3 N8 N7 -62.4(5) . . . . ?
O5 Ag3 N8 N7 61.2(5) . . . . ?
C27 C26 N9 C30 -0.6(7) . . . . ?
C25 C26 N9 C30 177.9(4) . . . . ?
C27 C26 N9 Ag3 -174.7(4) . . . . ?
C25 C26 N9 Ag3 3.9(5) . . . . ?
C29 C30 N9 C26 0.6(8) . . . . ?
C29 C30 N9 Ag3 174.2(4) . . . . ?
O2 Ag3 N9 C26 -106.0(3) . . . . ?
N8 Ag3 N9 C26 -0.8(3) . . . . ?
O5 Ag3 N9 C26 125.7(3) . . . . ?
O2 Ag3 N9 C30 80.4(4) . . . . ?
N8 Ag3 N9 C30 -174.4(4) . . . . ?
O5 Ag3 N9 C30 -47.8(5) . . . . ?
O2 C31 O1 Ag1 -4.9(6) . . . . ?
C32 C31 O1 Ag1 176.1(3) . . . . ?
O3 Ag1 O1 C31 -173.4(3) 2_656 . . . ?
N3 Ag1 O1 C31 -51.3(4) . . . . ?
N2 Ag1 O1 C31 34.9(4) . . . . ?
Ag2 Ag1 O1 C31 6.1(4) . . . . ?
O1 C31 O2 Ag2 -1.4(6) . . . . ?
C32 C31 O2 Ag2 177.6(3) . . . . ?
O1 C31 O2 Ag3 -177.7(3) . . . . ?
C32 C31 O2 Ag3 1.3(6) . . . . ?
N5 Ag2 O2 C31 -148.3(3) . . . . ?
N6 Ag2 O2 C31 120.7(3) . . . . ?
N2 Ag2 O2 C31 -20.2(4) . . . . ?
Ag1 Ag2 O2 C31 4.3(3) . . . . ?
N5 Ag2 O2 Ag3 29.1(2) . . . . ?
N6 Ag2 O2 Ag3 -61.86(17) . . . . ?
N2 Ag2 O2 Ag3 157.28(10) . . . . ?
Ag1 Ag2 O2 Ag3 -178.21(12) . . . . ?
N9 Ag3 O2 C31 -123.7(4) . . . . ?
N8 Ag3 O2 C31 155.9(4) . . . . ?
O5 Ag3 O2 C31 16.9(5) . . . . ?
N9 Ag3 O2 Ag2 59.42(17) . . . . ?
N8 Ag3 O2 Ag2 -20.95(16) . . . . ?
O5 Ag3 O2 Ag2 -159.90(15) . . . . ?
O4 C34 O3 Ag1 4.1(5) . . . 2_656 ?
C33 C34 O3 Ag1 178.2(3) . . . 2_656 ?
O7 N10 O5 Ag3 -40.0(12) . . . . ?
O6 N10 O5 Ag3 175.3(6) . . . . ?
O7' N10 O5 Ag3 18.0(11) . . . . ?
N9 Ag3 O5 N10 17.7(6) . . . . ?
O2 Ag3 O5 N10 -116.5(5) . . . . ?
N8 Ag3 O5 N10 115.9(5) . . . . ?
O5 N10 O7 O7' 103.7(11) . . . . ?
O6 N10 O7 O7' -110.0(11) . . . . ?
O5 N10 O7' O7 -98.4(14) . . . . ?
O6 N10 O7' O7 104.0(14) . . . . ?
N2 N1 C4 C1 -57.6(5) . . . . ?
C7 N1 C4 C1 130.8(4) . . . . ?
C3 C1 C4 N1 121.3(4) 2_756 . . . ?
C2 C1 C4 N1 -62.5(5) . . . . ?
C23 N7 C6 C3 -132.5(4) . . . . ?
N8 N7 C6 C3 52.6(5) . . . . ?
C2 C3 C6 N7 78.0(4) . . . . ?
C1 C3 C6 N7 -104.1(4) 2_756 . . . ?
O2 C31 C32 C33 -165.2(4) . . . . ?
O1 C31 C32 C33 13.9(6) . . . . ?
C31 C32 C33 C34 -0.6(7) . . . . ?
O4 C34 C33 C32 -103.0(5) . . . . ?
O3 C34 C33 C32 82.4(6) . . . . ?

_diffrn_measured_fraction_theta_max 0.838
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         1.274
_refine_diff_density_min         -1.035
_refine_diff_density_rms         0.098
_database_code_depnum_ccdc_archive 'CCDC 984128'
#######################################################################
#
#                 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_crystal4

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C74 H58 Ag6 N22 O16'
_chemical_formula_sum            'C74 H58 Ag6 N22 O16'
_chemical_formula_weight         2158.64

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   13.0400(8)
_cell_length_b                   13.9500(11)
_cell_length_c                   22.5400(15)
_cell_angle_alpha                107.566(7)
_cell_angle_beta                 96.682(5)
_cell_angle_gamma                96.412(6)
_cell_volume                     3835.5(5)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    3940
_cell_measurement_theta_min      3.0561
_cell_measurement_theta_max      29.1570

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.22
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.869
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2132
_exptl_absorpt_coefficient_mu    1.585
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.68136
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            24313
_diffrn_reflns_av_R_equivalents  0.0697
_diffrn_reflns_av_sigmaI/netI    0.1534
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         3.10
_diffrn_reflns_theta_max         25.35
_reflns_number_total             13752
_reflns_number_gt                6389
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

The distance of H7B---H12B, H8A---H9B, H7A---H8B and H11B---H12A were restrained to 2.01+-0.001 Å. For C13, C14, C21, C22, C44, C59, O12, O13, O13', O14, O1w, O1w', O2w and O2w', some anisotropic displacement ellipsoids 
were rather elongated which led us to use the ISOR restraints. For N4, C21, C22 and C23, some anisotropic displacement ellipsoids were rather elongated which led us to use the DELU restraints.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0959P)²+0.0000P] where P=(Fo²+2Fc²)/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         13752
_refine_ls_number_parameters     1090
_refine_ls_number_restraints     1629
_refine_ls_R_factor_all          0.1821
_refine_ls_R_factor_gt           0.0841
_refine_ls_wR_factor_ref         0.2334
_refine_ls_wR_factor_gt          0.1783
_refine_ls_goodness_of_fit_ref   0.988
_refine_ls_restrained_S_all      0.955
_refine_ls_shift/su_max          0.072
_refine_ls_shift/su_mean         0.001

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 0.02725(8) 0.19516(7) 0.16473(4) 0.0806(3) Uani 1 1 d . . .
Ag2 Ag 0.23951(6) 0.40585(5) 0.17049(3) 0.0519(2) Uani 1 1 d . . .
Ag3 Ag 0.18521(5) 0.47699(6) 0.05807(3) 0.0547(2) Uani 1 1 d . . .
Ag4 Ag 0.17634(7) 0.86086(6) 0.38438(4) 0.0670(2) Uani 1 1 d . . .
Ag5 Ag -0.08102(6) 0.69284(7) 0.33174(3) 0.0668(2) Uani 1 1 d . . .
Ag6 Ag -0.12838(6) 0.56272(6) 0.41540(3) 0.0653(2) Uani 1 1 d . . .
C1 C 0.0602(7) 0.4724(7) 0.2921(4) 0.0527(14) Uani 1 1 d U . .
C2 C 0.1603(7) 0.5311(7) 0.3053(4) 0.0534(14) Uani 1 1 d U . .
C3 C 0.1821(7) 0.5977(7) 0.2728(4) 0.0472(14) Uani 1 1 d U . .
C4 C 0.1011(7) 0.6123(7) 0.2284(4) 0.0488(15) Uani 1 1 d U . .
C5 C 0.0071(7) 0.5471(7) 0.2133(4) 0.0531(16) Uani 1 1 d U . .
C6 C -0.0144(7) 0.4771(7) 0.2457(4) 0.0556(15) Uani 1 1 d U . .
C7 C 0.03530(9) 0.4076(3) 0.33654(8) 0.0649(16) Uani 1 1 d U . .
H7A H 0.0521 0.4510 0.3801 0.078 Uiso 1 1 calc RD . .
H7B H -0.0388 0.3812 0.3280 0.078 Uiso 1 1 calc RD . .
C8 C 0.24054(11) 0.52772(19) 0.35929(11) 0.0607(14) Uani 1 1 d U . .
H8A H 0.2763 0.5960 0.3823 0.073 Uiso 1 1 calc RD . .
H8B H 0.2052 0.5018 0.3881 0.073 Uiso 1 1 calc RD . .
C9 C 0.2891(5) 0.6641(4) 0.2847(2) 0.0564(16) Uani 1 1 d U . .
H9A H 0.2797 0.7349 0.3008 0.068 Uiso 1 1 calc R . .
H9B H 0.3335 0.6497 0.3175 0.068 Uiso 1 1 calc RD . .
C10 C 0.1257(8) 0.6937(7) 0.1982(4) 0.0569(15) Uani 1 1 d U . .
H10A H 0.2001 0.7190 0.2086 0.068 Uiso 1 1 calc R . .
H10B H 0.1090 0.6634 0.1527 0.068 Uiso 1 1 calc R . .
C11 C -0.0700(6) 0.55152(13) 0.15719(14) 0.0583(15) Uani 1 1 d U . .
H11A H -0.0300 0.5669 0.1266 0.070 Uiso 1 1 calc R . .
H11B H -0.1111 0.4846 0.1371 0.070 Uiso 1 1 calc RD . .
C12 C -0.1224(3) 0.4048(2) 0.22392(11) 0.0629(16) Uani 1 1 d U . .
H12A H -0.1339 0.3763 0.1783 0.075 Uiso 1 1 calc RD . .
H12B H -0.1192 0.3488 0.2409 0.075 Uiso 1 1 calc RD . .
C13 C 0.1594(9) 0.3084(8) 0.3752(5) 0.0761(17) Uani 1 1 d U . .
H13 H 0.1714 0.3479 0.4174 0.091 Uiso 1 1 calc R . .
C14 C 0.2020(10) 0.2266(8) 0.3493(5) 0.0814(19) Uani 1 1 d U . .
H14 H 0.2506 0.1989 0.3701 0.098 Uiso 1 1 calc R . .
C15 C 0.1608(10) 0.1896(8) 0.2854(5) 0.0792(17) Uani 1 1 d U . .
C16 C 0.1823(10) 0.1057(8) 0.2375(5) 0.0811(18) Uani 1 1 d U . .
C17 C 0.2523(10) 0.0442(9) 0.2516(6) 0.0900(19) Uani 1 1 d U . .
H17 H 0.2842 0.0579 0.2930 0.108 Uiso 1 1 calc R . .
C18 C 0.2733(11) -0.0318(9) 0.2076(6) 0.095(2) Uani 1 1 d U . .
H18 H 0.3210 -0.0714 0.2179 0.114 Uiso 1 1 calc R . .
C19 C 0.2296(11) -0.0538(9) 0.1498(6) 0.095(2) Uani 1 1 d U . .
H19 H 0.2425 -0.1104 0.1187 0.113 Uiso 1 1 calc R . .
C20 C 0.1610(10) 0.0114(8) 0.1352(6) 0.085(2) Uani 1 1 d U . .
H20 H 0.1313 -0.0011 0.0935 0.103 Uiso 1 1 calc R . .
C21 C 0.4057(9) 0.4574(8) 0.3703(5) 0.0799(11) Uani 1 1 d U . .
H21 H 0.4310 0.4963 0.4120 0.096 Uiso 1 1 calc R . .
C22 C 0.4499(10) 0.3859(9) 0.3335(5) 0.0869(13) Uani 1 1 d U . .
H22 H 0.5118 0.3636 0.3443 0.104 Uiso 1 1 calc R . .
C23 C 0.3844(10) 0.3510(9) 0.2755(5) 0.0809(15) Uani 1 1 d U . .
C24 C 0.4028(10) 0.2766(9) 0.2172(5) 0.0820(17) Uani 1 1 d U . .
C25 C 0.4678(10) 0.2052(9) 0.2152(6) 0.0916(19) Uani 1 1 d U . .
H25 H 0.5058 0.2057 0.2528 0.110 Uiso 1 1 calc R . .
C26 C 0.4794(10) 0.1347(9) 0.1617(6) 0.094(2) Uani 1 1 d U . .
H26 H 0.5221 0.0854 0.1613 0.113 Uiso 1 1 calc R . .
C27 C 0.4236(10) 0.1403(9) 0.1074(6) 0.091(2) Uani 1 1 d U . .
H27 H 0.4291 0.0947 0.0686 0.110 Uiso 1 1 calc R . .
C28 C 0.3610(9) 0.2119(8) 0.1105(5) 0.081(2) Uani 1 1 d U . .
H28 H 0.3257 0.2146 0.0729 0.097 Uiso 1 1 calc R . .
C29 C 0.4100(7) 0.7260(7) 0.2271(4) 0.0545(17) Uani 1 1 d U . .
H29 H 0.4238 0.7932 0.2534 0.065 Uiso 1 1 calc R . .
C30 C 0.4559(7) 0.6874(7) 0.1771(4) 0.0515(18) Uani 1 1 d U . .
H30 H 0.5081 0.7207 0.1624 0.062 Uiso 1 1 calc R . .
C31 C 0.4079(7) 0.5848(7) 0.1516(4) 0.0478(16) Uani 1 1 d U . .
C32 C 0.4296(7) 0.5052(7) 0.0989(4) 0.0502(16) Uani 1 1 d U . .
C33 C 0.5317(7) 0.4977(7) 0.0880(4) 0.0554(17) Uani 1 1 d U . .
H33 H 0.5859 0.5471 0.1136 0.066 Uiso 1 1 calc R . .
C34 C 0.5538(8) 0.4204(7) 0.0410(4) 0.0590(19) Uani 1 1 d U . .
H34 H 0.6223 0.4151 0.0344 0.071 Uiso 1 1 calc R . .
C35 C 0.4721(7) 0.3501(7) 0.0035(4) 0.057(2) Uani 1 1 d U . .
H35 H 0.4840 0.2961 -0.0297 0.068 Uiso 1 1 calc R . .
C36 C 0.3727(8) 0.3601(7) 0.0153(4) 0.0579(18) Uani 1 1 d U . .
H36 H 0.3178 0.3112 -0.0101 0.070 Uiso 1 1 calc R . .
C37 C 0.0126(8) 0.8172(7) 0.1796(4) 0.0556(15) Uani 1 1 d U . .
H37 H -0.0032 0.7919 0.1359 0.067 Uiso 1 1 calc R . .
C38 C -0.0164(8) 0.9004(8) 0.2180(4) 0.0636(16) Uani 1 1 d U . .
H38 H -0.0558 0.9446 0.2056 0.076 Uiso 1 1 calc R . .
C39 C 0.0221(8) 0.9083(8) 0.2781(4) 0.0637(16) Uani 1 1 d U . .
C40 C 0.0164(9) 0.9866(8) 0.3376(5) 0.0724(17) Uani 1 1 d U . .
C41 C -0.0419(9) 1.0640(9) 0.3406(5) 0.0811(18) Uani 1 1 d U . .
H41 H -0.0794 1.0679 0.3039 0.097 Uiso 1 1 calc R . .
C42 C -0.0452(10) 1.1341(9) 0.3963(5) 0.088(2) Uani 1 1 d U . .
H42 H -0.0862 1.1851 0.3983 0.106 Uiso 1 1 calc R . .
C43 C 0.0116(10) 1.1298(10) 0.4492(6) 0.092(2) Uani 1 1 d U . .
H43 H 0.0104 1.1781 0.4879 0.111 Uiso 1 1 calc R . .
C44 C 0.0700(10) 1.0551(9) 0.4455(5) 0.086(2) Uani 1 1 d U . .
H44 H 0.1075 1.0511 0.4822 0.104 Uiso 1 1 calc R . .
C45 C -0.2016(7) 0.6501(7) 0.1283(4) 0.0553(18) Uani 1 1 d U . .
H45 H -0.2067 0.6216 0.0849 0.066 Uiso 1 1 calc R . .
C46 C -0.2535(8) 0.7237(7) 0.1583(4) 0.0580(17) Uani 1 1 d U . .
H46 H -0.3005 0.7568 0.1406 0.070 Uiso 1 1 calc R . .
C47 C -0.2204(8) 0.7390(7) 0.2225(4) 0.0603(15) Uani 1 1 d U . .
C48 C -0.2464(8) 0.8126(8) 0.2780(5) 0.0673(15) Uani 1 1 d U . .
C49 C -0.3117(9) 0.8784(8) 0.2752(5) 0.0720(19) Uani 1 1 d U . .
H49 H -0.3433 0.8782 0.2359 0.086 Uiso 1 1 calc R . .
C50 C -0.3332(9) 0.9446(8) 0.3270(5) 0.078(2) Uani 1 1 d U . .
H50 H -0.3790 0.9902 0.3243 0.094 Uiso 1 1 calc R . .
C51 C -0.2868(9) 0.9437(9) 0.3832(5) 0.0851(19) Uani 1 1 d U . .
H51 H -0.3032 0.9870 0.4199 0.102 Uiso 1 1 calc R . .
C52 C -0.2148(9) 0.8789(9) 0.3872(5) 0.0790(15) Uani 1 1 d U . .
H52 H -0.1802 0.8815 0.4262 0.095 Uiso 1 1 calc R . .
C53 C -0.3009(8) 0.4354(8) 0.2043(5) 0.0672(19) Uani 1 1 d U . .
H53 H -0.3168 0.3938 0.1625 0.081 Uiso 1 1 calc R . .
C54 C -0.3670(8) 0.4907(8) 0.2388(4) 0.069(2) Uani 1 1 d U . .
H54 H -0.4363 0.4941 0.2254 0.083 Uiso 1 1 calc R . .
C55 C -0.3092(8) 0.5400(8) 0.2971(4) 0.0659(17) Uani 1 1 d U . .
C56 C -0.3388(9) 0.6111(9) 0.3518(5) 0.0719(17) Uani 1 1 d U . .
C57 C -0.4239(9) 0.6590(9) 0.3448(5) 0.0767(17) Uani 1 1 d U . .
H57 H -0.4642 0.6447 0.3054 0.092 Uiso 1 1 calc R . .
C58 C -0.4485(9) 0.7291(9) 0.3975(5) 0.0843(19) Uani 1 1 d U . .
H58 H -0.5070 0.7608 0.3940 0.101 Uiso 1 1 calc R . .
C59 C -0.3874(9) 0.7509(9) 0.4537(5) 0.0855(19) Uani 1 1 d U . .
H59 H -0.3992 0.8007 0.4893 0.103 Uiso 1 1 calc R . .
C60 C -0.3056(9) 0.6952(9) 0.4560(5) 0.080(2) Uani 1 1 d U . .
H60 H -0.2676 0.7039 0.4953 0.096 Uiso 1 1 calc R . .
C61 C -0.0092(7) 0.6658(6) -0.0792(4) 0.0476(17) Uani 1 1 d U . .
C62 C 0.1699(7) 0.6396(7) 0.0104(4) 0.0507(18) Uani 1 1 d U . .
C63 C 0.0942(7) 0.7313(6) -0.0653(4) 0.0484(17) Uani 1 1 d U . .
C64 C 0.1744(7) 0.7198(7) -0.0216(4) 0.0495(17) Uani 1 1 d U . .
C65 C 0.2687(8) 0.7857(7) -0.0107(4) 0.0558(18) Uani 1 1 d U . .
H65 H 0.3251 0.7823 0.0175 0.067 Uiso 1 1 calc R . .
C66 C 0.2763(8) 0.8546(7) -0.0420(4) 0.0601(19) Uani 1 1 d U . .
H66 H 0.3382 0.8996 -0.0342 0.072 Uiso 1 1 calc R . .
C67 C 0.1987(8) 0.8594(7) -0.0828(4) 0.0605(19) Uani 1 1 d U . .
H67 H 0.2090 0.9063 -0.1042 0.073 Uiso 1 1 calc R . .
C68 C 0.0898(7) 0.6856(7) 0.4416(4) 0.0492(15) Uani 1 1 d U . .
C69 C 0.1953(7) 0.5955(7) 0.5339(4) 0.0528(18) Uani 1 1 d U . .
C70 C 0.1998(7) 0.7238(7) 0.4753(4) 0.0508(16) Uani 1 1 d U . .
C71 C 0.2424(7) 0.6835(7) 0.5193(4) 0.0525(16) Uani 1 1 d U . .
C72 C 0.3405(7) 0.7279(7) 0.5504(4) 0.0584(18) Uani 1 1 d U . .
H72 H 0.3713 0.7045 0.5817 0.070 Uiso 1 1 calc R . .
C73 C 0.3959(8) 0.8087(7) 0.5360(4) 0.0600(19) Uani 1 1 d U . .
H73 H 0.4626 0.8398 0.5570 0.072 Uiso 1 1 calc R . .
C74 C 0.3462(7) 0.8385(7) 0.4897(4) 0.0546(18) Uani 1 1 d U . .
H74 H 0.3828 0.8903 0.4789 0.065 Uiso 1 1 calc R . .
N1 N 0.0942(8) 0.3236(5) 0.3274(3) 0.069(3) Uani 1 1 d . . .
N2 N 0.0992(6) 0.2521(5) 0.2740(3) 0.053(2) Uani 1 1 d . . .
N3 N 0.1388(7) 0.0890(6) 0.1792(4) 0.064(2) Uani 1 1 d . . .
N4 N 0.3171(8) 0.4625(7) 0.3353(4) 0.081(2) Uani 1 1 d U . .
N5 N 0.3068(6) 0.4034(6) 0.2752(3) 0.052(2) Uani 1 1 d . . .
N6 N 0.3470(6) 0.2780(5) 0.1632(3) 0.056(2) Uani 1 1 d . . .
N7 N 0.3415(5) 0.6529(5) 0.2333(3) 0.046(2) Uani 1 1 d . . .
N8 N 0.3402(5) 0.5651(5) 0.1871(3) 0.0416(19) Uani 1 1 d . . .
N9 N 0.3512(5) 0.4366(5) 0.0614(3) 0.046(2) Uani 1 1 d . . .
N10 N 0.0691(5) 0.7782(5) 0.2179(3) 0.0434(19) Uani 1 1 d . . .
N11 N 0.0775(6) 0.8324(5) 0.2777(3) 0.050(2) Uani 1 1 d . . .
N12 N 0.0752(8) 0.9853(7) 0.3892(4) 0.084(3) Uani 1 1 d . . .
N13 N -0.1405(6) 0.6246(5) 0.1724(3) 0.049(2) Uani 1 1 d . . .
N14 N -0.1501(6) 0.6772(5) 0.2297(3) 0.049(2) Uani 1 1 d . . .
N15 N -0.1954(7) 0.8119(6) 0.3338(4) 0.068(3) Uani 1 1 d . . .
N16 N -0.2086(6) 0.4528(6) 0.2426(3) 0.057(2) Uani 1 1 d . . .
N17 N -0.2112(5) 0.5172(5) 0.2992(3) 0.049(2) Uani 1 1 d . . .
N18 N -0.2781(6) 0.6312(6) 0.4065(3) 0.062(2) Uani 1 1 d . . .
N19 N 0.1057(6) 0.8008(5) -0.0955(3) 0.049(2) Uani 1 1 d . . .
N20 N 0.2521(6) 0.8012(5) 0.4590(3) 0.050(2) Uani 1 1 d . . .
N21 N 0.3900(7) 0.9872(7) 0.3745(4) 0.075(3) Uani 1 1 d . . .
N22 N 0.5882(14) -0.0876(10) 0.0909(7) 0.162(6) Uani 1 1 d . . .
O1 O -0.0745(5) 0.6703(5) -0.1218(3) 0.070(2) Uani 1 1 d . . .
O2 O -0.0273(5) 0.6086(6) -0.0486(4) 0.083(2) Uani 1 1 d . . .
O3 O 0.1944(5) 0.5579(5) -0.0224(3) 0.0625(19) Uani 1 1 d . . .
O4 O 0.1575(8) 0.6619(5) 0.0643(3) 0.092(3) Uani 1 1 d . . .
O5 O 0.0610(6) 0.7153(6) 0.3960(3) 0.085(3) Uani 1 1 d . . .
O6 O 0.0375(6) 0.6281(5) 0.4593(3) 0.073(2) Uani 1 1 d . . .
O7 O 0.1629(6) 0.6118(5) 0.5855(3) 0.074(2) Uani 1 1 d . . .
O8 O 0.1943(6) 0.5105(5) 0.4973(3) 0.076(2) Uani 1 1 d . . .
O9 O 0.3613(7) 0.8965(6) 0.3527(4) 0.105(3) Uani 1 1 d . . .
O10 O 0.3560(9) 1.0381(7) 0.4192(5) 0.131(4) Uani 1 1 d . . .
O11 O 0.4437(8) 1.0346(9) 0.3462(5) 0.130(4) Uani 1 1 d . . .
O12 O 0.5482(11) -0.1269(9) 0.1217(6) 0.147(4) Uani 1 1 d U . .
O13 O 0.5704(18) -0.0541(15) 0.0502(9) 0.114(6) Uani 0.50 1 d PU . .
O13' O 0.646(3) -0.101(2) 0.0565(14) 0.170(7) Uani 0.50 1 d PU . .
O14 O 0.6771(16) -0.0524(14) 0.1295(9) 0.225(6) Uani 1 1 d U . .
O1W O 0.1835(18) 0.7687(16) 0.6969(10) 0.131(6) Uani 0.50 1 d PU . .
O1W' O 0.267(2) 0.747(2) 0.7084(11) 0.158(7) Uani 0.50 1 d PU . .
O2W O 0.896(2) -0.1035(19) 0.0232(11) 0.159(7) Uani 0.50 1 d PU . .
O2W' O 0.840(2) -0.149(2) 0.0495(13) 0.170(7) Uani 0.50 1 d PU . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 N19 2.210(7) 2_565 ?
Ag1 N3 2.253(9) . ?
Ag1 N2 2.386(7) . ?
Ag1 O1 2.410(7) 2_565 ?
Ag2 O1 2.280(6) 2_565 ?
Ag2 N8 2.352(7) . ?
Ag2 N6 2.368(8) . ?
Ag2 N5 2.431(7) . ?
Ag2 Ag3 3.0272(11) . ?
Ag3 O2 2.215(7) 2_565 ?
Ag3 N9 2.296(7) . ?
Ag3 O3 2.415(7) . ?
Ag4 N20 2.267(8) . ?
Ag4 N12 2.278(9) . ?
Ag4 O5 2.486(8) . ?
Ag4 N11 2.488(7) . ?
Ag5 O5 2.144(7) . ?
Ag5 N14 2.306(7) . ?
Ag5 N15 2.346(9) . ?
Ag5 Ag6 3.0526(12) . ?
Ag6 O6 2.237(7) . ?
Ag6 N18 2.282(9) . ?
Ag6 O7 2.419(7) 2_566 ?
Ag6 N17 2.571(7) . ?
C1 C6 1.364(13) . ?
C1 C2 1.410(13) . ?
C1 C7 1.576(10) . ?
C2 C3 1.372(13) . ?
C2 C8 1.525(10) . ?
C3 C4 1.443(12) . ?
C3 C9 1.533(10) . ?
C4 C5 1.383(12) . ?
C4 C10 1.514(13) . ?
C5 C6 1.409(14) . ?
C5 C11 1.542(10) . ?
C6 C12 1.569(10) . ?
C7 N1 1.448(9) . ?
C8 N4 1.466(9) . ?
C9 N7 1.389(8) . ?
C10 N10 1.445(11) . ?
C11 N13 1.441(9) . ?
C12 N16 1.413(9) . ?
C13 C14 1.330(15) . ?
C13 N1 1.375(14) . ?
C14 C15 1.393(15) . ?
C15 N2 1.309(14) . ?
C15 C16 1.412(15) . ?
C16 N3 1.310(14) . ?
C16 C17 1.393(17) . ?
C17 C18 1.296(15) . ?
C18 C19 1.289(17) . ?
C19 C20 1.426(18) . ?
C20 N3 1.316(13) . ?
C21 C22 1.324(15) . ?
C21 N4 1.342(14) . ?
C22 C23 1.393(15) . ?
C23 N5 1.313(14) . ?
C23 C24 1.473(14) . ?
C24 N6 1.349(14) . ?
C24 C25 1.372(16) . ?
C25 C26 1.343(15) . ?
C26 C27 1.376(18) . ?
C27 C28 1.350(17) . ?
C28 N6 1.313(12) . ?
C29 N7 1.331(11) . ?
C29 C30 1.334(12) . ?
C30 C31 1.410(12) . ?
C31 N8 1.320(11) . ?
C31 C32 1.440(11) . ?
C32 N9 1.329(10) . ?
C32 C33 1.392(13) . ?
C33 C34 1.348(12) . ?
C34 C35 1.367(12) . ?
C35 C36 1.367(13) . ?
C36 N9 1.328(10) . ?
C37 C38 1.344(12) . ?
C37 N10 1.344(12) . ?
C38 C39 1.355(14) . ?
C39 N11 1.345(13) . ?
C39 C40 1.468(13) . ?
C40 N12 1.323(14) . ?
C40 C41 1.380(16) . ?
C41 C42 1.347(14) . ?
C42 C43 1.349(17) . ?
C43 C44 1.347(17) . ?
C44 N12 1.360(12) . ?
C45 C46 1.346(13) . ?
C45 N13 1.357(12) . ?
C46 C47 1.405(13) . ?
C47 N14 1.355(12) . ?
C47 C48 1.462(13) . ?
C48 C49 1.329(15) . ?
C48 N15 1.357(13) . ?
C49 C50 1.334(13) . ?
C50 C51 1.343(16) . ?
C51 C52 1.388(17) . ?
C52 N15 1.352(12) . ?
C53 N16 1.350(12) . ?
C53 C54 1.374(14) . ?
C54 C55 1.370(13) . ?
C55 N17 1.350(12) . ?
C55 C56 1.452(13) . ?
C56 N18 1.318(12) . ?
C56 C57 1.375(15) . ?
C57 C58 1.389(14) . ?
C58 C59 1.345(15) . ?
C59 C60 1.394(17) . ?
C60 N18 1.318(12) . ?
C61 O2 1.222(11) . ?
C61 O1 1.229(11) . ?
C61 C63 1.485(12) . ?
C62 O4 1.195(10) . ?
C62 O3 1.253(10) . ?
C62 C64 1.503(14) . ?
C63 N19 1.348(12) . ?
C63 C64 1.408(13) . ?
C64 C65 1.400(12) . ?
C65 C66 1.353(14) . ?
C66 C67 1.308(14) . ?
C67 N19 1.334(11) . ?
C68 O6 1.185(11) . ?
C68 O5 1.253(12) . ?
C68 C70 1.500(12) . ?
C69 O8 1.221(10) . ?
C69 O7 1.248(11) . ?
C69 C71 1.455(14) . ?
C70 C71 1.373(13) . ?
C70 N20 1.378(12) . ?
C71 C72 1.366(12) . ?
C72 C73 1.412(14) . ?
C73 C74 1.358(14) . ?
C74 N20 1.303(11) . ?
N1 N2 1.326(9) . ?
N4 N5 1.339(9) . ?
N7 N8 1.344(8) . ?
N10 N11 1.316(8) . ?
N13 N14 1.307(8) . ?
N16 N17 1.327(9) . ?
N19 Ag1 2.210(7) 2_565 ?
N21 O10 1.207(11) . ?
N21 O9 1.209(11) . ?
N21 O11 1.259(13) . ?
N22 O13' 1.13(3) . ?
N22 O12 1.142(17) . ?
N22 O13 1.16(2) . ?
N22 O14 1.31(2) . ?
O1 Ag2 2.280(6) 2_565 ?
O1 Ag1 2.410(7) 2_565 ?
O2 Ag3 2.215(7) 2_565 ?
O7 Ag6 2.419(7) 2_566 ?
O13 O13' 1.26(4) . ?
O13' O14 1.56(3) . ?
O1W O1W' 1.18(3) . ?
O2W O2W' 1.23(4) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N19 Ag1 N3 139.4(3) 2_565 . ?
N19 Ag1 N2 144.2(3) 2_565 . ?
N3 Ag1 N2 72.8(3) . . ?
N19 Ag1 O1 71.1(2) 2_565 2_565 ?
N3 Ag1 O1 122.0(3) . 2_565 ?
N2 Ag1 O1 108.2(2) . 2_565 ?
O1 Ag2 N8 135.0(3) 2_565 . ?
O1 Ag2 N6 108.4(3) 2_565 . ?
N8 Ag2 N6 111.0(3) . . ?
O1 Ag2 N5 121.5(3) 2_565 . ?
N8 Ag2 N5 92.3(2) . . ?
N6 Ag2 N5 69.9(2) . . ?
O1 Ag2 Ag3 71.48(18) 2_565 . ?
N8 Ag2 Ag3 70.64(16) . . ?
N6 Ag2 Ag3 119.76(19) . . ?
N5 Ag2 Ag3 162.34(18) . . ?
O2 Ag3 N9 134.7(3) 2_565 . ?
O2 Ag3 O3 111.3(3) 2_565 . ?
N9 Ag3 O3 96.8(2) . . ?
O2 Ag3 Ag2 85.5(2) 2_565 . ?
N9 Ag3 Ag2 70.03(19) . . ?
O3 Ag3 Ag2 163.19(16) . . ?
N20 Ag4 N12 132.4(3) . . ?
N20 Ag4 O5 68.3(3) . . ?
N12 Ag4 O5 105.7(3) . . ?
N20 Ag4 N11 151.1(2) . . ?
N12 Ag4 N11 70.9(3) . . ?
O5 Ag4 N11 90.6(2) . . ?
O5 Ag5 N14 144.6(3) . . ?
O5 Ag5 N15 126.0(3) . . ?
N14 Ag5 N15 71.0(3) . . ?
O5 Ag5 Ag6 74.7(2) . . ?
N14 Ag5 Ag6 131.72(19) . . ?
N15 Ag5 Ag6 112.9(2) . . ?
O6 Ag6 N18 133.8(3) . . ?
O6 Ag6 O7 109.3(3) . 2_566 ?
N18 Ag6 O7 112.2(3) . 2_566 ?
O6 Ag6 N17 128.1(2) . . ?
N18 Ag6 N17 69.0(2) . . ?
O7 Ag6 N17 92.8(2) 2_566 . ?
O6 Ag6 Ag5 81.56(19) . . ?
N18 Ag6 Ag5 77.7(2) . . ?
O7 Ag6 Ag5 142.66(16) 2_566 . ?
N17 Ag6 Ag5 55.88(17) . . ?
C6 C1 C2 121.5(9) . . ?
C6 C1 C7 121.3(8) . . ?
C2 C1 C7 117.0(7) . . ?
C3 C2 C1 119.4(9) . . ?
C3 C2 C8 120.1(7) . . ?
C1 C2 C8 120.3(8) . . ?
C2 C3 C4 120.2(8) . . ?
C2 C3 C9 122.4(7) . . ?
C4 C3 C9 117.3(7) . . ?
C5 C4 C3 117.8(9) . . ?
C5 C4 C10 123.6(8) . . ?
C3 C4 C10 118.4(8) . . ?
C4 C5 C6 121.4(8) . . ?
C4 C5 C11 116.5(8) . . ?
C6 C5 C11 122.0(7) . . ?
C1 C6 C5 119.0(9) . . ?
C1 C6 C12 123.5(8) . . ?
C5 C6 C12 117.4(7) . . ?
N1 C7 C1 111.6(5) . . ?
N4 C8 C2 110.8(5) . . ?
N7 C9 C3 116.6(5) . . ?
N10 C10 C4 113.3(7) . . ?
N13 C11 C5 115.7(4) . . ?
N16 C12 C6 114.3(5) . . ?
C14 C13 N1 106.8(9) . . ?
C13 C14 C15 107.7(11) . . ?
N2 C15 C14 107.4(9) . . ?
N2 C15 C16 122.8(10) . . ?
C14 C15 C16 129.6(12) . . ?
N3 C16 C17 120.4(10) . . ?
N3 C16 C15 118.9(11) . . ?
C17 C16 C15 120.6(11) . . ?
C18 C17 C16 120.6(12) . . ?
C19 C18 C17 121.4(14) . . ?
C18 C19 C20 117.8(12) . . ?
N3 C20 C19 121.5(11) . . ?
C22 C21 N4 106.2(9) . . ?
C21 C22 C23 105.8(11) . . ?
N5 C23 C22 111.4(9) . . ?
N5 C23 C24 120.9(10) . . ?
C22 C23 C24 127.1(11) . . ?
N6 C24 C25 119.6(10) . . ?
N6 C24 C23 115.9(10) . . ?
C25 C24 C23 124.4(11) . . ?
C26 C25 C24 123.5(12) . . ?
C25 C26 C27 115.3(12) . . ?
C28 C27 C26 120.1(11) . . ?
N6 C28 C27 124.1(11) . . ?
N7 C29 C30 109.1(8) . . ?
C29 C30 C31 104.8(8) . . ?
N8 C31 C30 109.5(7) . . ?
N8 C31 C32 120.8(8) . . ?
C30 C31 C32 129.5(8) . . ?
N9 C32 C33 119.7(8) . . ?
N9 C32 C31 119.5(8) . . ?
C33 C32 C31 120.7(7) . . ?
C34 C33 C32 121.5(8) . . ?
C33 C34 C35 117.8(9) . . ?
C36 C35 C34 119.2(8) . . ?
N9 C36 C35 122.8(8) . . ?
C38 C37 N10 105.3(8) . . ?
C37 C38 C39 107.8(10) . . ?
N11 C39 C38 109.3(8) . . ?
N11 C39 C40 120.4(9) . . ?
C38 C39 C40 130.2(10) . . ?
N12 C40 C41 119.6(9) . . ?
N12 C40 C39 117.8(10) . . ?
C41 C40 C39 122.5(10) . . ?
C42 C41 C40 120.5(11) . . ?
C41 C42 C43 119.5(12) . . ?
C44 C43 C42 119.4(11) . . ?
C43 C44 N12 121.4(12) . . ?
C46 C45 N13 108.2(8) . . ?
C45 C46 C47 104.0(9) . . ?
N14 C47 C46 110.7(8) . . ?
N14 C47 C48 119.7(8) . . ?
C46 C47 C48 129.5(10) . . ?
C49 C48 N15 121.6(9) . . ?
C49 C48 C47 123.7(10) . . ?
N15 C48 C47 114.6(9) . . ?
C48 C49 C50 121.9(11) . . ?
C49 C50 C51 118.2(12) . . ?
C50 C51 C52 120.9(10) . . ?
N15 C52 C51 119.5(10) . . ?
N16 C53 C54 106.9(8) . . ?
C55 C54 C53 105.5(10) . . ?
N17 C55 C54 110.7(8) . . ?
N17 C55 C56 120.1(8) . . ?
C54 C55 C56 129.2(10) . . ?
N18 C56 C57 122.4(9) . . ?
N18 C56 C55 117.5(10) . . ?
C57 C56 C55 120.0(9) . . ?
C56 C57 C58 118.8(10) . . ?
C59 C58 C57 119.7(12) . . ?
C58 C59 C60 116.7(10) . . ?
N18 C60 C59 124.7(10) . . ?
O2 C61 O1 121.7(8) . . ?
O2 C61 C63 119.8(8) . . ?
O1 C61 C63 118.5(9) . . ?
O4 C62 O3 127.3(10) . . ?
O4 C62 C64 119.4(8) . . ?
O3 C62 C64 112.6(8) . . ?
N19 C63 C64 123.1(8) . . ?
N19 C63 C61 117.1(8) . . ?
C64 C63 C61 119.8(9) . . ?
C65 C64 C63 116.0(9) . . ?
C65 C64 C62 117.9(8) . . ?
C63 C64 C62 126.0(8) . . ?
C66 C65 C64 118.8(9) . . ?
C67 C66 C65 121.6(9) . . ?
C66 C67 N19 123.7(10) . . ?
O6 C68 O5 125.1(9) . . ?
O6 C68 C70 117.4(9) . . ?
O5 C68 C70 117.5(9) . . ?
O8 C69 O7 123.7(10) . . ?
O8 C69 C71 119.1(9) . . ?
O7 C69 C71 117.2(8) . . ?
C71 C70 N20 123.9(8) . . ?
C71 C70 C68 121.1(9) . . ?
N20 C70 C68 115.0(8) . . ?
C72 C71 C70 116.7(9) . . ?
C72 C71 C69 116.8(9) . . ?
C70 C71 C69 126.5(8) . . ?
C71 C72 C73 121.0(10) . . ?
C74 C73 C72 116.2(9) . . ?
N20 C74 C73 126.1(10) . . ?
N2 N1 C13 108.4(8) . . ?
N2 N1 C7 128.0(7) . . ?
C13 N1 C7 123.5(7) . . ?
C15 N2 N1 109.5(8) . . ?
C15 N2 Ag1 109.5(6) . . ?
N1 N2 Ag1 140.9(6) . . ?
C16 N3 C20 118.1(10) . . ?
C16 N3 Ag1 115.9(7) . . ?
C20 N3 Ag1 126.0(7) . . ?
N5 N4 C21 112.9(9) . . ?
N5 N4 C8 123.0(7) . . ?
C21 N4 C8 124.1(7) . . ?
C23 N5 N4 103.2(8) . . ?
C23 N5 Ag2 113.0(6) . . ?
N4 N5 Ag2 139.1(6) . . ?
C28 N6 C24 117.3(9) . . ?
C28 N6 Ag2 125.2(7) . . ?
C24 N6 Ag2 117.5(6) . . ?
C29 N7 N8 110.1(7) . . ?
C29 N7 C9 124.0(6) . . ?
N8 N7 C9 125.5(6) . . ?
C31 N8 N7 106.4(7) . . ?
C31 N8 Ag2 125.4(5) . . ?
N7 N8 Ag2 128.1(5) . . ?
C36 N9 C32 118.9(8) . . ?
C36 N9 Ag3 119.8(5) . . ?
C32 N9 Ag3 118.8(6) . . ?
N11 N10 C37 112.4(7) . . ?
N11 N10 C10 121.3(7) . . ?
C37 N10 C10 126.0(7) . . ?
N10 N11 C39 105.2(7) . . ?
N10 N11 Ag4 143.3(6) . . ?
C39 N11 Ag4 110.6(5) . . ?
C40 N12 C44 119.4(10) . . ?
C40 N12 Ag4 120.0(6) . . ?
C44 N12 Ag4 120.5(8) . . ?
N14 N13 C45 112.1(7) . . ?
N14 N13 C11 124.5(6) . . ?
C45 N13 C11 123.4(6) . . ?
N13 N14 C47 105.0(7) . . ?
N13 N14 Ag5 138.3(6) . . ?
C47 N14 Ag5 116.7(5) . . ?
C52 N15 C48 117.8(10) . . ?
C52 N15 Ag5 124.2(7) . . ?
C48 N15 Ag5 118.0(6) . . ?
N17 N16 C53 111.5(7) . . ?
N17 N16 C12 125.5(6) . . ?
C53 N16 C12 122.9(7) . . ?
N16 N17 C55 105.5(7) . . ?
N16 N17 Ag6 141.3(6) . . ?
C55 N17 Ag6 108.4(5) . . ?
C60 N18 C56 117.3(10) . . ?
C60 N18 Ag6 120.8(7) . . ?
C56 N18 Ag6 121.9(7) . . ?
C67 N19 C63 116.7(8) . . ?
C67 N19 Ag1 125.1(7) . 2_565 ?
C63 N19 Ag1 118.1(6) . 2_565 ?
C74 N20 C70 116.0(8) . . ?
C74 N20 Ag4 122.6(7) . . ?
C70 N20 Ag4 121.4(6) . . ?
O10 N21 O9 121.0(11) . . ?
O10 N21 O11 116.8(11) . . ?
O9 N21 O11 121.3(10) . . ?
O13' N22 O12 140(2) . . ?
O13' N22 O13 67(2) . . ?
O12 N22 O13 142(2) . . ?
O13' N22 O14 79(2) . . ?
O12 N22 O14 96.6(17) . . ?
O13 N22 O14 118.4(19) . . ?
C61 O1 Ag2 138.4(6) . 2_565 ?
C61 O1 Ag1 114.6(6) . 2_565 ?
Ag2 O1 Ag1 106.8(3) 2_565 2_565 ?
C61 O2 Ag3 122.0(6) . 2_565 ?
C62 O3 Ag3 94.4(6) . . ?
C68 O5 Ag5 135.7(7) . . ?
C68 O5 Ag4 116.5(6) . . ?
Ag5 O5 Ag4 106.5(3) . . ?
C68 O6 Ag6 122.9(6) . . ?
C69 O7 Ag6 98.1(6) . 2_566 ?
N22 O13 O13' 55.6(18) . . ?
N22 O13' O13 58(2) . . ?
N22 O13' O14 55.5(16) . . ?
O13 O13' O14 97(2) . . ?
N22 O14 O13' 45.4(14) . . ?

_diffrn_measured_fraction_theta_max 0.979
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.979
_refine_diff_density_max         1.579
_refine_diff_density_min         -0.778
_refine_diff_density_rms         0.149
_database_code_depnum_ccdc_archive 'CCDC 984129'
#######################################################################
#
#                 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_crystal5

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C46 H34 Ag5 N10 O12'
_chemical_formula_sum            'C46 H34 Ag5 N10 O12'
_chemical_formula_weight         1458.18

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'
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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   12.6750(5)
_cell_length_b                   14.3120(7)
_cell_length_c                   15.2200(7)
_cell_angle_alpha                106.736(4)
_cell_angle_beta                 99.655(4)
_cell_angle_gamma                115.188(4)
_cell_volume                     2254.41(18)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    5913
_cell_measurement_theta_min      2.8280
_cell_measurement_theta_max      29.1959

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.17
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.148
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1422
_exptl_absorpt_coefficient_mu    2.212
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.91987
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_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  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            16828
_diffrn_reflns_av_R_equivalents  0.0297
_diffrn_reflns_av_sigmaI/netI    0.0547
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_theta_min         2.83
_diffrn_reflns_theta_max         29.26
_reflns_number_total             10342
_reflns_number_gt                7279
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

For O1, O9, O9', and O11, some anisotropic displacement ellipsoids were rather elongated which led us to use the ISOR restraints. For O1, C39, O11 and N10, some anisotropic displacement ellipsoids were rather elongated which led us to use the DELU restraints. For O1, C39, O11 and N10, some anisotropic displacement ellipsoids were rather elongated which led us to use the SIMU restraints.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0458P)²+5.2957P] where P=(Fo²+2Fc²)/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         10342
_refine_ls_number_parameters     676
_refine_ls_number_restraints     38
_refine_ls_R_factor_all          0.0796
_refine_ls_R_factor_gt           0.0498
_refine_ls_wR_factor_ref         0.1245
_refine_ls_wR_factor_gt          0.1068
_refine_ls_goodness_of_fit_ref   1.015
_refine_ls_restrained_S_all      1.026
_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
Ag1 Ag 0.50616(5) 0.23738(4) 0.09149(3) 0.05043(14) Uani 1 1 d . . .
Ag2 Ag 0.76742(4) 0.32655(4) 0.10760(3) 0.05061(14) Uani 1 1 d . . .
Ag3 Ag 0.92459(5) 0.38128(4) -0.05728(4) 0.05076(14) Uani 1 1 d . . .
Ag4 Ag 0.03587(5) 0.01358(5) -0.58795(4) 0.05822(16) Uani 1 1 d . . .
Ag5 Ag 0.87962(5) -0.07004(4) 0.19088(3) 0.04776(13) Uani 1 1 d . . .
C1 C 0.4741(5) 0.0011(4) 0.0858(4) 0.0359(12) Uani 1 1 d . . .
C2 C 0.3790(5) -0.0353(4) 0.0015(4) 0.0364(12) Uani 1 1 d . . .
C3 C 0.5946(5) 0.0342(4) 0.0836(4) 0.0379(13) Uani 1 1 d . . .
C4 C 0.4470(6) -0.0023(5) 0.1780(4) 0.0443(14) Uani 1 1 d . . .
H4A H 0.3716 -0.0724 0.1616 0.053 Uiso 1 1 calc R . .
H4B H 0.5137 -0.0020 0.2202 0.053 Uiso 1 1 calc R . .
C5 C 0.2489(5) -0.0761(5) 0.0028(5) 0.0419(13) Uani 1 1 d . . .
H5A H 0.1917 -0.1311 -0.0618 0.050 Uiso 1 1 calc R . .
H5B H 0.2365 -0.1138 0.0470 0.050 Uiso 1 1 calc R . .
C6 C 0.6957(6) 0.0651(5) 0.1731(4) 0.0463(14) Uani 1 1 d . . .
H6A H 0.6668 0.0060 0.1971 0.056 Uiso 1 1 calc R . .
H6B H 0.7668 0.0688 0.1552 0.056 Uiso 1 1 calc R . .
C7 C 0.3857(7) 0.0972(6) 0.3036(5) 0.0607(19) Uani 1 1 d . . .
H7 H 0.3484 0.0395 0.3239 0.073 Uiso 1 1 calc R . .
C8 C 0.4028(8) 0.2036(6) 0.3421(5) 0.067(2) Uani 1 1 d . . .
H8 H 0.3804 0.2334 0.3938 0.080 Uiso 1 1 calc R . .
C9 C 0.4608(6) 0.2574(5) 0.2875(4) 0.0425(14) Uani 1 1 d . . .
C10 C 0.5028(6) 0.3724(5) 0.2947(4) 0.0455(14) Uani 1 1 d . . .
C11 C 0.5088(10) 0.4536(7) 0.3741(6) 0.090(3) Uani 1 1 d . . .
C12 C 0.577(3) 0.570(2) 0.378(2) 0.066(8) Uani 0.50 1 d P . .
C12' C 0.519(3) 0.550(3) 0.372(3) 0.081(10) Uani 0.50 1 d P . .
C13 C 0.5867(10) 0.5848(7) 0.3023(8) 0.088(3) Uani 1 1 d . . .
C14 C 0.5743(8) 0.4983(6) 0.2269(7) 0.078(2) Uani 1 1 d . . .
H14 H 0.5964 0.5131 0.1751 0.094 Uiso 1 1 calc R . .
C15 C 0.1586(7) 0.0296(6) 0.0928(5) 0.0558(17) Uani 1 1 d . . .
H15 H 0.1249 -0.0156 0.1252 0.067 Uiso 1 1 calc R . .
C16 C 0.1541(7) 0.1246(6) 0.0977(5) 0.0612(19) Uani 1 1 d . . .
H16 H 0.1179 0.1577 0.1343 0.073 Uiso 1 1 calc R . .
C17 C 0.2145(5) 0.1606(5) 0.0370(4) 0.0375(12) Uani 1 1 d . . .
C18 C 0.2368(5) 0.2579(5) 0.0141(4) 0.0414(13) Uani 1 1 d . . .
C19 C 0.2674(7) 0.3594(5) 0.0842(5) 0.0559(17) Uani 1 1 d . . .
H19 H 0.2716 0.3666 0.1476 0.067 Uiso 1 1 calc R . .
C20 C 0.2916(8) 0.4498(6) 0.0604(6) 0.071(2) Uani 1 1 d . . .
H20 H 0.3114 0.5186 0.1071 0.086 Uiso 1 1 calc R . .
C21 C 0.2864(9) 0.4380(6) -0.0316(7) 0.083(3) Uani 1 1 d . . .
H21 H 0.3046 0.4988 -0.0491 0.099 Uiso 1 1 calc R . .
C22 C 0.2532(8) 0.3331(6) -0.0996(6) 0.071(2) Uani 1 1 d . . .
H22 H 0.2493 0.3248 -0.1632 0.085 Uiso 1 1 calc R . .
C23 C 0.7486(8) 0.1924(6) 0.3452(5) 0.073(2) Uani 1 1 d . . .
H23 H 0.7292 0.1396 0.3727 0.088 Uiso 1 1 calc R . .
C24 C 0.7976(8) 0.3058(7) 0.3927(5) 0.076(2) Uani 1 1 d . . .
H24 H 0.8190 0.3463 0.4590 0.091 Uiso 1 1 calc R . .
C25 C 0.8085(6) 0.3478(5) 0.3218(4) 0.0510(16) Uani 1 1 d . . .
C26 C 0.8560(6) 0.4660(5) 0.3316(5) 0.0539(17) Uani 1 1 d . . .
C27 C 0.9007(9) 0.5522(7) 0.4207(6) 0.087(3) Uani 1 1 d . . .
H27 H 0.9015 0.5373 0.4764 0.105 Uiso 1 1 calc R . .
C28 C 0.9441(10) 0.6603(7) 0.4279(7) 0.097(3) Uani 1 1 d . . .
H28 H 0.9722 0.7196 0.4878 0.116 Uiso 1 1 calc R . .
C29 C 0.9453(9) 0.6788(6) 0.3460(6) 0.081(3) Uani 1 1 d . . .
H29 H 0.9752 0.7515 0.3484 0.098 Uiso 1 1 calc R . .
C30 C 0.9020(7) 0.5896(6) 0.2598(5) 0.0638(19) Uani 1 1 d . . .
H30 H 0.9040 0.6034 0.2038 0.077 Uiso 1 1 calc R . .
C31 C 1.0620(5) 0.4533(5) 0.1556(4) 0.0386(13) Uani 1 1 d . . .
C32 C 1.0554(6) 0.1860(5) 0.3111(4) 0.0407(13) Uani 1 1 d . . .
C33 C 1.1087(5) 0.4318(5) 0.2399(4) 0.0370(12) Uani 1 1 d . . .
C34 C 1.0615(5) 0.3235(5) 0.2375(4) 0.0364(12) Uani 1 1 d . . .
H34 H 0.9970 0.2629 0.1828 0.044 Uiso 1 1 calc R . .
C35 C 1.1081(5) 0.3042(5) 0.3143(4) 0.0390(13) Uani 1 1 d . . .
C36 C 1.2048(7) 0.3935(6) 0.3937(5) 0.066(2) Uani 1 1 d . . .
H36 H 1.2386 0.3812 0.4454 0.080 Uiso 1 1 calc R . .
C37 C 1.2523(8) 0.5012(6) 0.3971(5) 0.083(3) Uani 1 1 d . . .
H37 H 1.3178 0.5613 0.4514 0.100 Uiso 1 1 calc R . .
C38 C 1.2035(7) 0.5208(5) 0.3207(5) 0.0608(19) Uani 1 1 d . . .
H38 H 1.2349 0.5940 0.3240 0.073 Uiso 1 1 calc R . .
C39 C 0.2329(7) 0.0925(6) -0.3893(6) 0.0604(16) Uani 1 1 d U . .
C40 C 0.5868(5) 0.2563(4) -0.0871(4) 0.0333(12) Uani 1 1 d . . .
C41 C 0.3673(6) 0.1386(5) -0.3401(4) 0.0424(13) Uani 1 1 d . . .
C42 C 0.4168(5) 0.1820(4) -0.2404(4) 0.0363(12) Uani 1 1 d . . .
H42 H 0.3659 0.1836 -0.2033 0.044 Uiso 1 1 calc R . .
C43 C 0.5408(5) 0.2234(4) -0.1942(4) 0.0323(11) Uani 1 1 d . . .
C44 C 0.6165(6) 0.2247(5) -0.2496(4) 0.0458(14) Uani 1 1 d . . .
H44 H 0.7004 0.2539 -0.2195 0.055 Uiso 1 1 calc R . .
C45 C 0.5686(6) 0.1832(6) -0.3484(5) 0.0600(19) Uani 1 1 d . . .
H45 H 0.6205 0.1850 -0.3852 0.072 Uiso 1 1 calc R . .
C46 C 0.4443(6) 0.1387(6) -0.3943(4) 0.0566(17) Uani 1 1 d . . .
H46 H 0.4123 0.1087 -0.4619 0.068 Uiso 1 1 calc R . .
O1 O 0.1940(5) 0.0393(5) -0.4795(4) 0.0835(15) Uani 1 1 d U . .
O2 O 0.1692(4) 0.1075(5) -0.3405(4) 0.0715(15) Uani 1 1 d . . .
O3 O 0.5142(4) 0.2556(5) -0.0429(3) 0.0650(14) Uani 1 1 d . . .
O4 O 0.6943(4) 0.2793(4) -0.0490(3) 0.0466(10) Uani 1 1 d . . .
O5 O 0.9676(4) 0.1105(3) 0.2360(3) 0.0491(10) Uani 1 1 d . . .
O6 O 1.1044(5) 0.1751(4) 0.3817(3) 0.0647(13) Uani 1 1 d . . .
O7 O 0.9736(4) 0.3676(3) 0.0830(3) 0.0459(10) Uani 1 1 d . . .
O8 O 1.1127(4) 0.5503(3) 0.1610(3) 0.0575(12) Uani 1 1 d . . .
O9 O 0.0424(12) -0.2191(10) 0.1210(9) 0.079(3) Uani 0.50 1 d PU . .
O9' O 0.1451(15) -0.1736(13) 0.1639(12) 0.111(4) Uani 0.50 1 d PU . .
O10 O 0.0730(7) -0.0939(6) 0.2535(5) 0.102(2) Uani 1 1 d . . .
O11 O 0.1611(10) -0.1855(9) 0.2521(8) 0.164(3) Uani 1 1 d U . .
O1W O 0.7563(19) 0.1316(19) -0.4518(16) 0.356(11) Uani 1 1 d . . .
N1 N 0.4327(5) 0.0919(4) 0.2312(3) 0.0406(11) Uani 1 1 d . . .
N2 N 0.4805(4) 0.1890(4) 0.2207(3) 0.0381(11) Uani 1 1 d . . .
N3 N 0.5333(6) 0.3947(4) 0.2215(4) 0.0566(15) Uani 1 1 d . . .
N4 N 0.2205(4) 0.0141(4) 0.0326(3) 0.0401(11) Uani 1 1 d . . .
N5 N 0.2562(4) 0.0935(4) -0.0031(3) 0.0410(11) Uani 1 1 d . . .
N6 N 0.2269(5) 0.2442(4) -0.0781(4) 0.0481(13) Uani 1 1 d . . .
N7 N 0.7340(5) 0.1719(4) 0.2508(4) 0.0474(12) Uani 1 1 d . . .
N8 N 0.7689(4) 0.2653(4) 0.2344(3) 0.0403(11) Uani 1 1 d . . .
N9 N 0.8567(5) 0.4834(4) 0.2515(4) 0.0475(12) Uani 1 1 d . . .
N10 N 0.0866(9) -0.1651(6) 0.2087(7) 0.100(2) Uani 1 1 d U . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 O3 2.148(4) . ?
Ag1 N2 2.293(5) . ?
Ag1 N3 2.377(5) . ?
Ag1 Ag2 2.9335(7) . ?
Ag2 O4 2.190(4) . ?
Ag2 N9 2.300(5) . ?
Ag2 N8 2.339(5) . ?
Ag2 O7 2.542(4) . ?
Ag3 O8 2.170(4) 2_765 ?
Ag3 O7 2.208(4) . ?
Ag3 O9 2.483(12) 2_655 ?
Ag3 O9' 2.598(15) 2_655 ?
Ag3 Ag3 2.8605(10) 2_765 ?
Ag4 O1 2.188(6) . ?
Ag4 O2 2.252(5) 2_554 ?
Ag4 O6 2.313(5) 1_454 ?
Ag4 Ag4 3.0432(11) 2_554 ?
Ag4 Ag5 3.1799(7) 1_454 ?
Ag5 O5 2.158(4) . ?
Ag5 N6 2.209(5) 2_655 ?
Ag5 O2 2.598(5) 2_655 ?
Ag5 Ag4 3.1799(7) 1_656 ?
C1 C2 1.390(8) . ?
C1 C3 1.403(8) . ?
C1 C4 1.509(8) . ?
C2 C3 1.393(8) 2_655 ?
C2 C5 1.503(8) . ?
C3 C2 1.393(8) 2_655 ?
C3 C6 1.510(8) . ?
C4 N1 1.461(7) . ?
C4 H4A 0.9700 . ?
C4 H4B 0.9700 . ?
C5 N4 1.455(7) . ?
C5 H5A 0.9700 . ?
C5 H5B 0.9700 . ?
C6 N7 1.451(7) . ?
C6 H6A 0.9700 . ?
C6 H6B 0.9700 . ?
C7 N1 1.337(8) . ?
C7 C8 1.369(9) . ?
C7 H7 0.9300 . ?
C8 C9 1.385(9) . ?
C8 H8 0.9300 . ?
C9 N2 1.332(7) . ?
C9 C10 1.460(8) . ?
C10 N3 1.318(8) . ?
C10 C11 1.379(9) . ?
C11 C12' 1.34(4) . ?
C11 C12 1.49(3) . ?
C12 C12' 0.64(4) . ?
C12 C13 1.25(4) . ?
C12' C13 1.53(3) . ?
C13 C14 1.353(11) . ?
C14 N3 1.317(9) . ?
C14 H14 0.9300 . ?
C15 N4 1.332(7) . ?
C15 C16 1.366(9) . ?
C15 H15 0.9300 . ?
C16 C17 1.371(9) . ?
C16 H16 0.9300 . ?
C17 N5 1.333(7) . ?
C17 C18 1.456(8) . ?
C18 N6 1.336(8) . ?
C18 C19 1.374(8) . ?
C19 C20 1.367(10) . ?
C19 H19 0.9300 . ?
C20 C21 1.348(11) . ?
C20 H20 0.9300 . ?
C21 C22 1.387(10) . ?
C21 H21 0.9300 . ?
C22 N6 1.323(8) . ?
C22 H22 0.9300 . ?
C23 N7 1.344(8) . ?
C23 C24 1.364(10) . ?
C23 H23 0.9300 . ?
C24 C25 1.378(10) . ?
C24 H24 0.9300 . ?
C25 N8 1.334(7) . ?
C25 C26 1.485(9) . ?
C26 N9 1.313(8) . ?
C26 C27 1.366(9) . ?
C27 C28 1.366(12) . ?
C27 H27 0.9300 . ?
C28 C29 1.348(12) . ?
C28 H28 0.9300 . ?
C29 C30 1.360(10) . ?
C29 H29 0.9300 . ?
C30 N9 1.334(8) . ?
C30 H30 0.9300 . ?
C31 O8 1.227(7) . ?
C31 O7 1.271(7) . ?
C31 C33 1.489(8) . ?
C32 O6 1.233(7) . ?
C32 O5 1.245(7) . ?
C32 C35 1.514(8) . ?
C33 C38 1.370(8) . ?
C33 C34 1.391(8) . ?
C34 C35 1.373(8) . ?
C34 H34 0.9300 . ?
C35 C36 1.369(8) . ?
C36 C37 1.376(10) . ?
C36 H36 0.9300 . ?
C37 C38 1.383(10) . ?
C37 H37 0.9300 . ?
C38 H38 0.9300 . ?
C39 O2 1.228(9) . ?
C39 O1 1.249(9) . ?
C39 C41 1.492(9) . ?
C40 O3 1.227(7) . ?
C40 O4 1.242(6) . ?
C40 C43 1.491(7) . ?
C41 C42 1.374(8) . ?
C41 C46 1.380(9) . ?
C42 C43 1.384(7) . ?
C42 H42 0.9300 . ?
C43 C44 1.377(8) . ?
C44 C45 1.362(8) . ?
C44 H44 0.9300 . ?
C45 C46 1.377(9) . ?
C45 H45 0.9300 . ?
C46 H46 0.9300 . ?
O2 Ag4 2.252(5) 2_554 ?
O2 Ag5 2.598(5) 2_655 ?
O6 Ag4 2.313(5) 1_656 ?
O8 Ag3 2.170(4) 2_765 ?
O9 O9' 1.138(16) . ?
O9 N10 1.217(13) . ?
O9 Ag3 2.483(12) 2_655 ?
O9' N10 1.109(16) . ?
O9' O11 1.392(17) . ?
O9' Ag3 2.598(15) 2_655 ?
O10 N10 1.150(8) . ?
O11 N10 1.244(12) . ?
N1 N2 1.329(6) . ?
N4 N5 1.338(6) . ?
N6 Ag5 2.209(5) 2_655 ?
N7 N8 1.331(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
O3 Ag1 N2 171.29(18) . . ?
O3 Ag1 N3 116.7(2) . . ?
N2 Ag1 N3 71.31(17) . . ?
O3 Ag1 Ag2 75.20(12) . . ?
N2 Ag1 Ag2 108.01(12) . . ?
N3 Ag1 Ag2 97.10(14) . . ?
O4 Ag2 N9 139.26(18) . . ?
O4 Ag2 N8 146.77(16) . . ?
N9 Ag2 N8 72.50(18) . . ?
O4 Ag2 O7 86.15(14) . . ?
N9 Ag2 O7 93.34(16) . . ?
N8 Ag2 O7 104.48(15) . . ?
O4 Ag2 Ag1 83.06(11) . . ?
N9 Ag2 Ag1 99.77(13) . . ?
N8 Ag2 Ag1 80.96(12) . . ?
O7 Ag2 Ag1 166.82(9) . . ?
O8 Ag3 O7 160.21(16) 2_765 . ?
O8 Ag3 O9 115.6(3) 2_765 2_655 ?
O7 Ag3 O9 83.6(3) . 2_655 ?
O8 Ag3 O9' 104.5(4) 2_765 2_655 ?
O7 Ag3 O9' 95.0(4) . 2_655 ?
O9 Ag3 O9' 25.7(4) 2_655 2_655 ?
O8 Ag3 Ag3 78.33(11) 2_765 2_765 ?
O7 Ag3 Ag3 84.10(10) . 2_765 ?
O9 Ag3 Ag3 137.0(3) 2_655 2_765 ?
O9' Ag3 Ag3 161.8(4) 2_655 2_765 ?
O1 Ag4 O2 139.3(2) . 2_554 ?
O1 Ag4 O6 106.2(2) . 1_454 ?
O2 Ag4 O6 113.90(19) 2_554 1_454 ?
O1 Ag4 Ag4 70.89(16) . 2_554 ?
O2 Ag4 Ag4 79.62(13) 2_554 2_554 ?
O6 Ag4 Ag4 126.44(12) 1_454 2_554 ?
O1 Ag4 Ag5 150.05(15) . 1_454 ?
O2 Ag4 Ag5 53.91(13) 2_554 1_454 ?
O6 Ag4 Ag5 75.21(11) 1_454 1_454 ?
Ag4 Ag4 Ag5 133.12(3) 2_554 1_454 ?
O5 Ag5 N6 152.05(18) . 2_655 ?
O5 Ag5 O2 105.71(17) . 2_655 ?
N6 Ag5 O2 99.99(18) 2_655 2_655 ?
O5 Ag5 Ag4 79.35(11) . 1_656 ?
N6 Ag5 Ag4 127.83(14) 2_655 1_656 ?
O2 Ag5 Ag4 44.48(10) 2_655 1_656 ?
C2 C1 C3 119.9(5) . . ?
C2 C1 C4 120.3(5) . . ?
C3 C1 C4 119.7(5) . . ?
C1 C2 C3 119.5(5) . 2_655 ?
C1 C2 C5 119.8(5) . . ?
C3 C2 C5 120.7(5) 2_655 . ?
C2 C3 C1 120.6(5) 2_655 . ?
C2 C3 C6 119.6(5) 2_655 . ?
C1 C3 C6 119.7(5) . . ?
N1 C4 C1 113.6(5) . . ?
N1 C4 H4A 108.9 . . ?
C1 C4 H4A 108.9 . . ?
N1 C4 H4B 108.9 . . ?
C1 C4 H4B 108.9 . . ?
H4A C4 H4B 107.7 . . ?
N4 C5 C2 113.2(5) . . ?
N4 C5 H5A 108.9 . . ?
C2 C5 H5A 108.9 . . ?
N4 C5 H5B 108.9 . . ?
C2 C5 H5B 108.9 . . ?
H5A C5 H5B 107.8 . . ?
N7 C6 C3 113.3(5) . . ?
N7 C6 H6A 108.9 . . ?
C3 C6 H6A 108.9 . . ?
N7 C6 H6B 108.9 . . ?
C3 C6 H6B 108.9 . . ?
H6A C6 H6B 107.7 . . ?
N1 C7 C8 106.9(6) . . ?
N1 C7 H7 126.5 . . ?
C8 C7 H7 126.5 . . ?
C7 C8 C9 105.0(5) . . ?
C7 C8 H8 127.5 . . ?
C9 C8 H8 127.5 . . ?
N2 C9 C8 110.6(5) . . ?
N2 C9 C10 119.0(5) . . ?
C8 C9 C10 130.3(5) . . ?
N3 C10 C11 121.5(6) . . ?
N3 C10 C9 117.1(5) . . ?
C11 C10 C9 121.4(6) . . ?
C12' C11 C10 121.5(16) . . ?
C12' C11 C12 25.4(17) . . ?
C10 C11 C12 113.5(13) . . ?
C12' C12 C13 103(7) . . ?
C12' C12 C11 64(6) . . ?
C13 C12 C11 120.3(18) . . ?
C12 C12' C11 90(6) . . ?
C12 C12' C13 53(6) . . ?
C11 C12' C13 112(2) . . ?
C12 C13 C14 117.2(14) . . ?
C12 C13 C12' 24(2) . . ?
C14 C13 C12' 114.9(15) . . ?
N3 C14 C13 124.8(8) . . ?
N3 C14 H14 117.6 . . ?
C13 C14 H14 117.6 . . ?
N4 C15 C16 106.9(6) . . ?
N4 C15 H15 126.6 . . ?
C16 C15 H15 126.6 . . ?
C15 C16 C17 105.2(5) . . ?
C15 C16 H16 127.4 . . ?
C17 C16 H16 127.4 . . ?
N5 C17 C16 111.4(5) . . ?
N5 C17 C18 119.8(5) . . ?
C16 C17 C18 128.8(5) . . ?
N6 C18 C19 121.5(6) . . ?
N6 C18 C17 116.9(5) . . ?
C19 C18 C17 121.5(6) . . ?
C20 C19 C18 119.7(7) . . ?
C20 C19 H19 120.1 . . ?
C18 C19 H19 120.1 . . ?
C21 C20 C19 119.2(6) . . ?
C21 C20 H20 120.4 . . ?
C19 C20 H20 120.4 . . ?
C20 C21 C22 118.5(7) . . ?
C20 C21 H21 120.7 . . ?
C22 C21 H21 120.7 . . ?
N6 C22 C21 122.9(7) . . ?
N6 C22 H22 118.6 . . ?
C21 C22 H22 118.6 . . ?
N7 C23 C24 106.5(7) . . ?
N7 C23 H23 126.8 . . ?
C24 C23 H23 126.8 . . ?
C23 C24 C25 105.5(6) . . ?
C23 C24 H24 127.3 . . ?
C25 C24 H24 127.3 . . ?
N8 C25 C24 111.0(6) . . ?
N8 C25 C26 119.9(6) . . ?
C24 C25 C26 129.1(6) . . ?
N9 C26 C27 122.2(7) . . ?
N9 C26 C25 116.8(5) . . ?
C27 C26 C25 120.9(7) . . ?
C28 C27 C26 119.8(8) . . ?
C28 C27 H27 120.1 . . ?
C26 C27 H27 120.1 . . ?
C29 C28 C27 118.3(8) . . ?
C29 C28 H28 120.9 . . ?
C27 C28 H28 120.9 . . ?
C28 C29 C30 119.0(8) . . ?
C28 C29 H29 120.5 . . ?
C30 C29 H29 120.5 . . ?
N9 C30 C29 123.3(8) . . ?
N9 C30 H30 118.3 . . ?
C29 C30 H30 118.3 . . ?
O8 C31 O7 125.7(6) . . ?
O8 C31 C33 118.0(5) . . ?
O7 C31 C33 116.3(5) . . ?
O6 C32 O5 127.6(6) . . ?
O6 C32 C35 117.0(5) . . ?
O5 C32 C35 115.5(5) . . ?
C38 C33 C34 119.2(5) . . ?
C38 C33 C31 119.1(5) . . ?
C34 C33 C31 121.7(5) . . ?
C35 C34 C33 121.3(5) . . ?
C35 C34 H34 119.4 . . ?
C33 C34 H34 119.4 . . ?
C36 C35 C34 119.0(6) . . ?
C36 C35 C32 120.2(5) . . ?
C34 C35 C32 120.8(5) . . ?
C35 C36 C37 120.3(6) . . ?
C35 C36 H36 119.8 . . ?
C37 C36 H36 119.8 . . ?
C36 C37 C38 120.6(6) . . ?
C36 C37 H37 119.7 . . ?
C38 C37 H37 119.7 . . ?
C33 C38 C37 119.6(6) . . ?
C33 C38 H38 120.2 . . ?
C37 C38 H38 120.2 . . ?
O2 C39 O1 124.9(7) . . ?
O2 C39 C41 119.6(7) . . ?
O1 C39 C41 115.5(7) . . ?
O3 C40 O4 124.3(5) . . ?
O3 C40 C43 117.4(5) . . ?
O4 C40 C43 118.3(5) . . ?
C42 C41 C46 118.7(6) . . ?
C42 C41 C39 120.9(6) . . ?
C46 C41 C39 120.4(6) . . ?
C41 C42 C43 121.4(5) . . ?
C41 C42 H42 119.3 . . ?
C43 C42 H42 119.3 . . ?
C44 C43 C42 118.8(5) . . ?
C44 C43 C40 121.7(5) . . ?
C42 C43 C40 119.3(5) . . ?
C45 C44 C43 120.2(6) . . ?
C45 C44 H44 119.9 . . ?
C43 C44 H44 119.9 . . ?
C44 C45 C46 120.7(6) . . ?
C44 C45 H45 119.6 . . ?
C46 C45 H45 119.6 . . ?
C45 C46 C41 120.1(6) . . ?
C45 C46 H46 120.0 . . ?
C41 C46 H46 120.0 . . ?
C39 O1 Ag4 128.6(5) . . ?
C39 O2 Ag4 115.1(5) . 2_554 ?
C39 O2 Ag5 136.4(5) . 2_655 ?
Ag4 O2 Ag5 81.60(16) 2_554 2_655 ?
C40 O3 Ag1 131.7(4) . . ?
C40 O4 Ag2 120.3(3) . . ?
C32 O5 Ag5 128.6(4) . . ?
C32 O6 Ag4 127.0(4) . 1_656 ?
C31 O7 Ag3 119.4(4) . . ?
C31 O7 Ag2 110.4(3) . . ?
Ag3 O7 Ag2 95.22(15) . . ?
C31 O8 Ag3 130.3(4) . 2_765 ?
O9' O9 N10 56.1(10) . . ?
O9' O9 Ag3 82.8(10) . 2_655 ?
N10 O9 Ag3 116.2(8) . 2_655 ?
N10 O9' O9 65.6(12) . . ?
N10 O9' O11 58.3(10) . . ?
O9 O9' O11 109.7(15) . . ?
N10 O9' Ag3 113.9(11) . 2_655 ?
O9 O9' Ag3 71.5(10) . 2_655 ?
O11 O9' Ag3 95.3(9) . 2_655 ?
N10 O11 O9' 49.3(8) . . ?
N2 N1 C7 112.0(5) . . ?
N2 N1 C4 122.6(5) . . ?
C7 N1 C4 124.9(5) . . ?
N1 N2 C9 105.4(5) . . ?
N1 N2 Ag1 134.3(3) . . ?
C9 N2 Ag1 114.2(4) . . ?
C14 N3 C10 118.5(6) . . ?
C14 N3 Ag1 127.1(5) . . ?
C10 N3 Ag1 114.4(4) . . ?
C15 N4 N5 112.1(5) . . ?
C15 N4 C5 128.0(5) . . ?
N5 N4 C5 119.9(4) . . ?
C17 N5 N4 104.5(4) . . ?
C22 N6 C18 118.1(5) . . ?
C22 N6 Ag5 122.2(5) . 2_655 ?
C18 N6 Ag5 117.5(4) . 2_655 ?
N8 N7 C23 112.2(5) . . ?
N8 N7 C6 120.8(5) . . ?
C23 N7 C6 126.8(6) . . ?
N7 N8 C25 104.9(5) . . ?
N7 N8 Ag2 141.6(3) . . ?
C25 N8 Ag2 113.2(4) . . ?
C26 N9 C30 117.3(6) . . ?
C26 N9 Ag2 117.0(4) . . ?
C30 N9 Ag2 125.5(5) . . ?
O9' N10 O10 136.7(11) . . ?
O9' N10 O9 58.3(9) . . ?
O10 N10 O9 127.2(12) . . ?
O9' N10 O11 72.3(10) . . ?
O10 N10 O11 117.8(11) . . ?
O9 N10 O11 114.8(9) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O3 Ag1 Ag2 O4 -13.81(19) . . . . ?
N2 Ag1 Ag2 O4 157.75(16) . . . . ?
N3 Ag1 Ag2 O4 -129.65(19) . . . . ?
O3 Ag1 Ag2 N9 125.1(2) . . . . ?
N2 Ag1 Ag2 N9 -63.35(18) . . . . ?
N3 Ag1 Ag2 N9 9.2(2) . . . . ?
O3 Ag1 Ag2 N8 -164.58(19) . . . . ?
N2 Ag1 Ag2 N8 6.99(15) . . . . ?
N3 Ag1 Ag2 N8 79.58(18) . . . . ?
O3 Ag1 Ag2 O7 -49.0(4) . . . . ?
N2 Ag1 Ag2 O7 122.5(4) . . . . ?
N3 Ag1 Ag2 O7 -164.9(4) . . . . ?
C3 C1 C2 C3 -2.6(8) . . . 2_655 ?
C4 C1 C2 C3 -178.4(5) . . . 2_655 ?
C3 C1 C2 C5 177.0(5) . . . . ?
C4 C1 C2 C5 1.2(7) . . . . ?
C2 C1 C3 C2 2.6(8) . . . 2_655 ?
C4 C1 C3 C2 178.4(5) . . . 2_655 ?
C2 C1 C3 C6 -175.3(5) . . . . ?
C4 C1 C3 C6 0.5(7) . . . . ?
C2 C1 C4 N1 -79.8(6) . . . . ?
C3 C1 C4 N1 104.3(6) . . . . ?
C1 C2 C5 N4 87.4(6) . . . . ?
C3 C2 C5 N4 -93.1(6) 2_655 . . . ?
C2 C3 C6 N7 110.5(6) 2_655 . . . ?
C1 C3 C6 N7 -71.6(7) . . . . ?
N1 C7 C8 C9 0.4(9) . . . . ?
C7 C8 C9 N2 -1.2(9) . . . . ?
C7 C8 C9 C10 -179.7(7) . . . . ?
N2 C9 C10 N3 14.6(9) . . . . ?
C8 C9 C10 N3 -167.1(7) . . . . ?
N2 C9 C10 C11 -166.2(7) . . . . ?
C8 C9 C10 C11 12.2(12) . . . . ?
N3 C10 C11 C12' 15(2) . . . . ?
C9 C10 C11 C12' -164.5(17) . . . . ?
N3 C10 C11 C12 -12.6(18) . . . . ?
C9 C10 C11 C12 168.2(15) . . . . ?
C10 C11 C12 C12' 114(6) . . . . ?
C12' C11 C12 C13 -91(7) . . . . ?
C10 C11 C12 C13 24(3) . . . . ?
C13 C12 C12' C11 118(3) . . . . ?
C11 C12 C12' C13 -118(3) . . . . ?
C10 C11 C12' C12 -78(6) . . . . ?
C10 C11 C12' C13 -29(3) . . . . ?
C12 C11 C12' C13 50(4) . . . . ?
C12' C12 C13 C14 -91(6) . . . . ?
C11 C12 C13 C14 -23(3) . . . . ?
C11 C12 C13 C12' 68(5) . . . . ?
C11 C12' C13 C12 -73(5) . . . . ?
C12 C12' C13 C14 101(5) . . . . ?
C11 C12' C13 C14 28(3) . . . . ?
C12 C13 C14 N3 12(2) . . . . ?
C12' C13 C14 N3 -15(2) . . . . ?
N4 C15 C16 C17 0.7(8) . . . . ?
C15 C16 C17 N5 -0.7(8) . . . . ?
C15 C16 C17 C18 179.7(6) . . . . ?
N5 C17 C18 N6 39.6(8) . . . . ?
C16 C17 C18 N6 -140.8(7) . . . . ?
N5 C17 C18 C19 -140.0(6) . . . . ?
C16 C17 C18 C19 39.6(10) . . . . ?
N6 C18 C19 C20 -1.7(10) . . . . ?
C17 C18 C19 C20 177.9(6) . . . . ?
C18 C19 C20 C21 -0.8(12) . . . . ?
C19 C20 C21 C22 1.7(13) . . . . ?
C20 C21 C22 N6 -0.2(14) . . . . ?
N7 C23 C24 C25 0.6(10) . . . . ?
C23 C24 C25 N8 -0.2(9) . . . . ?
C23 C24 C25 C26 179.8(7) . . . . ?
N8 C25 C26 N9 -0.1(10) . . . . ?
C24 C25 C26 N9 179.8(8) . . . . ?
N8 C25 C26 C27 -177.9(7) . . . . ?
C24 C25 C26 C27 2.1(13) . . . . ?
N9 C26 C27 C28 2.3(14) . . . . ?
C25 C26 C27 C28 179.9(8) . . . . ?
C26 C27 C28 C29 -2.2(16) . . . . ?
C27 C28 C29 C30 0.8(16) . . . . ?
C28 C29 C30 N9 0.7(14) . . . . ?
O8 C31 C33 C38 1.6(9) . . . . ?
O7 C31 C33 C38 -179.6(6) . . . . ?
O8 C31 C33 C34 -176.1(5) . . . . ?
O7 C31 C33 C34 2.6(8) . . . . ?
C38 C33 C34 C35 0.0(9) . . . . ?
C31 C33 C34 C35 177.7(5) . . . . ?
C33 C34 C35 C36 -1.5(9) . . . . ?
C33 C34 C35 C32 179.7(5) . . . . ?
O6 C32 C35 C36 -0.7(9) . . . . ?
O5 C32 C35 C36 179.9(6) . . . . ?
O6 C32 C35 C34 178.1(6) . . . . ?
O5 C32 C35 C34 -1.3(8) . . . . ?
C34 C35 C36 C37 1.7(12) . . . . ?
C32 C35 C36 C37 -179.5(7) . . . . ?
C35 C36 C37 C38 -0.3(14) . . . . ?
C34 C33 C38 C37 1.5(11) . . . . ?
C31 C33 C38 C37 -176.3(7) . . . . ?
C36 C37 C38 C33 -1.3(14) . . . . ?
O2 C39 C41 C42 10.2(10) . . . . ?
O1 C39 C41 C42 -169.0(6) . . . . ?
O2 C39 C41 C46 -169.6(7) . . . . ?
O1 C39 C41 C46 11.2(10) . . . . ?
C46 C41 C42 C43 -1.2(9) . . . . ?
C39 C41 C42 C43 179.0(5) . . . . ?
C41 C42 C43 C44 2.5(8) . . . . ?
C41 C42 C43 C40 -172.5(5) . . . . ?
O3 C40 C43 C44 178.1(6) . . . . ?
O4 C40 C43 C44 -3.9(8) . . . . ?
O3 C40 C43 C42 -7.1(8) . . . . ?
O4 C40 C43 C42 170.9(5) . . . . ?
C42 C43 C44 C45 -1.6(9) . . . . ?
C40 C43 C44 C45 173.2(6) . . . . ?
C43 C44 C45 C46 -0.6(11) . . . . ?
C44 C45 C46 C41 1.9(11) . . . . ?
C42 C41 C46 C45 -1.0(10) . . . . ?
C39 C41 C46 C45 178.8(7) . . . . ?
O2 C39 O1 Ag4 26.9(12) . . . . ?
C41 C39 O1 Ag4 -153.9(5) . . . . ?
O2 Ag4 O1 C39 -88.0(7) 2_554 . . . ?
O6 Ag4 O1 C39 81.6(7) 1_454 . . . ?
Ag4 Ag4 O1 C39 -42.0(7) 2_554 . . . ?
Ag5 Ag4 O1 C39 170.0(5) 1_454 . . . ?
O1 C39 O2 Ag4 19.9(10) . . . 2_554 ?
C41 C39 O2 Ag4 -159.3(5) . . . 2_554 ?
O1 C39 O2 Ag5 124.8(7) . . . 2_655 ?
C41 C39 O2 Ag5 -54.3(10) . . . 2_655 ?
O4 C40 O3 Ag1 -22.6(9) . . . . ?
C43 C40 O3 Ag1 155.2(4) . . . . ?
N2 Ag1 O3 C40 -87.7(12) . . . . ?
N3 Ag1 O3 C40 115.7(6) . . . . ?
Ag2 Ag1 O3 C40 25.1(5) . . . . ?
O3 C40 O4 Ag2 -1.5(8) . . . . ?
C43 C40 O4 Ag2 -179.3(3) . . . . ?
N9 Ag2 O4 C40 -83.1(5) . . . . ?
N8 Ag2 O4 C40 75.5(5) . . . . ?
O7 Ag2 O4 C40 -173.7(4) . . . . ?
Ag1 Ag2 O4 C40 13.8(4) . . . . ?
O6 C32 O5 Ag5 -8.0(10) . . . . ?
C35 C32 O5 Ag5 171.3(4) . . . . ?
N6 Ag5 O5 C32 -154.3(5) 2_655 . . . ?
O2 Ag5 O5 C32 49.6(5) 2_655 . . . ?
Ag4 Ag5 O5 C32 13.4(5) 1_656 . . . ?
O5 C32 O6 Ag4 -8.9(10) . . . 1_656 ?
C35 C32 O6 Ag4 171.8(4) . . . 1_656 ?
O8 C31 O7 Ag3 12.3(8) . . . . ?
C33 C31 O7 Ag3 -166.4(4) . . . . ?
O8 C31 O7 Ag2 -96.4(6) . . . . ?
C33 C31 O7 Ag2 84.9(5) . . . . ?
O8 Ag3 O7 C31 -41.7(7) 2_765 . . . ?
O9 Ag3 O7 C31 124.4(5) 2_655 . . . ?
O9' Ag3 O7 C31 147.5(5) 2_655 . . . ?
Ag3 Ag3 O7 C31 -14.3(4) 2_765 . . . ?
O8 Ag3 O7 Ag2 75.2(5) 2_765 . . . ?
O9 Ag3 O7 Ag2 -118.7(3) 2_655 . . . ?
O9' Ag3 O7 Ag2 -95.6(4) 2_655 . . . ?
Ag3 Ag3 O7 Ag2 102.66(10) 2_765 . . . ?
O4 Ag2 O7 C31 143.2(4) . . . . ?
N9 Ag2 O7 C31 4.1(4) . . . . ?
N8 Ag2 O7 C31 -68.7(4) . . . . ?
Ag1 Ag2 O7 C31 178.2(3) . . . . ?
O4 Ag2 O7 Ag3 19.19(16) . . . . ?
N9 Ag2 O7 Ag3 -119.98(18) . . . . ?
N8 Ag2 O7 Ag3 167.24(14) . . . . ?
Ag1 Ag2 O7 Ag3 54.2(5) . . . . ?
O7 C31 O8 Ag3 1.5(9) . . . 2_765 ?
C33 C31 O8 Ag3 -179.9(4) . . . 2_765 ?
Ag3 O9 O9' N10 -128.4(8) 2_655 . . . ?
N10 O9 O9' O11 39.3(10) . . . . ?
Ag3 O9 O9' O11 -89.1(12) 2_655 . . . ?
N10 O9 O9' Ag3 128.4(8) . . . 2_655 ?
O9 O9' O11 N10 -42.6(12) . . . . ?
Ag3 O9' O11 N10 -114.8(11) 2_655 . . . ?
C8 C7 N1 N2 0.5(8) . . . . ?
C8 C7 N1 C4 172.3(6) . . . . ?
C1 C4 N1 N2 -22.5(8) . . . . ?
C1 C4 N1 C7 166.5(6) . . . . ?
C7 N1 N2 C9 -1.3(7) . . . . ?
C4 N1 N2 C9 -173.3(5) . . . . ?
C7 N1 N2 Ag1 -150.9(5) . . . . ?
C4 N1 N2 Ag1 37.1(8) . . . . ?
C8 C9 N2 N1 1.5(7) . . . . ?
C10 C9 N2 N1 -179.8(5) . . . . ?
C8 C9 N2 Ag1 158.2(5) . . . . ?
C10 C9 N2 Ag1 -23.2(7) . . . . ?
O3 Ag1 N2 N1 6.6(14) . . . . ?
N3 Ag1 N2 N1 164.6(6) . . . . ?
Ag2 Ag1 N2 N1 -103.8(5) . . . . ?
O3 Ag1 N2 C9 -141.1(10) . . . . ?
N3 Ag1 N2 C9 16.9(4) . . . . ?
Ag2 Ag1 N2 C9 108.5(4) . . . . ?
C13 C14 N3 C10 -0.7(14) . . . . ?
C13 C14 N3 Ag1 179.2(7) . . . . ?
C11 C10 N3 C14 2.4(11) . . . . ?
C9 C10 N3 C14 -178.4(7) . . . . ?
C11 C10 N3 Ag1 -177.6(7) . . . . ?
C9 C10 N3 Ag1 1.7(8) . . . . ?
O3 Ag1 N3 C14 -13.2(8) . . . . ?
N2 Ag1 N3 C14 170.5(7) . . . . ?
Ag2 Ag1 N3 C14 63.8(7) . . . . ?
O3 Ag1 N3 C10 166.8(5) . . . . ?
N2 Ag1 N3 C10 -9.6(5) . . . . ?
Ag2 Ag1 N3 C10 -116.3(5) . . . . ?
C16 C15 N4 N5 -0.5(8) . . . . ?
C16 C15 N4 C5 -179.4(6) . . . . ?
C2 C5 N4 C15 -137.3(6) . . . . ?
C2 C5 N4 N5 43.9(7) . . . . ?
C16 C17 N5 N4 0.4(7) . . . . ?
C18 C17 N5 N4 -180.0(5) . . . . ?
C15 N4 N5 C17 0.1(7) . . . . ?
C5 N4 N5 C17 179.0(5) . . . . ?
C21 C22 N6 C18 -2.2(12) . . . . ?
C21 C22 N6 Ag5 160.5(7) . . . 2_655 ?
C19 C18 N6 C22 3.2(9) . . . . ?
C17 C18 N6 C22 -176.4(6) . . . . ?
C19 C18 N6 Ag5 -160.3(5) . . . 2_655 ?
C17 C18 N6 Ag5 20.1(7) . . . 2_655 ?
C24 C23 N7 N8 -0.9(9) . . . . ?
C24 C23 N7 C6 173.8(7) . . . . ?
C3 C6 N7 N8 -53.6(8) . . . . ?
C3 C6 N7 C23 132.1(7) . . . . ?
C23 N7 N8 C25 0.8(7) . . . . ?
C6 N7 N8 C25 -174.3(5) . . . . ?
C23 N7 N8 Ag2 -172.1(6) . . . . ?
C6 N7 N8 Ag2 12.8(9) . . . . ?
C24 C25 N8 N7 -0.4(8) . . . . ?
C26 C25 N8 N7 179.6(6) . . . . ?
C24 C25 N8 Ag2 174.8(5) . . . . ?
C26 C25 N8 Ag2 -5.2(7) . . . . ?
O4 Ag2 N8 N7 12.7(8) . . . . ?
N9 Ag2 N8 N7 178.2(6) . . . . ?
O7 Ag2 N8 N7 -92.8(6) . . . . ?
Ag1 Ag2 N8 N7 74.9(6) . . . . ?
O4 Ag2 N8 C25 -159.8(4) . . . . ?
N9 Ag2 N8 C25 5.7(4) . . . . ?
O7 Ag2 N8 C25 94.7(4) . . . . ?
Ag1 Ag2 N8 C25 -97.6(4) . . . . ?
C27 C26 N9 C30 -0.7(11) . . . . ?
C25 C26 N9 C30 -178.4(6) . . . . ?
C27 C26 N9 Ag2 -176.6(7) . . . . ?
C25 C26 N9 Ag2 5.7(8) . . . . ?
C29 C30 N9 C26 -0.7(11) . . . . ?
C29 C30 N9 Ag2 174.8(6) . . . . ?
O4 Ag2 N9 C26 161.8(4) . . . . ?
N8 Ag2 N9 C26 -6.1(5) . . . . ?
O7 Ag2 N9 C26 -110.3(5) . . . . ?
Ag1 Ag2 N9 C26 71.1(5) . . . . ?
O4 Ag2 N9 C30 -13.7(7) . . . . ?
N8 Ag2 N9 C30 178.4(6) . . . . ?
O7 Ag2 N9 C30 74.2(5) . . . . ?
Ag1 Ag2 N9 C30 -104.4(5) . . . . ?
O9 O9' N10 O10 -112(2) . . . . ?
O11 O9' N10 O10 112(2) . . . . ?
Ag3 O9' N10 O10 -166.8(14) 2_655 . . . ?
O11 O9' N10 O9 -135.6(12) . . . . ?
Ag3 O9' N10 O9 -54.4(10) 2_655 . . . ?
O9 O9' N10 O11 135.6(12) . . . . ?
Ag3 O9' N10 O11 81.2(11) 2_655 . . . ?
Ag3 O9 N10 O9' 60.1(12) 2_655 . . . ?
O9' O9 N10 O10 127.3(15) . . . . ?
Ag3 O9 N10 O10 -172.6(7) 2_655 . . . ?
O9' O9 N10 O11 -47.3(13) . . . . ?
Ag3 O9 N10 O11 12.7(13) 2_655 . . . ?
O9' O11 N10 O10 -134.1(13) . . . . ?
O9' O11 N10 O9 41.0(11) . . . . ?

_diffrn_measured_fraction_theta_max 0.842
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         1.421
_refine_diff_density_min         -1.375
_refine_diff_density_rms         0.120
_database_code_depnum_ccdc_archive 'CCDC 984130'
#######################################################################
#
#                 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_crystal6

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C42 H32 Ag2 N9 O8'
_chemical_formula_sum            'C42 H32 Ag2 N9 O8'
_chemical_formula_weight         1006.51

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   11.4860(6)
_cell_length_b                   12.9510(8)
_cell_length_c                   13.9760(6)
_cell_angle_alpha                85.015(4)
_cell_angle_beta                 79.768(4)
_cell_angle_gamma                65.610(5)
_cell_volume                     1863.14(17)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    4147
_cell_measurement_theta_min      3.2027
_cell_measurement_theta_max      29.1961

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.21
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.794
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1010
_exptl_absorpt_coefficient_mu    1.123
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7514
_exptl_absorpt_correction_T_max  0.7984
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            14064
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_av_sigmaI/netI    0.0697
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         3.21
_diffrn_reflns_theta_max         29.26
_reflns_number_total             8471
_reflns_number_gt                5547
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

The distance of H4a...H5a was refined restrained to 2.1+-0.02 Å. 
For C41 and C42,  some anisotropic 
displacement ellipsoids were rather elongated 
which led us to use the ISOR restraints. For C41, C42, O4 and O8, some 
anisotropic displacement ellipsoids were rather elongated 
which led us to use the DELU restraints.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0639P)²+3.4769P] where P=(Fo²+2Fc²)/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         8471
_refine_ls_number_parameters     550
_refine_ls_number_restraints     15
_refine_ls_R_factor_all          0.1017
_refine_ls_R_factor_gt           0.0612
_refine_ls_wR_factor_ref         0.1630
_refine_ls_wR_factor_gt          0.1375
_refine_ls_goodness_of_fit_ref   1.021
_refine_ls_restrained_S_all      1.029
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.80573(5) 0.95504(4) 0.30918(4) 0.05535(17) Uani 1 1 d . . .
Ag2 Ag 1.19363(5) 0.83698(4) -0.17771(4) 0.05010(16) Uani 1 1 d . . .
C1 C 0.9983(5) 0.8994(4) 0.0445(4) 0.0362(12) Uani 1 1 d . . .
C2 C 1.0702(5) 0.9492(4) 0.0764(4) 0.0362(12) Uani 1 1 d . . .
C3 C 0.9263(5) 0.9500(4) -0.0318(4) 0.0379(12) Uani 1 1 d . . .
C4 C 0.9915(6) 0.7910(4) 0.0910(4) 0.0436(14) Uani 1 1 d . . .
H4A H 1.0034 0.7867 0.1585 0.052 Uiso 1 1 calc RD . .
H4B H 0.9064 0.7930 0.0898 0.052 Uiso 1 1 calc R . .
C5 C 1.1506(5) 0.8939(5) 0.1575(4) 0.0427(13) Uani 1 1 d . . .
H5A H 1.1437 0.8225 0.1764 0.051 Uiso 1 1 calc RD . .
H5B H 1.2408 0.8773 0.1326 0.051 Uiso 1 1 calc R . .
C6 C 0.8407(5) 0.9003(4) -0.0601(4) 0.0409(13) Uani 1 1 d . . .
H6A H 0.7957 0.8794 -0.0014 0.049 Uiso 1 1 calc R . .
H6B H 0.7760 0.9584 -0.0938 0.049 Uiso 1 1 calc R . .
C7 C 1.0785(7) 0.5920(5) 0.0342(5) 0.0519(16) Uani 1 1 d . . .
H7 H 1.0066 0.5765 0.0592 0.062 Uiso 1 1 calc R . .
C8 C 1.1911(7) 0.5197(5) -0.0156(5) 0.0532(16) Uani 1 1 d . . .
H8 H 1.2125 0.4453 -0.0318 0.064 Uiso 1 1 calc R . .
C9 C 1.2687(5) 0.5805(4) -0.0376(4) 0.0387(12) Uani 1 1 d . . .
C10 C 1.3999(6) 0.5410(5) -0.0919(4) 0.0417(13) Uani 1 1 d . . .
C11 C 1.4492(5) 0.4376(4) -0.1284(4) 0.0332(11) Uani 1 1 d . . .
H11 H 1.4010 0.3939 -0.1197 0.040 Uiso 1 1 calc R . .
C12 C 1.5673(6) 0.3981(5) -0.1771(5) 0.0549(17) Uani 1 1 d . . .
H12 H 1.6003 0.3260 -0.2031 0.066 Uiso 1 1 calc R . .
C13 C 1.6439(7) 0.4562(6) -0.1918(5) 0.0582(18) Uani 1 1 d . . .
H13 H 1.7281 0.4240 -0.2249 0.070 Uiso 1 1 calc R . .
C14 C 1.5934(7) 0.5635(6) -0.1563(5) 0.0570(17) Uani 1 1 d . . .
H14 H 1.6426 0.6065 -0.1673 0.068 Uiso 1 1 calc R . .
C15 C 1.1856(6) 0.9971(5) 0.2855(4) 0.0459(14) Uani 1 1 d . . .
H15 H 1.2731 0.9798 0.2651 0.055 Uiso 1 1 calc R . .
C16 C 1.1099(6) 1.0602(5) 0.3638(4) 0.0439(14) Uani 1 1 d . . .
H16 H 1.1340 1.0956 0.4071 0.053 Uiso 1 1 calc R . .
C17 C 0.9883(5) 1.0603(4) 0.3647(4) 0.0353(12) Uani 1 1 d . . .
C18 C 0.8705(5) 1.1148(4) 0.4340(4) 0.0362(12) Uani 1 1 d . . .
C19 C 0.8639(7) 1.1891(5) 0.5022(4) 0.0527(16) Uani 1 1 d . . .
H19 H 0.9349 1.2053 0.5048 0.063 Uiso 1 1 calc R . .
C20 C 0.7515(8) 1.2385(6) 0.5659(5) 0.065(2) Uani 1 1 d . . .
H20 H 0.7457 1.2881 0.6125 0.078 Uiso 1 1 calc R . .
C21 C 0.6490(8) 1.2145(6) 0.5604(5) 0.063(2) Uani 1 1 d . . .
H21 H 0.5717 1.2479 0.6027 0.076 Uiso 1 1 calc R . .
C22 C 0.6604(6) 1.1398(6) 0.4912(5) 0.0544(16) Uani 1 1 d . . .
H22 H 0.5896 1.1234 0.4881 0.065 Uiso 1 1 calc R . .
C23 C 0.8584(6) 0.7303(6) -0.1439(5) 0.0564(17) Uani 1 1 d . . .
H23 H 0.7772 0.7319 -0.1186 0.068 Uiso 1 1 calc R . .
C24 C 0.9479(6) 0.6555(5) -0.2095(5) 0.0551(16) Uani 1 1 d . . .
H24 H 0.9415 0.5958 -0.2375 0.066 Uiso 1 1 calc R . .
C25 C 1.0519(5) 0.6876(4) -0.2260(4) 0.0351(12) Uani 1 1 d . . .
C26 C 1.1789(5) 0.6374(4) -0.2863(4) 0.0363(12) Uani 1 1 d . . .
C27 C 1.2102(7) 0.5476(5) -0.3468(4) 0.0495(15) Uani 1 1 d . . .
H27 H 1.1483 0.5211 -0.3538 0.059 Uiso 1 1 calc R . .
C28 C 1.3325(8) 0.4986(6) -0.3957(5) 0.065(2) Uani 1 1 d . . .
H28 H 1.3549 0.4379 -0.4362 0.078 Uiso 1 1 calc R . .
C29 C 1.4226(7) 0.5383(6) -0.3856(5) 0.0622(19) Uani 1 1 d . . .
H29 H 1.5081 0.5029 -0.4156 0.075 Uiso 1 1 calc R . .
C30 C 1.3825(6) 0.6328(5) -0.3293(4) 0.0484(15) Uani 1 1 d . . .
H30 H 1.4409 0.6647 -0.3262 0.058 Uiso 1 1 calc R . .
C31 C 0.9489(8) 0.7065(6) 0.3794(5) 0.0566(17) Uani 1 1 d . . .
C32 C 0.9730(6) 0.6005(5) 0.4439(4) 0.0439(14) Uani 1 1 d . . .
C33 C 1.0885(6) 0.5073(5) 0.4235(4) 0.0466(14) Uani 1 1 d . . .
H33 H 1.1496 0.5119 0.3718 0.056 Uiso 1 1 calc R . .
C34 C 1.1172(6) 0.4070(5) 0.4772(4) 0.0434(13) Uani 1 1 d . . .
C35 C 1.2480(7) 0.3153(6) 0.4476(6) 0.0616(18) Uani 1 1 d . . .
C36 C 1.3598(5) 0.9632(4) -0.1389(4) 0.0361(12) Uani 1 1 d . . .
C37 C 1.4378(5) 0.9808(4) -0.0703(4) 0.0300(11) Uani 1 1 d . . .
C38 C 1.4798(5) 0.9024(4) 0.0040(4) 0.0336(11) Uani 1 1 d . . .
H38 H 1.4670 0.8357 0.0068 0.040 Uiso 1 1 calc R . .
C39 C 1.5401(5) 0.9211(4) 0.0733(4) 0.0298(11) Uani 1 1 d . . .
C40 C 1.5737(6) 0.8348(5) 0.1547(4) 0.0405(13) Uani 1 1 d . . .
C41 C 1.7332(7) 0.6786(6) 0.2183(5) 0.0592(14) Uani 1 1 d U . .
H41A H 1.8223 0.6275 0.2023 0.089 Uiso 1 1 calc R . .
H41B H 1.6800 0.6365 0.2282 0.089 Uiso 1 1 calc R . .
H41C H 1.7216 0.7180 0.2767 0.089 Uiso 1 1 calc R . .
C42 C 1.3742(10) 0.1536(8) 0.3440(7) 0.101(2) Uani 1 1 d U . .
H42A H 1.3610 0.1101 0.2981 0.151 Uiso 1 1 calc R . .
H42B H 1.4102 0.1052 0.3968 0.151 Uiso 1 1 calc R . .
H42C H 1.4327 0.1862 0.3125 0.151 Uiso 1 1 calc R . .
N1 N 1.0897(5) 0.6903(3) 0.0407(3) 0.0380(10) Uani 1 1 d . . .
N2 N 1.2058(4) 0.6852(4) -0.0027(3) 0.0380(10) Uani 1 1 d . . .
N3 N 1.4697(6) 0.6088(5) -0.1040(4) 0.0663(16) Uani 1 1 d . . .
N4 N 1.1105(4) 0.9645(4) 0.2432(3) 0.0376(10) Uani 1 1 d . . .
N5 N 0.9890(4) 1.0020(4) 0.2909(3) 0.0339(10) Uani 1 1 d . . .
N6 N 0.7691(4) 1.0898(4) 0.4283(3) 0.0406(11) Uani 1 1 d . . .
N7 N 0.9070(4) 0.8018(4) -0.1216(3) 0.0388(10) Uani 1 1 d . . .
N8 N 1.0249(4) 0.7772(3) -0.1720(3) 0.0314(9) Uani 1 1 d . . .
N9 N 1.2635(4) 0.6804(4) -0.2793(3) 0.0365(10) Uani 1 1 d . . .
O1 O 0.8464(6) 0.7877(5) 0.4036(5) 0.0938(19) Uani 1 1 d . . .
O2 O 1.0338(7) 0.7038(5) 0.3127(4) 0.0909(19) Uani 1 1 d . . .
O3 O 1.3440(6) 0.3023(6) 0.4737(7) 0.135(3) Uani 1 1 d . . .
O4 O 1.2482(6) 0.2457(5) 0.3824(5) 0.1013(19) Uani 1 1 d U . .
O5 O 1.3248(5) 0.8847(4) -0.1164(4) 0.0680(14) Uani 1 1 d . . .
O6 O 1.3313(5) 1.0305(4) -0.2064(3) 0.0726(15) Uani 1 1 d . . .
O7 O 1.4967(4) 0.8306(4) 0.2220(3) 0.0562(11) Uani 1 1 d . . .
O8 O 1.6958(4) 0.7609(3) 0.1384(3) 0.0547(11) Uani 1 1 d U . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 O6 2.256(4) 2_775 ?
Ag1 O1 2.355(5) . ?
Ag1 N6 2.376(5) . ?
Ag1 N5 2.388(5) . ?
Ag1 Ag2 3.1277(7) 2_775 ?
Ag2 O5 2.170(4) . ?
Ag2 N9 2.351(4) . ?
Ag2 N8 2.353(4) . ?
Ag2 Ag1 3.1277(7) 2_775 ?
C1 C2 1.385(8) . ?
C1 C3 1.413(7) . ?
C1 C4 1.521(7) . ?
C2 C3 1.409(7) 2_775 ?
C2 C5 1.528(7) . ?
C3 C2 1.409(7) 2_775 ?
C3 C6 1.498(8) . ?
C4 N1 1.459(7) . ?
C5 N4 1.460(7) . ?
C6 N7 1.450(7) . ?
C7 N1 1.345(7) . ?
C7 C8 1.352(9) . ?
C8 C9 1.395(8) . ?
C9 N2 1.334(7) . ?
C9 C10 1.460(8) . ?
C10 C11 1.328(7) . ?
C10 N3 1.396(8) . ?
C11 C12 1.313(8) . ?
C12 C13 1.355(10) . ?
C13 C14 1.367(9) . ?
C14 N3 1.384(9) . ?
C15 N4 1.340(7) . ?
C15 C16 1.361(8) . ?
C16 C17 1.394(8) . ?
C17 N5 1.327(7) . ?
C17 C18 1.460(8) . ?
C18 N6 1.349(7) . ?
C18 C19 1.383(8) . ?
C19 C20 1.370(10) . ?
C20 C21 1.352(11) . ?
C21 C22 1.378(10) . ?
C22 N6 1.339(8) . ?
C23 N7 1.343(8) . ?
C23 C24 1.354(9) . ?
C24 C25 1.396(8) . ?
C25 N8 1.335(6) . ?
C25 C26 1.461(8) . ?
C26 N9 1.324(7) . ?
C26 C27 1.383(8) . ?
C27 C28 1.357(10) . ?
C28 C29 1.364(11) . ?
C29 C30 1.378(9) . ?
C30 N9 1.333(7) . ?
C31 O2 1.215(9) . ?
C31 O1 1.227(9) . ?
C31 C32 1.527(8) . ?
C32 C33 1.379(8) . ?
C32 C34 1.399(8) 2_766 ?
C33 C34 1.388(8) . ?
C34 C32 1.399(8) 2_766 ?
C34 C35 1.493(9) . ?
C35 O3 1.164(9) . ?
C35 O4 1.336(9) . ?
C36 O6 1.221(7) . ?
C36 O5 1.237(7) . ?
C36 C37 1.511(7) . ?
C37 C39 1.390(7) 2_875 ?
C37 C38 1.391(7) . ?
C38 C39 1.377(7) . ?
C39 C37 1.390(7) 2_875 ?
C39 C40 1.507(7) . ?
C40 O7 1.186(7) . ?
C40 O8 1.323(7) . ?
C41 O8 1.467(7) . ?
C42 O4 1.488(11) . ?
N1 N2 1.341(6) . ?
N4 N5 1.339(6) . ?
N7 N8 1.332(6) . ?
O6 Ag1 2.256(4) 2_775 ?

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
O6 Ag1 O1 109.7(2) 2_775 . ?
O6 Ag1 N6 125.56(18) 2_775 . ?
O1 Ag1 N6 101.8(2) . . ?
O6 Ag1 N5 132.10(16) 2_775 . ?
O1 Ag1 N5 109.18(19) . . ?
N6 Ag1 N5 70.95(15) . . ?
O6 Ag1 Ag2 77.50(12) 2_775 2_775 ?
O1 Ag1 Ag2 169.57(16) . 2_775 ?
N6 Ag1 Ag2 78.93(11) . 2_775 ?
N5 Ag1 Ag2 61.01(10) . 2_775 ?
O5 Ag2 N9 123.35(18) . . ?
O5 Ag2 N8 155.22(18) . . ?
N9 Ag2 N8 70.44(15) . . ?
O5 Ag2 Ag1 78.16(12) . 2_775 ?
N9 Ag2 Ag1 107.70(11) . 2_775 ?
N8 Ag2 Ag1 119.56(10) . 2_775 ?
C2 C1 C3 120.3(5) . . ?
C2 C1 C4 121.8(5) . . ?
C3 C1 C4 117.9(5) . . ?
C1 C2 C3 120.1(5) . 2_775 ?
C1 C2 C5 120.8(5) . . ?
C3 C2 C5 119.0(5) 2_775 . ?
C2 C3 C1 119.5(5) 2_775 . ?
C2 C3 C6 120.7(5) 2_775 . ?
C1 C3 C6 119.7(5) . . ?
N1 C4 C1 111.8(4) . . ?
N4 C5 C2 113.3(4) . . ?
N7 C6 C3 115.0(4) . . ?
N1 C7 C8 107.2(6) . . ?
C7 C8 C9 105.5(5) . . ?
N2 C9 C8 110.5(5) . . ?
N2 C9 C10 122.2(5) . . ?
C8 C9 C10 127.3(5) . . ?
C11 C10 N3 122.0(6) . . ?
C11 C10 C9 116.7(5) . . ?
N3 C10 C9 121.3(5) . . ?
C12 C11 C10 118.8(6) . . ?
C11 C12 C13 123.9(6) . . ?
C12 C13 C14 117.8(6) . . ?
C13 C14 N3 120.5(7) . . ?
N4 C15 C16 107.2(5) . . ?
C15 C16 C17 104.8(5) . . ?
N5 C17 C16 111.1(5) . . ?
N5 C17 C18 121.0(5) . . ?
C16 C17 C18 128.0(5) . . ?
N6 C18 C19 121.8(5) . . ?
N6 C18 C17 117.1(5) . . ?
C19 C18 C17 121.1(6) . . ?
C20 C19 C18 119.3(7) . . ?
C21 C20 C19 119.4(7) . . ?
C20 C21 C22 119.1(7) . . ?
N6 C22 C21 122.8(7) . . ?
N7 C23 C24 108.4(6) . . ?
C23 C24 C25 104.8(5) . . ?
N8 C25 C24 109.9(5) . . ?
N8 C25 C26 119.0(5) . . ?
C24 C25 C26 131.0(5) . . ?
N9 C26 C27 121.4(5) . . ?
N9 C26 C25 117.1(4) . . ?
C27 C26 C25 121.5(5) . . ?
C28 C27 C26 119.1(6) . . ?
C27 C28 C29 120.2(6) . . ?
C28 C29 C30 117.6(6) . . ?
N9 C30 C29 122.8(7) . . ?
O2 C31 O1 126.8(7) . . ?
O2 C31 C32 117.6(7) . . ?
O1 C31 C32 115.5(7) . . ?
C33 C32 C34 118.1(5) . 2_766 ?
C33 C32 C31 118.8(6) . . ?
C34 C32 C31 123.1(6) 2_766 . ?
C32 C33 C34 122.5(6) . . ?
C33 C34 C32 119.4(5) . 2_766 ?
C33 C34 C35 115.9(6) . . ?
C32 C34 C35 124.7(5) 2_766 . ?
O3 C35 O4 120.2(7) . . ?
O3 C35 C34 127.0(7) . . ?
O4 C35 C34 112.8(6) . . ?
O6 C36 O5 126.6(5) . . ?
O6 C36 C37 117.8(5) . . ?
O5 C36 C37 115.4(5) . . ?
C39 C37 C38 117.8(5) 2_875 . ?
C39 C37 C36 122.0(5) 2_875 . ?
C38 C37 C36 119.9(5) . . ?
C39 C38 C37 121.5(5) . . ?
C38 C39 C37 120.7(5) . 2_875 ?
C38 C39 C40 117.4(5) . . ?
C37 C39 C40 121.8(5) 2_875 . ?
O7 C40 O8 124.6(5) . . ?
O7 C40 C39 123.2(5) . . ?
O8 C40 C39 112.0(5) . . ?
N2 N1 C7 111.8(5) . . ?
N2 N1 C4 122.6(4) . . ?
C7 N1 C4 125.6(5) . . ?
C9 N2 N1 105.1(4) . . ?
C14 N3 C10 116.9(6) . . ?
N5 N4 C15 111.9(4) . . ?
N5 N4 C5 121.4(5) . . ?
C15 N4 C5 126.7(5) . . ?
C17 N5 N4 105.0(4) . . ?
C17 N5 Ag1 113.4(3) . . ?
N4 N5 Ag1 138.7(3) . . ?
C22 N6 C18 117.6(5) . . ?
C22 N6 Ag1 126.7(4) . . ?
C18 N6 Ag1 115.7(3) . . ?
N8 N7 C23 110.5(5) . . ?
N8 N7 C6 122.2(5) . . ?
C23 N7 C6 127.1(5) . . ?
N7 N8 C25 106.4(4) . . ?
N7 N8 Ag2 137.3(3) . . ?
C25 N8 Ag2 115.9(3) . . ?
C26 N9 C30 118.7(5) . . ?
C26 N9 Ag2 117.5(3) . . ?
C30 N9 Ag2 123.9(4) . . ?
C31 O1 Ag1 117.1(5) . . ?
C35 O4 C42 117.9(7) . . ?
C36 O5 Ag2 130.3(4) . . ?
C36 O6 Ag1 127.2(4) . 2_775 ?
C40 O8 C41 113.3(5) . . ?

_diffrn_measured_fraction_theta_max 0.834
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         2.256
_refine_diff_density_min         -1.135
_refine_diff_density_rms         0.105
_database_code_depnum_ccdc_archive 'CCDC 984131'
#######################################################################
#
#                 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_crystal7

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C88 H62 Ag6 N18 O18'
_chemical_formula_sum            'C88 H62 Ag6 N18 O18'
_chemical_formula_weight         2306.78

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   10.3250(7)
_cell_length_b                   14.1580(10)
_cell_length_c                   14.9160(10)
_cell_angle_alpha                68.417(7)
_cell_angle_beta                 71.336(7)
_cell_angle_gamma                81.650(6)
_cell_volume                     1920.0(2)
_cell_formula_units_Z            1
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    3510
_cell_measurement_theta_min      2.9194
_cell_measurement_theta_max      29.2115

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.15
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.995
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1142
_exptl_absorpt_coefficient_mu    1.591
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.74832
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            13377
_diffrn_reflns_av_R_equivalents  0.0266
_diffrn_reflns_av_sigmaI/netI    0.0515
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_theta_min         2.93
_diffrn_reflns_theta_max         29.27
_reflns_number_total             8725
_reflns_number_gt                6122
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

The distance of H12...H11 was restrained to 2.12+-0.0001 Å. The distance of C12---H12 was restrained to 0.93+-0.0001 Å. The distance of H5B...H6A was restrained to 2.001+-0.0001 Å.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0333P)²+3.2749P] where P=(Fo²+2Fc²)/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         8725
_refine_ls_number_parameters     625
_refine_ls_number_restraints     3
_refine_ls_R_factor_all          0.0814
_refine_ls_R_factor_gt           0.0512
_refine_ls_wR_factor_ref         0.1197
_refine_ls_wR_factor_gt          0.1030
_refine_ls_goodness_of_fit_ref   1.067
_refine_ls_restrained_S_all      1.066
_refine_ls_shift/su_max          0.084
_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 0.71758(5) 0.08005(4) 0.79865(3) 0.06612(16) Uani 1 1 d . . .
Ag2 Ag 0.89470(4) 0.22688(3) 0.84876(3) 0.05191(13) Uani 1 1 d . . .
Ag3 Ag 1.21075(5) 0.22831(4) 0.75109(4) 0.07296(17) Uani 1 1 d . . .
C1 C 0.8570(5) -0.0078(3) 1.0330(3) 0.0391(10) Uani 1 1 d . . .
C2 C 0.9201(5) 0.0505(3) 1.0644(3) 0.0380(10) Uani 1 1 d . . .
C3 C 1.0608(5) 0.0572(3) 1.0325(3) 0.0393(11) Uani 1 1 d . . .
C7 C 0.5233(6) 0.1125(5) 1.0991(4) 0.0631(16) Uani 1 1 d . . .
H7 H 0.4961 0.0910 1.1691 0.076 Uiso 1 1 calc R . .
C8 C 0.4721(5) 0.1948(5) 1.0367(5) 0.0627(16) Uani 1 1 d . . .
H8 H 0.4046 0.2410 1.0548 0.075 Uiso 1 1 calc R . .
C9 C 0.5418(5) 0.1952(4) 0.9399(4) 0.0522(13) Uani 1 1 d . . .
C10 C 0.5311(5) 0.2664(4) 0.8422(4) 0.0538(13) Uani 1 1 d . . .
C11 C 0.4741(6) 0.3628(5) 0.8306(5) 0.0701(17) Uani 1 1 d . . .
H11 H 0.4382 0.3839 0.8861 0.084 Uiso 1 1 calc RD . .
C13 C 0.5242(8) 0.3959(7) 0.6585(7) 0.098(3) Uani 1 1 d . . .
H13 H 0.5245 0.4390 0.5940 0.117 Uiso 1 1 calc R . .
C14 C 0.5796(8) 0.2985(6) 0.6738(6) 0.092(2) Uani 1 1 d . . .
H14 H 0.6150 0.2770 0.6186 0.110 Uiso 1 1 calc R . .
C15 C 0.7413(6) 0.2673(4) 1.1525(4) 0.0584(15) Uani 1 1 d . . .
H15 H 0.7251 0.2499 1.2215 0.070 Uiso 1 1 calc R . .
C16 C 0.7125(6) 0.3581(5) 1.0886(4) 0.0613(15) Uani 1 1 d . . .
H16 H 0.6732 0.4156 1.1044 0.074 Uiso 1 1 calc R . .
C17 C 0.7533(5) 0.3478(4) 0.9953(4) 0.0420(11) Uani 1 1 d . . .
C18 C 0.7478(5) 0.4239(4) 0.8970(4) 0.0466(12) Uani 1 1 d . . .
C19 C 0.6851(6) 0.5179(4) 0.8892(5) 0.0644(16) Uani 1 1 d . . .
H19 H 0.6444 0.5356 0.9465 0.077 Uiso 1 1 calc R . .
C20 C 0.6832(7) 0.5856(5) 0.7956(6) 0.080(2) Uani 1 1 d . . .
H20 H 0.6425 0.6500 0.7885 0.096 Uiso 1 1 calc R . .
C21 C 0.7419(7) 0.5565(5) 0.7138(6) 0.0788(19) Uani 1 1 d . . .
H21 H 0.7399 0.6004 0.6501 0.095 Uiso 1 1 calc R . .
C22 C 0.8045(6) 0.4614(4) 0.7261(4) 0.0606(14) Uani 1 1 d . . .
H22 H 0.8461 0.4425 0.6697 0.073 Uiso 1 1 calc R . .
C23 C 1.1078(6) 0.2999(4) 1.0551(4) 0.0541(13) Uani 1 1 d . . .
H23 H 1.0966 0.2906 1.1222 0.065 Uiso 1 1 calc R . .
C24 C 1.1131(6) 0.3894(4) 0.9798(4) 0.0556(14) Uani 1 1 d . . .
H24 H 1.1072 0.4539 0.9839 0.067 Uiso 1 1 calc R . .
C25 C 1.1292(5) 0.3652(4) 0.8948(4) 0.0446(11) Uani 1 1 d . . .
C26 C 1.1351(5) 0.4336(4) 0.7931(4) 0.0494(12) Uani 1 1 d . . .
C27 C 1.1125(6) 0.5379(4) 0.7709(5) 0.0659(16) Uani 1 1 d . . .
H27 H 1.0931 0.5656 0.8216 0.079 Uiso 1 1 calc R . .
C28 C 1.1186(8) 0.5984(5) 0.6764(6) 0.087(2) Uani 1 1 d . . .
H28 H 1.1053 0.6682 0.6616 0.105 Uiso 1 1 calc R . .
C29 C 1.1441(8) 0.5587(5) 0.6015(6) 0.091(2) Uani 1 1 d . . .
H29 H 1.1464 0.6002 0.5361 0.109 Uiso 1 1 calc R . .
C30 C 1.1665(7) 0.4553(5) 0.6260(5) 0.0744(18) Uani 1 1 d . . .
H30 H 1.1861 0.4273 0.5755 0.089 Uiso 1 1 calc R . .
C31 C 0.9947(6) 0.1960(4) 0.6572(4) 0.0524(13) Uani 1 1 d . . .
C32 C 1.1665(6) -0.1207(5) 0.5913(6) 0.0688(18) Uani 1 1 d . . .
C33 C 1.2309(6) 0.0124(8) 0.3470(6) 0.090(3) Uani 1 1 d . . .
C34 C 1.0576(5) 0.1471(4) 0.5783(3) 0.0428(11) Uani 1 1 d . . .
C35 C 1.0859(5) 0.0441(4) 0.6063(3) 0.0424(11) Uani 1 1 d . . .
H35 H 1.0644 0.0061 0.6747 0.051 Uiso 1 1 calc R . .
C36 C 1.1452(5) -0.0064(4) 0.5377(4) 0.0477(12) Uani 1 1 d . . .
C37 C 1.1740(5) 0.0505(5) 0.4365(4) 0.0556(14) Uani 1 1 d . . .
C38 C 1.1452(6) 0.1527(6) 0.4084(4) 0.0656(17) Uani 1 1 d . . .
H38 H 1.1635 0.1906 0.3402 0.079 Uiso 1 1 calc R . .
C39 C 1.0901(6) 0.2018(4) 0.4774(4) 0.0565(14) Uani 1 1 d . . .
H39 H 1.0750 0.2719 0.4554 0.068 Uiso 1 1 calc R . .
C40 C 1.3773(6) 0.1473(4) 0.6008(4) 0.0522(13) Uani 1 1 d . . .
C41 C 1.4726(10) 0.1992(8) 0.3654(8) 0.049(2) Uani 0.50 1 d P . .
C42 C 1.4621(5) -0.0255(4) 0.6015(3) 0.0419(11) Uani 1 1 d . . .
H42 H 1.4362 -0.0438 0.6712 0.050 Uiso 1 1 calc R . .
C43 C 1.4422(5) 0.0736(3) 0.5456(3) 0.0395(10) Uani 1 1 d . . .
C44 C 1.4810(5) 0.1004(4) 0.4405(3) 0.0419(11) Uani 1 1 d . . .
C45 C 1.5726(12) 0.3409(9) 0.3762(10) 0.072(4) Uani 0.50 1 d P . .
H45A H 1.5358 0.3985 0.3966 0.108 Uiso 0.50 1 calc PR . .
H45B H 1.6280 0.3638 0.3072 0.108 Uiso 0.50 1 calc PR . .
H45C H 1.6275 0.2991 0.4181 0.108 Uiso 0.50 1 calc PR . .
N1 N 0.6203(4) 0.0680(3) 1.0417(3) 0.0466(10) Uani 1 1 d . . .
N2 N 0.6316(4) 0.1165(3) 0.9438(3) 0.0431(9) Uani 1 1 d . . .
N3 N 0.5849(5) 0.2335(4) 0.7645(4) 0.0686(14) Uani 1 1 d . . .
N4 N 0.7979(4) 0.2068(3) 1.0979(3) 0.0429(9) Uani 1 1 d . . .
N5 N 0.8066(4) 0.2557(3) 0.9999(3) 0.0394(9) Uani 1 1 d . . .
N6 N 0.8068(4) 0.3965(3) 0.8159(3) 0.0483(10) Uani 1 1 d . . .
N7 N 1.1216(4) 0.2267(3) 1.0160(3) 0.0435(9) Uani 1 1 d . . .
N8 N 1.1369(4) 0.2649(3) 0.9170(3) 0.0439(9) Uani 1 1 d . . .
N9 N 1.1610(5) 0.3928(3) 0.7208(3) 0.0547(11) Uani 1 1 d . . .
O1 O 0.9695(6) 0.2879(3) 0.6296(3) 0.0902(15) Uani 1 1 d . . .
O2 O 0.9722(4) 0.1373(3) 0.7479(2) 0.0553(9) Uani 1 1 d . . .
O3 O 1.1171(6) -0.1577(3) 0.6818(4) 0.0932(17) Uani 1 1 d . . .
O4 O 1.2347(5) -0.1753(4) 0.5383(5) 0.1072(18) Uani 1 1 d . . .
H4 H 1.2596 -0.1393 0.4788 0.161 Uiso 1 1 calc R . .
O5 O 1.2827(6) -0.0793(6) 0.3658(5) 0.128(2) Uani 1 1 d . . .
O6 O 1.2264(6) 0.0630(6) 0.2664(4) 0.136(3) Uani 1 1 d . . .
O7 O 1.3234(4) 0.1093(3) 0.6935(3) 0.0591(10) Uani 1 1 d . . .
O8 O 1.3789(5) 0.2396(3) 0.5533(4) 0.0890(15) Uani 1 1 d . . .
O9 O 1.4650(10) 0.2842(6) 0.3857(6) 0.072(2) Uani 0.50 1 d P . .
O10 O 1.4733(9) 0.2041(6) 0.2819(5) 0.068(2) Uani 0.50 1 d P . .
C4 C 0.7035(6) -0.0223(5) 1.0745(5) 0.0554(14) Uani 1 1 d . . .
H4A H 0.671(6) -0.065(4) 1.058(4) 0.067 Uiso 1 1 d . . .
H4B H 0.672(6) -0.042(4) 1.143(5) 0.067 Uiso 1 1 d . . .
C5 C 0.8324(7) 0.0989(4) 1.1397(4) 0.0483(12) Uani 1 1 d . . .
H5A H 0.748(6) 0.065(4) 1.174(4) 0.058 Uiso 1 1 d . . .
H5B H 0.8783(4) 0.094(4) 1.185(4) 0.058 Uiso 1 1 d D . .
C6 C 1.1252(7) 0.1178(4) 1.0713(5) 0.0524(14) Uani 1 1 d . . .
H6A H 1.0799(13) 0.113(4) 1.142(4) 0.063 Uiso 1 1 d D . .
H6B H 1.209(6) 0.103(4) 1.063(4) 0.063 Uiso 1 1 d . . .
C12 C 0.4705(7) 0.4275(6) 0.7366(7) 0.086(2) Uani 1 1 d D . .
H12 H 0.434(7) 0.4896(16) 0.7428(11) 0.104 Uiso 1 1 d D . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 N2 2.280(4) . ?
Ag1 N3 2.371(5) . ?
Ag1 O5 2.458(6) 2_756 ?
Ag1 O6 2.475(7) 2_756 ?
Ag1 Ag2 3.3686(7) . ?
Ag2 O2 2.202(3) . ?
Ag2 N5 2.310(4) . ?
Ag2 N6 2.370(4) . ?
Ag2 Ag3 3.1187(7) . ?
Ag3 O7 2.188(3) . ?
Ag3 N9 2.218(4) . ?
Ag3 N8 2.568(4) . ?
C1 C2 1.400(6) . ?
C1 C3 1.401(6) 2_757 ?
C1 C4 1.520(8) . ?
C2 C3 1.382(7) . ?
C2 C5 1.512(6) . ?
C3 C1 1.401(6) 2_757 ?
C3 C6 1.514(6) . ?
C7 N1 1.341(7) . ?
C7 C8 1.357(8) . ?
C8 C9 1.390(7) . ?
C9 N2 1.340(6) . ?
C9 C10 1.463(8) . ?
C10 N3 1.333(7) . ?
C10 C11 1.377(8) . ?
C11 C12 1.373(10) . ?
C13 C12 1.328(11) . ?
C13 C14 1.379(10) . ?
C14 N3 1.341(8) . ?
C15 N4 1.342(6) . ?
C15 C16 1.348(8) . ?
C16 C17 1.376(7) . ?
C17 N5 1.326(6) . ?
C17 C18 1.479(7) . ?
C18 N6 1.337(6) . ?
C18 C19 1.375(7) . ?
C19 C20 1.377(9) . ?
C20 C21 1.360(10) . ?
C21 C22 1.381(8) . ?
C22 N6 1.322(6) . ?
C23 N7 1.335(6) . ?
C23 C24 1.343(8) . ?
C24 C25 1.387(7) . ?
C25 N8 1.330(6) . ?
C25 C26 1.456(7) . ?
C26 N9 1.340(6) . ?
C26 C27 1.391(7) . ?
C27 C28 1.339(9) . ?
C28 C29 1.365(10) . ?
C29 C30 1.376(9) . ?
C30 N9 1.352(7) . ?
C31 O1 1.227(7) . ?
C31 O2 1.266(6) . ?
C31 C34 1.505(7) . ?
C32 O3 1.214(8) . ?
C32 O4 1.285(7) . ?
C32 C36 1.537(9) . ?
C33 O6 1.163(10) . ?
C33 O5 1.294(11) . ?
C33 C37 1.535(8) . ?
C34 C39 1.368(7) . ?
C34 C35 1.376(7) . ?
C35 C36 1.394(6) . ?
C36 C37 1.380(7) . ?
C37 C38 1.366(9) . ?
C38 C39 1.380(8) . ?
C40 O8 1.236(7) . ?
C40 O7 1.248(6) . ?
C40 C43 1.513(7) . ?
C41 O10 1.219(12) . ?
C41 O9 1.331(13) . ?
C41 C44 1.447(11) . ?
C42 C43 1.368(6) . ?
C42 C44 1.390(6) 2_856 ?
C43 C44 1.403(6) . ?
C44 C42 1.390(6) 2_856 ?
C45 O9 1.405(14) . ?
N1 N2 1.340(5) . ?
N1 C4 1.449(7) . ?
N4 N5 1.346(5) . ?
N4 C5 1.461(6) . ?
N7 N8 1.337(5) . ?
N7 C6 1.458(7) . ?
O5 Ag1 2.458(6) 2_756 ?
O6 Ag1 2.475(7) 2_756 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N2 Ag1 N3 71.89(16) . . ?
N2 Ag1 O5 155.30(19) . 2_756 ?
N3 Ag1 O5 86.6(2) . 2_756 ?
N2 Ag1 O6 142.46(19) . 2_756 ?
N3 Ag1 O6 135.40(19) . 2_756 ?
O5 Ag1 O6 51.6(2) 2_756 2_756 ?
N2 Ag1 Ag2 60.45(10) . . ?
N3 Ag1 Ag2 80.07(12) . . ?
O5 Ag1 Ag2 128.74(17) 2_756 . ?
O6 Ag1 Ag2 135.74(13) 2_756 . ?
O2 Ag2 N5 157.08(14) . . ?
O2 Ag2 N6 130.34(14) . . ?
N5 Ag2 N6 71.50(14) . . ?
O2 Ag2 Ag3 64.99(10) . . ?
N5 Ag2 Ag3 118.86(9) . . ?
N6 Ag2 Ag3 109.31(10) . . ?
O2 Ag2 Ag1 51.88(10) . . ?
N5 Ag2 Ag1 117.92(9) . . ?
N6 Ag2 Ag1 112.94(10) . . ?
Ag3 Ag2 Ag1 116.764(16) . . ?
O7 Ag3 N9 147.60(15) . . ?
O7 Ag3 N8 138.06(13) . . ?
N9 Ag3 N8 70.28(14) . . ?
O7 Ag3 Ag2 122.60(11) . . ?
N9 Ag3 Ag2 78.71(12) . . ?
N8 Ag3 Ag2 66.78(9) . . ?
C2 C1 C3 118.6(4) . 2_757 ?
C2 C1 C4 120.4(5) . . ?
C3 C1 C4 120.9(4) 2_757 . ?
C3 C2 C1 120.3(4) . . ?
C3 C2 C5 120.9(4) . . ?
C1 C2 C5 118.7(5) . . ?
C2 C3 C1 121.1(4) . 2_757 ?
C2 C3 C6 118.6(4) . . ?
C1 C3 C6 120.3(5) 2_757 . ?
N1 C7 C8 107.7(5) . . ?
C7 C8 C9 105.4(5) . . ?
N2 C9 C8 110.0(5) . . ?
N2 C9 C10 119.7(5) . . ?
C8 C9 C10 130.2(5) . . ?
N3 C10 C11 122.1(6) . . ?
N3 C10 C9 115.8(5) . . ?
C11 C10 C9 122.0(5) . . ?
C12 C11 C10 119.6(7) . . ?
C12 C13 C14 119.4(7) . . ?
N3 C14 C13 123.2(7) . . ?
N4 C15 C16 107.3(5) . . ?
C15 C16 C17 105.5(4) . . ?
N5 C17 C16 111.3(5) . . ?
N5 C17 C18 119.6(4) . . ?
C16 C17 C18 129.1(5) . . ?
N6 C18 C19 121.6(5) . . ?
N6 C18 C17 116.6(4) . . ?
C19 C18 C17 121.8(5) . . ?
C18 C19 C20 119.2(6) . . ?
C21 C20 C19 118.7(6) . . ?
C20 C21 C22 119.5(6) . . ?
N6 C22 C21 121.8(6) . . ?
N7 C23 C24 107.5(5) . . ?
C23 C24 C25 105.4(4) . . ?
N8 C25 C24 110.5(5) . . ?
N8 C25 C26 120.9(4) . . ?
C24 C25 C26 128.5(5) . . ?
N9 C26 C27 120.4(5) . . ?
N9 C26 C25 117.9(4) . . ?
C27 C26 C25 121.7(5) . . ?
C28 C27 C26 119.9(6) . . ?
C27 C28 C29 120.8(6) . . ?
C28 C29 C30 117.8(7) . . ?
N9 C30 C29 122.5(6) . . ?
O1 C31 O2 125.3(5) . . ?
O1 C31 C34 118.5(5) . . ?
O2 C31 C34 116.1(5) . . ?
O3 C32 O4 121.6(7) . . ?
O3 C32 C36 119.6(5) . . ?
O4 C32 C36 118.8(7) . . ?
O6 C33 O5 121.7(7) . . ?
O6 C33 C37 121.7(9) . . ?
O5 C33 C37 116.7(8) . . ?
C39 C34 C35 117.5(5) . . ?
C39 C34 C31 122.3(5) . . ?
C35 C34 C31 120.2(4) . . ?
C34 C35 C36 123.5(5) . . ?
C37 C36 C35 117.6(5) . . ?
C37 C36 C32 130.7(5) . . ?
C35 C36 C32 111.7(5) . . ?
C38 C37 C36 119.0(5) . . ?
C38 C37 C33 113.2(6) . . ?
C36 C37 C33 127.7(7) . . ?
C37 C38 C39 122.5(5) . . ?
C34 C39 C38 119.8(5) . . ?
O8 C40 O7 123.9(5) . . ?
O8 C40 C43 119.6(5) . . ?
O7 C40 C43 116.5(5) . . ?
O10 C41 O9 119.7(10) . . ?
O10 C41 C44 119.0(9) . . ?
O9 C41 C44 121.3(9) . . ?
C43 C42 C44 123.5(4) . 2_856 ?
C42 C43 C44 117.8(4) . . ?
C42 C43 C40 118.2(4) . . ?
C44 C43 C40 123.9(4) . . ?
C42 C44 C43 118.7(4) 2_856 . ?
C42 C44 C41 112.8(6) 2_856 . ?
C43 C44 C41 128.6(6) . . ?
N2 N1 C7 111.1(5) . . ?
N2 N1 C4 121.0(4) . . ?
C7 N1 C4 127.9(5) . . ?
C9 N2 N1 105.7(4) . . ?
C9 N2 Ag1 115.4(3) . . ?
N1 N2 Ag1 136.8(3) . . ?
C10 N3 C14 116.7(6) . . ?
C10 N3 Ag1 115.0(4) . . ?
C14 N3 Ag1 127.0(5) . . ?
C15 N4 N5 111.2(4) . . ?
C15 N4 C5 124.9(4) . . ?
N5 N4 C5 123.6(4) . . ?
C17 N5 N4 104.7(4) . . ?
C17 N5 Ag2 116.5(3) . . ?
N4 N5 Ag2 138.7(3) . . ?
C22 N6 C18 119.1(5) . . ?
C22 N6 Ag2 125.1(4) . . ?
C18 N6 Ag2 115.6(3) . . ?
C23 N7 N8 111.7(4) . . ?
C23 N7 C6 125.5(5) . . ?
N8 N7 C6 122.7(4) . . ?
C25 N8 N7 104.8(4) . . ?
C25 N8 Ag3 108.1(3) . . ?
N7 N8 Ag3 146.0(3) . . ?
C26 N9 C30 118.6(5) . . ?
C26 N9 Ag3 121.4(4) . . ?
C30 N9 Ag3 119.8(4) . . ?
C31 O2 Ag2 109.6(3) . . ?
C33 O5 Ag1 91.3(5) . 2_756 ?
C33 O6 Ag1 93.9(6) . 2_756 ?
C40 O7 Ag3 109.3(3) . . ?
C41 O9 C45 128.3(10) . . ?
N1 C4 C1 115.1(4) . . ?
N4 C5 C2 115.8(4) . . ?
N7 C6 C3 112.6(4) . . ?
C13 C12 C11 118.9(7) . . ?

_diffrn_measured_fraction_theta_max 0.832
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.996
_refine_diff_density_max         0.767
_refine_diff_density_min         -1.037
_refine_diff_density_rms         0.090
_database_code_depnum_ccdc_archive 'CCDC 984132'
#######################################################################
#
#                 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_crystal8

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C46 H33 Ag3 N9 O10'
_chemical_formula_sum            'C46 H33 Ag3 N9 O10'
_chemical_formula_weight         1195.42

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           Triclinic
_symmetry_space_group_name_H-M   p-1

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

_cell_length_a                   11.9270(7)
_cell_length_b                   13.9400(7)
_cell_length_c                   14.0600(9)
_cell_angle_alpha                71.773(5)
_cell_angle_beta                 79.535(5)
_cell_angle_gamma                74.679(5)
_cell_volume                     2128.9(2)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    2287
_cell_measurement_theta_min      3.0937
_cell_measurement_theta_max      29.2235

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.17
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.865
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1186
_exptl_absorpt_coefficient_mu    1.440
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.76077
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_detector_area_resol_mean 10.2375
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            13275
_diffrn_reflns_av_R_equivalents  0.0466
_diffrn_reflns_av_sigmaI/netI    0.0918
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_theta_min         3.10
_diffrn_reflns_theta_max         25.03
_reflns_number_total             7474
_reflns_number_gt                4410
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_cell_refinement       CrysAlis
_computing_data_reduction        CrysAlis
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.

The distance of H6A---H5B was restrained to 1.95+-0.001 Å. For Ag3 and O8, some anisotropic displacement ellipsoids were rather elongated which led us to use the DELU restraints.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0730P)²+0.0000P] where P=(Fo²+2Fc²)/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         7474
_refine_ls_number_parameters     640
_refine_ls_number_restraints     2
_refine_ls_R_factor_all          0.1174
_refine_ls_R_factor_gt           0.0646
_refine_ls_wR_factor_ref         0.1760
_refine_ls_wR_factor_gt          0.1405
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_restrained_S_all      1.024
_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
Ag1 Ag 0.60389(6) 0.17141(6) 0.58998(6) 0.0748(3) Uani 1 1 d . . .
Ag2 Ag 0.08448(6) 0.53363(5) 0.56775(6) 0.0658(3) Uani 1 1 d . . .
Ag3 Ag 0.28962(5) 0.65755(5) 0.58639(5) 0.0564(2) Uani 1 1 d U . .
C1 C 0.4231(6) 0.4525(5) 0.4782(6) 0.0380(17) Uani 1 1 d . . .
C2 C 0.4452(6) 0.4307(5) 0.5762(6) 0.0399(18) Uani 1 1 d . . .
C3 C 0.5240(6) 0.4769(5) 0.5990(6) 0.0409(18) Uani 1 1 d . . .
C7 C 0.3736(8) 0.3005(7) 0.3289(7) 0.058(2) Uani 1 1 d . . .
H7 H 0.3203 0.3451 0.2851 0.070 Uiso 1 1 calc R . .
C8 C 0.4422(8) 0.2078(7) 0.3206(8) 0.067(3) Uani 1 1 d . . .
H8 H 0.4443 0.1758 0.2712 0.080 Uiso 1 1 calc R . .
C9 C 0.5068(7) 0.1721(7) 0.3998(7) 0.055(2) Uani 1 1 d . . .
C10 C 0.5965(8) 0.0779(6) 0.4209(7) 0.058(2) Uani 1 1 d . . .
C11 C 0.6210(9) 0.0100(7) 0.3601(9) 0.079(3) Uani 1 1 d . . .
H11 H 0.5773 0.0235 0.3071 0.095 Uiso 1 1 calc R . .
C12 C 0.7084(13) -0.0746(10) 0.3797(12) 0.103(4) Uani 1 1 d . . .
H12 H 0.7258 -0.1191 0.3390 0.124 Uiso 1 1 calc R . .
C13 C 0.7708(12) -0.0962(8) 0.4569(12) 0.104(5) Uani 1 1 d . . .
H13 H 0.8302 -0.1555 0.4711 0.125 Uiso 1 1 calc R . .
C14 C 0.7449(10) -0.0290(9) 0.5137(9) 0.098(4) Uani 1 1 d . . .
H14 H 0.7900 -0.0426 0.5659 0.117 Uiso 1 1 calc R . .
C15 C 0.3079(7) 0.3770(6) 0.8323(7) 0.058(2) Uani 1 1 d . . .
H15 H 0.3641 0.3273 0.8702 0.070 Uiso 1 1 calc R . .
C16 C 0.2137(7) 0.4384(7) 0.8680(7) 0.061(2) Uani 1 1 d . . .
H16 H 0.1904 0.4394 0.9345 0.073 Uiso 1 1 calc R . .
C17 C 0.1591(6) 0.4997(6) 0.7841(6) 0.0459(19) Uani 1 1 d . . .
C18 C 0.0525(7) 0.5847(7) 0.7792(7) 0.056(2) Uani 1 1 d . . .
C19 C 0.0095(8) 0.6270(8) 0.8585(8) 0.079(3) Uani 1 1 d . . .
H19 H 0.0449 0.6019 0.9179 0.095 Uiso 1 1 calc R . .
C20 C -0.0892(9) 0.7091(10) 0.8469(11) 0.096(4) Uani 1 1 d . . .
H20 H -0.1212 0.7396 0.8988 0.115 Uiso 1 1 calc R . .
C21 C -0.1370(9) 0.7431(9) 0.7587(11) 0.088(3) Uani 1 1 d . . .
H21 H -0.2023 0.7977 0.7489 0.105 Uiso 1 1 calc R . .
C22 C -0.0892(8) 0.6973(8) 0.6860(8) 0.074(3) Uani 1 1 d . . .
H22 H -0.1231 0.7222 0.6259 0.089 Uiso 1 1 calc R . .
C23 C 0.5079(8) 0.5198(7) 0.8518(7) 0.060(2) Uani 1 1 d . . .
H23 H 0.5656 0.4735 0.8902 0.072 Uiso 1 1 calc R . .
C24 C 0.4296(8) 0.5985(7) 0.8771(7) 0.062(2) Uani 1 1 d . . .
H24 H 0.4215 0.6177 0.9361 0.075 Uiso 1 1 calc R . .
C25 C 0.3633(6) 0.6454(6) 0.7972(6) 0.0423(18) Uani 1 1 d . . .
C26 C 0.2667(7) 0.7357(6) 0.7824(6) 0.049(2) Uani 1 1 d . . .
C27 C 0.2294(8) 0.7924(7) 0.8512(8) 0.070(3) Uani 1 1 d . . .
H27 H 0.2642 0.7719 0.9106 0.084 Uiso 1 1 calc R . .
C28 C 0.1423(10) 0.8776(9) 0.8322(9) 0.089(3) Uani 1 1 d . . .
H28 H 0.1173 0.9168 0.8779 0.107 Uiso 1 1 calc R . .
C29 C 0.0914(10) 0.9058(8) 0.7465(10) 0.091(3) Uani 1 1 d . . .
H29 H 0.0318 0.9649 0.7317 0.109 Uiso 1 1 calc R . .
C30 C 0.1296(8) 0.8453(7) 0.6814(8) 0.067(3) Uani 1 1 d . . .
H30 H 0.0931 0.8639 0.6232 0.081 Uiso 1 1 calc R . .
C31 C 0.5440(8) 0.0298(7) 0.8098(7) 0.055(2) Uani 1 1 d . . .
C32 C 0.5067(7) -0.1922(6) 0.9714(7) 0.051(2) Uani 1 1 d . . .
C33 C 0.4423(6) 0.0063(6) 0.8879(6) 0.0459(19) Uani 1 1 d . . .
C34 C 0.4262(6) -0.0863(6) 0.9557(6) 0.0469(19) Uani 1 1 d . . .
C35 C 0.3224(6) -0.0885(6) 1.0200(6) 0.0440(19) Uani 1 1 d . . .
H35 H 0.3105 -0.1515 1.0638 0.053 Uiso 1 1 calc R . .
C36 C 0.2384(6) -0.0010(6) 1.0203(6) 0.049(2) Uani 1 1 d . . .
C37 C 0.2554(7) 0.0923(7) 0.9572(7) 0.058(2) Uani 1 1 d . . .
H37 H 0.2008 0.1532 0.9598 0.070 Uiso 1 1 calc R . .
C38 C 0.3526(7) 0.0944(6) 0.8912(7) 0.059(2) Uani 1 1 d . . .
H38 H 0.3608 0.1575 0.8454 0.071 Uiso 1 1 calc R . .
C39 C -0.0074(8) 0.6624(6) 0.3700(7) 0.052(2) Uani 1 1 d . . .
C40 C 0.1822(7) 0.7398(7) 0.4036(8) 0.059(2) Uani 1 1 d . . .
C41 C 0.0329(6) 0.7534(6) 0.2965(6) 0.0462(19) Uani 1 1 d . . .
C42 C 0.1287(6) 0.7857(5) 0.3088(6) 0.0425(19) Uani 1 1 d . . .
C43 C 0.1636(6) 0.8667(6) 0.2356(7) 0.049(2) Uani 1 1 d . . .
H43 H 0.2254 0.8912 0.2443 0.059 Uiso 1 1 calc R . .
C44 C 0.1095(7) 0.9118(6) 0.1505(7) 0.052(2) Uani 1 1 d . . .
C45 C 0.0195(7) 0.8806(6) 0.1347(7) 0.056(2) Uani 1 1 d . . .
H45 H -0.0152 0.9118 0.0751 0.068 Uiso 1 1 calc R . .
C46 C -0.0211(7) 0.8016(6) 0.2078(7) 0.060(2) Uani 1 1 d . . .
H46 H -0.0846 0.7802 0.1982 0.072 Uiso 1 1 calc R . .
N1 N 0.3973(5) 0.3151(5) 0.4115(5) 0.0449(16) Uani 1 1 d . . .
N2 N 0.4804(5) 0.2358(5) 0.4573(5) 0.0454(16) Uani 1 1 d . . .
N3 N 0.6567(6) 0.0572(6) 0.4986(6) 0.066(2) Uani 1 1 d . . .
N4 N 0.3068(5) 0.4000(4) 0.7331(5) 0.0442(15) Uani 1 1 d . . .
N5 N 0.2151(5) 0.4764(5) 0.7010(5) 0.0448(16) Uani 1 1 d . . .
N6 N 0.0050(5) 0.6173(5) 0.6938(6) 0.0550(18) Uani 1 1 d . . .
N7 N 0.4886(5) 0.5193(5) 0.7617(5) 0.0433(15) Uani 1 1 d . . .
N8 N 0.3995(5) 0.5963(4) 0.7267(5) 0.0419(15) Uani 1 1 d . . .
N9 N 0.2160(5) 0.7616(5) 0.6977(5) 0.0504(17) Uani 1 1 d . . .
O1 O 0.5351(5) 0.1179(5) 0.7564(5) 0.0753(18) Uani 1 1 d . . .
O2 O 0.6312(5) -0.0419(5) 0.8005(5) 0.0741(18) Uani 1 1 d . . .
O3 O 0.6103(5) -0.2027(5) 0.9226(5) 0.0791(19) Uani 1 1 d . . .
H3 H 0.6200 -0.1460 0.8866 0.119 Uiso 1 1 calc R . .
O4 O 0.4754(5) -0.2663(4) 1.0299(5) 0.0715(18) Uani 1 1 d . . .
O5 O -0.1108(6) 0.6706(5) 0.3992(6) 0.084(2) Uani 1 1 d . . .
O6 O 0.0693(5) 0.5800(4) 0.3948(5) 0.0698(17) Uani 1 1 d . . .
O7 O 0.1192(7) 0.7339(7) 0.4832(6) 0.106(3) Uani 1 1 d . . .
O8 O 0.2893(6) 0.7170(5) 0.3997(5) 0.0704(16) Uani 1 1 d U . .
O9 O 0.1356(5) 1.0012(4) 0.0800(5) 0.0670(17) Uani 1 1 d . . .
O1W O 0.2019(7) 0.5271(7) 0.2286(8) 0.032(2) Uani 0.50 1 d P . .
O1W' O 0.1719(11) 0.5730(12) 0.1428(16) 0.109(6) Uani 0.50 1 d P . .
C4 C 0.3395(7) 0.4015(7) 0.4523(8) 0.053(2) Uani 1 1 d . . .
H4A H 0.290(7) 0.376(6) 0.505(7) 0.063 Uiso 1 1 d . . .
H4B H 0.285(7) 0.448(6) 0.405(7) 0.063 Uiso 1 1 d . . .
C5 C 0.3883(8) 0.3552(6) 0.6609(7) 0.054(2) Uani 1 1 d . . .
H5A H 0.341(7) 0.333(6) 0.643(7) 0.065 Uiso 1 1 d . . .
H5B H 0.440(4) 0.314(6) 0.693(7) 0.065 Uiso 1 1 d D . .
C6 C 0.5549(7) 0.4484(6) 0.7041(7) 0.051(2) Uani 1 1 d . . .
H6A H 0.533(6) 0.377(6) 0.746(6) 0.061 Uiso 1 1 d D . .
H6B H 0.626(7) 0.444(6) 0.709(7) 0.061 Uiso 1 1 d . . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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 N3 2.245(8) . ?
Ag1 O1 2.289(7) . ?
Ag1 O8 2.306(6) 2_666 ?
Ag1 N2 2.388(7) . ?
Ag1 Ag3 3.1946(11) 2_666 ?
Ag2 O6 2.341(6) . ?
Ag2 N6 2.345(8) . ?
Ag2 N5 2.459(6) . ?
Ag3 N9 2.361(7) . ?
Ag3 N8 2.373(6) . ?
Ag3 O8 2.493(6) . ?
Ag3 O7 2.516(7) . ?
Ag3 Ag1 3.1946(11) 2_666 ?
C1 C2 1.374(10) . ?
C1 C3 1.398(10) 2_666 ?
C1 C4 1.516(10) . ?
C2 C3 1.401(10) . ?
C2 C5 1.513(11) . ?
C3 C1 1.398(10) 2_666 ?
C3 C6 1.493(11) . ?
C7 N1 1.329(10) . ?
C7 C8 1.360(12) . ?
C8 C9 1.358(12) . ?
C9 N2 1.324(10) . ?
C9 C10 1.444(12) . ?
C10 N3 1.330(11) . ?
C10 C11 1.407(13) . ?
C11 C12 1.343(16) . ?
C12 C13 1.339(18) . ?
C13 C14 1.354(17) . ?
C14 N3 1.360(12) . ?
C15 N4 1.333(10) . ?
C15 C16 1.342(12) . ?
C16 C17 1.378(11) . ?
C17 N5 1.324(10) . ?
C17 C18 1.486(11) . ?
C18 N6 1.319(11) . ?
C18 C19 1.378(13) . ?
C19 C20 1.401(14) . ?
C20 C21 1.355(16) . ?
C21 C22 1.334(15) . ?
C22 N6 1.351(11) . ?
C23 N7 1.330(10) . ?
C23 C24 1.337(12) . ?
C24 C25 1.380(11) . ?
C25 N8 1.324(9) . ?
C25 C26 1.453(11) . ?
C26 N9 1.338(10) . ?
C26 C27 1.377(12) . ?
C27 C28 1.346(13) . ?
C28 C29 1.348(15) . ?
C29 C30 1.372(14) . ?
C30 N9 1.327(11) . ?
C31 O1 1.210(10) . ?
C31 O2 1.257(10) . ?
C31 C33 1.512(11) . ?
C32 O4 1.202(9) . ?
C32 O3 1.295(9) . ?
C32 C34 1.508(11) . ?
C33 C34 1.380(10) . ?
C33 C38 1.407(11) . ?
C34 C35 1.395(10) . ?
C35 C36 1.360(10) . ?
C36 O9 1.353(9) 1_546 ?
C36 C37 1.368(11) . ?
C37 C38 1.348(11) . ?
C39 O5 1.214(9) . ?
C39 O6 1.261(9) . ?
C39 C41 1.493(11) . ?
C40 O7 1.223(11) . ?
C40 O8 1.228(9) . ?
C40 C42 1.466(11) . ?
C41 C42 1.389(10) . ?
C41 C46 1.400(11) . ?
C42 C43 1.370(10) . ?
C43 C44 1.356(11) . ?
C44 C45 1.336(11) . ?
C44 O9 1.398(9) . ?
C45 C46 1.377(11) . ?
N1 N2 1.352(8) . ?
N1 C4 1.452(10) . ?
N4 N5 1.341(8) . ?
N4 C5 1.442(11) . ?
N7 N8 1.334(8) . ?
N7 C6 1.453(10) . ?
O8 Ag1 2.306(6) 2_666 ?
O9 C36 1.353(9) 1_564 ?
O1W O1W' 1.24(2) . ?

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
N3 Ag1 O1 119.4(3) . . ?
N3 Ag1 O8 127.0(2) . 2_666 ?
O1 Ag1 O8 99.0(2) . 2_666 ?
N3 Ag1 N2 73.7(3) . . ?
O1 Ag1 N2 123.1(2) . . ?
O8 Ag1 N2 115.7(2) 2_666 . ?
N3 Ag1 Ag3 92.00(19) . 2_666 ?
O1 Ag1 Ag3 147.37(17) . 2_666 ?
O8 Ag1 Ag3 50.83(15) 2_666 2_666 ?
N2 Ag1 Ag3 71.54(14) . 2_666 ?
O6 Ag2 N6 133.4(2) . . ?
O6 Ag2 N5 146.8(2) . . ?
N6 Ag2 N5 69.5(2) . . ?
N9 Ag3 N8 69.8(2) . . ?
N9 Ag3 O8 126.1(2) . . ?
N8 Ag3 O8 148.0(2) . . ?
N9 Ag3 O7 94.4(3) . . ?
N8 Ag3 O7 160.7(3) . . ?
O8 Ag3 O7 50.7(2) . . ?
N9 Ag3 Ag1 96.13(15) . 2_666 ?
N8 Ag3 Ag1 111.07(13) . 2_666 ?
O8 Ag3 Ag1 45.81(15) . 2_666 ?
O7 Ag3 Ag1 80.66(17) . 2_666 ?
C2 C1 C3 120.6(6) . 2_666 ?
C2 C1 C4 120.4(7) . . ?
C3 C1 C4 119.0(7) 2_666 . ?
C1 C2 C3 119.9(6) . . ?
C1 C2 C5 121.5(7) . . ?
C3 C2 C5 118.6(7) . . ?
C1 C3 C2 119.5(7) 2_666 . ?
C1 C3 C6 120.0(7) 2_666 . ?
C2 C3 C6 120.5(7) . . ?
N1 C7 C8 107.0(8) . . ?
C9 C8 C7 105.4(8) . . ?
N2 C9 C8 111.9(8) . . ?
N2 C9 C10 122.0(8) . . ?
C8 C9 C10 126.1(9) . . ?
N3 C10 C11 120.5(9) . . ?
N3 C10 C9 118.5(8) . . ?
C11 C10 C9 121.0(9) . . ?
C12 C11 C10 119.2(12) . . ?
C13 C12 C11 121.1(12) . . ?
C12 C13 C14 118.1(12) . . ?
C13 C14 N3 123.5(13) . . ?
N4 C15 C16 107.8(8) . . ?
C15 C16 C17 104.7(8) . . ?
N5 C17 C16 111.7(8) . . ?
N5 C17 C18 120.5(7) . . ?
C16 C17 C18 127.8(8) . . ?
N6 C18 C19 123.2(8) . . ?
N6 C18 C17 115.4(8) . . ?
C19 C18 C17 121.4(9) . . ?
C18 C19 C20 118.0(11) . . ?
C21 C20 C19 118.7(11) . . ?
C22 C21 C20 119.2(10) . . ?
C21 C22 N6 124.5(11) . . ?
N7 C23 C24 107.8(8) . . ?
C23 C24 C25 105.5(8) . . ?
N8 C25 C24 110.3(7) . . ?
N8 C25 C26 119.8(7) . . ?
C24 C25 C26 129.9(8) . . ?
N9 C26 C27 121.5(8) . . ?
N9 C26 C25 116.5(7) . . ?
C27 C26 C25 122.0(8) . . ?
C28 C27 C26 119.7(10) . . ?
C27 C28 C29 119.7(10) . . ?
C28 C29 C30 118.5(10) . . ?
N9 C30 C29 123.1(10) . . ?
O1 C31 O2 123.0(8) . . ?
O1 C31 C33 117.3(8) . . ?
O2 C31 C33 119.7(8) . . ?
O4 C32 O3 120.1(7) . . ?
O4 C32 C34 120.1(7) . . ?
O3 C32 C34 119.8(7) . . ?
C34 C33 C38 116.7(7) . . ?
C34 C33 C31 130.1(7) . . ?
C38 C33 C31 113.2(7) . . ?
C33 C34 C35 119.3(7) . . ?
C33 C34 C32 128.9(7) . . ?
C35 C34 C32 111.7(7) . . ?
C36 C35 C34 121.6(7) . . ?
O9 C36 C35 124.2(7) 1_546 . ?
O9 C36 C37 116.0(7) 1_546 . ?
C35 C36 C37 119.9(7) . . ?
C38 C37 C36 118.9(8) . . ?
C37 C38 C33 123.4(8) . . ?
O5 C39 O6 124.2(8) . . ?
O5 C39 C41 119.0(8) . . ?
O6 C39 C41 116.8(7) . . ?
O7 C40 O8 122.3(9) . . ?
O7 C40 C42 118.9(8) . . ?
O8 C40 C42 118.5(8) . . ?
C42 C41 C46 118.9(7) . . ?
C42 C41 C39 122.2(7) . . ?
C46 C41 C39 118.6(7) . . ?
C43 C42 C41 118.6(7) . . ?
C43 C42 C40 121.5(7) . . ?
C41 C42 C40 119.6(6) . . ?
C44 C43 C42 121.0(7) . . ?
C45 C44 C43 122.0(7) . . ?
C45 C44 O9 115.9(8) . . ?
C43 C44 O9 121.7(8) . . ?
C44 C45 C46 119.1(8) . . ?
C45 C46 C41 120.4(7) . . ?
C7 N1 N2 111.4(7) . . ?
C7 N1 C4 125.8(8) . . ?
N2 N1 C4 122.7(7) . . ?
C9 N2 N1 104.2(7) . . ?
C9 N2 Ag1 109.8(5) . . ?
N1 N2 Ag1 145.9(5) . . ?
C10 N3 C14 117.4(9) . . ?
C10 N3 Ag1 116.1(6) . . ?
C14 N3 Ag1 126.5(8) . . ?
C15 N4 N5 111.5(7) . . ?
C15 N4 C5 129.2(7) . . ?
N5 N4 C5 119.3(7) . . ?
C17 N5 N4 104.2(6) . . ?
C17 N5 Ag2 111.0(5) . . ?
N4 N5 Ag2 139.1(5) . . ?
C18 N6 C22 116.5(8) . . ?
C18 N6 Ag2 119.2(5) . . ?
C22 N6 Ag2 124.3(7) . . ?
C23 N7 N8 111.1(6) . . ?
C23 N7 C6 126.6(7) . . ?
N8 N7 C6 122.2(6) . . ?
C25 N8 N7 105.3(6) . . ?
C25 N8 Ag3 116.1(5) . . ?
N7 N8 Ag3 138.5(5) . . ?
C30 N9 C26 117.5(8) . . ?
C30 N9 Ag3 124.7(6) . . ?
C26 N9 Ag3 117.7(5) . . ?
C31 O1 Ag1 127.6(6) . . ?
C39 O6 Ag2 110.1(6) . . ?
C40 O7 Ag3 92.9(6) . . ?
C40 O8 Ag1 122.5(6) . 2_666 ?
C40 O8 Ag3 93.9(6) . . ?
Ag1 O8 Ag3 83.36(19) 2_666 . ?
C36 O9 C44 121.6(6) 1_564 . ?
N1 C4 C1 113.8(6) . . ?
N4 C5 C2 115.3(7) . . ?
N7 C6 C3 114.2(6) . . ?

_diffrn_measured_fraction_theta_max 0.992
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.992
_refine_diff_density_max         0.893
_refine_diff_density_min         -0.664
_refine_diff_density_rms         0.110
_database_code_depnum_ccdc_archive 'CCDC 984133'
