# Electronic Supplementary Material (ESI) for Chemical Science.
# This journal is © The Royal Society of Chemistry 2017

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y
_database_code_depnum_ccdc_archive 'CCDC 1558954'

_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;
_audit_creation_date             2017-06-05
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.03.28 svn.r3405 for OlexSys, GUI svn.r5337)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C56 H48 Ag5 N17, 2(C F3 O3 S)'
_chemical_formula_sum            'C58 H48 Ag5 F6 N17 O6 S2'
_chemical_formula_weight         1796.60
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           63
_space_group_name_H-M_alt        'C m c m'
_space_group_name_Hall           '-C 2c 2'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, -y, z+1/2'
3 'x, -y, -z'
4 '-x, y, -z+1/2'
5 'x+1/2, y+1/2, z'
6 '-x+1/2, -y+1/2, z+1/2'
7 'x+1/2, -y+1/2, -z'
8 '-x+1/2, y+1/2, -z+1/2'
9 '-x, -y, -z'
10 'x, y, -z-1/2'
11 '-x, y, z'
12 'x, -y, z-1/2'
13 '-x+1/2, -y+1/2, -z'
14 'x+1/2, y+1/2, -z-1/2'
15 '-x+1/2, y+1/2, z'
16 'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   12.842(6)
_cell_length_b                   21.083(5)
_cell_length_c                   25.145(5)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     6808(4)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    12843
_cell_measurement_temperature    173.15(10)
_cell_measurement_theta_max      31.3642
_cell_measurement_theta_min      1.8677
_exptl_absorpt_coefficient_mu    1.551
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6445
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.753
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             3536
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.11
_exptl_special_details           
;
 ?
;
_diffrn_reflns_av_R_equivalents  0.1303
_diffrn_reflns_av_unetI/netI     0.0677
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_k_min       -27
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            23139
_diffrn_reflns_theta_full        27.63
_diffrn_reflns_theta_max         27.63
_diffrn_reflns_theta_min         1.86
_diffrn_ambient_temperature      173.15(10)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed tube'
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         ?
_reflns_number_gt                3913
_reflns_number_total             4196
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_refine_diff_density_max         2.525
_refine_diff_density_min         -5.077
_refine_diff_density_rms         0.288
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.098
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     249
_refine_ls_number_reflns         4196
_refine_ls_number_restraints     52
_refine_ls_R_factor_all          0.1871
_refine_ls_R_factor_gt           0.1818
_refine_ls_restrained_S_all      1.094
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0001P)²+979.5070P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3393
_refine_ls_wR_factor_ref         0.3422
_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 > 2sigma(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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C6-C2
 0.55 with sigma of 0.1
 C2-C4
 2.2 with sigma of 0.1
 N1-C1 \\sim N1-C6
 with sigma of 0.01
3. Rigid bond restraints
 N2, Ag2
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
4. Uiso/Uaniso restraints and constraints
N2 \\sim Ag2: within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C3) \\sim Ueq, Uanis(C17) \\sim Ueq, Uanis(C18) \\sim Ueq, Uanis(C19)
\\sim Ueq, Uanis(C4) \\sim Ueq, : with sigma of 0.01 and sigma for terminal
atoms of 0.02
Uanis(Ag2) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.01
Uanis(N1) \\sim Ueq, Uanis(C6) \\sim Ueq: with sigma of 0.001 and sigma for
terminal atoms of 0.001
: with sigma of 0.0005 and sigma for terminal atoms of 0.0005
5. Others
 Fixed Sof: Ag1(0.8) Ag1A(0.1) Ag1B(0.1) Ag2(0.25) N1(0.25) C2(0.25) C3(0.25)
 C6(0.25)
 Fixed Uiso: C2(0.05) C5(0.05)
6.a Me refined with riding coordinates:
 C10(H10A,H10B,H10C), C16(H16A,H16B,H16C)
6.b Aromatic/amide H refined with riding coordinates:
 C8(H8), C9(H9), C12(H12), C13(H13), C14(H14), C18(H18), C19(H19)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_site_symmetry_order
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Ag1 Ag 0.6199(2) 0.57372(12) 0.30633(7) 0.0427(6) Uani 0.80 d . 1 1 . . .
Ag1A Ag 0.5811(10) 0.5663(6) 0.3076(5) 0.014(2) Uiso 0.10 d . 2 1 . . .
Ag1B Ag 0.6607(9) 0.5812(5) 0.3043(5) 0.013(2) Uiso 0.10 d . 3 1 . . .
Ag2 Ag 0.4814(2) 0.73560(15) 0.2500 0.0278(10) Uani 0.50 d . . 2 S TU P
N1 N 0.625(3) 0.4560(12) 0.2500 0.037(8) Uani 0.50 d . . 2 DS TU P
N2 N 0.6716(15) 0.7154(10) 0.2500 0.035(4) Uani 1 d . . 2 S TU P
N3 N 0.6593(12) 0.7222(8) 0.3432(6) 0.046(4) Uani 1 d . . 1 . . .
N4 N 0.6658(13) 0.6225(8) 0.3784(6) 0.045(4) Uani 1 d . . 1 . . .
N5 N 0.6751(13) 0.5151(10) 0.4076(7) 0.059(5) Uani 1 d . . 1 . . .
N6 N 0.5000 0.5104(11) 0.4079(8) 0.046(5) Uani 1 d . . 2 S T P
C1 C 0.556(3) 0.5061(13) 0.2500 0.076(13) Uani 1 d . . 2 DS T P
C2 C 0.544(4) 0.436(2) 0.2500 0.050 Uiso 0.50 d . 2 2 DS TU P
C3 C 0.652(4) 0.405(2) 0.2500 0.031(9) Uani 0.50 d . . 2 S TU P
C4 C 0.588(3) 0.3382(15) 0.2500 0.067(9) Uani 1 d . . 2 DS TU P
C5 C 0.5000 0.307(2) 0.2500 0.050 Uiso 1 d . . 4 S TU P
C6 C 0.556(3) 0.4060(15) 0.2500 0.014(6) Uani 0.50 d . 1 2 DS TU P
C7 C 0.7177(17) 0.7018(11) 0.2960(7) 0.054(5) Uani 1 d . . 1 . . .
C8 C 0.8137(17) 0.6710(14) 0.2968(10) 0.075(8) Uani 1 d . . 1 . . .
H8 H 0.8476 0.6624 0.3287 0.090 Uiso 1 calc . . 1 R . .
C9 C 0.856(3) 0.654(2) 0.2500 0.078(12) Uani 1 d . . 2 S T P
H9 H 0.9162 0.6296 0.2500 0.094 Uiso 1 calc . . 2 RS T P
C10 C 0.6635(18) 0.7920(11) 0.3523(9) 0.067(6) Uani 1 d . . 1 . . .
H10A H 0.6252 0.8024 0.3839 0.100 Uiso 1 calc . . 1 R . .
H10B H 0.6333 0.8136 0.3224 0.100 Uiso 1 calc . . 1 R . .
H10C H 0.7346 0.8050 0.3564 0.100 Uiso 1 calc . . 1 R . .
C11 C 0.6598(16) 0.6831(11) 0.3877(7) 0.052(5) Uani 1 d . . 1 . . .
C12 C 0.6502(18) 0.7091(11) 0.4402(8) 0.057(5) Uani 1 d . . 1 . . .
H12 H 0.6437 0.7525 0.4458 0.068 Uiso 1 calc . . 1 R . .
C13 C 0.6511(14) 0.6684(11) 0.4803(7) 0.055(5) Uani 1 d . . 1 . . .
H13 H 0.6469 0.6838 0.5149 0.066 Uiso 1 calc . . 1 R . .
C14 C 0.6584(18) 0.6026(11) 0.4721(7) 0.059(6) Uani 1 d . . 1 . . .
H14 H 0.6586 0.5745 0.5007 0.071 Uiso 1 calc . . 1 R . .
C15 C 0.6651(13) 0.5810(9) 0.4208(7) 0.040(4) Uani 1 d . . 1 . . .
C16 C 0.781(3) 0.493(2) 0.3975(11) 0.138(17) Uani 1 d . . 1 . . .
H16A H 0.7793 0.4487 0.3887 0.207 Uiso 1 calc . . 1 R . .
H16B H 0.8225 0.4994 0.4287 0.207 Uiso 1 calc . . 1 R . .
H16C H 0.8100 0.5165 0.3684 0.207 Uiso 1 calc . . 1 R . .
C17 C 0.591(2) 0.4822(11) 0.4028(8) 0.062(6) Uani 1 d . . 1 . U .
C18 C 0.597(2) 0.4130(13) 0.3922(10) 0.081(7) Uani 1 d . . 1 . U .
H18 H 0.6591 0.3903 0.3884 0.097 Uiso 1 calc . . 1 R . .
C19 C 0.5000 0.3876(18) 0.3891(14) 0.074(10) Uani 1 d . . 2 S TU P
H19 H 0.5000 0.3440 0.3837 0.089 Uiso 1 calc . . 2 RS T P
S1 S 0.5000 0.1790(5) 0.0763(4) 0.072(3) Uani 1 d . . 2 S T P
F1 F 0.4216(19) 0.0930(13) 0.0155(9) 0.182(12) Uani 1 d . . 1 . . .
F2 F 0.5000 0.1609(17) -0.0268(9) 0.157(14) Uani 1 d . . 2 S T P
O1 O 0.5897(17) 0.2172(11) 0.0740(9) 0.119(8) Uani 1 d . . 1 . . .
O2 O 0.5000 0.1362(18) 0.1204(13) 0.166(19) Uani 1 d . . 2 S T P
C20 C 0.5000 0.129(2) 0.0200(15) 0.078(13) Uani 1 d . . 2 S T P


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag1 3.080(5) 11_655 ?
Ag1 Ag1 2.833(4) 10_556 ?
Ag1 N4 2.166(15) . ?
Ag1 C1 2.17(3) . ?
Ag1A Ag1A 2.08(2) 11_655 ?
Ag1A Ag1A 2.90(2) 10_556 ?
Ag1A N4 2.400(19) . ?
Ag1A C1 1.95(2) . ?
Ag1A C1 2.61(3) 11_655 ?
Ag1B Ag1B 2.73(2) 10_556 ?
Ag1B N4 2.058(19) . ?
Ag1B C1 2.49(3) . ?
Ag1B C7 2.65(3) . ?
Ag2 Ag2 0.478(6) 11_655 ?
Ag2 N2 2.010(19) 11_655 ?
Ag2 N2 2.48(2) . ?
N1 C1 1.38(4) . ?
N1 C2 1.12(7) . ?
N1 C3 1.14(5) . ?
N1 C6 1.37(4) . ?
N2 Ag2 2.010(19) 11_655 ?
N2 C7 1.33(2) . ?
N2 C7 1.33(2) 10_556 ?
N3 C7 1.47(2) . ?
N3 C10 1.49(3) . ?
N3 C11 1.39(2) . ?
N4 C11 1.30(3) . ?
N4 C15 1.38(2) . ?
N5 C15 1.43(3) . ?
N5 C16 1.46(4) . ?
N5 C17 1.29(3) . ?
N6 C17 1.31(3) . ?
N6 C17 1.31(3) 11_655 ?
C1 Ag1 2.17(3) 10_556 ?
C1 Ag1A 2.61(3) 11_655 ?
C1 Ag1A 1.95(2) 10_556 ?
C1 Ag1A 2.61(3) 4_655 ?
C1 Ag1B 2.49(3) 10_556 ?
C1 C1 1.44(8) 11_655 ?
C1 C2 1.48(6) . ?
C1 C2 1.95(6) 11_655 ?
C2 C1 1.95(6) 11_655 ?
C2 C2 1.13(11) 11_655 ?
C2 C3 1.54(7) . ?
C3 C4 1.62(5) . ?
C3 C6 1.23(6) . ?
C4 C5 1.31(4) . ?
C4 C6 1.49(4) . ?
C5 C4 1.31(4) 11_655 ?
C6 C6 1.45(7) 11_655 ?
C7 C8 1.39(3) . ?
C8 H8 0.9300 . ?
C8 C9 1.34(3) . ?
C9 C8 1.34(3) 10_556 ?
C9 H9 0.9300 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C11 C12 1.43(2) . ?
C12 H12 0.9300 . ?
C12 C13 1.33(3) . ?
C13 H13 0.9300 . ?
C13 C14 1.40(3) . ?
C14 H14 0.9300 . ?
C14 C15 1.37(2) . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C17 C18 1.49(3) . ?
C18 H18 0.9300 . ?
C18 C19 1.36(3) . ?
C19 C18 1.36(3) 11_655 ?
C19 H19 0.9300 . ?
S1 O1 1.41(2) . ?
S1 O1 1.41(2) 11_655 ?
S1 O2 1.43(3) . ?
S1 C20 1.76(5) . ?
F1 C20 1.27(3) . ?
F2 C20 1.36(4) . ?
C20 F1 1.27(3) 11_655 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Ag1 Ag1 Ag1 90.0 10_556 11_655 ?
N4 Ag1 Ag1 146.8(4) . 10_556 ?
N4 Ag1 Ag1 105.8(4) . 11_655 ?
N4 Ag1 C1 163.9(8) . . ?
C1 Ag1 Ag1 49.3(6) . 10_556 ?
C1 Ag1 Ag1 67.8(10) . 11_655 ?
Ag1A Ag1A Ag1A 89.998(1) 11_655 10_556 ?
Ag1A Ag1A N4 117.0(5) 11_655 . ?
Ag1A Ag1A C1 47.6(8) 11_655 11_655 ?
N4 Ag1A Ag1A 137.9(5) . 10_556 ?
N4 Ag1A C1 163.3(9) . 11_655 ?
C1 Ag1A Ag1A 56.3(5) 11_655 10_556 ?
C1 Ag1A Ag1A 80.5(12) . 11_655 ?
C1 Ag1A Ag1A 42.2(8) . 10_556 ?
C1 Ag1A N4 161.1(13) . . ?
C1 Ag1A C1 33.0(19) . 11_655 ?
N4 Ag1B Ag1B 154.9(5) . 10_556 ?
N4 Ag1B C1 141.7(9) . . ?
N4 Ag1B C7 70.0(7) . . ?
C1 Ag1B Ag1B 56.7(5) . 10_556 ?
C1 Ag1B C7 135.8(8) . . ?
C7 Ag1B Ag1B 85.5(4) . 10_556 ?
Ag2 Ag2 N2 167.8(6) 11_655 11_655 ?
Ag2 Ag2 N2 9.9(5) 11_655 . ?
N2 Ag2 N2 157.9(11) 11_655 . ?
C2 N1 C1 72(4) . . ?
C2 N1 C3 86(4) . . ?
C2 N1 C6 29(3) . . ?
C3 N1 C1 158(5) . . ?
C3 N1 C6 58(3) . . ?
C6 N1 C1 100(4) . . ?
Ag2 N2 Ag2 2.34(12) 11_655 . ?
C7 N2 Ag2 118.3(12) . . ?
C7 N2 Ag2 118.3(12) 10_556 . ?
C7 N2 Ag2 118.7(12) 10_556 11_655 ?
C7 N2 Ag2 118.7(12) . 11_655 ?
C7 N2 C7 121(2) 10_556 . ?
C7 N3 C10 113.2(16) . . ?
C11 N3 C7 118.3(17) . . ?
C11 N3 C10 117.6(16) . . ?
Ag1 N4 Ag1A 11.8(3) . . ?
Ag1B N4 Ag1 14.7(3) . . ?
Ag1B N4 Ag1A 26.4(5) . . ?
C11 N4 Ag1 126.8(12) . . ?
C11 N4 Ag1A 126.2(13) . . ?
C11 N4 Ag1B 125.1(13) . . ?
C11 N4 C15 119.0(16) . . ?
C15 N4 Ag1 110.1(12) . . ?
C15 N4 Ag1A 105.0(12) . . ?
C15 N4 Ag1B 115.6(12) . . ?
C15 N5 C16 116(2) . . ?
C17 N5 C15 117.8(17) . . ?
C17 N5 C16 126(3) . . ?
C17 N6 C17 125(3) 11_655 . ?
Ag1 C1 Ag1 81.4(12) . 10_556 ?
Ag1 C1 Ag1A 107.3(11) . 4_655 ?
Ag1 C1 Ag1A 64.7(6) 10_556 4_655 ?
Ag1 C1 Ag1A 64.7(6) . 11_655 ?
Ag1 C1 Ag1A 107.3(11) 10_556 11_655 ?
Ag1 C1 Ag1B 11.1(3) . . ?
Ag1 C1 Ag1B 11.1(3) 10_556 10_556 ?
Ag1 C1 Ag1B 74.7(11) . 10_556 ?
Ag1 C1 Ag1B 74.7(11) 10_556 . ?
Ag1A C1 Ag1 13.3(4) . . ?
Ag1A C1 Ag1 89.6(14) . 10_556 ?
Ag1A C1 Ag1 13.3(4) 10_556 10_556 ?
Ag1A C1 Ag1 89.6(14) 10_556 . ?
Ag1A C1 Ag1A 95.7(15) 10_556 . ?
Ag1A C1 Ag1A 51.9(8) 10_556 4_655 ?
Ag1A C1 Ag1A 51.9(8) . 11_655 ?
Ag1A C1 Ag1A 67.4(10) 4_655 11_655 ?
Ag1A C1 Ag1A 101.9(12) 10_556 11_655 ?
Ag1A C1 Ag1A 101.9(12) . 4_655 ?
Ag1A C1 Ag1B 24.4(7) 10_556 10_556 ?
Ag1A C1 Ag1B 84.5(13) . 10_556 ?
Ag1A C1 Ag1B 84.5(13) 10_556 . ?
Ag1A C1 Ag1B 24.4(7) . . ?
Ag1B C1 Ag1A 111.1(11) 10_556 11_655 ?
Ag1B C1 Ag1A 75.5(7) . 11_655 ?
Ag1B C1 Ag1A 111.1(11) . 4_655 ?
Ag1B C1 Ag1A 75.5(7) 10_556 4_655 ?
Ag1B C1 Ag1B 66.7(11) . 10_556 ?
N1 C1 Ag1 105(2) . . ?
N1 C1 Ag1 105(2) . 10_556 ?
N1 C1 Ag1A 143.7(10) . 4_655 ?
N1 C1 Ag1A 143.7(10) . 11_655 ?
N1 C1 Ag1A 113(2) . . ?
N1 C1 Ag1A 113(2) . 10_556 ?
N1 C1 Ag1B 98(2) . 10_556 ?
N1 C1 Ag1B 98(2) . . ?
N1 C1 C1 130(2) . 11_655 ?
N1 C1 C2 81(3) . 11_655 ?
N1 C1 C2 46(3) . . ?
C1 C1 Ag1 112.2(9) 11_655 . ?
C1 C1 Ag1 112.2(9) 11_655 10_556 ?
C1 C1 Ag1A 47.6(8) 11_655 11_655 ?
C1 C1 Ag1A 99.5(12) 11_655 10_556 ?
C1 C1 Ag1A 99.5(12) 11_655 . ?
C1 C1 Ag1A 47.6(8) 11_655 4_655 ?
C1 C1 Ag1B 122.7(8) 11_655 10_556 ?
C1 C1 Ag1B 122.7(8) 11_655 . ?
C1 C1 C2 48.8(19) 11_655 11_655 ?
C1 C1 C2 84(3) 11_655 . ?
C2 C1 Ag1 133.9(14) . . ?
C2 C1 Ag1 133.9(14) . 10_556 ?
C2 C1 Ag1 138.0(9) 11_655 . ?
C2 C1 Ag1 138.0(9) 11_655 10_556 ?
C2 C1 Ag1A 131.6(8) . 10_556 ?
C2 C1 Ag1A 131.6(8) . . ?
C2 C1 Ag1A 126.7(14) 11_655 10_556 ?
C2 C1 Ag1A 85.5(19) 11_655 11_655 ?
C2 C1 Ag1A 114(3) . 11_655 ?
C2 C1 Ag1A 114(3) . 4_655 ?
C2 C1 Ag1A 126.7(14) 11_655 . ?
C2 C1 Ag1A 85.5(19) 11_655 4_655 ?
C2 C1 Ag1B 134(2) . 10_556 ?
C2 C1 Ag1B 134(2) . . ?
C2 C1 Ag1B 146.7(6) 11_655 10_556 ?
C2 C1 Ag1B 146.7(6) 11_655 . ?
C2 C1 C2 35(4) . 11_655 ?
N1 C2 C1 110(4) . 11_655 ?
N1 C2 C1 62(3) . . ?
N1 C2 C2 158(3) . 11_655 ?
N1 C2 C3 48(3) . . ?
C1 C2 C1 47(3) . 11_655 ?
C1 C2 C3 110(4) . . ?
C2 C2 C1 96(3) 11_655 . ?
C2 C2 C1 48.8(19) 11_655 11_655 ?
C2 C2 C3 154(3) 11_655 . ?
C3 C2 C1 157(4) . 11_655 ?
N1 C3 C2 46(3) . . ?
N1 C3 C4 132(5) . . ?
N1 C3 C6 71(4) . . ?
C2 C3 C4 86(3) . . ?
C6 C3 C2 24(2) . . ?
C6 C3 C4 61(3) . . ?
C5 C4 C3 150(4) . . ?
C5 C4 C6 104(3) . . ?
C6 C4 C3 46(2) . . ?
C4 C5 C4 120(4) . 11_655 ?
N1 C6 C4 124(3) . . ?
N1 C6 C6 130(2) . 11_655 ?
C3 C6 N1 52(3) . . ?
C3 C6 C4 73(3) . . ?
C3 C6 C6 179(3) . 11_655 ?
C6 C6 C4 106.1(19) 11_655 . ?
N2 C7 Ag1B 98.8(14) . . ?
N2 C7 N3 114.4(18) . . ?
N2 C7 C8 120.4(19) . . ?
N3 C7 Ag1B 94.3(12) . . ?
C8 C7 Ag1B 78.2(15) . . ?
C8 C7 N3 125.3(18) . . ?
C7 C8 H8 121.0 . . ?
C9 C8 C7 118(3) . . ?
C9 C8 H8 121.0 . . ?
C8 C9 C8 122(4) . 10_556 ?
C8 C9 H9 118.8 10_556 . ?
C8 C9 H9 118.8 . . ?
N3 C10 H10A 109.5 . . ?
N3 C10 H10B 109.5 . . ?
N3 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
N3 C11 C12 121(2) . . ?
N4 C11 N3 116.0(16) . . ?
N4 C11 C12 123.0(19) . . ?
C11 C12 H12 121.6 . . ?
C13 C12 C11 117(2) . . ?
C13 C12 H12 121.6 . . ?
C12 C13 H13 119.0 . . ?
C12 C13 C14 121.9(18) . . ?
C14 C13 H13 119.0 . . ?
C13 C14 H14 121.0 . . ?
C15 C14 C13 118.0(18) . . ?
C15 C14 H14 121.0 . . ?
N4 C15 N5 115.8(15) . . ?
C14 C15 N4 121.1(18) . . ?
C14 C15 N5 123.0(17) . . ?
N5 C16 H16A 109.5 . . ?
N5 C16 H16B 109.5 . . ?
N5 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
N5 C17 N6 119(2) . . ?
N5 C17 C18 120(2) . . ?
N6 C17 C18 121(3) . . ?
C17 C18 H18 125.0 . . ?
C19 C18 C17 110(3) . . ?
C19 C18 H18 125.0 . . ?
C18 C19 C18 133(4) . 11_655 ?
C18 C19 H19 113.4 . . ?
C18 C19 H19 113.4 11_655 . ?
O1 S1 O1 110(2) . 11_655 ?
O1 S1 O2 113.2(14) . . ?
O1 S1 O2 113.2(14) 11_655 . ?
O1 S1 C20 108.0(12) . . ?
O1 S1 C20 108.0(12) 11_655 . ?
O2 S1 C20 104(2) . . ?
F1 C20 S1 116(2) 11_655 . ?
F1 C20 S1 116(2) . . ?
F1 C20 F1 105(5) . 11_655 ?
F1 C20 F2 103(3) 11_655 . ?
F1 C20 F2 103(3) . . ?
F2 C20 S1 114(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
Ag1 Ag1 N4 Ag1A 133.6(18) 10_556 . . . ?
Ag1 Ag1 N4 Ag1A 18.0(16) 11_655 . . . ?
Ag1 Ag1 N4 Ag1B -46.2(15) 10_556 . . . ?
Ag1 Ag1 N4 Ag1B -161.9(14) 11_655 . . . ?
Ag1 Ag1 N4 C11 42(2) 10_556 . . . ?
Ag1 Ag1 N4 C11 -73.2(18) 11_655 . . . ?
Ag1 Ag1 N4 C15 -160.7(8) 10_556 . . . ?
Ag1 Ag1 N4 C15 83.6(12) 11_655 . . . ?
Ag1 Ag1 C1 Ag1 110.6(8) 11_655 . . 10_556 ?
Ag1 Ag1 C1 Ag1A -3.2(3) 11_655 . . 11_655 ?
Ag1 Ag1 C1 Ag1A -17.1(17) 11_655 . . . ?
Ag1 Ag1 C1 Ag1A -113.8(9) 10_556 . . 11_655 ?
Ag1 Ag1 C1 Ag1A -60.1(6) 10_556 . . 4_655 ?
Ag1 Ag1 C1 Ag1A 100.1(11) 11_655 . . 10_556 ?
Ag1 Ag1 C1 Ag1A -128(2) 10_556 . . . ?
Ag1 Ag1 C1 Ag1A -10.5(5) 10_556 . . 10_556 ?
Ag1 Ag1 C1 Ag1A 50.5(9) 11_655 . . 4_655 ?
Ag1 Ag1 C1 Ag1B 162.2(15) 11_655 . . . ?
Ag1 Ag1 C1 Ag1B 119.6(7) 11_655 . . 10_556 ?
Ag1 Ag1 C1 Ag1B 9.0(4) 10_556 . . 10_556 ?
Ag1 Ag1 C1 Ag1B 51.6(18) 10_556 . . . ?
Ag1 Ag1 C1 N1 -145.9(19) 11_655 . . . ?
Ag1 Ag1 C1 N1 104(2) 10_556 . . . ?
Ag1 Ag1 C1 C1 -110.6(8) 10_556 . . 11_655 ?
Ag1 Ag1 C1 C1 -0.003(4) 11_655 . . 11_655 ?
Ag1 Ag1 C1 C2 -52(3) 11_655 . . 11_655 ?
Ag1 Ag1 C1 C2 -104(4) 11_655 . . . ?
Ag1 Ag1 C1 C2 -163(4) 10_556 . . 11_655 ?
Ag1 Ag1 C1 C2 146(5) 10_556 . . . ?
Ag1 N4 C11 N3 -24(3) . . . . ?
Ag1 N4 C11 C12 153.7(16) . . . . ?
Ag1 N4 C15 N5 22.9(19) . . . . ?
Ag1 N4 C15 C14 -159.0(16) . . . . ?
Ag1 C1 C2 N1 65(3) 10_556 . . . ?
Ag1 C1 C2 N1 -65(3) . . . . ?
Ag1 C1 C2 C1 -115(3) 10_556 . . 11_655 ?
Ag1 C1 C2 C1 115(3) . . . 11_655 ?
Ag1 C1 C2 C2 -115(3) 10_556 . . 11_655 ?
Ag1 C1 C2 C2 115(3) . . . 11_655 ?
Ag1 C1 C2 C3 65(3) 10_556 . . . ?
Ag1 C1 C2 C3 -65(3) . . . . ?
Ag1A Ag1A N4 Ag1 -160.6(17) 11_655 . . . ?
Ag1A Ag1A N4 Ag1 -36.2(14) 10_556 . . . ?
Ag1A Ag1A N4 Ag1B -36.1(11) 10_556 . . . ?
Ag1A Ag1A N4 Ag1B -160.5(11) 11_655 . . . ?
Ag1A Ag1A N4 C11 -63.0(18) 11_655 . . . ?
Ag1A Ag1A N4 C11 61(2) 10_556 . . . ?
Ag1A Ag1A N4 C15 81.7(11) 11_655 . . . ?
Ag1A Ag1A N4 C15 -153.9(9) 10_556 . . . ?
Ag1A Ag1A C1 Ag1 112.4(9) 11_655 . . 10_556 ?
Ag1A Ag1A C1 Ag1 11.8(5) 10_556 . . 10_556 ?
Ag1A Ag1A C1 Ag1 63(2) 10_556 . . . ?
Ag1A Ag1A C1 Ag1 163.9(16) 11_655 . . . ?
Ag1A Ag1A C1 Ag1A 100.6(13) 11_655 . . 10_556 ?
Ag1A Ag1A C1 Ag1A 48.4(10) 11_655 . . 4_655 ?
Ag1A Ag1A C1 Ag1A -52.2(9) 10_556 . . 4_655 ?
Ag1A Ag1A C1 Ag1A -100.6(13) 10_556 . . 11_655 ?
Ag1A Ag1A C1 Ag1B 163.6(11) 11_655 . . . ?
Ag1A Ag1A C1 Ag1B 21.7(8) 10_556 . . 10_556 ?
Ag1A Ag1A C1 Ag1B 63.0(19) 10_556 . . . ?
Ag1A Ag1A C1 Ag1B 122.3(7) 11_655 . . 10_556 ?
Ag1A Ag1A C1 N1 118(3) 10_556 . . . ?
Ag1A Ag1A C1 N1 -141(2) 11_655 . . . ?
Ag1A Ag1A C1 C1 -0.004(3) 11_655 . . 11_655 ?
Ag1A Ag1A C1 C1 -100.6(13) 10_556 . . 11_655 ?
Ag1A Ag1A C1 C2 -90(4) 11_655 . . . ?
Ag1A Ag1A C1 C2 -145(3) 10_556 . . 11_655 ?
Ag1A Ag1A C1 C2 169(5) 10_556 . . . ?
Ag1A Ag1A C1 C2 -45(3) 11_655 . . 11_655 ?
Ag1A N4 C11 N3 -39(3) . . . . ?
Ag1A N4 C11 C12 139.0(17) . . . . ?
Ag1A N4 C15 N5 34.0(18) . . . . ?
Ag1A N4 C15 C14 -147.9(17) . . . . ?
Ag1A C1 C2 N1 -83(4) . . . . ?
Ag1A C1 C2 N1 83(4) 10_556 . . . ?
Ag1A C1 C2 N1 142.5(13) 4_655 . . . ?
Ag1A C1 C2 N1 -142.5(13) 11_655 . . . ?
Ag1A C1 C2 C1 -97(4) 10_556 . . 11_655 ?
Ag1A C1 C2 C1 97(4) . . . 11_655 ?
Ag1A C1 C2 C1 -37.5(13) 4_655 . . 11_655 ?
Ag1A C1 C2 C1 37.5(13) 11_655 . . 11_655 ?
Ag1A C1 C2 C2 37.5(13) 11_655 . . 11_655 ?
Ag1A C1 C2 C2 -97(4) 10_556 . . 11_655 ?
Ag1A C1 C2 C2 97(4) . . . 11_655 ?
Ag1A C1 C2 C2 -37.5(13) 4_655 . . 11_655 ?
Ag1A C1 C2 C3 83(4) 10_556 . . . ?
Ag1A C1 C2 C3 142.5(13) 4_655 . . . ?
Ag1A C1 C2 C3 -83(4) . . . . ?
Ag1A C1 C2 C3 -142.5(13) 11_655 . . . ?
Ag1B Ag1B N4 Ag1 111(2) 10_556 . . . ?
Ag1B Ag1B N4 Ag1A 111.3(17) 10_556 . . . ?
Ag1B Ag1B N4 C11 9(3) 10_556 . . . ?
Ag1B Ag1B N4 C15 -177.4(10) 10_556 . . . ?
Ag1B Ag1B C1 Ag1 -8.2(3) 10_556 . . 10_556 ?
Ag1B Ag1B C1 Ag1 -134.7(16) 10_556 . . . ?
Ag1B Ag1B C1 Ag1A -17.3(6) 10_556 . . 10_556 ?
Ag1B Ag1B C1 Ag1A -134.3(14) 10_556 . . . ?
Ag1B Ag1B C1 Ag1A -121.0(8) 10_556 . . 11_655 ?
Ag1B Ag1B C1 Ag1A -62.7(7) 10_556 . . 4_655 ?
Ag1B Ag1B C1 N1 95.4(17) 10_556 . . . ?
Ag1B Ag1B C1 C1 -115.0(7) 10_556 . . 11_655 ?
Ag1B Ag1B C1 C2 -178(4) 10_556 . . 11_655 ?
Ag1B Ag1B C1 C2 129(4) 10_556 . . . ?
Ag1B Ag1B C7 N2 29.5(12) 10_556 . . . ?
Ag1B Ag1B C7 N3 145.0(11) 10_556 . . . ?
Ag1B Ag1B C7 C8 -89.9(13) 10_556 . . . ?
Ag1B N4 C11 N3 -6(3) . . . . ?
Ag1B N4 C11 C12 171.7(16) . . . . ?
Ag1B N4 C15 N5 8(2) . . . . ?
Ag1B N4 C15 C14 -173.8(16) . . . . ?
Ag1B C1 C2 N1 -49(3) . . . . ?
Ag1B C1 C2 N1 49(3) 10_556 . . . ?
Ag1B C1 C2 C1 131(3) . . . 11_655 ?
Ag1B C1 C2 C1 -131(3) 10_556 . . 11_655 ?
Ag1B C1 C2 C2 -131(3) 10_556 . . 11_655 ?
Ag1B C1 C2 C2 131(3) . . . 11_655 ?
Ag1B C1 C2 C3 49(3) 10_556 . . . ?
Ag1B C1 C2 C3 -49(3) . . . . ?
Ag1B C7 C8 C9 91(3) . . . . ?
Ag2 Ag2 N2 C7 -99.0(17) 11_655 . . 10_556 ?
Ag2 Ag2 N2 C7 98.8(17) 11_655 . . . ?
Ag2 N2 C7 Ag1B 78.1(14) . . . . ?
Ag2 N2 C7 Ag1B 80.7(15) 11_655 . . . ?
Ag2 N2 C7 N3 -21(3) . . . . ?
Ag2 N2 C7 N3 -18(3) 11_655 . . . ?
Ag2 N2 C7 C8 159.5(18) . . . . ?
Ag2 N2 C7 C8 162.2(18) 11_655 . . . ?
N1 C1 C2 C1 180.0 . . . 11_655 ?
N1 C1 C2 C2 180.0 . . . 11_655 ?
N1 C1 C2 C3 0.0 . . . . ?
N1 C2 C3 C4 180.0 . . . . ?
N1 C2 C3 C6 180.0 . . . . ?
N1 C3 C4 C5 0.0 . . . . ?
N1 C3 C4 C6 0.0 . . . . ?
N1 C3 C6 C4 180.0 . . . . ?
N1 C3 C6 C6 -179.8(5) . . . 11_655 ?
N2 Ag2 N2 Ag2 -179.926(4) 11_655 . . 11_655 ?
N2 Ag2 N2 C7 -81.1(17) 11_655 . . . ?
N2 Ag2 N2 C7 81.1(17) 11_655 . . 10_556 ?
N2 C7 C8 C9 -2(4) . . . . ?
N3 C7 C8 C9 178(3) . . . . ?
N3 C11 C12 C13 180(2) . . . . ?
N4 Ag1 C1 Ag1 180(3) . . . 10_556 ?
N4 Ag1 C1 Ag1A 52(4) . . . . ?
N4 Ag1 C1 Ag1A 169(3) . . . 10_556 ?
N4 Ag1 C1 Ag1A 120(3) . . . 4_655 ?
N4 Ag1 C1 Ag1A 66(4) . . . 11_655 ?
N4 Ag1 C1 Ag1B -171(3) . . . 10_556 ?
N4 Ag1 C1 Ag1B -128(4) . . . . ?
N4 Ag1 C1 N1 -77(5) . . . . ?
N4 Ag1 C1 C1 69(4) . . . 11_655 ?
N4 Ag1 C1 C2 -34(7) . . . . ?
N4 Ag1 C1 C2 17(6) . . . 11_655 ?
N4 Ag1A C1 Ag1 -38(3) . . . . ?
N4 Ag1A C1 Ag1 -89(3) . . . 10_556 ?
N4 Ag1A C1 Ag1A 158(3) . . . 11_655 ?
N4 Ag1A C1 Ag1A -101(3) . . . 10_556 ?
N4 Ag1A C1 Ag1A -153(3) . . . 4_655 ?
N4 Ag1A C1 Ag1B -38(3) . . . . ?
N4 Ag1A C1 Ag1B -79(3) . . . 10_556 ?
N4 Ag1A C1 N1 17(5) . . . . ?
N4 Ag1A C1 C1 158(3) . . . 11_655 ?
N4 Ag1A C1 C2 114(4) . . . 11_655 ?
N4 Ag1A C1 C2 68(6) . . . . ?
N4 Ag1B C1 Ag1 148.2(12) . . . 10_556 ?
N4 Ag1B C1 Ag1 21.6(16) . . . . ?
N4 Ag1B C1 Ag1A 22.0(17) . . . . ?
N4 Ag1B C1 Ag1A 35.3(15) . . . 11_655 ?
N4 Ag1B C1 Ag1A 139.1(13) . . . 10_556 ?
N4 Ag1B C1 Ag1A 93.6(14) . . . 4_655 ?
N4 Ag1B C1 Ag1B 156.3(10) . . . 10_556 ?
N4 Ag1B C1 N1 -108(2) . . . . ?
N4 Ag1B C1 C1 41.3(15) . . . 11_655 ?
N4 Ag1B C1 C2 -22(5) . . . 11_655 ?
N4 Ag1B C1 C2 -75(4) . . . . ?
N4 Ag1B C7 N2 -145.2(15) . . . . ?
N4 Ag1B C7 N3 -29.8(11) . . . . ?
N4 Ag1B C7 C8 95.4(14) . . . . ?
N4 C11 C12 C13 2(3) . . . . ?
N5 C17 C18 C19 179(2) . . . . ?
N6 C17 C18 C19 0(4) . . . . ?
C1 Ag1 N4 Ag1A -46(4) . . . . ?
C1 Ag1 N4 Ag1B 134(4) . . . . ?
C1 Ag1 N4 C11 -137(4) . . . . ?
C1 Ag1 N4 C15 19(4) . . . . ?
C1 Ag1A N4 Ag1 179(100) 11_655 . . . ?
C1 Ag1A N4 Ag1 43(3) . . . . ?
C1 Ag1A N4 Ag1B 179(4) 11_655 . . . ?
C1 Ag1A N4 Ag1B 44(3) . . . . ?
C1 Ag1A N4 C11 141(3) . . . . ?
C1 Ag1A N4 C11 -83(4) 11_655 . . . ?
C1 Ag1A N4 C15 62(4) 11_655 . . . ?
C1 Ag1A N4 C15 -74(4) . . . . ?
C1 Ag1A C1 Ag1 112.4(9) 11_655 . . 10_556 ?
C1 Ag1A C1 Ag1 163.9(16) 11_655 . . . ?
C1 Ag1A C1 Ag1A 100.6(13) 11_655 . . 10_556 ?
C1 Ag1A C1 Ag1A 48.4(10) 11_655 . . 4_655 ?
C1 Ag1A C1 Ag1A 0.004(6) 11_655 . . 11_655 ?
C1 Ag1A C1 Ag1B 122.3(7) 11_655 . . 10_556 ?
C1 Ag1A C1 Ag1B 163.6(11) 11_655 . . . ?
C1 Ag1A C1 N1 -141(2) 11_655 . . . ?
C1 Ag1A C1 C2 -45(3) 11_655 . . 11_655 ?
C1 Ag1A C1 C2 -90(4) 11_655 . . . ?
C1 Ag1B N4 Ag1 -16.4(13) . . . . ?
C1 Ag1B N4 Ag1A -16.4(13) . . . . ?
C1 Ag1B N4 C11 -118(2) . . . . ?
C1 Ag1B N4 C15 55(2) . . . . ?
C1 Ag1B C7 N2 0(2) . . . . ?
C1 Ag1B C7 N3 115.5(15) . . . . ?
C1 Ag1B C7 C8 -119.3(18) . . . . ?
C1 N1 C2 C1 0.0 . . . 11_655 ?
C1 N1 C2 C2 -0.013(3) . . . 11_655 ?
C1 N1 C2 C3 180.0 . . . . ?
C1 N1 C3 C2 0.0 . . . . ?
C1 N1 C3 C4 0.0 . . . . ?
C1 N1 C3 C6 0.0 . . . . ?
C1 N1 C6 C3 180.0 . . . . ?
C1 N1 C6 C4 180.0 . . . . ?
C1 N1 C6 C6 0.0 . . . 11_655 ?
C1 C1 C2 N1 180.0 11_655 . . . ?
C1 C1 C2 C2 0.0 11_655 . . 11_655 ?
C1 C1 C2 C3 180.0 11_655 . . . ?
C1 C2 C3 N1 0.0 . . . . ?
C1 C2 C3 N1 -0.007(2) 11_655 . . . ?
C1 C2 C3 C4 180.0 . . . . ?
C1 C2 C3 C4 179.993(2) 11_655 . . . ?
C1 C2 C3 C6 180.0 . . . . ?
C1 C2 C3 C6 179.993(2) 11_655 . . . ?
C2 N1 C1 Ag1 -137.5(11) . . . 10_556 ?
C2 N1 C1 Ag1 137.5(11) . . . . ?
C2 N1 C1 Ag1A -126.3(17) . . . 10_556 ?
C2 N1 C1 Ag1A -70(4) . . . 4_655 ?
C2 N1 C1 Ag1A 126.3(17) . . . . ?
C2 N1 C1 Ag1A 70(4) . . . 11_655 ?
C2 N1 C1 Ag1B -146.3(7) . . . 10_556 ?
C2 N1 C1 Ag1B 146.3(7) . . . . ?
C2 N1 C1 C1 0.005(2) . . . 11_655 ?
C2 N1 C1 C2 0.0 . . . 11_655 ?
C2 N1 C3 C4 0.0 . . . . ?
C2 N1 C3 C6 0.0 . . . . ?
C2 N1 C6 C3 180.0 . . . . ?
C2 N1 C6 C4 180.0 . . . . ?
C2 N1 C6 C6 0.0 . . . 11_655 ?
C2 C1 C2 N1 180.005(1) 11_655 . . . ?
C2 C1 C2 C1 0.0 11_655 . . 11_655 ?
C2 C1 C2 C3 180.005(1) 11_655 . . . ?
C2 C2 C3 N1 -179.989(2) 11_655 . . . ?
C2 C2 C3 C4 0.011(3) 11_655 . . . ?
C2 C2 C3 C6 0.011(3) 11_655 . . . ?
C2 C3 C4 C5 0.0 . . . . ?
C2 C3 C4 C6 0.0 . . . . ?
C2 C3 C6 N1 0.0 . . . . ?
C2 C3 C6 C4 180.0 . . . . ?
C2 C3 C6 C6 -179.8(5) . . . 11_655 ?
C3 N1 C1 Ag1 -137.5(11) . . . 10_556 ?
C3 N1 C1 Ag1 137.5(11) . . . . ?
C3 N1 C1 Ag1A -126.3(17) . . . 10_556 ?
C3 N1 C1 Ag1A -70(4) . . . 4_655 ?
C3 N1 C1 Ag1A 70(4) . . . 11_655 ?
C3 N1 C1 Ag1A 126.3(17) . . . . ?
C3 N1 C1 Ag1B 146.3(7) . . . . ?
C3 N1 C1 Ag1B -146.3(7) . . . 10_556 ?
C3 N1 C1 C1 0.005(2) . . . 11_655 ?
C3 N1 C1 C2 0.0 . . . 11_655 ?
C3 N1 C1 C2 0.0 . . . . ?
C3 N1 C2 C1 180.0 . . . 11_655 ?
C3 N1 C2 C1 180.0 . . . . ?
C3 N1 C2 C2 179.987(3) . . . 11_655 ?
C3 N1 C6 C4 0.0 . . . . ?
C3 N1 C6 C6 180.0 . . . 11_655 ?
C3 C4 C5 C4 0.0 . . . 11_655 ?
C3 C4 C6 N1 0.0 . . . . ?
C3 C4 C6 C6 180.0 . . . 11_655 ?
C4 C3 C6 N1 180.0 . . . . ?
C4 C3 C6 C6 0.2(5) . . . 11_655 ?
C5 C4 C6 N1 180.0 . . . . ?
C5 C4 C6 C3 180.0 . . . . ?
C5 C4 C6 C6 0.0 . . . 11_655 ?
C6 N1 C1 Ag1 137.5(11) . . . . ?
C6 N1 C1 Ag1 -137.5(11) . . . 10_556 ?
C6 N1 C1 Ag1A -126.3(17) . . . 10_556 ?
C6 N1 C1 Ag1A 126.3(17) . . . . ?
C6 N1 C1 Ag1A 70(4) . . . 11_655 ?
C6 N1 C1 Ag1A -70(4) . . . 4_655 ?
C6 N1 C1 Ag1B -146.3(7) . . . 10_556 ?
C6 N1 C1 Ag1B 146.3(7) . . . . ?
C6 N1 C1 C1 0.005(2) . . . 11_655 ?
C6 N1 C1 C2 0.0 . . . 11_655 ?
C6 N1 C1 C2 0.0 . . . . ?
C6 N1 C2 C1 180.0 . . . 11_655 ?
C6 N1 C2 C1 180.0 . . . . ?
C6 N1 C2 C2 179.987(3) . . . 11_655 ?
C6 N1 C2 C3 0.0 . . . . ?
C6 N1 C3 C2 0.0 . . . . ?
C6 N1 C3 C4 0.0 . . . . ?
C6 C3 C4 C5 0.0 . . . . ?
C6 C4 C5 C4 0.0 . . . 11_655 ?
C7 Ag1B N4 Ag1 123.8(15) . . . . ?
C7 Ag1B N4 Ag1A 123.7(12) . . . . ?
C7 Ag1B N4 C11 21.9(17) . . . . ?
C7 Ag1B N4 C15 -164.9(15) . . . . ?
C7 Ag1B C1 Ag1 -98.8(19) . . . . ?
C7 Ag1B C1 Ag1 27.7(17) . . . 10_556 ?
C7 Ag1B C1 Ag1A -98.4(16) . . . . ?
C7 Ag1B C1 Ag1A -85.1(12) . . . 11_655 ?
C7 Ag1B C1 Ag1A 18.7(19) . . . 10_556 ?
C7 Ag1B C1 Ag1A -26.8(19) . . . 4_655 ?
C7 Ag1B C1 Ag1B 35.9(16) . . . 10_556 ?
C7 Ag1B C1 N1 131.3(13) . . . . ?
C7 Ag1B C1 C1 -79.1(13) . . . 11_655 ?
C7 Ag1B C1 C2 -142(4) . . . 11_655 ?
C7 Ag1B C1 C2 165(3) . . . . ?
C7 N2 C7 Ag1B -84(2) 10_556 . . . ?
C7 N2 C7 N3 177.5(14) 10_556 . . . ?
C7 N2 C7 C8 -2(4) 10_556 . . . ?
C7 N3 C11 N4 -32(3) . . . . ?
C7 N3 C11 C12 150.2(19) . . . . ?
C7 C8 C9 C8 6(6) . . . 10_556 ?
C10 N3 C7 Ag1B -175.9(13) . . . . ?
C10 N3 C7 N2 -74(2) . . . . ?
C10 N3 C7 C8 105(3) . . . . ?
C10 N3 C11 N4 -173.9(18) . . . . ?
C10 N3 C11 C12 8(3) . . . . ?
C11 N3 C7 Ag1B 40.6(17) . . . . ?
C11 N3 C7 N2 142(2) . . . . ?
C11 N3 C7 C8 -38(3) . . . . ?
C11 N4 C15 N5 -178.2(17) . . . . ?
C11 N4 C15 C14 0(3) . . . . ?
C11 C12 C13 C14 -2(3) . . . . ?
C12 C13 C14 C15 0(3) . . . . ?
C13 C14 C15 N4 1(3) . . . . ?
C13 C14 C15 N5 178.6(18) . . . . ?
C15 N4 C11 N3 -179.0(16) . . . . ?
C15 N4 C11 C12 -1(3) . . . . ?
C15 N5 C17 N6 3(3) . . . . ?
C15 N5 C17 C18 -176.5(18) . . . . ?
C16 N5 C15 N4 81(2) . . . . ?
C16 N5 C15 C14 -97(3) . . . . ?
C16 N5 C17 N6 -173(2) . . . . ?
C16 N5 C17 C18 8(3) . . . . ?
C17 N5 C15 N4 -95(2) . . . . ?
C17 N5 C15 C14 87(3) . . . . ?
C17 N6 C17 N5 178.6(16) 11_655 . . . ?
C17 N6 C17 C18 -2(4) 11_655 . . . ?
C17 C18 C19 C18 2(6) . . . 11_655 ?
O1 S1 C20 F1 178(3) 11_655 . . 11_655 ?
O1 S1 C20 F1 -178(3) . . . . ?
O1 S1 C20 F1 59(3) . . . 11_655 ?
O1 S1 C20 F1 -59(3) 11_655 . . . ?
O1 S1 C20 F2 59.4(13) 11_655 . . . ?
O1 S1 C20 F2 -59.4(13) . . . . ?
O2 S1 C20 F1 -62(3) . . . 11_655 ?
O2 S1 C20 F1 62(3) . . . . ?
O2 S1 C20 F2 180.0 . . . . ?
_olex2_submission_special_instructions 'No special instructions were received'

# SQUEEZE RESULTS
# Note: Data are Listed for all Voids in the P1 Unit Cell
# i.e. Centre of Gravity, Solvent Accessible Volume,
# Recovered number of Electrons in the Void and
# Details about the Squeezed Material
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.000 0.456 0.250 166 89 ' '
2 0.000 0.544 0.750 166 89 ' '
3 0.500 -0.044 0.250 166 89 ' '
4 0.500 0.044 0.750 166 89 ' '
_platon_squeeze_details          ?
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 1558956'
_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C59 H55 Ag5 F6 N17 O6 S2'
_chemical_formula_weight         1815.67

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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                   14.3867(3)
_cell_length_b                   15.4794(3)
_cell_length_c                   18.9913(6)
_cell_angle_alpha                101.197(2)
_cell_angle_beta                 93.200(2)
_cell_angle_gamma                94.368(2)
_cell_volume                     4125.97(18)
_cell_formula_units_Z            2
_cell_measurement_temperature    173.00(10)
_cell_measurement_reflns_used    14229
_cell_measurement_theta_min      4.4020
_cell_measurement_theta_max      75.7510

_exptl_crystal_description       Prism
_exptl_crystal_colour            Pale-yellow
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.08
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.461
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1794
_exptl_absorpt_coefficient_mu    10.375
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.19397
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173.00(10)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'micro-focus sealed X-ray tube'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'four-circle diffractometer'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            15629
_diffrn_reflns_av_R_equivalents  0.0792
_diffrn_reflns_av_sigmaI/netI    0.0878
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         3.76
_diffrn_reflns_theta_max         70.00
_reflns_number_total             15629
_reflns_number_gt                12054
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_cell_refinement       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_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 > 2sigma(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)+(0.1741P)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    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         15629
_refine_ls_number_parameters     915
_refine_ls_number_restraints     60
_refine_ls_R_factor_all          0.1007
_refine_ls_R_factor_gt           0.0884
_refine_ls_wR_factor_ref         0.2632
_refine_ls_wR_factor_gt          0.2452
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_restrained_S_all      1.065
_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 0.66780(4) 0.72861(3) 0.36866(3) 0.05218(18) Uani 1 1 d . A .
Ag2 Ag 0.65787(4) 0.71894(4) 0.21863(3) 0.05451(18) Uani 1 1 d . A .
Ag3 Ag 0.87337(4) 0.72458(4) 0.20757(4) 0.05632(19) Uani 1 1 d . . .
Ag4 Ag 0.88206(4) 0.71344(4) 0.35389(3) 0.05534(19) Uani 1 1 d . . .
Ag5 Ag 0.74962(3) 0.49214(4) 0.24860(3) 0.04879(18) Uani 1 1 d . . .
N2 N 0.6192(4) 0.6625(4) 0.4524(3) 0.0408(12) Uani 1 1 d . . .
N3 N 0.6174(4) 0.5210(4) 0.3823(3) 0.0442(12) Uani 1 1 d . . .
N4 N 0.6038(4) 0.5200(4) 0.2590(3) 0.0419(12) Uani 1 1 d . . .
N5 N 0.6002(4) 0.5031(4) 0.1339(4) 0.0495(14) Uani 1 1 d . . .
N6 N 0.6166(4) 0.6468(5) 0.1097(4) 0.0511(14) Uani 1 1 d . . .
N7 N 0.6236(5) 0.7919(6) 0.0952(6) 0.070(2) Uani 1 1 d . . .
N8 N 0.7827(5) 0.8091(5) 0.0941(4) 0.0570(16) Uani 1 1 d . . .
N9 N 0.9418(6) 0.8088(6) 0.0918(6) 0.073(2) Uani 1 1 d . . .
N10 N 0.9113(4) 0.6615(5) 0.1017(4) 0.0529(15) Uani 1 1 d . . .
N11 N 0.8877(4) 0.5177(5) 0.1237(3) 0.0475(13) Uani 1 1 d . . .
N12 N 0.9013(4) 0.5170(4) 0.2468(3) 0.0446(13) Uani 1 1 d . . .
N13 N 0.9019(4) 0.4968(4) 0.3663(4) 0.0457(13) Uani 1 1 d . . .
N14 N 0.9115(4) 0.6369(4) 0.4377(4) 0.0476(13) Uani 1 1 d . . .
N15 N 0.9316(4) 0.7829(5) 0.5048(5) 0.0602(18) Uani 1 1 d . . .
N16 N 0.7763(4) 0.8039(4) 0.5110(4) 0.0489(14) Uani 1 1 d . . .
N17 N 0.6178(4) 0.8097(4) 0.5141(4) 0.0522(15) Uani 1 1 d . . .
C1 C 0.7318(7) 0.8120(6) 0.3054(5) 0.061(2) Uani 1 1 d . . .
C2 C 0.8303(7) 0.8082(6) 0.2988(5) 0.0596(19) Uani 1 1 d . A .
N1 N 0.7030(17) 0.9041(11) 0.3150(12) 0.046(5) Uani 0.464(18) 1 d PU A 1
C8 C 0.7853(10) 0.9579(10) 0.3216(13) 0.044(5) Uani 0.464(18) 1 d PGU A 1
C7 C 0.8001(11) 1.0491(9) 0.3291(13) 0.086(11) Uani 0.464(18) 1 d PG A 1
H7 H 0.7499 1.0836 0.3349 0.103 Uiso 0.464(18) 1 calc PR A 1
C6 C 0.8899(13) 1.0886(8) 0.3279(13) 0.100(11) Uani 0.464(18) 1 d PG A 1
H6 H 0.8998 1.1497 0.3330 0.120 Uiso 0.464(18) 1 calc PR A 1
C5 C 0.9649(10) 1.0370(12) 0.3192(13) 0.106(12) Uani 0.464(18) 1 d PG A 1
H5 H 1.0250 1.0634 0.3185 0.127 Uiso 0.464(18) 1 calc PR A 1
C4 C 0.9502(11) 0.9457(11) 0.3117(14) 0.094(11) Uani 0.464(18) 1 d PGU A 1
H4 H 1.0004 0.9112 0.3059 0.113 Uiso 0.464(18) 1 calc PR A 1
C3 C 0.8604(13) 0.9062(7) 0.3129(14) 0.050(8) Uani 0.464(18) 1 d PGU A 1
C9 C 0.615(2) 0.9365(18) 0.3188(16) 0.072(7) Uani 0.464(18) 1 d PU A 1
H9A H 0.5710 0.8980 0.2845 0.108 Uiso 0.464(18) 1 calc PR A 1
H9B H 0.6184 0.9948 0.3081 0.108 Uiso 0.464(18) 1 calc PR A 1
H9C H 0.5943 0.9389 0.3664 0.108 Uiso 0.464(18) 1 calc PR A 1
N1' N 0.8784(15) 0.8888(13) 0.3100(13) 0.055(4) Uani 0.536(18) 1 d P A 2
C3' C 0.7247(11) 0.8991(7) 0.3248(11) 0.053(7) Uani 0.536(18) 1 d PGU A 2
C8' C 0.8112(10) 0.9465(10) 0.3269(11) 0.051(5) Uani 0.536(18) 1 d PGU A 2
C7' C 0.8182(12) 1.0384(10) 0.3425(13) 0.091(9) Uani 0.536(18) 1 d PGU A 2
H7' H 0.8761 1.0701 0.3440 0.109 Uiso 0.536(18) 1 calc PR A 2
C6' C 0.7387(15) 1.0829(7) 0.3561(15) 0.156(18) Uani 0.536(18) 1 d PG A 2
H6' H 0.7434 1.1443 0.3665 0.187 Uiso 0.536(18) 1 calc PR A 2
C5' C 0.6522(13) 1.0355(10) 0.3540(12) 0.112(11) Uani 0.536(18) 1 d PG A 2
H5' H 0.5991 1.0652 0.3630 0.134 Uiso 0.536(18) 1 calc PR A 2
C4' C 0.6453(10) 0.9436(10) 0.3383(10) 0.072(6) Uani 0.536(18) 1 d PGU A 2
H4' H 0.5874 0.9119 0.3369 0.087 Uiso 0.536(18) 1 calc PR A 2
C9' C 0.9734(15) 0.9201(16) 0.3047(13) 0.068(5) Uani 0.536(18) 1 d PU A 2
H9'A H 1.0141 0.8779 0.3166 0.102 Uiso 0.536(18) 1 calc PR A 2
H9'B H 0.9881 0.9757 0.3374 0.102 Uiso 0.536(18) 1 calc PR A 2
H9'C H 0.9818 0.9278 0.2564 0.102 Uiso 0.536(18) 1 calc PR A 2
C10 C 0.6143(4) 0.7179(5) 0.5163(4) 0.0437(15) Uani 1 1 d . . .
C11 C 0.6102(5) 0.6885(6) 0.5803(5) 0.0544(18) Uani 1 1 d . . .
H11 H 0.6084 0.7278 0.6239 0.065 Uiso 1 1 calc R . .
C12 C 0.6089(5) 0.6000(5) 0.5769(4) 0.0507(16) Uani 1 1 d . . .
H12 H 0.6056 0.5787 0.6193 0.061 Uiso 1 1 calc R . .
C13 C 0.6122(4) 0.5402(5) 0.5125(4) 0.0433(14) Uani 1 1 d . . .
H13 H 0.6123 0.4797 0.5109 0.052 Uiso 1 1 calc R . .
C14 C 0.6154(4) 0.5757(5) 0.4508(4) 0.0413(14) Uani 1 1 d . . .
C15 C 0.6341(5) 0.4296(4) 0.3786(4) 0.0446(14) Uani 1 1 d . . .
H15A H 0.6918 0.4264 0.4056 0.067 Uiso 1 1 calc R . .
H15B H 0.6378 0.4013 0.3293 0.067 Uiso 1 1 calc R . .
H15C H 0.5837 0.4003 0.3986 0.067 Uiso 1 1 calc R . .
C16 C 0.5663(4) 0.5418(4) 0.3213(4) 0.0397(13) Uani 1 1 d . . .
C17 C 0.4826(4) 0.5809(5) 0.3278(4) 0.0421(14) Uani 1 1 d . . .
H17 H 0.4578 0.5955 0.3723 0.051 Uiso 1 1 calc R . .
C18 C 0.4374(5) 0.5973(5) 0.2669(5) 0.0500(17) Uani 1 1 d . . .
H18 H 0.3816 0.6239 0.2700 0.060 Uiso 1 1 calc R . .
C19 C 0.4746(5) 0.5744(5) 0.2004(4) 0.0483(16) Uani 1 1 d . . .
H19 H 0.4449 0.5853 0.1587 0.058 Uiso 1 1 calc R . .
C20 C 0.5577(4) 0.5348(5) 0.1990(4) 0.0428(14) Uani 1 1 d . . .
C21 C 0.5906(5) 0.4075(6) 0.1090(5) 0.0561(18) Uani 1 1 d . . .
H21A H 0.5839 0.3792 0.1494 0.084 Uiso 1 1 calc R . .
H21B H 0.6452 0.3895 0.0853 0.084 Uiso 1 1 calc R . .
H21C H 0.5364 0.3909 0.0759 0.084 Uiso 1 1 calc R . .
C22 C 0.6133(4) 0.5586(6) 0.0840(4) 0.0492(16) Uani 1 1 d . . .
C23 C 0.6270(6) 0.5242(7) 0.0121(5) 0.062(2) Uani 1 1 d . . .
H23 H 0.6244 0.4635 -0.0051 0.075 Uiso 1 1 calc R . .
C24 C 0.6447(7) 0.5829(8) -0.0325(5) 0.070(3) Uani 1 1 d . . .
H24 H 0.6585 0.5622 -0.0797 0.084 Uiso 1 1 calc R . .
C25 C 0.6417(7) 0.6737(9) -0.0071(6) 0.075(3) Uani 1 1 d . . .
H25 H 0.6483 0.7131 -0.0381 0.091 Uiso 1 1 calc R . .
C26 C 0.6291(5) 0.7037(6) 0.0640(5) 0.058(2) Uani 1 1 d . . .
C27 C 0.5310(8) 0.8235(9) 0.1010(11) 0.107(5) Uani 1 1 d . . .
H27A H 0.5159 0.8500 0.0606 0.161 Uiso 1 1 calc R . .
H27B H 0.5304 0.8666 0.1447 0.161 Uiso 1 1 calc R . .
H27C H 0.4858 0.7748 0.1014 0.161 Uiso 1 1 calc R . .
C28 C 0.7025(6) 0.8490(7) 0.1047(6) 0.065(2) Uani 1 1 d . . .
C29 C 0.7058(8) 0.9407(8) 0.1277(8) 0.085(3) Uani 1 1 d . . .
H29 H 0.6510 0.9681 0.1357 0.102 Uiso 1 1 calc R . .
C30 C 0.7895(10) 0.9890(8) 0.1380(9) 0.093(4) Uani 1 1 d . . .
H30 H 0.7920 1.0502 0.1521 0.112 Uiso 1 1 calc R . .
C31 C 0.8718(9) 0.9481(7) 0.1278(8) 0.083(3) Uani 1 1 d . . .
H31 H 0.9298 0.9807 0.1367 0.100 Uiso 1 1 calc R . .
C32 C 0.8646(7) 0.8571(7) 0.1037(6) 0.067(2) Uani 1 1 d . . .
C33 C 1.0337(8) 0.8524(9) 0.0822(11) 0.113(6) Uani 1 1 d . . .
H33A H 1.0263 0.8906 0.0484 0.170 Uiso 1 1 calc R . .
H33B H 1.0748 0.8084 0.0644 0.170 Uiso 1 1 calc R . .
H33C H 1.0599 0.8867 0.1276 0.170 Uiso 1 1 calc R . .
C34 C 0.9252(5) 0.7184(7) 0.0578(5) 0.060(2) Uani 1 1 d . . .
C35 C 0.9225(7) 0.6893(9) -0.0169(6) 0.074(3) Uani 1 1 d . . .
H35 H 0.9325 0.7290 -0.0474 0.089 Uiso 1 1 calc R . .
C36 C 0.9048(7) 0.6019(8) -0.0431(5) 0.067(2) Uani 1 1 d . . .
H36 H 0.9000 0.5817 -0.0927 0.081 Uiso 1 1 calc R . .
C37 C 0.8936(5) 0.5414(7) 0.0007(5) 0.058(2) Uani 1 1 d . . .
H37 H 0.8832 0.4811 -0.0183 0.069 Uiso 1 1 calc R . .
C38 C 0.8984(4) 0.5743(6) 0.0763(5) 0.0521(17) Uani 1 1 d . . .
C39 C 0.8549(6) 0.4257(6) 0.0974(5) 0.0569(19) Uani 1 1 d . . .
H39A H 0.8029 0.4215 0.0626 0.085 Uiso 1 1 calc R . .
H39B H 0.8355 0.3998 0.1369 0.085 Uiso 1 1 calc R . .
H39C H 0.9044 0.3946 0.0754 0.085 Uiso 1 1 calc R . .
C40 C 0.9417(4) 0.5394(5) 0.1916(4) 0.0417(14) Uani 1 1 d . . .
C41 C 1.0339(5) 0.5780(6) 0.1965(4) 0.0513(17) Uani 1 1 d . . .
H41 H 1.0618 0.5918 0.1566 0.062 Uiso 1 1 calc R . .
C42 C 1.0821(5) 0.5949(7) 0.2658(5) 0.059(2) Uani 1 1 d . . .
H42 H 1.1424 0.6228 0.2724 0.070 Uiso 1 1 calc R . .
C43 C 1.0404(5) 0.5705(6) 0.3230(5) 0.0529(18) Uani 1 1 d . . .
H43 H 1.0721 0.5810 0.3683 0.063 Uiso 1 1 calc R . .
C44 C 0.9499(5) 0.5297(5) 0.3119(4) 0.0462(15) Uani 1 1 d . . .
C45 C 0.8934(6) 0.4000(6) 0.3574(5) 0.0540(17) Uani 1 1 d . . .
H45A H 0.8933 0.3738 0.3072 0.081 Uiso 1 1 calc R . .
H45B H 0.8361 0.3811 0.3757 0.081 Uiso 1 1 calc R . .
H45C H 0.9452 0.3820 0.3834 0.081 Uiso 1 1 calc R . .
C46 C 0.8975(4) 0.5518(5) 0.4327(4) 0.0464(15) Uani 1 1 d . . .
C47 C 0.8738(5) 0.5140(6) 0.4926(5) 0.0499(16) Uani 1 1 d . . .
H47 H 0.8655 0.4531 0.4890 0.060 Uiso 1 1 calc R . .
C48 C 0.8637(6) 0.5718(7) 0.5565(5) 0.062(2) Uani 1 1 d . . .
H48 H 0.8440 0.5494 0.5957 0.074 Uiso 1 1 calc R . .
C49 C 0.8819(6) 0.6598(7) 0.5631(5) 0.063(2) Uani 1 1 d . . .
H49 H 0.8781 0.6975 0.6072 0.075 Uiso 1 1 calc R . .
C50 C 0.9068(5) 0.6942(6) 0.5021(4) 0.0517(17) Uani 1 1 d . . .
C51 C 1.0267(6) 0.8131(8) 0.4929(7) 0.086(4) Uani 1 1 d . . .
H51A H 1.0644 0.7639 0.4868 0.129 Uiso 1 1 calc R . .
H51B H 1.0522 0.8571 0.5336 0.129 Uiso 1 1 calc R . .
H51C H 1.0262 0.8380 0.4504 0.129 Uiso 1 1 calc R . .
C52 C 0.8626(5) 0.8431(6) 0.5139(5) 0.058(2) Uani 1 1 d . . .
C53 C 0.8827(7) 0.9328(7) 0.5236(9) 0.093(4) Uani 1 1 d . . .
H53 H 0.9439 0.9579 0.5266 0.112 Uiso 1 1 calc R . .
C54 C 0.8082(8) 0.9843(7) 0.5286(9) 0.103(5) Uani 1 1 d . . .
H54 H 0.8197 1.0453 0.5339 0.123 Uiso 1 1 calc R . .
C55 C 0.7181(6) 0.9484(6) 0.5261(7) 0.077(3) Uani 1 1 d . . .
H55 H 0.6678 0.9829 0.5286 0.092 Uiso 1 1 calc R . .
C56 C 0.7056(5) 0.8550(5) 0.5193(5) 0.0561(19) Uani 1 1 d . . .
C57 C 0.5361(6) 0.8552(6) 0.5386(8) 0.087(4) Uani 1 1 d . . .
H57A H 0.4826 0.8130 0.5336 0.130 Uiso 1 1 calc R . .
H57B H 0.5245 0.8986 0.5101 0.130 Uiso 1 1 calc R . .
H57C H 0.5480 0.8838 0.5882 0.130 Uiso 1 1 calc R . .
S1 S 1.28469(12) 0.67476(11) 0.44948(11) 0.0476(4) Uani 1 1 d . . .
F1 F 1.2102(5) 0.7893(5) 0.3830(4) 0.0871(19) Uani 1 1 d . . .
F2 F 1.3122(5) 0.8475(4) 0.4694(4) 0.0819(17) Uani 1 1 d . . .
F3 F 1.3573(6) 0.7797(5) 0.3704(4) 0.093(2) Uani 1 1 d . . .
O1 O 1.2138(5) 0.6863(6) 0.4993(5) 0.086(2) Uani 1 1 d . . .
O2 O 1.2622(5) 0.6083(4) 0.3853(4) 0.0680(17) Uani 1 1 d . . .
O3 O 1.3769(4) 0.6730(4) 0.4804(4) 0.0559(13) Uani 1 1 d . . .
C58 C 1.2913(6) 0.7789(6) 0.4159(5) 0.0570(19) Uani 1 1 d . . .
S2 S 1.25442(13) 0.67201(15) 0.11273(11) 0.0548(4) Uani 1 1 d . . .
F4 F 1.2051(6) 0.7885(6) 0.2194(4) 0.107(3) Uani 1 1 d . . .
F5 F 1.2719(7) 0.8440(5) 0.1417(5) 0.099(2) Uani 1 1 d . . .
F6 F 1.3534(5) 0.7858(5) 0.2136(4) 0.095(2) Uani 1 1 d . . .
O4 O 1.1646(5) 0.6757(5) 0.0772(4) 0.0713(17) Uani 1 1 d . . .
O5 O 1.2565(5) 0.6094(6) 0.1587(5) 0.0757(19) Uani 1 1 d . . .
O6 O 1.3326(5) 0.6742(6) 0.0688(5) 0.080(2) Uani 1 1 d . . .
C59 C 1.2731(8) 0.7776(8) 0.1751(5) 0.072(3) Uani 1 1 d . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 C1 2.122(9) . ?
Ag1 N2 2.171(6) . ?
Ag1 Ag2 2.8191(9) . ?
Ag1 Ag4 3.1332(8) . ?
Ag2 C1 2.138(10) . ?
Ag2 N6 2.178(7) . ?
Ag2 Ag3 3.1149(8) . ?
Ag3 C2 2.106(10) . ?
Ag3 N10 2.176(7) . ?
Ag3 Ag4 2.8137(9) . ?
Ag4 C2 2.115(9) . ?
Ag4 N14 2.202(7) . ?
Ag5 N4 2.185(5) . ?
Ag5 N12 2.191(5) . ?
N2 C14 1.335(9) . ?
N2 C10 1.352(9) . ?
N3 C14 1.411(10) . ?
N3 C16 1.439(10) . ?
N3 C15 1.441(9) . ?
N4 C16 1.323(10) . ?
N4 C20 1.353(10) . ?
N5 C22 1.408(11) . ?
N5 C20 1.427(10) . ?
N5 C21 1.457(10) . ?
N6 C22 1.354(11) . ?
N6 C26 1.361(11) . ?
N7 C28 1.366(12) . ?
N7 C26 1.388(14) . ?
N7 C27 1.456(12) . ?
N8 C32 1.328(12) . ?
N8 C28 1.356(12) . ?
N9 C32 1.389(14) . ?
N9 C34 1.420(14) . ?
N9 C33 1.476(15) . ?
N10 C34 1.337(12) . ?
N10 C38 1.338(11) . ?
N11 C38 1.380(11) . ?
N11 C40 1.435(10) . ?
N11 C39 1.449(10) . ?
N12 C40 1.317(10) . ?
N12 C44 1.357(10) . ?
N13 C46 1.385(10) . ?
N13 C44 1.427(10) . ?
N13 C45 1.469(11) . ?
N14 C46 1.302(11) . ?
N14 C50 1.373(11) . ?
N15 C50 1.383(12) . ?
N15 C52 1.407(11) . ?
N15 C51 1.455(10) . ?
N16 C52 1.333(9) . ?
N16 C56 1.333(11) . ?
N17 C56 1.386(9) . ?
N17 C10 1.427(10) . ?
N17 C57 1.467(10) . ?
C1 C3' 1.341(14) . ?
C1 C2 1.433(14) . ?
C1 N1 1.50(2) . ?
C2 N1' 1.352(19) . ?
C2 C3 1.513(14) . ?
N1 C8 1.38(2) . ?
N1 C9 1.40(3) . ?
C8 C7 1.3900 . ?
C8 C3 1.3900 . ?
C7 C6 1.3900 . ?
C7 H7 0.9300 . ?
C6 C5 1.3900 . ?
C6 H6 0.9300 . ?
C5 C4 1.3900 . ?
C5 H5 0.9300 . ?
C4 C3 1.3900 . ?
C4 H4 0.9300 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
N1' C8' 1.37(3) . ?
N1' C9' 1.43(3) . ?
C3' C8' 1.3900 . ?
C3' C4' 1.3900 . ?
C8' C7' 1.3900 . ?
C7' C6' 1.3900 . ?
C7' H7' 0.9300 . ?
C6' C5' 1.3900 . ?
C6' H6' 0.9300 . ?
C5' C4' 1.3900 . ?
C5' H5' 0.9300 . ?
C4' H4' 0.9300 . ?
C9' H9'A 0.9600 . ?
C9' H9'B 0.9600 . ?
C9' H9'C 0.9600 . ?
C10 C11 1.380(12) . ?
C11 C12 1.358(12) . ?
C11 H11 0.9300 . ?
C12 C13 1.389(11) . ?
C12 H12 0.9300 . ?
C13 C14 1.390(11) . ?
C13 H13 0.9300 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C16 C17 1.388(9) . ?
C17 C18 1.372(12) . ?
C17 H17 0.9300 . ?
C18 C19 1.391(12) . ?
C18 H18 0.9300 . ?
C19 C20 1.384(10) . ?
C19 H19 0.9300 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 C23 1.397(12) . ?
C23 C24 1.378(15) . ?
C23 H23 0.9300 . ?
C24 C25 1.400(18) . ?
C24 H24 0.9300 . ?
C25 C26 1.366(16) . ?
C25 H25 0.9300 . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 C29 1.397(16) . ?
C29 C30 1.351(18) . ?
C29 H29 0.9300 . ?
C30 C31 1.390(18) . ?
C30 H30 0.9300 . ?
C31 C32 1.388(15) . ?
C31 H31 0.9300 . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C34 C35 1.399(16) . ?
C35 C36 1.348(17) . ?
C35 H35 0.9300 . ?
C36 C37 1.376(15) . ?
C36 H36 0.9300 . ?
C37 C38 1.422(13) . ?
C37 H37 0.9300 . ?
C39 H39A 0.9600 . ?
C39 H39B 0.9600 . ?
C39 H39C 0.9600 . ?
C40 C41 1.403(10) . ?
C41 C42 1.421(12) . ?
C41 H41 0.9300 . ?
C42 C43 1.370(13) . ?
C42 H42 0.9300 . ?
C43 C44 1.390(10) . ?
C43 H43 0.9300 . ?
C45 H45A 0.9600 . ?
C45 H45B 0.9600 . ?
C45 H45C 0.9600 . ?
C46 C47 1.423(11) . ?
C47 C48 1.382(13) . ?
C47 H47 0.9300 . ?
C48 C49 1.347(15) . ?
C48 H48 0.9300 . ?
C49 C50 1.418(13) . ?
C49 H49 0.9300 . ?
C51 H51A 0.9600 . ?
C51 H51B 0.9600 . ?
C51 H51C 0.9600 . ?
C52 C53 1.371(13) . ?
C53 C54 1.380(17) . ?
C53 H53 0.9300 . ?
C54 C55 1.366(14) . ?
C54 H54 0.9300 . ?
C55 C56 1.422(12) . ?
C55 H55 0.9300 . ?
C57 H57A 0.9600 . ?
C57 H57B 0.9600 . ?
C57 H57C 0.9600 . ?
S1 O3 1.425(6) . ?
S1 O1 1.428(7) . ?
S1 O2 1.439(6) . ?
S1 C58 1.843(9) . ?
F1 C58 1.328(11) . ?
F2 C58 1.323(11) . ?
F3 C58 1.319(11) . ?
S2 O5 1.426(8) . ?
S2 O4 1.434(7) . ?
S2 O6 1.440(7) . ?
S2 C59 1.814(11) . ?
F4 C59 1.324(14) . ?
F5 C59 1.309(14) . ?
F6 C59 1.317(13) . ?

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
C1 Ag1 N2 167.7(3) . . ?
C1 Ag1 Ag2 48.8(3) . . ?
N2 Ag1 Ag2 143.44(16) . . ?
C1 Ag1 Ag4 64.9(3) . . ?
N2 Ag1 Ag4 110.68(14) . . ?
Ag2 Ag1 Ag4 84.95(2) . . ?
C1 Ag2 N6 160.2(3) . . ?
C1 Ag2 Ag1 48.3(2) . . ?
N6 Ag2 Ag1 150.38(18) . . ?
C1 Ag2 Ag3 68.0(3) . . ?
N6 Ag2 Ag3 97.59(16) . . ?
Ag1 Ag2 Ag3 94.65(2) . . ?
C2 Ag3 N10 167.6(3) . . ?
C2 Ag3 Ag4 48.3(3) . . ?
N10 Ag3 Ag4 143.88(18) . . ?
C2 Ag3 Ag2 65.1(3) . . ?
N10 Ag3 Ag2 112.59(17) . . ?
Ag4 Ag3 Ag2 85.39(2) . . ?
C2 Ag4 N14 162.2(3) . . ?
C2 Ag4 Ag3 48.1(3) . . ?
N14 Ag4 Ag3 149.02(17) . . ?
C2 Ag4 Ag1 67.8(3) . . ?
N14 Ag4 Ag1 99.72(15) . . ?
Ag3 Ag4 Ag1 94.36(2) . . ?
N4 Ag5 N12 159.0(2) . . ?
C14 N2 C10 118.6(6) . . ?
C14 N2 Ag1 125.9(5) . . ?
C10 N2 Ag1 113.5(5) . . ?
C14 N3 C16 119.6(6) . . ?
C14 N3 C15 118.2(6) . . ?
C16 N3 C15 116.9(6) . . ?
C16 N4 C20 118.5(6) . . ?
C16 N4 Ag5 124.0(5) . . ?
C20 N4 Ag5 115.7(5) . . ?
C22 N5 C20 119.6(6) . . ?
C22 N5 C21 119.6(7) . . ?
C20 N5 C21 115.6(7) . . ?
C22 N6 C26 119.6(8) . . ?
C22 N6 Ag2 128.1(5) . . ?
C26 N6 Ag2 108.0(6) . . ?
C28 N7 C26 119.2(8) . . ?
C28 N7 C27 121.6(10) . . ?
C26 N7 C27 117.6(9) . . ?
C32 N8 C28 120.2(9) . . ?
C32 N9 C34 117.6(8) . . ?
C32 N9 C33 121.0(9) . . ?
C34 N9 C33 115.7(10) . . ?
C34 N10 C38 121.3(8) . . ?
C34 N10 Ag3 113.0(6) . . ?
C38 N10 Ag3 123.5(6) . . ?
C38 N11 C40 118.2(6) . . ?
C38 N11 C39 120.2(7) . . ?
C40 N11 C39 117.1(7) . . ?
C40 N12 C44 119.9(6) . . ?
C40 N12 Ag5 123.0(5) . . ?
C44 N12 Ag5 115.2(5) . . ?
C46 N13 C44 119.1(6) . . ?
C46 N13 C45 122.0(7) . . ?
C44 N13 C45 114.6(6) . . ?
C46 N14 C50 121.0(7) . . ?
C46 N14 Ag4 127.7(5) . . ?
C50 N14 Ag4 105.7(5) . . ?
C50 N15 C52 119.4(6) . . ?
C50 N15 C51 120.4(8) . . ?
C52 N15 C51 120.0(8) . . ?
C52 N16 C56 118.2(7) . . ?
C56 N17 C10 117.0(6) . . ?
C56 N17 C57 121.2(7) . . ?
C10 N17 C57 116.1(7) . . ?
C3' C1 C2 102.2(9) . . ?
C3' C1 N1 13.9(12) . . ?
C2 C1 N1 112.8(11) . . ?
C3' C1 Ag1 117.5(10) . . ?
C2 C1 Ag1 116.6(6) . . ?
N1 C1 Ag1 116.8(10) . . ?
C3' C1 Ag2 128.8(10) . . ?
C2 C1 Ag2 109.0(7) . . ?
N1 C1 Ag2 115.2(11) . . ?
Ag1 C1 Ag2 82.9(3) . . ?
N1' C2 C1 113.4(13) . . ?
N1' C2 C3 14.1(13) . . ?
C1 C2 C3 99.4(10) . . ?
N1' C2 Ag3 110.8(11) . . ?
C1 C2 Ag3 117.7(7) . . ?
C3 C2 Ag3 119.6(11) . . ?
N1' C2 Ag4 117.6(12) . . ?
C1 C2 Ag4 110.7(6) . . ?
C3 C2 Ag4 127.1(10) . . ?
Ag3 C2 Ag4 83.6(3) . . ?
C8 N1 C9 123.4(18) . . ?
C8 N1 C1 105.2(17) . . ?
C9 N1 C1 131.4(18) . . ?
N1 C8 C7 130.1(14) . . ?
N1 C8 C3 109.7(14) . . ?
C7 C8 C3 120.0 . . ?
C8 C7 C6 120.0 . . ?
C8 C7 H7 120.0 . . ?
C6 C7 H7 120.0 . . ?
C5 C6 C7 120.0 . . ?
C5 C6 H6 120.0 . . ?
C7 C6 H6 120.0 . . ?
C6 C5 C4 120.0 . . ?
C6 C5 H5 120.0 . . ?
C4 C5 H5 120.0 . . ?
C3 C4 C5 120.0 . . ?
C3 C4 H4 120.0 . . ?
C5 C4 H4 120.0 . . ?
C4 C3 C8 120.0 . . ?
C4 C3 C2 127.1(12) . . ?
C8 C3 C2 112.6(12) . . ?
C2 N1' C8' 103.8(15) . . ?
C2 N1' C9' 135(2) . . ?
C8' N1' C9' 121.2(17) . . ?
C1 C3' C8' 111.0(11) . . ?
C1 C3' C4' 128.9(11) . . ?
C8' C3' C4' 120.0 . . ?
N1' C8' C3' 109.5(12) . . ?
N1' C8' C7' 130.5(12) . . ?
C3' C8' C7' 120.0 . . ?
C6' C7' C8' 120.0 . . ?
C6' C7' H7' 120.0 . . ?
C8' C7' H7' 120.0 . . ?
C7' C6' C5' 120.0 . . ?
C7' C6' H6' 120.0 . . ?
C5' C6' H6' 120.0 . . ?
C6' C5' C4' 120.0 . . ?
C6' C5' H5' 120.0 . . ?
C4' C5' H5' 120.0 . . ?
C5' C4' C3' 120.0 . . ?
C5' C4' H4' 120.0 . . ?
C3' C4' H4' 120.0 . . ?
N1' C9' H9'A 109.5 . . ?
N1' C9' H9'B 109.5 . . ?
H9'A C9' H9'B 109.5 . . ?
N1' C9' H9'C 109.5 . . ?
H9'A C9' H9'C 109.5 . . ?
H9'B C9' H9'C 109.5 . . ?
N2 C10 C11 122.5(7) . . ?
N2 C10 N17 115.7(7) . . ?
C11 C10 N17 121.7(7) . . ?
C12 C11 C10 117.2(8) . . ?
C12 C11 H11 121.4 . . ?
C10 C11 H11 121.4 . . ?
C11 C12 C13 122.5(8) . . ?
C11 C12 H12 118.8 . . ?
C13 C12 H12 118.8 . . ?
C12 C13 C14 116.3(7) . . ?
C12 C13 H13 121.9 . . ?
C14 C13 H13 121.9 . . ?
N2 C14 C13 122.7(7) . . ?
N2 C14 N3 116.1(6) . . ?
C13 C14 N3 121.2(7) . . ?
N3 C15 H15A 109.5 . . ?
N3 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
N3 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
N4 C16 C17 122.7(6) . . ?
N4 C16 N3 115.3(6) . . ?
C17 C16 N3 121.9(7) . . ?
C18 C17 C16 118.3(6) . . ?
C18 C17 H17 120.9 . . ?
C16 C17 H17 120.9 . . ?
C17 C18 C19 120.4(6) . . ?
C17 C18 H18 119.8 . . ?
C19 C18 H18 119.8 . . ?
C20 C19 C18 117.2(7) . . ?
C20 C19 H19 121.4 . . ?
C18 C19 H19 121.4 . . ?
N4 C20 C19 122.8(7) . . ?
N4 C20 N5 114.3(6) . . ?
C19 C20 N5 122.9(7) . . ?
N5 C21 H21A 109.5 . . ?
N5 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
N5 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
N6 C22 C23 121.6(9) . . ?
N6 C22 N5 117.0(7) . . ?
C23 C22 N5 121.4(8) . . ?
C24 C23 C22 118.0(10) . . ?
C24 C23 H23 121.0 . . ?
C22 C23 H23 121.0 . . ?
C23 C24 C25 120.2(10) . . ?
C23 C24 H24 119.9 . . ?
C25 C24 H24 119.9 . . ?
C26 C25 C24 119.1(9) . . ?
C26 C25 H25 120.4 . . ?
C24 C25 H25 120.4 . . ?
N6 C26 C25 121.2(10) . . ?
N6 C26 N7 114.4(9) . . ?
C25 C26 N7 124.3(9) . . ?
N7 C27 H27A 109.5 . . ?
N7 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
N7 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N8 C28 N7 114.2(9) . . ?
N8 C28 C29 120.2(9) . . ?
N7 C28 C29 125.5(10) . . ?
C30 C29 C28 119.3(11) . . ?
C30 C29 H29 120.4 . . ?
C28 C29 H29 120.4 . . ?
C29 C30 C31 120.6(11) . . ?
C29 C30 H30 119.7 . . ?
C31 C30 H30 119.7 . . ?
C32 C31 C30 117.7(11) . . ?
C32 C31 H31 121.1 . . ?
C30 C31 H31 121.1 . . ?
N8 C32 C31 121.9(10) . . ?
N8 C32 N9 114.9(9) . . ?
C31 C32 N9 123.0(10) . . ?
N9 C33 H33A 109.5 . . ?
N9 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
N9 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
N10 C34 C35 121.3(10) . . ?
N10 C34 N9 115.7(9) . . ?
C35 C34 N9 123.0(9) . . ?
C36 C35 C34 117.7(10) . . ?
C36 C35 H35 121.2 . . ?
C34 C35 H35 121.2 . . ?
C35 C36 C37 122.4(10) . . ?
C35 C36 H36 118.8 . . ?
C37 C36 H36 118.8 . . ?
C36 C37 C38 117.6(9) . . ?
C36 C37 H37 121.2 . . ?
C38 C37 H37 121.2 . . ?
N10 C38 N11 119.4(8) . . ?
N10 C38 C37 119.5(8) . . ?
N11 C38 C37 121.0(8) . . ?
N11 C39 H39A 109.5 . . ?
N11 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
N11 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
N12 C40 C41 123.1(7) . . ?
N12 C40 N11 116.2(6) . . ?
C41 C40 N11 120.6(6) . . ?
C40 C41 C42 116.3(7) . . ?
C40 C41 H41 121.9 . . ?
C42 C41 H41 121.9 . . ?
C43 C42 C41 120.6(7) . . ?
C43 C42 H42 119.7 . . ?
C41 C42 H42 119.7 . . ?
C42 C43 C44 118.6(8) . . ?
C42 C43 H43 120.7 . . ?
C44 C43 H43 120.7 . . ?
N12 C44 C43 121.5(7) . . ?
N12 C44 N13 115.1(6) . . ?
C43 C44 N13 123.4(7) . . ?
N13 C45 H45A 109.5 . . ?
N13 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
N13 C45 H45C 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
N14 C46 N13 118.9(7) . . ?
N14 C46 C47 121.9(7) . . ?
N13 C46 C47 119.2(7) . . ?
C48 C47 C46 117.1(8) . . ?
C48 C47 H47 121.4 . . ?
C46 C47 H47 121.4 . . ?
C49 C48 C47 121.4(9) . . ?
C49 C48 H48 119.3 . . ?
C47 C48 H48 119.3 . . ?
C48 C49 C50 119.3(9) . . ?
C48 C49 H49 120.4 . . ?
C50 C49 H49 120.4 . . ?
N14 C50 N15 117.6(7) . . ?
N14 C50 C49 119.1(8) . . ?
N15 C50 C49 123.2(8) . . ?
N15 C51 H51A 109.5 . . ?
N15 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
N15 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
N16 C52 C53 123.7(8) . . ?
N16 C52 N15 113.3(7) . . ?
C53 C52 N15 123.0(8) . . ?
C52 C53 C54 117.3(9) . . ?
C52 C53 H53 121.4 . . ?
C54 C53 H53 121.4 . . ?
C55 C54 C53 121.9(10) . . ?
C55 C54 H54 119.1 . . ?
C53 C54 H54 119.1 . . ?
C54 C55 C56 116.1(9) . . ?
C54 C55 H55 121.9 . . ?
C56 C55 H55 121.9 . . ?
N16 C56 N17 114.9(7) . . ?
N16 C56 C55 122.7(7) . . ?
N17 C56 C55 122.2(7) . . ?
N17 C57 H57A 109.5 . . ?
N17 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
N17 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
O3 S1 O1 115.4(5) . . ?
O3 S1 O2 113.0(4) . . ?
O1 S1 O2 116.1(5) . . ?
O3 S1 C58 103.2(4) . . ?
O1 S1 C58 103.3(4) . . ?
O2 S1 C58 103.4(5) . . ?
F3 C58 F2 107.4(9) . . ?
F3 C58 F1 109.0(9) . . ?
F2 C58 F1 108.2(7) . . ?
F3 C58 S1 110.6(6) . . ?
F2 C58 S1 110.8(7) . . ?
F1 C58 S1 110.7(7) . . ?
O5 S2 O4 114.6(5) . . ?
O5 S2 O6 114.8(5) . . ?
O4 S2 O6 115.7(5) . . ?
O5 S2 C59 103.3(5) . . ?
O4 S2 C59 103.2(5) . . ?
O6 S2 C59 102.7(5) . . ?
F5 C59 F6 108.0(10) . . ?
F5 C59 F4 105.0(10) . . ?
F6 C59 F4 108.6(9) . . ?
F5 C59 S2 111.8(7) . . ?
F6 C59 S2 111.8(8) . . ?
F4 C59 S2 111.3(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
N2 Ag1 Ag2 C1 -179.1(4) . . . . ?
Ag4 Ag1 Ag2 C1 -60.7(4) . . . . ?
C1 Ag1 Ag2 N6 169.2(5) . . . . ?
N2 Ag1 Ag2 N6 -9.9(4) . . . . ?
Ag4 Ag1 Ag2 N6 108.5(3) . . . . ?
C1 Ag1 Ag2 Ag3 54.9(4) . . . . ?
N2 Ag1 Ag2 Ag3 -124.2(2) . . . . ?
Ag4 Ag1 Ag2 Ag3 -5.78(2) . . . . ?
C1 Ag2 Ag3 C2 1.9(4) . . . . ?
N6 Ag2 Ag3 C2 167.7(3) . . . . ?
Ag1 Ag2 Ag3 C2 -39.3(3) . . . . ?
C1 Ag2 Ag3 N10 -164.8(3) . . . . ?
N6 Ag2 Ag3 N10 1.0(3) . . . . ?
Ag1 Ag2 Ag3 N10 154.0(2) . . . . ?
C1 Ag2 Ag3 Ag4 47.7(3) . . . . ?
N6 Ag2 Ag3 Ag4 -146.54(18) . . . . ?
Ag1 Ag2 Ag3 Ag4 6.43(2) . . . . ?
N10 Ag3 Ag4 C2 176.6(4) . . . . ?
Ag2 Ag3 Ag4 C2 -60.5(3) . . . . ?
C2 Ag3 Ag4 N14 171.8(4) . . . . ?
N10 Ag3 Ag4 N14 -11.6(4) . . . . ?
Ag2 Ag3 Ag4 N14 111.3(3) . . . . ?
C2 Ag3 Ag4 Ag1 54.7(3) . . . . ?
N10 Ag3 Ag4 Ag1 -128.7(3) . . . . ?
Ag2 Ag3 Ag4 Ag1 -5.78(2) . . . . ?
C1 Ag1 Ag4 C2 0.9(4) . . . . ?
N2 Ag1 Ag4 C2 -166.7(3) . . . . ?
Ag2 Ag1 Ag4 C2 47.4(3) . . . . ?
C1 Ag1 Ag4 N14 167.6(3) . . . . ?
N2 Ag1 Ag4 N14 0.0(2) . . . . ?
Ag2 Ag1 Ag4 N14 -145.90(17) . . . . ?
C1 Ag1 Ag4 Ag3 -40.1(3) . . . . ?
N2 Ag1 Ag4 Ag3 152.35(16) . . . . ?
Ag2 Ag1 Ag4 Ag3 6.40(2) . . . . ?
C1 Ag1 N2 C14 -132.8(14) . . . . ?
Ag2 Ag1 N2 C14 44.2(6) . . . . ?
Ag4 Ag1 N2 C14 -66.4(5) . . . . ?
C1 Ag1 N2 C10 31.1(16) . . . . ?
Ag2 Ag1 N2 C10 -152.0(3) . . . . ?
Ag4 Ag1 N2 C10 97.5(4) . . . . ?
N12 Ag5 N4 C16 -79.7(9) . . . . ?
N12 Ag5 N4 C20 84.9(8) . . . . ?
C1 Ag2 N6 C22 122.7(10) . . . . ?
Ag1 Ag2 N6 C22 -33.0(8) . . . . ?
Ag3 Ag2 N6 C22 80.6(6) . . . . ?
C1 Ag2 N6 C26 -33.7(11) . . . . ?
Ag1 Ag2 N6 C26 170.6(3) . . . . ?
Ag3 Ag2 N6 C26 -75.8(5) . . . . ?
C2 Ag3 N10 C34 17.0(16) . . . . ?
Ag4 Ag3 N10 C34 -151.2(4) . . . . ?
Ag2 Ag3 N10 C34 93.8(5) . . . . ?
C2 Ag3 N10 C38 -146.4(13) . . . . ?
Ag4 Ag3 N10 C38 45.4(7) . . . . ?
Ag2 Ag3 N10 C38 -69.6(6) . . . . ?
N4 Ag5 N12 C40 -78.7(9) . . . . ?
N4 Ag5 N12 C44 85.4(8) . . . . ?
C2 Ag4 N14 C46 125.5(10) . . . . ?
Ag3 Ag4 N14 C46 -34.2(7) . . . . ?
Ag1 Ag4 N14 C46 81.6(6) . . . . ?
C2 Ag4 N14 C50 -27.9(11) . . . . ?
Ag3 Ag4 N14 C50 172.4(3) . . . . ?
Ag1 Ag4 N14 C50 -71.8(4) . . . . ?
N2 Ag1 C1 C3' -52(2) . . . . ?
Ag2 Ag1 C1 C3' 130.3(12) . . . . ?
Ag4 Ag1 C1 C3' -123.3(11) . . . . ?
N2 Ag1 C1 C2 69.8(17) . . . . ?
Ag2 Ag1 C1 C2 -107.7(8) . . . . ?
Ag4 Ag1 C1 C2 -1.4(6) . . . . ?
N2 Ag1 C1 N1 -68(2) . . . . ?
Ag2 Ag1 C1 N1 114.7(13) . . . . ?
Ag4 Ag1 C1 N1 -138.9(12) . . . . ?
N2 Ag1 C1 Ag2 177.6(12) . . . . ?
Ag4 Ag1 C1 Ag2 106.4(3) . . . . ?
N6 Ag2 C1 C3' 76.0(16) . . . . ?
Ag1 Ag2 C1 C3' -119.8(13) . . . . ?
Ag3 Ag2 C1 C3' 121.7(12) . . . . ?
N6 Ag2 C1 C2 -48.4(12) . . . . ?
Ag1 Ag2 C1 C2 115.8(7) . . . . ?
Ag3 Ag2 C1 C2 -2.7(5) . . . . ?
N6 Ag2 C1 N1 79.6(14) . . . . ?
Ag1 Ag2 C1 N1 -116.3(12) . . . . ?
Ag3 Ag2 C1 N1 125.3(11) . . . . ?
N6 Ag2 C1 Ag1 -164.2(7) . . . . ?
Ag3 Ag2 C1 Ag1 -118.4(3) . . . . ?
C3' C1 C2 N1' -3.1(17) . . . . ?
N1 C1 C2 N1' 6.4(19) . . . . ?
Ag1 C1 C2 N1' -132.8(13) . . . . ?
Ag2 C1 C2 N1' 135.8(13) . . . . ?
C3' C1 C2 C3 -4.0(17) . . . . ?
N1 C1 C2 C3 5.5(16) . . . . ?
Ag1 C1 C2 C3 -133.7(11) . . . . ?
Ag2 C1 C2 C3 134.8(11) . . . . ?
C3' C1 C2 Ag3 -134.7(11) . . . . ?
N1 C1 C2 Ag3 -125.2(12) . . . . ?
Ag1 C1 C2 Ag3 95.6(7) . . . . ?
Ag2 C1 C2 Ag3 4.1(8) . . . . ?
C3' C1 C2 Ag4 131.6(10) . . . . ?
N1 C1 C2 Ag4 141.2(11) . . . . ?
Ag1 C1 C2 Ag4 2.0(9) . . . . ?
Ag2 C1 C2 Ag4 -89.5(6) . . . . ?
N10 Ag3 C2 N1' -54(2) . . . . ?
Ag4 Ag3 C2 N1' 117.2(13) . . . . ?
Ag2 Ag3 C2 N1' -135.7(13) . . . . ?
N10 Ag3 C2 C1 79.2(15) . . . . ?
Ag4 Ag3 C2 C1 -110.0(7) . . . . ?
Ag2 Ag3 C2 C1 -3.0(6) . . . . ?
N10 Ag3 C2 C3 -41(2) . . . . ?
Ag4 Ag3 C2 C3 129.3(12) . . . . ?
Ag2 Ag3 C2 C3 -123.6(11) . . . . ?
N10 Ag3 C2 Ag4 -170.7(12) . . . . ?
Ag2 Ag3 C2 Ag4 107.1(3) . . . . ?
N14 Ag4 C2 N1' 83.7(16) . . . . ?
Ag3 Ag4 C2 N1' -110.2(13) . . . . ?
Ag1 Ag4 C2 N1' 131.3(13) . . . . ?
N14 Ag4 C2 C1 -48.9(13) . . . . ?
Ag3 Ag4 C2 C1 117.2(7) . . . . ?
Ag1 Ag4 C2 C1 -1.3(6) . . . . ?
N14 Ag4 C2 C3 71.3(17) . . . . ?
Ag3 Ag4 C2 C3 -122.6(14) . . . . ?
Ag1 Ag4 C2 C3 118.9(13) . . . . ?
N14 Ag4 C2 Ag3 -166.1(7) . . . . ?
Ag1 Ag4 C2 Ag3 -118.5(3) . . . . ?
C3' C1 N1 C8 36(6) . . . . ?
C2 C1 N1 C8 -6(2) . . . . ?
Ag1 C1 N1 C8 133.3(13) . . . . ?
Ag2 C1 N1 C8 -131.9(14) . . . . ?
C3' C1 N1 C9 -142(8) . . . . ?
C2 C1 N1 C9 175(2) . . . . ?
Ag1 C1 N1 C9 -46(3) . . . . ?
Ag2 C1 N1 C9 49(3) . . . . ?
C9 N1 C8 C7 -4(3) . . . . ?
C1 N1 C8 C7 177.5(15) . . . . ?
C9 N1 C8 C3 -178(2) . . . . ?
C1 N1 C8 C3 3(2) . . . . ?
N1 C8 C7 C6 -174(2) . . . . ?
C3 C8 C7 C6 0.0 . . . . ?
C8 C7 C6 C5 0.0 . . . . ?
C7 C6 C5 C4 0.0 . . . . ?
C6 C5 C4 C3 0.0 . . . . ?
C5 C4 C3 C8 0.0 . . . . ?
C5 C4 C3 C2 174(2) . . . . ?
N1 C8 C3 C4 175.0(19) . . . . ?
C7 C8 C3 C4 0.0 . . . . ?
N1 C8 C3 C2 0.2(19) . . . . ?
C7 C8 C3 C2 -174.8(19) . . . . ?
N1' C2 C3 C4 6(7) . . . . ?
C1 C2 C3 C4 -177.9(13) . . . . ?
Ag3 C2 C3 C4 -48.5(18) . . . . ?
Ag4 C2 C3 C4 57(2) . . . . ?
N1' C2 C3 C8 180(8) . . . . ?
C1 C2 C3 C8 -3.5(15) . . . . ?
Ag3 C2 C3 C8 125.9(11) . . . . ?
Ag4 C2 C3 C8 -128.5(12) . . . . ?
C1 C2 N1' C8' 2(2) . . . . ?
C3 C2 N1' C8' 6(7) . . . . ?
Ag3 C2 N1' C8' 137.1(13) . . . . ?
Ag4 C2 N1' C8' -129.2(14) . . . . ?
C1 C2 N1' C9' -175(2) . . . . ?
C3 C2 N1' C9' -171(9) . . . . ?
Ag3 C2 N1' C9' -40(3) . . . . ?
Ag4 C2 N1' C9' 54(3) . . . . ?
C2 C1 C3' C8' 2.7(14) . . . . ?
N1 C1 C3' C8' -138(7) . . . . ?
Ag1 C1 C3' C8' 131.7(10) . . . . ?
Ag2 C1 C3' C8' -124.4(11) . . . . ?
C2 C1 C3' C4' 179.2(13) . . . . ?
N1 C1 C3' C4' 39(5) . . . . ?
Ag1 C1 C3' C4' -51.7(18) . . . . ?
Ag2 C1 C3' C4' 52(2) . . . . ?
C2 N1' C8' C3' -0.5(19) . . . . ?
C9' N1' C8' C3' 176.8(18) . . . . ?
C2 N1' C8' C7' -178.7(15) . . . . ?
C9' N1' C8' C7' -1(3) . . . . ?
C1 C3' C8' N1' -1.5(18) . . . . ?
C4' C3' C8' N1' -178.4(17) . . . . ?
C1 C3' C8' C7' 176.9(18) . . . . ?
C4' C3' C8' C7' 0.0 . . . . ?
N1' C8' C7' C6' 178(2) . . . . ?
C3' C8' C7' C6' 0.0 . . . . ?
C8' C7' C6' C5' 0.0 . . . . ?
C7' C6' C5' C4' 0.0 . . . . ?
C6' C5' C4' C3' 0.0 . . . . ?
C1 C3' C4' C5' -176(2) . . . . ?
C8' C3' C4' C5' 0.0 . . . . ?
C14 N2 C10 C11 3.2(9) . . . . ?
Ag1 N2 C10 C11 -161.9(6) . . . . ?
C14 N2 C10 N17 -179.4(5) . . . . ?
Ag1 N2 C10 N17 15.5(7) . . . . ?
C56 N17 C10 N2 -86.8(9) . . . . ?
C57 N17 C10 N2 119.5(9) . . . . ?
C56 N17 C10 C11 90.5(9) . . . . ?
C57 N17 C10 C11 -63.1(11) . . . . ?
N2 C10 C11 C12 -1.6(11) . . . . ?
N17 C10 C11 C12 -178.8(6) . . . . ?
C10 C11 C12 C13 0.5(11) . . . . ?
C11 C12 C13 C14 -1.1(10) . . . . ?
C10 N2 C14 C13 -3.9(9) . . . . ?
Ag1 N2 C14 C13 159.2(5) . . . . ?
C10 N2 C14 N3 177.8(5) . . . . ?
Ag1 N2 C14 N3 -19.1(8) . . . . ?
C12 C13 C14 N2 2.8(9) . . . . ?
C12 C13 C14 N3 -178.9(6) . . . . ?
C16 N3 C14 N2 -39.7(8) . . . . ?
C15 N3 C14 N2 166.7(6) . . . . ?
C16 N3 C14 C13 141.9(6) . . . . ?
C15 N3 C14 C13 -11.7(9) . . . . ?
C20 N4 C16 C17 -1.3(10) . . . . ?
Ag5 N4 C16 C17 162.9(5) . . . . ?
C20 N4 C16 N3 177.6(6) . . . . ?
Ag5 N4 C16 N3 -18.1(8) . . . . ?
C14 N3 C16 N4 148.0(6) . . . . ?
C15 N3 C16 N4 -58.1(8) . . . . ?
C14 N3 C16 C17 -33.1(9) . . . . ?
C15 N3 C16 C17 120.9(7) . . . . ?
N4 C16 C17 C18 -0.1(10) . . . . ?
N3 C16 C17 C18 -178.9(6) . . . . ?
C16 C17 C18 C19 0.6(11) . . . . ?
C17 C18 C19 C20 0.2(11) . . . . ?
C16 N4 C20 C19 2.2(10) . . . . ?
Ag5 N4 C20 C19 -163.3(5) . . . . ?
C16 N4 C20 N5 -175.6(6) . . . . ?
Ag5 N4 C20 N5 18.9(8) . . . . ?
C18 C19 C20 N4 -1.6(11) . . . . ?
C18 C19 C20 N5 176.0(7) . . . . ?
C22 N5 C20 N4 -132.1(7) . . . . ?
C21 N5 C20 N4 73.4(8) . . . . ?
C22 N5 C20 C19 50.0(10) . . . . ?
C21 N5 C20 C19 -104.4(8) . . . . ?
C26 N6 C22 C23 3.3(10) . . . . ?
Ag2 N6 C22 C23 -150.7(6) . . . . ?
C26 N6 C22 N5 -180.0(6) . . . . ?
Ag2 N6 C22 N5 26.1(9) . . . . ?
C20 N5 C22 N6 23.1(9) . . . . ?
C21 N5 C22 N6 176.5(6) . . . . ?
C20 N5 C22 C23 -160.1(7) . . . . ?
C21 N5 C22 C23 -6.7(10) . . . . ?
N6 C22 C23 C24 0.3(11) . . . . ?
N5 C22 C23 C24 -176.4(8) . . . . ?
C22 C23 C24 C25 -4.6(13) . . . . ?
C23 C24 C25 C26 5.5(14) . . . . ?
C22 N6 C26 C25 -2.4(11) . . . . ?
Ag2 N6 C26 C25 156.3(7) . . . . ?
C22 N6 C26 N7 175.0(6) . . . . ?
Ag2 N6 C26 N7 -26.3(8) . . . . ?
C24 C25 C26 N6 -1.9(13) . . . . ?
C24 C25 C26 N7 -179.0(8) . . . . ?
C28 N7 C26 N6 111.2(10) . . . . ?
C27 N7 C26 N6 -82.8(13) . . . . ?
C28 N7 C26 C25 -71.5(12) . . . . ?
C27 N7 C26 C25 94.5(13) . . . . ?
C32 N8 C28 N7 -178.0(9) . . . . ?
C32 N8 C28 C29 -1.6(15) . . . . ?
C26 N7 C28 N8 -11.4(14) . . . . ?
C27 N7 C28 N8 -176.9(12) . . . . ?
C26 N7 C28 C29 172.4(11) . . . . ?
C27 N7 C28 C29 6.9(19) . . . . ?
N8 C28 C29 C30 1(2) . . . . ?
N7 C28 C29 C30 177.0(13) . . . . ?
C28 C29 C30 C31 -2(2) . . . . ?
C29 C30 C31 C32 3(2) . . . . ?
C28 N8 C32 C31 2.9(16) . . . . ?
C28 N8 C32 N9 179.5(9) . . . . ?
C30 C31 C32 N8 -3(2) . . . . ?
C30 C31 C32 N9 -179.7(12) . . . . ?
C34 N9 C32 N8 12.1(14) . . . . ?
C33 N9 C32 N8 164.3(12) . . . . ?
C34 N9 C32 C31 -171.4(11) . . . . ?
C33 N9 C32 C31 -19(2) . . . . ?
C38 N10 C34 C35 3.0(12) . . . . ?
Ag3 N10 C34 C35 -160.7(7) . . . . ?
C38 N10 C34 N9 -177.5(7) . . . . ?
Ag3 N10 C34 N9 18.7(8) . . . . ?
C32 N9 C34 N10 -88.7(10) . . . . ?
C33 N9 C34 N10 117.7(12) . . . . ?
C32 N9 C34 C35 90.8(12) . . . . ?
C33 N9 C34 C35 -62.8(14) . . . . ?
N10 C34 C35 C36 0.4(13) . . . . ?
N9 C34 C35 C36 -179.1(9) . . . . ?
C34 C35 C36 C37 -2.8(15) . . . . ?
C35 C36 C37 C38 1.8(14) . . . . ?
C34 N10 C38 N11 177.7(6) . . . . ?
Ag3 N10 C38 N11 -20.3(9) . . . . ?
C34 N10 C38 C37 -4.0(10) . . . . ?
Ag3 N10 C38 C37 158.1(5) . . . . ?
C40 N11 C38 N10 -36.9(9) . . . . ?
C39 N11 C38 N10 167.3(6) . . . . ?
C40 N11 C38 C37 144.7(6) . . . . ?
C39 N11 C38 C37 -11.0(10) . . . . ?
C36 C37 C38 N10 1.6(11) . . . . ?
C36 C37 C38 N11 179.9(7) . . . . ?
C44 N12 C40 C41 -1.1(11) . . . . ?
Ag5 N12 C40 C41 162.3(6) . . . . ?
C44 N12 C40 N11 175.5(6) . . . . ?
Ag5 N12 C40 N11 -21.0(9) . . . . ?
C38 N11 C40 N12 146.2(7) . . . . ?
C39 N11 C40 N12 -57.4(8) . . . . ?
C38 N11 C40 C41 -37.1(10) . . . . ?
C39 N11 C40 C41 119.4(8) . . . . ?
N12 C40 C41 C42 -2.0(12) . . . . ?
N11 C40 C41 C42 -178.5(7) . . . . ?
C40 C41 C42 C43 2.8(13) . . . . ?
C41 C42 C43 C44 -0.6(13) . . . . ?
C40 N12 C44 C43 3.5(11) . . . . ?
Ag5 N12 C44 C43 -161.1(6) . . . . ?
C40 N12 C44 N13 -175.3(6) . . . . ?
Ag5 N12 C44 N13 20.0(8) . . . . ?
C42 C43 C44 N12 -2.6(12) . . . . ?
C42 C43 C44 N13 176.1(8) . . . . ?
C46 N13 C44 N12 -129.7(7) . . . . ?
C45 N13 C44 N12 73.0(8) . . . . ?
C46 N13 C44 C43 51.5(10) . . . . ?
C45 N13 C44 C43 -105.9(9) . . . . ?
C50 N14 C46 N13 179.3(6) . . . . ?
Ag4 N14 C46 N13 29.4(9) . . . . ?
C50 N14 C46 C47 2.0(10) . . . . ?
Ag4 N14 C46 C47 -147.8(6) . . . . ?
C44 N13 C46 N14 20.1(9) . . . . ?
C45 N13 C46 N14 175.7(6) . . . . ?
C44 N13 C46 C47 -162.6(6) . . . . ?
C45 N13 C46 C47 -7.0(9) . . . . ?
N14 C46 C47 C48 1.7(10) . . . . ?
N13 C46 C47 C48 -175.5(7) . . . . ?
C46 C47 C48 C49 -4.5(11) . . . . ?
C47 C48 C49 C50 3.6(12) . . . . ?
C46 N14 C50 N15 173.7(6) . . . . ?
Ag4 N14 C50 N15 -30.7(7) . . . . ?
C46 N14 C50 C49 -3.1(10) . . . . ?
Ag4 N14 C50 C49 152.5(6) . . . . ?
C52 N15 C50 N14 111.7(9) . . . . ?
C51 N15 C50 N14 -63.6(12) . . . . ?
C52 N15 C50 C49 -71.6(11) . . . . ?
C51 N15 C50 C49 113.1(11) . . . . ?
C48 C49 C50 N14 0.3(11) . . . . ?
C48 C49 C50 N15 -176.3(7) . . . . ?
C56 N16 C52 C53 -1.2(16) . . . . ?
C56 N16 C52 N15 179.7(8) . . . . ?
C50 N15 C52 N16 -7.0(13) . . . . ?
C51 N15 C52 N16 168.3(9) . . . . ?
C50 N15 C52 C53 173.9(11) . . . . ?
C51 N15 C52 C53 -10.8(17) . . . . ?
N16 C52 C53 C54 -2(2) . . . . ?
N15 C52 C53 C54 177.2(13) . . . . ?
C52 C53 C54 C55 2(3) . . . . ?
C53 C54 C55 C56 1(2) . . . . ?
C52 N16 C56 N17 178.7(8) . . . . ?
C52 N16 C56 C55 4.4(15) . . . . ?
C10 N17 C56 N16 13.1(12) . . . . ?
C57 N17 C56 N16 165.3(10) . . . . ?
C10 N17 C56 C55 -172.6(10) . . . . ?
C57 N17 C56 C55 -20.4(16) . . . . ?
C54 C55 C56 N16 -4.3(19) . . . . ?
C54 C55 C56 N17 -178.2(12) . . . . ?
O3 S1 C58 F3 57.2(8) . . . . ?
O1 S1 C58 F3 177.7(8) . . . . ?
O2 S1 C58 F3 -60.8(8) . . . . ?
O3 S1 C58 F2 -61.8(7) . . . . ?
O1 S1 C58 F2 58.8(8) . . . . ?
O2 S1 C58 F2 -179.8(6) . . . . ?
O3 S1 C58 F1 178.2(6) . . . . ?
O1 S1 C58 F1 -61.3(8) . . . . ?
O2 S1 C58 F1 60.2(7) . . . . ?
O5 S2 C59 F5 -179.1(8) . . . . ?
O4 S2 C59 F5 -59.3(9) . . . . ?
O6 S2 C59 F5 61.3(9) . . . . ?
O5 S2 C59 F6 59.7(9) . . . . ?
O4 S2 C59 F6 179.4(8) . . . . ?
O6 S2 C59 F6 -60.0(10) . . . . ?
O5 S2 C59 F4 -62.0(9) . . . . ?
O4 S2 C59 F4 57.7(10) . . . . ?
O6 S2 C59 F4 178.3(9) . . . . ?

_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        70.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         2.727
_refine_diff_density_min         -3.202
_refine_diff_density_rms         0.190

# SQUEEZE RESULTS
# Note: Data are Listed for all Voids in the P1 Unit Cell
# i.e. Centre of Gravity, Solvent Accessible Volume,
# Recovered number of Electrons in the Void and
# Details about the Squeezed Material
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 -0.025 0.000 0.000 1181 284 ' '
_platon_squeeze_details          ?
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_CCDC2
_database_code_depnum_ccdc_archive 'CCDC 1558963'
_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C64 H58 Ag4 F9 N17 O10 S2'
_chemical_formula_weight         1891.87

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   C2/c

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

_cell_length_a                   32.1129(19)
_cell_length_b                   12.1233(3)
_cell_length_c                   24.0913(16)
_cell_angle_alpha                90.00
_cell_angle_beta                 130.309(10)
_cell_angle_gamma                90.00
_cell_volume                     7152.2(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    173.00(10)
_cell_measurement_reflns_used    8941
_cell_measurement_theta_min      4.7970
_cell_measurement_theta_max      76.0820

_exptl_crystal_description       Block
_exptl_crystal_colour            Colorless
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.16
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.757
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3768
_exptl_absorpt_coefficient_mu    10.011
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.08444
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173.00(10)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'micro-focus sealed X-ray tube'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            14679
_diffrn_reflns_av_R_equivalents  0.0409
_diffrn_reflns_av_sigmaI/netI    0.0430
_diffrn_reflns_limit_h_min       -39
_diffrn_reflns_limit_h_max       38
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_theta_min         3.61
_diffrn_reflns_theta_max         70.00
_reflns_number_total             6779
_reflns_number_gt                6142
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_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 > 2sigma(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)+(0.0991P)²+128.6386P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    Constr
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       0.000032(13)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         6779
_refine_ls_number_parameters     560
_refine_ls_number_restraints     92
_refine_ls_R_factor_all          0.1026
_refine_ls_R_factor_gt           0.0965
_refine_ls_wR_factor_ref         0.2531
_refine_ls_wR_factor_gt          0.2480
_refine_ls_goodness_of_fit_ref   1.136
_refine_ls_restrained_S_all      1.131
_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 0.18070(3) 0.19192(7) 0.48347(4) 0.0573(3) Uani 1 1 d . . .
Ag2 Ag 0.29746(4) 0.21558(7) 0.61086(4) 0.0626(3) Uani 1 1 d . . .
N1 N 0.1090(3) 0.1383(7) 0.4716(4) 0.0506(18) Uani 1 1 d . . .
C1 C 0.0654(4) 0.2058(10) 0.4396(5) 0.058(3) Uani 1 1 d . . .
C2 C 0.0194(5) 0.1716(17) 0.4282(7) 0.099(6) Uani 1 1 d . . .
H2A H -0.0106 0.2184 0.4048 0.118 Uiso 1 1 calc R . .
C3 C 0.0174(5) 0.0741(19) 0.4499(7) 0.119(8) Uani 1 1 d . . .
H3A H -0.0133 0.0537 0.4437 0.142 Uiso 1 1 calc R . .
C4 C 0.0606(6) 0.0013(15) 0.4820(7) 0.092(5) Uani 1 1 d . . .
H4A H 0.0592 -0.0692 0.4960 0.111 Uiso 1 1 calc R . .
C5 C 0.1062(5) 0.0384(10) 0.4924(6) 0.065(3) Uani 1 1 d . . .
N2 N 0.1515(4) -0.0310(8) 0.5241(6) 0.077(3) Uani 1 1 d . . .
C6 C 0.1429(9) -0.1466(16) 0.4977(15) 0.166(12) Uani 1 1 d . . .
H6A H 0.1059 -0.1555 0.4535 0.250 Uiso 1 1 calc R . .
H6B H 0.1501 -0.1964 0.5340 0.250 Uiso 1 1 calc R . .
H6C H 0.1673 -0.1624 0.4885 0.250 Uiso 1 1 calc R . .
N3 N 0.2054(4) 0.0965(7) 0.6141(5) 0.064(2) Uani 1 1 d . . .
C7 C 0.2031(5) -0.0012(9) 0.5874(7) 0.071(3) Uani 1 1 d . . .
C8 C 0.2472(6) -0.0700(11) 0.6221(9) 0.088(4) Uani 1 1 d . . .
H8A H 0.2438 -0.1392 0.6028 0.106 Uiso 1 1 calc R . .
C9 C 0.2949(6) -0.0376(12) 0.6832(10) 0.100(5) Uani 1 1 d . . .
H9A H 0.3249 -0.0844 0.7067 0.119 Uiso 1 1 calc R . .
C10 C 0.3007(5) 0.0653(13) 0.7125(8) 0.084(4) Uani 1 1 d . . .
H10A H 0.3341 0.0889 0.7553 0.101 Uiso 1 1 calc R . .
C11 C 0.2540(5) 0.1327(12) 0.6749(6) 0.071(3) Uani 1 1 d . . .
N4 N 0.2539(4) 0.2403(12) 0.6984(6) 0.089(4) Uani 1 1 d . . .
C12 C 0.2039(9) 0.273(2) 0.6830(19) 0.23(2) Uani 1 1 d . . .
H12A H 0.1798 0.2105 0.6647 0.350 Uiso 1 1 calc R . .
H12B H 0.1865 0.3306 0.6473 0.350 Uiso 1 1 calc R . .
H12C H 0.2122 0.2988 0.7269 0.350 Uiso 1 1 calc R . .
N5 N 0.3275(4) 0.3031(8) 0.7130(4) 0.061(2) Uani 1 1 d . . .
C13 C 0.2973(5) 0.3122(12) 0.7333(6) 0.074(3) Uani 1 1 d . . .
C14 C 0.3066(5) 0.3871(12) 0.7815(7) 0.080(4) Uani 1 1 d . . .
H14A H 0.2851 0.3891 0.7948 0.096 Uiso 1 1 calc R . .
C15 C 0.3484(5) 0.4600(12) 0.8102(6) 0.075(4) Uani 1 1 d . . .
H15A H 0.3550 0.5133 0.8429 0.090 Uiso 1 1 calc R . .
C16 C 0.3810(5) 0.4563(11) 0.7918(6) 0.069(3) Uani 1 1 d . . .
H16A H 0.4092 0.5064 0.8105 0.083 Uiso 1 1 calc R . .
C17 C 0.3693(5) 0.3725(10) 0.7431(6) 0.065(3) Uani 1 1 d . . .
N6 N 0.4004(5) 0.3666(9) 0.7222(7) 0.083(3) Uani 1 1 d . . .
C18 C 0.4249(12) 0.4578(17) 0.7199(16) 0.188(14) Uani 1 1 d . . .
H18A H 0.4152 0.5224 0.7323 0.282 Uiso 1 1 calc R . .
H18B H 0.4128 0.4659 0.6718 0.282 Uiso 1 1 calc R . .
H18C H 0.4638 0.4486 0.7541 0.282 Uiso 1 1 calc R . .
N7 N 0.4149(4) 0.2667(8) 0.6532(5) 0.059(2) Uani 1 1 d . . .
C19 C 0.4098(5) 0.2620(9) 0.7039(6) 0.056(2) Uani 1 1 d . . .
C20 C 0.4140(5) 0.1650(11) 0.7361(6) 0.068(3) Uani 1 1 d . . .
H20A H 0.4103 0.1624 0.7712 0.081 Uiso 1 1 calc R . .
C21 C 0.4240(7) 0.0723(13) 0.7144(10) 0.103(6) Uani 1 1 d . . .
H21A H 0.4266 0.0046 0.7346 0.124 Uiso 1 1 calc R . .
C22 C 0.4303(6) 0.0769(11) 0.6631(9) 0.087(4) Uani 1 1 d . . .
H22A H 0.4382 0.0135 0.6497 0.105 Uiso 1 1 calc R . .
C23 C 0.4249(5) 0.1742(10) 0.6331(6) 0.061(3) Uani 1 1 d . . .
N8 N 0.4307(4) 0.1903(9) 0.5804(5) 0.066(2) Uani 1 1 d . . .
C24 C 0.4470(7) 0.0918(15) 0.5616(9) 0.107(6) Uani 1 1 d . . .
H24A H 0.4496 0.1114 0.5253 0.161 Uiso 1 1 calc R . .
H24B H 0.4202 0.0348 0.5430 0.161 Uiso 1 1 calc R . .
H24C H 0.4818 0.0656 0.6044 0.161 Uiso 1 1 calc R . .
C25 C 0.2421(7) 0.3307(14) 0.5004(9) 0.041(4) Uani 0.50 1 d PD . 1
C26 C 0.2252(13) 0.376(3) 0.5269(17) 0.092(8) Uani 0.50 1 d PDU . 1
C27 C 0.2189(11) 0.442(2) 0.5686(14) 0.095(9) Uani 0.50 1 d PGU . 1
C28 C 0.1857(9) 0.4088(17) 0.5835(13) 0.087(8) Uani 0.50 1 d PG . 1
H28A H 0.1679 0.3412 0.5665 0.104 Uiso 0.50 1 calc PR . 1
C29 C 0.1791(10) 0.476(2) 0.6239(15) 0.140(15) Uani 0.50 1 d PGU . 1
H29A H 0.1568 0.4539 0.6339 0.168 Uiso 0.50 1 calc PR . 1
C30 C 0.2057(12) 0.578(2) 0.6494(15) 0.15(2) Uani 0.50 1 d PG . 1
H30A H 0.2012 0.6228 0.6764 0.186 Uiso 0.50 1 calc PR . 1
C31 C 0.2389(13) 0.6111(19) 0.6344(18) 0.17(2) Uiso 0.50 1 d PG . 1
H31A H 0.2567 0.6788 0.6515 0.204 Uiso 0.50 1 calc PR . 1
C32 C 0.2455(12) 0.544(3) 0.5940(18) 0.16(3) Uiso 0.50 1 d PGD . 1
N9 N 0.2774(14) 0.576(4) 0.5759(17) 0.20(3) Uani 0.50 1 d PD . 1
C33 C 0.2352(19) 0.627(3) 0.502(3) 0.19(3) Uani 0.50 1 d PD . 1
H33A H 0.2267 0.6995 0.5075 0.283 Uiso 0.50 1 calc PR . 1
H33B H 0.2028 0.5822 0.4743 0.283 Uiso 0.50 1 calc PR . 1
H33C H 0.2494 0.6307 0.4771 0.283 Uiso 0.50 1 calc PR . 1
C34 C 0.322(3) 0.650(7) 0.637(4) 0.31(5) Uiso 0.50 1 d PD . .
H34A H 0.3455 0.6078 0.6813 0.463 Uiso 0.50 1 calc PR . 1
H34B H 0.3050 0.7079 0.6445 0.463 Uiso 0.50 1 calc PR . 1
H34C H 0.3421 0.6819 0.6252 0.463 Uiso 0.50 1 calc PR . 1
O1 O 0.2146(10) 0.0595(18) 0.4522(10) 0.118(9) Uani 0.50 1 d PD . 2
O2 O 0.2943(7) 0.0700(12) 0.5464(9) 0.070(4) Uani 0.50 1 d PD . 2
C35 C 0.2598(8) 0.038(3) 0.4894(13) 0.090(8) Uani 0.50 1 d PDU . 2
C36 C 0.2853(14) -0.034(3) 0.449(2) 0.21(4) Uani 0.50 1 d PD . 2
F11 F 0.300(3) 0.055(4) 0.451(4) 0.67(10) Uiso 0.50 1 d PD . 2
F12 F 0.3205(10) -0.098(3) 0.5015(15) 0.201(16) Uani 0.50 1 d PD . 2
F13 F 0.2436(14) -0.073(3) 0.4010(13) 0.27(3) Uani 0.50 1 d PD . 2
S1 S 0.4393(6) 0.7810(8) 0.8508(8) 0.130(5) Uani 0.505(19) 1 d PD A 1
O3 O 0.3964(18) 0.753(2) 0.7750(16) 0.33(5) Uani 0.505(19) 1 d PD A 1
O4 O 0.432(2) 0.887(3) 0.8684(19) 0.25(4) Uani 0.505(19) 1 d PD A 1
O5 O 0.446(2) 0.695(3) 0.898(2) 0.175(18) Uiso 0.505(19) 1 d PD A 1
S1' S 0.4638(8) 0.7827(12) 0.9012(11) 0.158(7) Uani 0.495(19) 1 d PD A 2
O3' O 0.5187(14) 0.764(3) 0.9686(18) 0.20(2) Uani 0.495(19) 1 d PD A 2
O4' O 0.4457(18) 0.896(2) 0.881(3) 0.38(8) Uani 0.495(19) 1 d PD A 2
O5' O 0.4233(16) 0.699(3) 0.877(3) 0.20(2) Uani 0.495(19) 1 d PDU A 2
F21 F 0.4689(11) 0.818(2) 0.7812(13) 0.371(17) Uani 1 1 d DU A .
F22 F 0.5299(7) 0.8130(19) 0.8898(14) 0.290(12) Uani 1 1 d DU A .
F23 F 0.4928(6) 0.6709(12) 0.8328(8) 0.168(5) Uani 1 1 d DU A .
C37 C 0.4785(8) 0.7721(12) 0.8391(8) 0.115(6) Uani 1 1 d DU . .
O6 O 0.4200(5) 1.1153(13) 0.8813(6) 0.116(4) Uani 1 1 d . . .
C38 C 0.4160(17) 1.146(3) 0.925(2) 0.224(17) Uani 1 1 d . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 N1 2.227(8) . ?
Ag1 C25 2.263(15) 7_556 ?
Ag1 O1 2.322(16) . ?
Ag1 C25 2.418(17) . ?
Ag1 C26 2.48(3) . ?
Ag1 Ag2 2.9449(12) . ?
Ag1 Ag2 2.9958(11) 7_556 ?
Ag2 C25 2.170(16) 7_556 ?
Ag2 N5 2.246(8) . ?
Ag2 O2 2.309(14) . ?
Ag2 C25 2.463(19) . ?
Ag2 C26 2.68(3) . ?
Ag2 Ag1 2.9957(11) 7_556 ?
N1 C5 1.336(14) . ?
N1 C1 1.352(13) . ?
C1 C2 1.380(17) . ?
C1 N8 1.383(15) 7_556 ?
C2 C3 1.31(3) . ?
C3 C4 1.38(2) . ?
C4 C5 1.392(17) . ?
C5 N2 1.402(16) . ?
N2 C7 1.390(16) . ?
N2 C6 1.49(2) . ?
N3 C7 1.326(15) . ?
N3 C11 1.347(15) . ?
C7 C8 1.369(17) . ?
C8 C9 1.32(2) . ?
C9 C10 1.39(2) . ?
C10 C11 1.407(17) . ?
C11 N4 1.423(18) . ?
N4 C13 1.375(18) . ?
N4 C12 1.45(2) . ?
N5 C17 1.334(15) . ?
N5 C13 1.344(16) . ?
C13 C14 1.346(16) . ?
C14 C15 1.365(19) . ?
C15 C16 1.378(17) . ?
C16 C17 1.406(15) . ?
C17 N6 1.379(15) . ?
N6 C18 1.379(19) . ?
N6 C19 1.437(15) . ?
N7 C19 1.335(13) . ?
N7 C23 1.340(14) . ?
C19 C20 1.365(15) . ?
C20 C21 1.36(2) . ?
C21 C22 1.38(2) . ?
C22 C23 1.335(17) . ?
C23 N8 1.412(14) . ?
N8 C1 1.383(15) 7_556 ?
N8 C24 1.487(15) . ?
C25 C26 1.204(10) . ?
C25 C25 2.02(3) 7_556 ?
C25 Ag2 2.170(16) 7_556 ?
C25 Ag1 2.263(15) 7_556 ?
C26 C27 1.40(3) . ?
C27 C28 1.3900 . ?
C27 C32 1.3900 . ?
C28 C29 1.3900 . ?
C29 C30 1.3900 . ?
C30 C31 1.3900 . ?
C31 C32 1.3900 . ?
C32 N9 1.402(10) . ?
N9 C33 1.51(3) . ?
N9 C34 1.52(3) . ?
C34 F13 1.90(7) 7_556 ?
O1 C35 1.14(2) . ?
O2 C35 1.14(2) . ?
C35 C36 1.84(6) . ?
C36 F13 1.16(3) . ?
C36 F11 1.17(3) . ?
C36 F12 1.27(5) . ?
F13 C34 1.90(7) 7_556 ?
S1 O4 1.42(2) . ?
S1 O5 1.44(3) . ?
S1 O3 1.45(2) . ?
S1 C37 1.46(3) . ?
S1' O5' 1.44(3) . ?
S1' O3' 1.45(3) . ?
S1' O4' 1.45(3) . ?
S1' C37 1.84(3) . ?
F21 C37 1.342(19) . ?
F22 C37 1.362(19) . ?
F23 C37 1.352(17) . ?
O6 C38 1.21(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
N1 Ag1 C25 156.0(5) . 7_556 ?
N1 Ag1 O1 114.8(8) . . ?
C25 Ag1 O1 44.0(8) 7_556 . ?
N1 Ag1 C25 152.6(4) . . ?
C25 Ag1 C25 51.1(7) 7_556 . ?
O1 Ag1 C25 91.9(8) . . ?
N1 Ag1 C26 125.5(5) . . ?
C25 Ag1 C26 76.6(7) 7_556 . ?
O1 Ag1 C26 119.6(9) . . ?
C25 Ag1 C26 28.4(3) . . ?
N1 Ag1 Ag2 132.5(2) . . ?
C25 Ag1 Ag2 47.0(4) 7_556 . ?
O1 Ag1 Ag2 81.8(6) . . ?
C25 Ag1 Ag2 53.6(4) . . ?
C26 Ag1 Ag2 58.4(7) . . ?
N1 Ag1 Ag2 137.9(2) . 7_556 ?
C25 Ag1 Ag2 53.7(5) 7_556 7_556 ?
O1 Ag1 Ag2 67.9(6) . 7_556 ?
C25 Ag1 Ag2 45.7(4) . 7_556 ?
C26 Ag1 Ag2 68.3(6) . 7_556 ?
Ag2 Ag1 Ag2 89.37(3) . 7_556 ?
C25 Ag2 N5 165.7(5) 7_556 . ?
C25 Ag2 O2 40.2(6) 7_556 . ?
N5 Ag2 O2 154.0(5) . . ?
C25 Ag2 C25 51.3(7) 7_556 . ?
N5 Ag2 C25 114.5(4) . . ?
O2 Ag2 C25 91.1(5) . . ?
C25 Ag2 C26 74.0(8) 7_556 . ?
N5 Ag2 C26 91.9(6) . . ?
O2 Ag2 C26 114.0(7) . . ?
C25 Ag2 C26 26.7(4) . . ?
C25 Ag2 Ag1 49.7(4) 7_556 . ?
N5 Ag2 Ag1 122.8(3) . . ?
O2 Ag2 Ag1 75.7(4) . . ?
C25 Ag2 Ag1 52.2(4) . . ?
C26 Ag2 Ag1 52.1(7) . . ?
C25 Ag2 Ag1 52.9(4) 7_556 7_556 ?
N5 Ag2 Ag1 120.6(3) . 7_556 ?
O2 Ag2 Ag1 72.9(4) . 7_556 ?
C25 Ag2 Ag1 47.8(3) . 7_556 ?
C26 Ag2 Ag1 70.7(5) . 7_556 ?
Ag1 Ag2 Ag1 90.63(3) . 7_556 ?
C5 N1 C1 117.9(9) . . ?
C5 N1 Ag1 122.0(7) . . ?
C1 N1 Ag1 120.0(7) . . ?
N1 C1 C2 120.8(12) . . ?
N1 C1 N8 117.1(9) . 7_556 ?
C2 C1 N8 122.1(11) . 7_556 ?
C3 C2 C1 120.9(14) . . ?
C2 C3 C4 120.5(12) . . ?
C3 C4 C5 116.9(14) . . ?
N1 C5 C4 122.9(13) . . ?
N1 C5 N2 116.9(10) . . ?
C4 C5 N2 120.2(12) . . ?
C7 N2 C5 121.4(10) . . ?
C7 N2 C6 118.2(13) . . ?
C5 N2 C6 119.5(13) . . ?
C7 N3 C11 118.8(11) . . ?
N3 C7 C8 122.5(13) . . ?
N3 C7 N2 114.7(11) . . ?
C8 C7 N2 122.7(12) . . ?
C9 C8 C7 119.6(14) . . ?
C8 C9 C10 120.8(13) . . ?
C9 C10 C11 117.3(14) . . ?
N3 C11 C10 120.9(13) . . ?
N3 C11 N4 115.7(10) . . ?
C10 C11 N4 123.5(12) . . ?
C13 N4 C11 124.2(11) . . ?
C13 N4 C12 120.0(14) . . ?
C11 N4 C12 115.7(13) . . ?
C17 N5 C13 117.5(9) . . ?
C17 N5 Ag2 117.4(7) . . ?
C13 N5 Ag2 122.6(8) . . ?
N5 C13 C14 124.0(12) . . ?
N5 C13 N4 114.2(10) . . ?
C14 C13 N4 121.8(12) . . ?
C13 C14 C15 118.1(12) . . ?
C14 C15 C16 121.3(11) . . ?
C15 C16 C17 116.4(12) . . ?
N5 C17 N6 118.7(10) . . ?
N5 C17 C16 122.7(11) . . ?
N6 C17 C16 118.4(12) . . ?
C18 N6 C17 122.6(12) . . ?
C18 N6 C19 117.2(11) . . ?
C17 N6 C19 120.2(10) . . ?
C19 N7 C23 119.7(10) . . ?
N7 C19 C20 122.0(11) . . ?
N7 C19 N6 114.7(9) . . ?
C20 C19 N6 123.4(10) . . ?
C21 C20 C19 117.1(11) . . ?
C20 C21 C22 121.2(12) . . ?
C23 C22 C21 118.6(12) . . ?
C22 C23 N7 121.4(10) . . ?
C22 C23 N8 124.2(11) . . ?
N7 C23 N8 114.3(10) . . ?
C1 N8 C23 122.3(9) 7_556 . ?
C1 N8 C24 119.8(10) 7_556 . ?
C23 N8 C24 116.1(11) . . ?
C26 C25 C25 130(2) . 7_556 ?
C26 C25 Ag2 132(2) . 7_556 ?
C25 C25 Ag2 71.9(8) 7_556 7_556 ?
C26 C25 Ag1 142(2) . 7_556 ?
C25 C25 Ag1 68.4(8) 7_556 7_556 ?
Ag2 C25 Ag1 83.2(5) 7_556 7_556 ?
C26 C25 Ag1 78.7(18) . . ?
C25 C25 Ag1 60.5(8) 7_556 . ?
Ag2 C25 Ag1 81.3(6) 7_556 . ?
Ag1 C25 Ag1 128.9(7) 7_556 . ?
C26 C25 Ag2 86.6(19) . . ?
C25 C25 Ag2 56.8(9) 7_556 . ?
Ag2 C25 Ag2 128.7(7) 7_556 . ?
Ag1 C25 Ag2 78.5(6) 7_556 . ?
Ag1 C25 Ag2 74.2(5) . . ?
C25 C26 C27 165(3) . . ?
C25 C26 Ag1 72.9(17) . . ?
C27 C26 Ag1 121(2) . . ?
C25 C26 Ag2 66.7(16) . . ?
C27 C26 Ag2 109(2) . . ?
Ag1 C26 Ag2 69.5(8) . . ?
C28 C27 C32 120.0 . . ?
C28 C27 C26 120(2) . . ?
C32 C27 C26 120(2) . . ?
C29 C28 C27 120.0 . . ?
C30 C29 C28 120.0 . . ?
C31 C30 C29 120.0 . . ?
C30 C31 C32 120.0 . . ?
C31 C32 C27 120.0 . . ?
C31 C32 N9 122(3) . . ?
C27 C32 N9 118(3) . . ?
C32 N9 C33 102(3) . . ?
C32 N9 C34 106(3) . . ?
C33 N9 C34 118(6) . . ?
N9 C34 F13 36.0(14) . 7_556 ?
C35 O1 Ag1 122(2) . . ?
C35 O2 Ag2 131(2) . . ?
O1 C35 O2 129(3) . . ?
O1 C35 C36 118(2) . . ?
O2 C35 C36 112(2) . . ?
F13 C36 F11 126(4) . . ?
F13 C36 F12 118(2) . . ?
F11 C36 F12 116(2) . . ?
F13 C36 C35 96(3) . . ?
F11 C36 C35 81(4) . . ?
F12 C36 C35 101(4) . . ?
C36 F13 C34 151(4) . 7_556 ?
O4 S1 O5 112.7(18) . . ?
O4 S1 O3 112.3(17) . . ?
O5 S1 O3 110.9(17) . . ?
O4 S1 C37 118(3) . . ?
O5 S1 C37 112(2) . . ?
O3 S1 C37 89(3) . . ?
O5' S1' O3' 118.0(14) . . ?
O5' S1' O4' 117.9(13) . . ?
O3' S1' O4' 117.3(13) . . ?
O5' S1' C37 105(3) . . ?
O3' S1' C37 98(2) . . ?
O4' S1' C37 92.9(15) . . ?
F21 C37 F23 97.4(17) . . ?
F21 C37 F22 96.3(17) . . ?
F23 C37 F22 97.3(16) . . ?
F21 C37 S1 121.5(16) . . ?
F23 C37 S1 119.1(14) . . ?
F22 C37 S1 119.8(16) . . ?
F21 C37 S1' 144.0(18) . . ?
F23 C37 S1' 116.0(14) . . ?
F22 C37 S1' 92.7(14) . . ?
S1 C37 S1' 29.9(8) . . ?

_diffrn_measured_fraction_theta_max 0.999
_diffrn_reflns_theta_full        70.00
_diffrn_measured_fraction_theta_full 0.999
_refine_diff_density_max         1.372
_refine_diff_density_min         -1.730
_refine_diff_density_rms         0.151
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_CCDC3
_database_code_depnum_ccdc_archive 'CCDC 1558960'
_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C73.50 H68 Ag5 F9 N18 O12.50 S3'
_chemical_formula_weight         2209.99

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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                   14.8347(3)
_cell_length_b                   15.7643(3)
_cell_length_c                   18.6915(4)
_cell_angle_alpha                96.459(2)
_cell_angle_beta                 93.928(2)
_cell_angle_gamma                95.369(2)
_cell_volume                     4310.55(15)
_cell_formula_units_Z            2
_cell_measurement_temperature    173.00(10)
_cell_measurement_reflns_used    22818
_cell_measurement_theta_min      4.5250
_cell_measurement_theta_max      76.5820

_exptl_crystal_description       Block
_exptl_crystal_colour            Pale-yellow
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.12
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.703
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2198
_exptl_absorpt_coefficient_mu    10.391
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.04249
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173.00(10)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'micro-focus sealed X-ray tube'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'four-circle diffractometer'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            33560
_diffrn_reflns_av_R_equivalents  0.0557
_diffrn_reflns_av_sigmaI/netI    0.0570
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         3.48
_diffrn_reflns_theta_max         70.01
_reflns_number_total             16326
_reflns_number_gt                14704
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_cell_refinement       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_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 > 2sigma(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)+(0.1035P)²+4.4570P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         16326
_refine_ls_number_parameters     1127
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0573
_refine_ls_R_factor_gt           0.0534
_refine_ls_wR_factor_ref         0.1578
_refine_ls_wR_factor_gt          0.1529
_refine_ls_goodness_of_fit_ref   1.021
_refine_ls_restrained_S_all      1.021
_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 0.17022(2) 0.24843(2) 0.367920(19) 0.02873(10) Uani 1 1 d . . .
Ag2 Ag 0.18342(3) 0.24275(2) 0.220592(19) 0.03058(10) Uani 1 1 d . . .
Ag3 Ag 0.38759(2) 0.25318(2) 0.186938(19) 0.02791(10) Uani 1 1 d . . .
Ag4 Ag 0.37517(3) 0.23539(2) 0.332067(19) 0.03064(10) Uani 1 1 d . . .
Ag5 Ag 0.25285(2) 0.03478(2) 0.249219(19) 0.02831(10) Uani 1 1 d . . .
N1 N 0.2132(3) 0.4935(3) 0.2995(3) 0.0336(9) Uani 1 1 d . . .
H1 H 0.2443 0.5422 0.2984 0.040 Uiso 1 1 calc R . .
N2 N 0.4006(3) 0.4922(2) 0.3117(2) 0.0304(9) Uani 1 1 d . . .
H2 H 0.3806 0.5410 0.3233 0.037 Uiso 1 1 calc R . .
N3 N 0.1171(3) 0.1722(3) 0.4500(2) 0.0277(8) Uani 1 1 d . . .
N4 N 0.1200(3) 0.0405(3) 0.3801(2) 0.0280(8) Uani 1 1 d . . .
N5 N 0.1125(2) 0.0524(2) 0.2570(2) 0.0213(7) Uani 1 1 d . . .
N6 N 0.1139(3) 0.0422(2) 0.1315(2) 0.0236(7) Uani 1 1 d . . .
N7 N 0.1486(3) 0.1838(2) 0.1087(2) 0.0249(8) Uani 1 1 d . . .
N8 N 0.1716(3) 0.3292(3) 0.0945(3) 0.0332(9) Uani 1 1 d . . .
N9 N 0.3235(3) 0.3340(2) 0.0767(2) 0.0302(8) Uani 1 1 d . . .
N10 N 0.4731(3) 0.3236(3) 0.0601(3) 0.0349(9) Uani 1 1 d . . .
N11 N 0.4251(3) 0.1850(3) 0.0856(2) 0.0249(8) Uani 1 1 d . . .
N12 N 0.3863(3) 0.0500(2) 0.1211(2) 0.0245(8) Uani 1 1 d . . .
N13 N 0.3977(2) 0.0462(2) 0.2458(2) 0.0214(7) Uani 1 1 d . . .
N14 N 0.3936(3) 0.0238(2) 0.3661(2) 0.0239(7) Uani 1 1 d . . .
N15 N 0.3946(3) 0.1624(2) 0.4260(2) 0.0251(8) Uani 1 1 d . . .
N16 N 0.4074(3) 0.3049(3) 0.4782(3) 0.0337(9) Uani 1 1 d . . .
N17 N 0.2582(3) 0.3146(3) 0.4973(2) 0.0317(9) Uani 1 1 d . . .
N18 N 0.1063(3) 0.3098(3) 0.5116(3) 0.0381(10) Uani 1 1 d . . .
C1 C 0.1797(3) 0.3510(3) 0.3017(3) 0.0276(9) Uani 1 1 d . . .
C2 C 0.2488(3) 0.4160(3) 0.3000(3) 0.0280(9) Uani 1 1 d . . .
C3 C 0.1202(4) 0.4814(3) 0.3011(3) 0.0323(10) Uani 1 1 d . . .
C4 C 0.0567(4) 0.5398(4) 0.2990(4) 0.0435(13) Uani 1 1 d . . .
H4 H 0.0740 0.5978 0.2977 0.052 Uiso 1 1 calc R . .
C5 C -0.0339(4) 0.5089(4) 0.2989(4) 0.0488(15) Uani 1 1 d . . .
H5 H -0.0785 0.5464 0.2965 0.059 Uiso 1 1 calc R . .
C6 C -0.0589(4) 0.4216(4) 0.3024(4) 0.0488(15) Uani 1 1 d . . .
H6 H -0.1199 0.4024 0.3038 0.059 Uiso 1 1 calc R . .
C7 C 0.0051(4) 0.3636(3) 0.3036(3) 0.0393(12) Uani 1 1 d . . .
H7 H -0.0125 0.3057 0.3053 0.047 Uiso 1 1 calc R . .
C8 C 0.0963(3) 0.3929(3) 0.3025(3) 0.0284(9) Uani 1 1 d . . .
C9 C 0.4017(3) 0.3494(3) 0.2784(3) 0.0275(9) Uani 1 1 d . . .
C10 C 0.3477(4) 0.4148(3) 0.2968(3) 0.0292(10) Uani 1 1 d . . .
C11 C 0.4897(3) 0.4798(3) 0.3054(3) 0.0297(10) Uani 1 1 d . . .
C12 C 0.5663(4) 0.5395(3) 0.3146(4) 0.0412(12) Uani 1 1 d . . .
H12 H 0.5618 0.5976 0.3275 0.049 Uiso 1 1 calc R . .
C13 C 0.6488(4) 0.5091(4) 0.3038(4) 0.0466(14) Uani 1 1 d . . .
H13 H 0.7013 0.5471 0.3103 0.056 Uiso 1 1 calc R . .
C14 C 0.6552(4) 0.4217(4) 0.2831(4) 0.0465(14) Uani 1 1 d . . .
H14 H 0.7117 0.4028 0.2753 0.056 Uiso 1 1 calc R . .
C15 C 0.5788(4) 0.3633(4) 0.2741(3) 0.0364(11) Uani 1 1 d . . .
H15 H 0.5839 0.3055 0.2608 0.044 Uiso 1 1 calc R . .
C16 C 0.4937(3) 0.3914(3) 0.2851(3) 0.0278(9) Uani 1 1 d . . .
C17 C 0.1083(3) 0.2191(3) 0.5132(3) 0.0339(11) Uani 1 1 d . . .
C18 C 0.1002(4) 0.1839(4) 0.5770(3) 0.0420(13) Uani 1 1 d . . .
H18 H 0.0936 0.2179 0.6199 0.050 Uiso 1 1 calc R . .
C19 C 0.1024(4) 0.0960(4) 0.5747(3) 0.0437(13) Uani 1 1 d . . .
H19 H 0.0995 0.0705 0.6172 0.052 Uiso 1 1 calc R . .
C20 C 0.1087(3) 0.0462(3) 0.5105(3) 0.0338(11) Uani 1 1 d . . .
H20 H 0.1088 -0.0129 0.5086 0.041 Uiso 1 1 calc R . .
C21 C 0.1149(3) 0.0866(3) 0.4482(3) 0.0261(9) Uani 1 1 d . . .
C22 C 0.1367(4) -0.0500(3) 0.3774(3) 0.0330(10) Uani 1 1 d . . .
H22A H 0.0847 -0.0824 0.3923 0.049 Uiso 1 1 calc R . .
H22B H 0.1890 -0.0550 0.4092 0.049 Uiso 1 1 calc R . .
H22C H 0.1472 -0.0716 0.3290 0.049 Uiso 1 1 calc R . .
C23 C 0.0726(3) 0.0647(3) 0.3191(2) 0.0223(8) Uani 1 1 d . . .
C24 C -0.0110(3) 0.0980(3) 0.3209(3) 0.0282(9) Uani 1 1 d . . .
H24 H -0.0377 0.1079 0.3642 0.034 Uiso 1 1 calc R . .
C25 C -0.0535(3) 0.1158(3) 0.2572(3) 0.0303(10) Uani 1 1 d . . .
H25 H -0.1093 0.1383 0.2575 0.036 Uiso 1 1 calc R . .
C26 C -0.0135(3) 0.1004(3) 0.1925(3) 0.0276(9) Uani 1 1 d . . .
H26 H -0.0417 0.1119 0.1491 0.033 Uiso 1 1 calc R . .
C27 C 0.0692(3) 0.0676(3) 0.1948(3) 0.0230(8) Uani 1 1 d . . .
C28 C 0.0910(3) -0.0499(3) 0.1047(3) 0.0286(9) Uani 1 1 d . . .
H28A H 0.0813 -0.0817 0.1449 0.043 Uiso 1 1 calc R . .
H28B H 0.1401 -0.0708 0.0793 0.043 Uiso 1 1 calc R . .
H28C H 0.0367 -0.0568 0.0727 0.043 Uiso 1 1 calc R . .
C29 C 0.1325(3) 0.0999(3) 0.0824(3) 0.0243(9) Uani 1 1 d . . .
C30 C 0.1390(3) 0.0731(3) 0.0087(3) 0.0305(10) Uani 1 1 d . . .
H30 H 0.1309 0.0151 -0.0090 0.037 Uiso 1 1 calc R . .
C31 C 0.1574(4) 0.1344(4) -0.0364(3) 0.0359(11) Uani 1 1 d . . .
H31 H 0.1637 0.1177 -0.0850 0.043 Uiso 1 1 calc R . .
C32 C 0.1667(4) 0.2210(3) -0.0106(3) 0.0359(11) Uani 1 1 d . . .
H32 H 0.1752 0.2631 -0.0414 0.043 Uiso 1 1 calc R . .
C33 C 0.1628(3) 0.2420(3) 0.0622(3) 0.0287(10) Uani 1 1 d . . .
C34 C 0.0876(4) 0.3685(4) 0.1073(4) 0.0424(13) Uani 1 1 d . . .
H34A H 0.0716 0.3995 0.0677 0.064 Uiso 1 1 calc R . .
H34B H 0.0965 0.4073 0.1512 0.064 Uiso 1 1 calc R . .
H34C H 0.0396 0.3245 0.1115 0.064 Uiso 1 1 calc R . .
C35 C 0.2539(4) 0.3784(3) 0.0940(3) 0.0320(10) Uani 1 1 d . . .
C36 C 0.2645(4) 0.4671(3) 0.1133(3) 0.0394(12) Uani 1 1 d . . .
H36 H 0.2152 0.4973 0.1237 0.047 Uiso 1 1 calc R . .
C37 C 0.3516(5) 0.5084(4) 0.1164(4) 0.0498(15) Uani 1 1 d . . .
H37 H 0.3613 0.5671 0.1310 0.060 Uiso 1 1 calc R . .
C38 C 0.4247(4) 0.4637(4) 0.0982(4) 0.0449(14) Uani 1 1 d . . .
H38 H 0.4831 0.4913 0.0994 0.054 Uiso 1 1 calc R . .
C39 C 0.4065(4) 0.3749(3) 0.0779(3) 0.0329(10) Uani 1 1 d . . .
C40 C 0.5663(4) 0.3607(4) 0.0523(5) 0.0521(16) Uani 1 1 d . . .
H40A H 0.6040 0.3153 0.0417 0.078 Uiso 1 1 calc R . .
H40B H 0.5899 0.3951 0.0964 0.078 Uiso 1 1 calc R . .
H40C H 0.5657 0.3959 0.0136 0.078 Uiso 1 1 calc R . .
C41 C 0.4503(3) 0.2352(3) 0.0353(3) 0.0307(10) Uani 1 1 d . . .
C42 C 0.4568(4) 0.2038(4) -0.0353(3) 0.0381(12) Uani 1 1 d . . .
H42 H 0.4766 0.2398 -0.0684 0.046 Uiso 1 1 calc R . .
C43 C 0.4331(4) 0.1170(4) -0.0563(3) 0.0378(11) Uani 1 1 d . . .
H43 H 0.4335 0.0949 -0.1046 0.045 Uiso 1 1 calc R . .
C44 C 0.4089(3) 0.0632(3) -0.0060(3) 0.0310(10) Uani 1 1 d . . .
H44 H 0.3942 0.0046 -0.0193 0.037 Uiso 1 1 calc R . .
C45 C 0.4069(3) 0.0995(3) 0.0661(3) 0.0245(9) Uani 1 1 d . . .
C46 C 0.3444(3) -0.0385(3) 0.1002(3) 0.0307(10) Uani 1 1 d . . .
H46A H 0.3880 -0.0726 0.0786 0.046 Uiso 1 1 calc R . .
H46B H 0.2930 -0.0383 0.0660 0.046 Uiso 1 1 calc R . .
H46C H 0.3247 -0.0624 0.1422 0.046 Uiso 1 1 calc R . .
C47 C 0.4402(3) 0.0655(3) 0.1875(3) 0.0229(8) Uani 1 1 d . . .
C48 C 0.5311(3) 0.0953(3) 0.1934(3) 0.0256(9) Uani 1 1 d . . .
H48 H 0.5600 0.1087 0.1529 0.031 Uiso 1 1 calc R . .
C49 C 0.5785(3) 0.1050(3) 0.2604(3) 0.0305(10) Uani 1 1 d . . .
H49 H 0.6396 0.1258 0.2653 0.037 Uiso 1 1 calc R . .
C50 C 0.5357(3) 0.0839(3) 0.3205(3) 0.0278(9) Uani 1 1 d . . .
H50 H 0.5669 0.0896 0.3659 0.033 Uiso 1 1 calc R . .
C51 C 0.4444(3) 0.0539(3) 0.3100(3) 0.0225(8) Uani 1 1 d . . .
C52 C 0.3897(4) -0.0697(3) 0.3682(3) 0.0320(10) Uani 1 1 d . . .
H52A H 0.4435 -0.0830 0.3945 0.048 Uiso 1 1 calc R . .
H52B H 0.3859 -0.0984 0.3198 0.048 Uiso 1 1 calc R . .
H52C H 0.3372 -0.0887 0.3917 0.048 Uiso 1 1 calc R . .
C53 C 0.3887(3) 0.0769(3) 0.4302(2) 0.0231(8) Uani 1 1 d . . .
C54 C 0.3731(3) 0.0441(3) 0.4954(3) 0.0311(10) Uani 1 1 d . . .
H54 H 0.3673 -0.0148 0.4975 0.037 Uiso 1 1 calc R . .
C55 C 0.3665(4) 0.0997(4) 0.5557(3) 0.0377(11) Uani 1 1 d . . .
H55 H 0.3545 0.0788 0.5990 0.045 Uiso 1 1 calc R . .
C56 C 0.3778(4) 0.1876(3) 0.5526(3) 0.0352(11) Uani 1 1 d . . .
H56 H 0.3755 0.2261 0.5938 0.042 Uiso 1 1 calc R . .
C57 C 0.3924(3) 0.2165(3) 0.4872(3) 0.0294(10) Uani 1 1 d . . .
C58 C 0.5017(4) 0.3405(4) 0.4758(3) 0.0408(12) Uani 1 1 d . . .
H58A H 0.5241 0.3693 0.5225 0.061 Uiso 1 1 calc R . .
H58B H 0.5047 0.3806 0.4408 0.061 Uiso 1 1 calc R . .
H58C H 0.5382 0.2950 0.4625 0.061 Uiso 1 1 calc R . .
C59 C 0.3397(4) 0.3568(3) 0.4929(3) 0.0299(10) Uani 1 1 d . . .
C60 C 0.3543(4) 0.4463(3) 0.4980(4) 0.0427(13) Uani 1 1 d . . .
H60 H 0.4114 0.4744 0.4943 0.051 Uiso 1 1 calc R . .
C61 C 0.2798(5) 0.4906(4) 0.5088(5) 0.0570(18) Uani 1 1 d . . .
H61 H 0.2869 0.5503 0.5126 0.068 Uiso 1 1 calc R . .
C62 C 0.1944(5) 0.4491(4) 0.5142(4) 0.0493(15) Uani 1 1 d . . .
H62 H 0.1441 0.4792 0.5210 0.059 Uiso 1 1 calc R . .
C63 C 0.1877(4) 0.3595(3) 0.5089(3) 0.0325(10) Uani 1 1 d . . .
C64 C 0.0207(5) 0.3473(5) 0.5208(5) 0.0596(19) Uani 1 1 d . . .
H64A H -0.0289 0.3027 0.5126 0.089 Uiso 1 1 calc R . .
H64B H 0.0132 0.3879 0.4867 0.089 Uiso 1 1 calc R . .
H64C H 0.0215 0.3760 0.5690 0.089 Uiso 1 1 calc R . .
S1 S 0.75271(8) 0.14997(8) 0.09766(7) 0.0297(2) Uani 1 1 d . . .
F1 F 0.7983(4) 0.3072(3) 0.0710(3) 0.0744(14) Uani 1 1 d . . .
F2 F 0.8780(3) 0.2681(3) 0.1590(3) 0.0673(12) Uani 1 1 d . . .
F3 F 0.7414(4) 0.2988(4) 0.1703(3) 0.0894(18) Uani 1 1 d . . .
O1 O 0.8191(3) 0.1200(3) 0.0518(2) 0.0416(9) Uani 1 1 d . . .
O2 O 0.7528(3) 0.1137(3) 0.1652(3) 0.0520(11) Uani 1 1 d . . .
O3 O 0.6642(3) 0.1545(3) 0.0634(2) 0.0403(9) Uani 1 1 d . . .
C65 C 0.7951(4) 0.2622(4) 0.1260(4) 0.0471(14) Uani 1 1 d . . .
S2 S 0.22100(10) 0.85038(8) 0.56106(8) 0.0372(3) Uani 1 1 d . . .
F4 F 0.3184(3) 0.7418(3) 0.6155(4) 0.0845(17) Uani 1 1 d . . .
F5 F 0.2022(3) 0.6817(2) 0.5525(3) 0.0617(11) Uani 1 1 d . . .
F6 F 0.1902(5) 0.7473(3) 0.6579(3) 0.093(2) Uani 1 1 d . . .
O4 O 0.2833(5) 0.8509(3) 0.5082(4) 0.082(2) Uani 1 1 d . . .
O5 O 0.2422(4) 0.9145(3) 0.6214(3) 0.0579(12) Uani 1 1 d . . .
O6 O 0.1263(3) 0.8421(3) 0.5354(3) 0.0589(13) Uani 1 1 d . . .
C66 C 0.2310(4) 0.7497(3) 0.5985(3) 0.0386(12) Uani 1 1 d . . .
S3 S 0.22653(11) 0.76741(10) 0.20855(10) 0.0492(4) Uani 1 1 d . . .
F7 F 0.2693(4) 0.7760(3) 0.0760(3) 0.0756(14) Uani 1 1 d . . .
F8 F 0.2081(4) 0.6519(3) 0.0936(3) 0.0836(16) Uani 1 1 d . . .
F9 F 0.1261(4) 0.7563(3) 0.0874(3) 0.0701(13) Uani 1 1 d . . .
O7 O 0.3197(4) 0.7471(4) 0.2219(3) 0.0702(15) Uani 1 1 d . . .
O8 O 0.1598(4) 0.7154(4) 0.2399(4) 0.0813(19) Uani 1 1 d . . .
O9 O 0.2192(4) 0.8583(3) 0.2167(3) 0.0541(11) Uani 1 1 d . . .
C67 C 0.2073(5) 0.7360(4) 0.1104(4) 0.0541(16) Uani 1 1 d . . .
O10 O 0.3376(4) 0.6538(3) 0.3347(3) 0.0543(12) Uani 1 1 d . . .
C68 C 0.3011(8) 0.6992(6) 0.3923(5) 0.078(3) Uani 1 1 d . . .
O11 O 0.1787(5) 0.4012(4) -0.1111(4) 0.0753(17) Uani 1 1 d . . .
C69 C 0.3285(8) 0.3726(10) -0.1275(9) 0.120(5) Uani 1 1 d . . .
H69A H 0.3080 0.3434 -0.1745 0.179 Uiso 1 1 calc R . .
H69B H 0.3273 0.3322 -0.0928 0.179 Uiso 1 1 calc R . .
H69C H 0.3894 0.3988 -0.1284 0.179 Uiso 1 1 calc R . .
C70 C 0.2677(9) 0.4400(8) -0.1073(7) 0.111(5) Uani 1 1 d . . .
H70A H 0.2856 0.4674 -0.0587 0.133 Uiso 1 1 calc R . .
H70B H 0.2720 0.4834 -0.1401 0.133 Uiso 1 1 calc R . .
C71 C 0.1137(8) 0.4617(5) -0.0926(6) 0.088(3) Uani 1 1 d . . .
H71A H 0.1148 0.5048 -0.1258 0.105 Uiso 1 1 calc R . .
H71B H 0.1297 0.4905 -0.0441 0.105 Uiso 1 1 calc R . .
C72 C 0.0214(7) 0.4154(6) -0.0967(7) 0.090(3) Uani 1 1 d . . .
H72A H 0.0009 0.3969 -0.1463 0.135 Uiso 1 1 calc R . .
H72B H -0.0195 0.4530 -0.0757 0.135 Uiso 1 1 calc R . .
H72C H 0.0231 0.3664 -0.0706 0.135 Uiso 1 1 calc R . .
O12 O 0.4878(6) 0.8277(7) 0.2080(5) 0.056(2) Uani 0.50 1 d P . .
C73 C 0.5274(9) 0.7734(14) 0.2491(9) 0.071(5) Uani 0.50 1 d P . .
O13 O 0.2073(6) 1.0510(5) 0.8003(5) 0.0440(18) Uani 0.50 1 d P . .
C74 C 0.2706(8) 1.0770(7) 0.7579(8) 0.047(3) Uani 0.50 1 d P . .
O14 O -0.0474(5) -0.1118(5) 0.2498(5) 0.0402(17) Uani 0.50 1 d P . .
C75 C -0.0535(8) 0.7988(7) 0.2202(6) 0.035(2) Uani 0.50 1 d P . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 C1 2.144(5) . ?
Ag1 N3 2.195(4) . ?
Ag1 Ag2 2.7661(5) . ?
Ag1 Ag4 3.1781(5) . ?
Ag2 C1 2.158(5) . ?
Ag2 N7 2.197(4) . ?
Ag2 Ag3 3.1284(5) . ?
Ag3 C9 2.139(5) . ?
Ag3 N11 2.203(4) . ?
Ag3 Ag4 2.7751(5) . ?
Ag4 C9 2.172(4) . ?
Ag4 N15 2.223(4) . ?
Ag5 N5 2.138(3) . ?
Ag5 N13 2.145(3) . ?
N1 C2 1.376(6) . ?
N1 C3 1.378(7) . ?
N1 H1 0.8600 . ?
N2 C11 1.365(7) . ?
N2 C10 1.377(6) . ?
N2 H2 0.8600 . ?
N3 C17 1.342(7) . ?
N3 C21 1.344(6) . ?
N4 C21 1.403(7) . ?
N4 C23 1.407(6) . ?
N4 C22 1.465(6) . ?
N5 C23 1.343(6) . ?
N5 C27 1.345(6) . ?
N6 C29 1.386(6) . ?
N6 C27 1.432(6) . ?
N6 C28 1.482(6) . ?
N7 C33 1.345(6) . ?
N7 C29 1.351(6) . ?
N8 C35 1.384(7) . ?
N8 C33 1.429(6) . ?
N8 C34 1.466(7) . ?
N9 C39 1.333(7) . ?
N9 C35 1.339(7) . ?
N10 C39 1.369(7) . ?
N10 C41 1.420(7) . ?
N10 C40 1.472(7) . ?
N11 C41 1.346(6) . ?
N11 C45 1.352(6) . ?
N12 C45 1.392(6) . ?
N12 C47 1.413(6) . ?
N12 C46 1.474(6) . ?
N13 C51 1.331(6) . ?
N13 C47 1.345(6) . ?
N14 C53 1.392(6) . ?
N14 C51 1.430(6) . ?
N14 C52 1.475(6) . ?
N15 C57 1.351(7) . ?
N15 C53 1.353(6) . ?
N16 C59 1.376(7) . ?
N16 C57 1.421(6) . ?
N16 C58 1.463(7) . ?
N17 C63 1.333(7) . ?
N17 C59 1.337(7) . ?
N18 C63 1.383(7) . ?
N18 C17 1.437(7) . ?
N18 C64 1.463(8) . ?
C1 C2 1.385(7) . ?
C1 C8 1.456(7) . ?
C2 C10 1.475(7) . ?
C3 C4 1.380(8) . ?
C3 C8 1.411(7) . ?
C4 C5 1.385(9) . ?
C4 H4 0.9300 . ?
C5 C6 1.401(9) . ?
C5 H5 0.9300 . ?
C6 C7 1.380(9) . ?
C6 H6 0.9300 . ?
C7 C8 1.391(7) . ?
C7 H7 0.9300 . ?
C9 C10 1.392(7) . ?
C9 C16 1.451(7) . ?
C11 C12 1.395(7) . ?
C11 C16 1.410(7) . ?
C12 C13 1.375(8) . ?
C12 H12 0.9300 . ?
C13 C14 1.402(9) . ?
C13 H13 0.9300 . ?
C14 C15 1.379(9) . ?
C14 H14 0.9300 . ?
C15 C16 1.397(7) . ?
C15 H15 0.9300 . ?
C17 C18 1.378(8) . ?
C18 C19 1.384(9) . ?
C18 H18 0.9300 . ?
C19 C20 1.372(9) . ?
C19 H19 0.9300 . ?
C20 C21 1.393(7) . ?
C20 H20 0.9300 . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C23 C24 1.391(7) . ?
C24 C25 1.378(7) . ?
C24 H24 0.9300 . ?
C25 C26 1.391(7) . ?
C25 H25 0.9300 . ?
C26 C27 1.377(6) . ?
C26 H26 0.9300 . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
C29 C30 1.407(7) . ?
C30 C31 1.374(7) . ?
C30 H30 0.9300 . ?
C31 C32 1.387(8) . ?
C31 H31 0.9300 . ?
C32 C33 1.370(8) . ?
C32 H32 0.9300 . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 0.9600 . ?
C35 C36 1.396(7) . ?
C36 C37 1.386(9) . ?
C36 H36 0.9300 . ?
C37 C38 1.388(9) . ?
C37 H37 0.9300 . ?
C38 C39 1.404(8) . ?
C38 H38 0.9300 . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C41 C42 1.370(8) . ?
C42 C43 1.386(9) . ?
C42 H42 0.9300 . ?
C43 C44 1.379(8) . ?
C43 H43 0.9300 . ?
C44 C45 1.406(7) . ?
C44 H44 0.9300 . ?
C46 H46A 0.9600 . ?
C46 H46B 0.9600 . ?
C46 H46C 0.9600 . ?
C47 C48 1.379(6) . ?
C48 C49 1.380(7) . ?
C48 H48 0.9300 . ?
C49 C50 1.384(7) . ?
C49 H49 0.9300 . ?
C50 C51 1.386(6) . ?
C50 H50 0.9300 . ?
C52 H52A 0.9600 . ?
C52 H52B 0.9600 . ?
C52 H52C 0.9600 . ?
C53 C54 1.403(7) . ?
C54 C55 1.363(8) . ?
C54 H54 0.9300 . ?
C55 C56 1.387(8) . ?
C55 H55 0.9300 . ?
C56 C57 1.376(8) . ?
C56 H56 0.9300 . ?
C58 H58A 0.9600 . ?
C58 H58B 0.9600 . ?
C58 H58C 0.9600 . ?
C59 C60 1.398(7) . ?
C60 C61 1.376(9) . ?
C60 H60 0.9300 . ?
C61 C62 1.386(10) . ?
C61 H61 0.9300 . ?
C62 C63 1.397(8) . ?
C62 H62 0.9300 . ?
C64 H64A 0.9600 . ?
C64 H64B 0.9600 . ?
C64 H64C 0.9600 . ?
S1 O1 1.428(4) . ?
S1 O3 1.432(4) . ?
S1 O2 1.444(5) . ?
S1 C65 1.828(6) . ?
F1 C65 1.314(9) . ?
F2 C65 1.327(8) . ?
F3 C65 1.313(8) . ?
S2 O4 1.399(5) . ?
S2 O5 1.424(5) . ?
S2 O6 1.443(5) . ?
S2 C66 1.820(5) . ?
F4 C66 1.334(8) . ?
F5 C66 1.315(7) . ?
F6 C66 1.302(8) . ?
S3 O8 1.425(5) . ?
S3 O9 1.439(5) . ?
S3 O7 1.459(6) . ?
S3 C67 1.840(8) . ?
F7 C67 1.312(9) . ?
F8 C67 1.329(7) . ?
F9 C67 1.330(9) . ?
O10 C68 1.393(9) . ?
O11 C70 1.395(12) . ?
O11 C71 1.451(12) . ?
C69 C70 1.491(19) . ?
C69 H69A 0.9600 . ?
C69 H69B 0.9600 . ?
C69 H69C 0.9600 . ?
C70 H70A 0.9700 . ?
C70 H70B 0.9700 . ?
C71 C72 1.482(15) . ?
C71 H71A 0.9700 . ?
C71 H71B 0.9700 . ?
C72 H72A 0.9600 . ?
C72 H72B 0.9600 . ?
C72 H72C 0.9600 . ?
O12 C73 1.36(2) . ?
O13 C74 1.334(16) . ?
O14 C75 1.447(13) 1_545 ?
C75 O14 1.447(13) 1_565 ?

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
C1 Ag1 N3 157.36(17) . . ?
C1 Ag1 Ag2 50.21(13) . . ?
N3 Ag1 Ag2 141.95(11) . . ?
C1 Ag1 Ag4 83.04(14) . . ?
N3 Ag1 Ag4 117.87(11) . . ?
Ag2 Ag1 Ag4 70.041(13) . . ?
C1 Ag2 N7 148.50(16) . . ?
C1 Ag2 Ag1 49.76(12) . . ?
N7 Ag2 Ag1 152.18(10) . . ?
C1 Ag2 Ag3 103.24(13) . . ?
N7 Ag2 Ag3 87.87(10) . . ?
Ag1 Ag2 Ag3 109.986(15) . . ?
C9 Ag3 N11 156.46(16) . . ?
C9 Ag3 Ag4 50.44(12) . . ?
N11 Ag3 Ag4 141.77(10) . . ?
C9 Ag3 Ag2 82.31(14) . . ?
N11 Ag3 Ag2 119.29(10) . . ?
Ag4 Ag3 Ag2 70.702(13) . . ?
C9 Ag4 N15 151.30(17) . . ?
C9 Ag4 Ag3 49.41(13) . . ?
N15 Ag4 Ag3 151.05(10) . . ?
C9 Ag4 Ag1 101.15(14) . . ?
N15 Ag4 Ag1 88.96(10) . . ?
Ag3 Ag4 Ag1 108.347(15) . . ?
N5 Ag5 N13 167.86(14) . . ?
C2 N1 C3 109.6(4) . . ?
C2 N1 H1 125.2 . . ?
C3 N1 H1 125.2 . . ?
C11 N2 C10 109.6(4) . . ?
C11 N2 H2 125.2 . . ?
C10 N2 H2 125.2 . . ?
C17 N3 C21 118.5(4) . . ?
C17 N3 Ag1 113.6(3) . . ?
C21 N3 Ag1 125.7(3) . . ?
C21 N4 C23 119.6(4) . . ?
C21 N4 C22 117.8(4) . . ?
C23 N4 C22 116.8(4) . . ?
C23 N5 C27 119.8(4) . . ?
C23 N5 Ag5 124.9(3) . . ?
C27 N5 Ag5 114.0(3) . . ?
C29 N6 C27 120.4(4) . . ?
C29 N6 C28 119.2(4) . . ?
C27 N6 C28 112.2(4) . . ?
C33 N7 C29 118.7(4) . . ?
C33 N7 Ag2 110.7(3) . . ?
C29 N7 Ag2 129.3(3) . . ?
C35 N8 C33 118.8(4) . . ?
C35 N8 C34 121.7(4) . . ?
C33 N8 C34 117.2(4) . . ?
C39 N9 C35 119.6(4) . . ?
C39 N10 C41 120.3(4) . . ?
C39 N10 C40 121.1(5) . . ?
C41 N10 C40 117.6(5) . . ?
C41 N11 C45 118.7(4) . . ?
C41 N11 Ag3 115.4(3) . . ?
C45 N11 Ag3 124.4(3) . . ?
C45 N12 C47 119.1(4) . . ?
C45 N12 C46 117.8(4) . . ?
C47 N12 C46 116.3(4) . . ?
C51 N13 C47 119.7(4) . . ?
C51 N13 Ag5 114.8(3) . . ?
C47 N13 Ag5 123.5(3) . . ?
C53 N14 C51 120.2(4) . . ?
C53 N14 C52 118.8(4) . . ?
C51 N14 C52 114.1(4) . . ?
C57 N15 C53 118.9(4) . . ?
C57 N15 Ag4 108.4(3) . . ?
C53 N15 Ag4 131.0(3) . . ?
C59 N16 C57 118.7(4) . . ?
C59 N16 C58 121.6(4) . . ?
C57 N16 C58 116.9(4) . . ?
C63 N17 C59 118.9(4) . . ?
C63 N18 C17 118.3(4) . . ?
C63 N18 C64 122.3(5) . . ?
C17 N18 C64 119.1(5) . . ?
C2 C1 C8 105.5(4) . . ?
C2 C1 Ag1 130.0(4) . . ?
C8 C1 Ag1 109.4(3) . . ?
C2 C1 Ag2 113.9(4) . . ?
C8 C1 Ag2 117.1(3) . . ?
Ag1 C1 Ag2 80.03(15) . . ?
N1 C2 C1 110.0(4) . . ?
N1 C2 C10 118.2(4) . . ?
C1 C2 C10 131.8(4) . . ?
N1 C3 C4 129.9(5) . . ?
N1 C3 C8 107.4(4) . . ?
C4 C3 C8 122.7(5) . . ?
C3 C4 C5 117.6(5) . . ?
C3 C4 H4 121.2 . . ?
C5 C4 H4 121.2 . . ?
C4 C5 C6 120.6(6) . . ?
C4 C5 H5 119.7 . . ?
C6 C5 H5 119.7 . . ?
C7 C6 C5 121.4(5) . . ?
C7 C6 H6 119.3 . . ?
C5 C6 H6 119.3 . . ?
C6 C7 C8 119.0(5) . . ?
C6 C7 H7 120.5 . . ?
C8 C7 H7 120.5 . . ?
C7 C8 C3 118.7(5) . . ?
C7 C8 C1 133.8(5) . . ?
C3 C8 C1 107.5(4) . . ?
C10 C9 C16 104.7(4) . . ?
C10 C9 Ag3 129.9(4) . . ?
C16 C9 Ag3 108.5(3) . . ?
C10 C9 Ag4 114.9(3) . . ?
C16 C9 Ag4 118.2(3) . . ?
Ag3 C9 Ag4 80.15(15) . . ?
N2 C10 C9 110.1(4) . . ?
N2 C10 C2 117.3(4) . . ?
C9 C10 C2 132.6(4) . . ?
N2 C11 C12 129.5(5) . . ?
N2 C11 C16 107.5(4) . . ?
C12 C11 C16 123.0(5) . . ?
C13 C12 C11 117.3(5) . . ?
C13 C12 H12 121.3 . . ?
C11 C12 H12 121.3 . . ?
C12 C13 C14 121.2(5) . . ?
C12 C13 H13 119.4 . . ?
C14 C13 H13 119.4 . . ?
C15 C14 C13 120.8(6) . . ?
C15 C14 H14 119.6 . . ?
C13 C14 H14 119.6 . . ?
C14 C15 C16 119.8(5) . . ?
C14 C15 H15 120.1 . . ?
C16 C15 H15 120.1 . . ?
C15 C16 C11 117.8(5) . . ?
C15 C16 C9 134.2(5) . . ?
C11 C16 C9 108.0(4) . . ?
N3 C17 C18 123.2(5) . . ?
N3 C17 N18 116.4(5) . . ?
C18 C17 N18 120.4(5) . . ?
C17 C18 C19 117.5(5) . . ?
C17 C18 H18 121.3 . . ?
C19 C18 H18 121.3 . . ?
C20 C19 C18 120.6(5) . . ?
C20 C19 H19 119.7 . . ?
C18 C19 H19 119.7 . . ?
C19 C20 C21 118.3(5) . . ?
C19 C20 H20 120.8 . . ?
C21 C20 H20 120.8 . . ?
N3 C21 C20 121.8(5) . . ?
N3 C21 N4 116.1(4) . . ?
C20 C21 N4 122.1(5) . . ?
N4 C22 H22A 109.5 . . ?
N4 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
N4 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
N5 C23 C24 120.8(4) . . ?
N5 C23 N4 115.5(4) . . ?
C24 C23 N4 123.7(4) . . ?
C25 C24 C23 118.8(4) . . ?
C25 C24 H24 120.6 . . ?
C23 C24 H24 120.6 . . ?
C24 C25 C26 120.4(4) . . ?
C24 C25 H25 119.8 . . ?
C26 C25 H25 119.8 . . ?
C27 C26 C25 117.7(4) . . ?
C27 C26 H26 121.2 . . ?
C25 C26 H26 121.2 . . ?
N5 C27 C26 122.4(4) . . ?
N5 C27 N6 114.4(4) . . ?
C26 C27 N6 123.1(4) . . ?
N6 C28 H28A 109.5 . . ?
N6 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N6 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
N7 C29 N6 117.2(4) . . ?
N7 C29 C30 120.7(4) . . ?
N6 C29 C30 122.1(4) . . ?
C31 C30 C29 118.5(5) . . ?
C31 C30 H30 120.8 . . ?
C29 C30 H30 120.8 . . ?
C30 C31 C32 120.9(5) . . ?
C30 C31 H31 119.5 . . ?
C32 C31 H31 119.5 . . ?
C33 C32 C31 117.1(5) . . ?
C33 C32 H32 121.5 . . ?
C31 C32 H32 121.5 . . ?
N7 C33 C32 123.8(5) . . ?
N7 C33 N8 114.5(4) . . ?
C32 C33 N8 121.7(4) . . ?
N8 C34 H34A 109.5 . . ?
N8 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
N8 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
N9 C35 N8 114.9(4) . . ?
N9 C35 C36 122.4(5) . . ?
N8 C35 C36 122.6(5) . . ?
C37 C36 C35 117.4(5) . . ?
C37 C36 H36 121.3 . . ?
C35 C36 H36 121.3 . . ?
C36 C37 C38 121.2(5) . . ?
C36 C37 H37 119.4 . . ?
C38 C37 H37 119.4 . . ?
C37 C38 C39 117.0(5) . . ?
C37 C38 H38 121.5 . . ?
C39 C38 H38 121.5 . . ?
N9 C39 N10 115.1(4) . . ?
N9 C39 C38 122.4(5) . . ?
N10 C39 C38 122.5(5) . . ?
N10 C40 H40A 109.5 . . ?
N10 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
N10 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
N11 C41 C42 122.8(5) . . ?
N11 C41 N10 116.0(5) . . ?
C42 C41 N10 121.1(5) . . ?
C41 C42 C43 118.4(5) . . ?
C41 C42 H42 120.8 . . ?
C43 C42 H42 120.8 . . ?
C44 C43 C42 120.3(5) . . ?
C44 C43 H43 119.8 . . ?
C42 C43 H43 119.8 . . ?
C43 C44 C45 118.0(5) . . ?
C43 C44 H44 121.0 . . ?
C45 C44 H44 121.0 . . ?
N11 C45 N12 116.3(4) . . ?
N11 C45 C44 121.5(4) . . ?
N12 C45 C44 122.2(4) . . ?
N12 C46 H46A 109.5 . . ?
N12 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
N12 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
N13 C47 C48 121.0(4) . . ?
N13 C47 N12 115.5(4) . . ?
C48 C47 N12 123.4(4) . . ?
C47 C48 C49 118.9(4) . . ?
C47 C48 H48 120.6 . . ?
C49 C48 H48 120.6 . . ?
C48 C49 C50 120.5(4) . . ?
C48 C49 H49 119.8 . . ?
C50 C49 H49 119.8 . . ?
C49 C50 C51 117.1(5) . . ?
C49 C50 H50 121.4 . . ?
C51 C50 H50 121.4 . . ?
N13 C51 C50 122.7(4) . . ?
N13 C51 N14 114.3(4) . . ?
C50 C51 N14 122.9(4) . . ?
N14 C52 H52A 109.5 . . ?
N14 C52 H52B 109.5 . . ?
H52A C52 H52B 109.5 . . ?
N14 C52 H52C 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
N15 C53 N14 116.8(4) . . ?
N15 C53 C54 121.0(4) . . ?
N14 C53 C54 122.1(4) . . ?
C55 C54 C53 119.0(5) . . ?
C55 C54 H54 120.5 . . ?
C53 C54 H54 120.5 . . ?
C54 C55 C56 120.1(5) . . ?
C54 C55 H55 119.9 . . ?
C56 C55 H55 119.9 . . ?
C57 C56 C55 118.6(5) . . ?
C57 C56 H56 120.7 . . ?
C55 C56 H56 120.7 . . ?
N15 C57 C56 122.2(4) . . ?
N15 C57 N16 114.5(4) . . ?
C56 C57 N16 123.3(5) . . ?
N16 C58 H58A 109.5 . . ?
N16 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
N16 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
N17 C59 N16 114.6(4) . . ?
N17 C59 C60 122.9(5) . . ?
N16 C59 C60 122.3(5) . . ?
C61 C60 C59 116.7(5) . . ?
C61 C60 H60 121.7 . . ?
C59 C60 H60 121.7 . . ?
C60 C61 C62 121.9(5) . . ?
C60 C61 H61 119.0 . . ?
C62 C61 H61 119.0 . . ?
C61 C62 C63 116.7(6) . . ?
C61 C62 H62 121.7 . . ?
C63 C62 H62 121.7 . . ?
N17 C63 N18 114.3(5) . . ?
N17 C63 C62 122.9(5) . . ?
N18 C63 C62 122.8(5) . . ?
N18 C64 H64A 109.5 . . ?
N18 C64 H64B 109.5 . . ?
H64A C64 H64B 109.5 . . ?
N18 C64 H64C 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
O1 S1 O3 116.2(3) . . ?
O1 S1 O2 113.7(3) . . ?
O3 S1 O2 114.5(3) . . ?
O1 S1 C65 103.4(3) . . ?
O3 S1 C65 103.9(3) . . ?
O2 S1 C65 102.7(3) . . ?
F3 C65 F1 106.3(6) . . ?
F3 C65 F2 108.8(6) . . ?
F1 C65 F2 108.2(6) . . ?
F3 C65 S1 110.8(5) . . ?
F1 C65 S1 111.9(4) . . ?
F2 C65 S1 110.6(4) . . ?
O4 S2 O5 115.0(4) . . ?
O4 S2 O6 116.3(5) . . ?
O5 S2 O6 112.5(3) . . ?
O4 S2 C66 104.6(3) . . ?
O5 S2 C66 104.3(3) . . ?
O6 S2 C66 102.0(3) . . ?
F6 C66 F5 110.1(5) . . ?
F6 C66 F4 106.7(6) . . ?
F5 C66 F4 105.1(5) . . ?
F6 C66 S2 111.7(4) . . ?
F5 C66 S2 113.3(4) . . ?
F4 C66 S2 109.5(4) . . ?
O8 S3 O9 116.6(4) . . ?
O8 S3 O7 114.9(4) . . ?
O9 S3 O7 112.6(3) . . ?
O8 S3 C67 105.6(4) . . ?
O9 S3 C67 103.8(3) . . ?
O7 S3 C67 101.0(4) . . ?
F7 C67 F8 108.8(7) . . ?
F7 C67 F9 108.7(6) . . ?
F8 C67 F9 107.5(6) . . ?
F7 C67 S3 110.9(5) . . ?
F8 C67 S3 111.6(5) . . ?
F9 C67 S3 109.3(5) . . ?
C70 O11 C71 112.8(9) . . ?
C70 C69 H69A 109.5 . . ?
C70 C69 H69B 109.5 . . ?
H69A C69 H69B 109.5 . . ?
C70 C69 H69C 109.5 . . ?
H69A C69 H69C 109.5 . . ?
H69B C69 H69C 109.5 . . ?
O11 C70 C69 108.4(10) . . ?
O11 C70 H70A 110.0 . . ?
C69 C70 H70A 110.0 . . ?
O11 C70 H70B 110.0 . . ?
C69 C70 H70B 110.0 . . ?
H70A C70 H70B 108.4 . . ?
O11 C71 C72 109.5(7) . . ?
O11 C71 H71A 109.8 . . ?
C72 C71 H71A 109.8 . . ?
O11 C71 H71B 109.8 . . ?
C72 C71 H71B 109.8 . . ?
H71A C71 H71B 108.2 . . ?
C71 C72 H72A 109.5 . . ?
C71 C72 H72B 109.5 . . ?
H72A C72 H72B 109.5 . . ?
C71 C72 H72C 109.5 . . ?
H72A C72 H72C 109.5 . . ?
H72B C72 H72C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N3 Ag1 Ag2 C1 152.2(2) . . . . ?
Ag4 Ag1 Ag2 C1 -97.74(18) . . . . ?
C1 Ag1 Ag2 N7 -142.2(3) . . . . ?
N3 Ag1 Ag2 N7 10.1(3) . . . . ?
Ag4 Ag1 Ag2 N7 120.1(2) . . . . ?
C1 Ag1 Ag2 Ag3 90.66(18) . . . . ?
N3 Ag1 Ag2 Ag3 -117.13(17) . . . . ?
Ag4 Ag1 Ag2 Ag3 -7.074(13) . . . . ?
C1 Ag2 Ag3 C9 9.03(17) . . . . ?
N7 Ag2 Ag3 C9 159.23(16) . . . . ?
Ag1 Ag2 Ag3 C9 -42.61(12) . . . . ?
C1 Ag2 Ag3 N11 -161.00(18) . . . . ?
N7 Ag2 Ag3 N11 -10.80(15) . . . . ?
Ag1 Ag2 Ag3 N11 147.36(12) . . . . ?
C1 Ag2 Ag3 Ag4 59.71(13) . . . . ?
N7 Ag2 Ag3 Ag4 -150.08(10) . . . . ?
Ag1 Ag2 Ag3 Ag4 8.074(14) . . . . ?
N11 Ag3 Ag4 C9 150.8(2) . . . . ?
Ag2 Ag3 Ag4 C9 -96.04(18) . . . . ?
C9 Ag3 Ag4 N15 -146.9(3) . . . . ?
N11 Ag3 Ag4 N15 4.0(3) . . . . ?
Ag2 Ag3 Ag4 N15 117.1(2) . . . . ?
C9 Ag3 Ag4 Ag1 89.09(18) . . . . ?
N11 Ag3 Ag4 Ag1 -120.10(16) . . . . ?
Ag2 Ag3 Ag4 Ag1 -6.952(12) . . . . ?
C1 Ag1 Ag4 C9 8.51(18) . . . . ?
N3 Ag1 Ag4 C9 -162.31(18) . . . . ?
Ag2 Ag1 Ag4 C9 58.60(13) . . . . ?
C1 Ag1 Ag4 N15 161.46(16) . . . . ?
N3 Ag1 Ag4 N15 -9.37(16) . . . . ?
Ag2 Ag1 Ag4 N15 -148.45(10) . . . . ?
C1 Ag1 Ag4 Ag3 -42.19(13) . . . . ?
N3 Ag1 Ag4 Ag3 146.99(13) . . . . ?
Ag2 Ag1 Ag4 Ag3 7.900(14) . . . . ?
C1 Ag1 N3 C17 -50.2(6) . . . . ?
Ag2 Ag1 N3 C17 -161.7(3) . . . . ?
Ag4 Ag1 N3 C17 105.5(3) . . . . ?
C1 Ag1 N3 C21 146.9(4) . . . . ?
Ag2 Ag1 N3 C21 35.4(5) . . . . ?
Ag4 Ag1 N3 C21 -57.4(4) . . . . ?
N13 Ag5 N5 C23 -81.7(8) . . . . ?
N13 Ag5 N5 C27 85.5(8) . . . . ?
C1 Ag2 N7 C33 41.3(5) . . . . ?
Ag1 Ag2 N7 C33 157.6(2) . . . . ?
Ag3 Ag2 N7 C33 -70.9(3) . . . . ?
C1 Ag2 N7 C29 -151.7(4) . . . . ?
Ag1 Ag2 N7 C29 -35.4(5) . . . . ?
Ag3 Ag2 N7 C29 96.1(4) . . . . ?
C9 Ag3 N11 C41 -46.5(6) . . . . ?
Ag4 Ag3 N11 C41 -156.2(3) . . . . ?
Ag2 Ag3 N11 C41 108.0(3) . . . . ?
C9 Ag3 N11 C45 147.4(4) . . . . ?
Ag4 Ag3 N11 C45 37.7(4) . . . . ?
Ag2 Ag3 N11 C45 -58.0(4) . . . . ?
N5 Ag5 N13 C51 83.2(8) . . . . ?
N5 Ag5 N13 C47 -81.0(8) . . . . ?
C9 Ag4 N15 C57 41.9(5) . . . . ?
Ag3 Ag4 N15 C57 162.1(2) . . . . ?
Ag1 Ag4 N15 C57 -69.8(3) . . . . ?
C9 Ag4 N15 C53 -153.6(4) . . . . ?
Ag3 Ag4 N15 C53 -33.4(5) . . . . ?
Ag1 Ag4 N15 C53 94.8(4) . . . . ?
N3 Ag1 C1 C2 115.3(6) . . . . ?
Ag2 Ag1 C1 C2 -113.0(5) . . . . ?
Ag4 Ag1 C1 C2 -43.2(5) . . . . ?
N3 Ag1 C1 C8 -16.4(6) . . . . ?
Ag2 Ag1 C1 C8 115.3(4) . . . . ?
Ag4 Ag1 C1 C8 -174.9(3) . . . . ?
N3 Ag1 C1 Ag2 -131.7(4) . . . . ?
Ag4 Ag1 C1 Ag2 69.77(11) . . . . ?
N7 Ag2 C1 C2 -83.8(5) . . . . ?
Ag1 Ag2 C1 C2 129.5(4) . . . . ?
Ag3 Ag2 C1 C2 24.3(4) . . . . ?
N7 Ag2 C1 C8 39.9(5) . . . . ?
Ag1 Ag2 C1 C8 -106.8(4) . . . . ?
Ag3 Ag2 C1 C8 148.1(3) . . . . ?
N7 Ag2 C1 Ag1 146.8(2) . . . . ?
Ag3 Ag2 C1 Ag1 -105.12(11) . . . . ?
C3 N1 C2 C1 0.2(6) . . . . ?
C3 N1 C2 C10 178.6(5) . . . . ?
C8 C1 C2 N1 -0.2(6) . . . . ?
Ag1 C1 C2 N1 -133.2(4) . . . . ?
Ag2 C1 C2 N1 129.6(4) . . . . ?
C8 C1 C2 C10 -178.2(5) . . . . ?
Ag1 C1 C2 C10 48.7(8) . . . . ?
Ag2 C1 C2 C10 -48.4(7) . . . . ?
C2 N1 C3 C4 -177.7(6) . . . . ?
C2 N1 C3 C8 -0.2(6) . . . . ?
N1 C3 C4 C5 177.8(6) . . . . ?
C8 C3 C4 C5 0.6(10) . . . . ?
C3 C4 C5 C6 1.3(11) . . . . ?
C4 C5 C6 C7 -2.1(12) . . . . ?
C5 C6 C7 C8 0.9(11) . . . . ?
C6 C7 C8 C3 0.9(9) . . . . ?
C6 C7 C8 C1 -178.5(6) . . . . ?
N1 C3 C8 C7 -179.5(5) . . . . ?
C4 C3 C8 C7 -1.7(9) . . . . ?
N1 C3 C8 C1 0.0(6) . . . . ?
C4 C3 C8 C1 177.8(5) . . . . ?
C2 C1 C8 C7 179.6(6) . . . . ?
Ag1 C1 C8 C7 -36.9(7) . . . . ?
Ag2 C1 C8 C7 51.6(8) . . . . ?
C2 C1 C8 C3 0.1(6) . . . . ?
Ag1 C1 C8 C3 143.7(4) . . . . ?
Ag2 C1 C8 C3 -127.8(4) . . . . ?
N11 Ag3 C9 C10 114.7(5) . . . . ?
Ag4 Ag3 C9 C10 -114.4(5) . . . . ?
Ag2 Ag3 C9 C10 -43.1(4) . . . . ?
N11 Ag3 C9 C16 -14.3(6) . . . . ?
Ag4 Ag3 C9 C16 116.6(4) . . . . ?
Ag2 Ag3 C9 C16 -172.1(3) . . . . ?
N11 Ag3 C9 Ag4 -130.9(3) . . . . ?
Ag2 Ag3 C9 Ag4 71.28(11) . . . . ?
N15 Ag4 C9 C10 -83.8(5) . . . . ?
Ag3 Ag4 C9 C10 129.6(4) . . . . ?
Ag1 Ag4 C9 C10 24.9(4) . . . . ?
N15 Ag4 C9 C16 40.7(6) . . . . ?
Ag3 Ag4 C9 C16 -105.8(4) . . . . ?
Ag1 Ag4 C9 C16 149.5(3) . . . . ?
N15 Ag4 C9 Ag3 146.6(3) . . . . ?
Ag1 Ag4 C9 Ag3 -104.69(11) . . . . ?
C11 N2 C10 C9 -1.4(6) . . . . ?
C11 N2 C10 C2 -179.2(4) . . . . ?
C16 C9 C10 N2 1.6(6) . . . . ?
Ag3 C9 C10 N2 -128.8(4) . . . . ?
Ag4 C9 C10 N2 133.0(4) . . . . ?
C16 C9 C10 C2 179.0(5) . . . . ?
Ag3 C9 C10 C2 48.6(8) . . . . ?
Ag4 C9 C10 C2 -49.6(7) . . . . ?
N1 C2 C10 N2 16.0(7) . . . . ?
C1 C2 C10 N2 -166.1(5) . . . . ?
N1 C2 C10 C9 -161.2(5) . . . . ?
C1 C2 C10 C9 16.7(10) . . . . ?
C10 N2 C11 C12 179.1(6) . . . . ?
C10 N2 C11 C16 0.5(6) . . . . ?
N2 C11 C12 C13 -179.1(6) . . . . ?
C16 C11 C12 C13 -0.8(9) . . . . ?
C11 C12 C13 C14 1.1(10) . . . . ?
C12 C13 C14 C15 -1.1(11) . . . . ?
C13 C14 C15 C16 0.6(10) . . . . ?
C14 C15 C16 C11 -0.2(8) . . . . ?
C14 C15 C16 C9 177.8(6) . . . . ?
N2 C11 C16 C15 179.0(5) . . . . ?
C12 C11 C16 C15 0.3(8) . . . . ?
N2 C11 C16 C9 0.5(6) . . . . ?
C12 C11 C16 C9 -178.2(5) . . . . ?
C10 C9 C16 C15 -179.4(6) . . . . ?
Ag3 C9 C16 C15 -37.4(7) . . . . ?
Ag4 C9 C16 C15 51.1(7) . . . . ?
C10 C9 C16 C11 -1.3(5) . . . . ?
Ag3 C9 C16 C11 140.7(4) . . . . ?
Ag4 C9 C16 C11 -130.8(4) . . . . ?
C21 N3 C17 C18 2.3(8) . . . . ?
Ag1 N3 C17 C18 -161.9(4) . . . . ?
C21 N3 C17 N18 -176.9(4) . . . . ?
Ag1 N3 C17 N18 18.9(6) . . . . ?
C63 N18 C17 N3 -78.1(6) . . . . ?
C64 N18 C17 N3 108.4(6) . . . . ?
C63 N18 C17 C18 102.7(6) . . . . ?
C64 N18 C17 C18 -70.8(8) . . . . ?
N3 C17 C18 C19 0.7(9) . . . . ?
N18 C17 C18 C19 179.8(5) . . . . ?
C17 C18 C19 C20 -2.5(9) . . . . ?
C18 C19 C20 C21 1.4(9) . . . . ?
C17 N3 C21 C20 -3.5(7) . . . . ?
Ag1 N3 C21 C20 158.6(4) . . . . ?
C17 N3 C21 N4 177.0(4) . . . . ?
Ag1 N3 C21 N4 -20.8(6) . . . . ?
C19 C20 C21 N3 1.7(8) . . . . ?
C19 C20 C21 N4 -178.9(5) . . . . ?
C23 N4 C21 N3 -40.1(6) . . . . ?
C22 N4 C21 N3 167.7(4) . . . . ?
C23 N4 C21 C20 140.5(5) . . . . ?
C22 N4 C21 C20 -11.8(7) . . . . ?
C27 N5 C23 C24 -3.8(6) . . . . ?
Ag5 N5 C23 C24 162.7(3) . . . . ?
C27 N5 C23 N4 175.0(4) . . . . ?
Ag5 N5 C23 N4 -18.5(5) . . . . ?
C21 N4 C23 N5 147.0(4) . . . . ?
C22 N4 C23 N5 -60.4(5) . . . . ?
C21 N4 C23 C24 -34.2(6) . . . . ?
C22 N4 C23 C24 118.4(5) . . . . ?
N5 C23 C24 C25 1.8(7) . . . . ?
N4 C23 C24 C25 -177.0(4) . . . . ?
C23 C24 C25 C26 0.3(7) . . . . ?
C24 C25 C26 C27 -0.4(7) . . . . ?
C23 N5 C27 C26 3.8(6) . . . . ?
Ag5 N5 C27 C26 -164.1(3) . . . . ?
C23 N5 C27 N6 -172.9(4) . . . . ?
Ag5 N5 C27 N6 19.3(5) . . . . ?
C25 C26 C27 N5 -1.7(7) . . . . ?
C25 C26 C27 N6 174.7(4) . . . . ?
C29 N6 C27 N5 -127.5(4) . . . . ?
C28 N6 C27 N5 84.4(5) . . . . ?
C29 N6 C27 C26 55.9(6) . . . . ?
C28 N6 C27 C26 -92.3(5) . . . . ?
C33 N7 C29 N6 -177.0(4) . . . . ?
Ag2 N7 C29 N6 16.9(6) . . . . ?
C33 N7 C29 C30 6.0(6) . . . . ?
Ag2 N7 C29 C30 -160.1(3) . . . . ?
C27 N6 C29 N7 30.7(6) . . . . ?
C28 N6 C29 N7 176.8(4) . . . . ?
C27 N6 C29 C30 -152.2(4) . . . . ?
C28 N6 C29 C30 -6.2(6) . . . . ?
N7 C29 C30 C31 -3.3(7) . . . . ?
N6 C29 C30 C31 179.8(4) . . . . ?
C29 C30 C31 C32 -2.0(8) . . . . ?
C30 C31 C32 C33 4.2(8) . . . . ?
C29 N7 C33 C32 -3.6(7) . . . . ?
Ag2 N7 C33 C32 164.9(4) . . . . ?
C29 N7 C33 N8 175.0(4) . . . . ?
Ag2 N7 C33 N8 -16.5(5) . . . . ?
C31 C32 C33 N7 -1.5(8) . . . . ?
C31 C32 C33 N8 180.0(5) . . . . ?
C35 N8 C33 N7 115.2(5) . . . . ?
C34 N8 C33 N7 -81.9(6) . . . . ?
C35 N8 C33 C32 -66.2(7) . . . . ?
C34 N8 C33 C32 96.7(6) . . . . ?
C39 N9 C35 N8 -177.0(5) . . . . ?
C39 N9 C35 C36 0.2(8) . . . . ?
C33 N8 C35 N9 -13.6(7) . . . . ?
C34 N8 C35 N9 -175.7(5) . . . . ?
C33 N8 C35 C36 169.2(5) . . . . ?
C34 N8 C35 C36 7.1(8) . . . . ?
N9 C35 C36 C37 -2.1(9) . . . . ?
N8 C35 C36 C37 174.9(6) . . . . ?
C35 C36 C37 C38 2.5(10) . . . . ?
C36 C37 C38 C39 -1.1(10) . . . . ?
C35 N9 C39 N10 179.4(5) . . . . ?
C35 N9 C39 C38 1.4(8) . . . . ?
C41 N10 C39 N9 6.2(7) . . . . ?
C40 N10 C39 N9 174.1(5) . . . . ?
C41 N10 C39 C38 -175.9(5) . . . . ?
C40 N10 C39 C38 -7.9(9) . . . . ?
C37 C38 C39 N9 -0.9(9) . . . . ?
C37 C38 C39 N10 -178.7(6) . . . . ?
C45 N11 C41 C42 1.3(7) . . . . ?
Ag3 N11 C41 C42 -165.5(4) . . . . ?
C45 N11 C41 N10 -176.7(4) . . . . ?
Ag3 N11 C41 N10 16.4(5) . . . . ?
C39 N10 C41 N11 -72.9(6) . . . . ?
C40 N10 C41 N11 118.8(6) . . . . ?
C39 N10 C41 C42 109.0(6) . . . . ?
C40 N10 C41 C42 -59.3(7) . . . . ?
N11 C41 C42 C43 2.4(8) . . . . ?
N10 C41 C42 C43 -179.6(5) . . . . ?
C41 C42 C43 C44 -3.8(8) . . . . ?
C42 C43 C44 C45 1.5(8) . . . . ?
C41 N11 C45 N12 176.3(4) . . . . ?
Ag3 N11 C45 N12 -18.0(5) . . . . ?
C41 N11 C45 C44 -3.7(7) . . . . ?
Ag3 N11 C45 C44 161.9(3) . . . . ?
C47 N12 C45 N11 -44.9(6) . . . . ?
C46 N12 C45 N11 165.0(4) . . . . ?
C47 N12 C45 C44 135.2(5) . . . . ?
C46 N12 C45 C44 -14.9(6) . . . . ?
C43 C44 C45 N11 2.3(7) . . . . ?
C43 C44 C45 N12 -177.8(4) . . . . ?
C51 N13 C47 C48 -1.7(6) . . . . ?
Ag5 N13 C47 C48 161.8(3) . . . . ?
C51 N13 C47 N12 176.1(4) . . . . ?
Ag5 N13 C47 N12 -20.5(5) . . . . ?
C45 N12 C47 N13 151.8(4) . . . . ?
C46 N12 C47 N13 -57.7(5) . . . . ?
C45 N12 C47 C48 -30.5(6) . . . . ?
C46 N12 C47 C48 120.0(5) . . . . ?
N13 C47 C48 C49 0.2(7) . . . . ?
N12 C47 C48 C49 -177.4(4) . . . . ?
C47 C48 C49 C50 0.9(7) . . . . ?
C48 C49 C50 C51 -0.6(7) . . . . ?
C47 N13 C51 C50 2.1(6) . . . . ?
Ag5 N13 C51 C50 -162.7(3) . . . . ?
C47 N13 C51 N14 -174.3(4) . . . . ?
Ag5 N13 C51 N14 20.9(4) . . . . ?
C49 C50 C51 N13 -1.0(7) . . . . ?
C49 C50 C51 N14 175.2(4) . . . . ?
C53 N14 C51 N13 -126.6(4) . . . . ?
C52 N14 C51 N13 82.8(5) . . . . ?
C53 N14 C51 C50 57.0(6) . . . . ?
C52 N14 C51 C50 -93.6(5) . . . . ?
C57 N15 C53 N14 -178.4(4) . . . . ?
Ag4 N15 C53 N14 18.4(6) . . . . ?
C57 N15 C53 C54 5.1(7) . . . . ?
Ag4 N15 C53 C54 -158.1(3) . . . . ?
C51 N14 C53 N15 29.3(6) . . . . ?
C52 N14 C53 N15 178.5(4) . . . . ?
C51 N14 C53 C54 -154.2(4) . . . . ?
C52 N14 C53 C54 -5.0(7) . . . . ?
N15 C53 C54 C55 -1.9(7) . . . . ?
N14 C53 C54 C55 -178.2(5) . . . . ?
C53 C54 C55 C56 -1.8(8) . . . . ?
C54 C55 C56 C57 2.2(9) . . . . ?
C53 N15 C57 C56 -4.7(7) . . . . ?
Ag4 N15 C57 C56 162.0(4) . . . . ?
C53 N15 C57 N16 174.5(4) . . . . ?
Ag4 N15 C57 N16 -18.8(5) . . . . ?
C55 C56 C57 N15 1.1(8) . . . . ?
C55 C56 C57 N16 -178.1(5) . . . . ?
C59 N16 C57 N15 118.4(5) . . . . ?
C58 N16 C57 N15 -80.1(6) . . . . ?
C59 N16 C57 C56 -62.4(7) . . . . ?
C58 N16 C57 C56 99.2(6) . . . . ?
C63 N17 C59 N16 -177.7(5) . . . . ?
C63 N17 C59 C60 -1.8(8) . . . . ?
C57 N16 C59 N17 -15.7(7) . . . . ?
C58 N16 C59 N17 -176.3(5) . . . . ?
C57 N16 C59 C60 168.4(5) . . . . ?
C58 N16 C59 C60 7.7(8) . . . . ?
N17 C59 C60 C61 0.7(9) . . . . ?
N16 C59 C60 C61 176.3(6) . . . . ?
C59 C60 C61 C62 -0.2(11) . . . . ?
C60 C61 C62 C63 0.7(12) . . . . ?
C59 N17 C63 N18 179.3(5) . . . . ?
C59 N17 C63 C62 2.3(8) . . . . ?
C17 N18 C63 N17 9.4(7) . . . . ?
C64 N18 C63 N17 -177.3(6) . . . . ?
C17 N18 C63 C62 -173.6(6) . . . . ?
C64 N18 C63 C62 -0.3(9) . . . . ?
C61 C62 C63 N17 -1.8(10) . . . . ?
C61 C62 C63 N18 -178.4(6) . . . . ?
O1 S1 C65 F3 -178.8(5) . . . . ?
O3 S1 C65 F3 59.4(6) . . . . ?
O2 S1 C65 F3 -60.3(6) . . . . ?
O1 S1 C65 F1 62.7(5) . . . . ?
O3 S1 C65 F1 -59.1(5) . . . . ?
O2 S1 C65 F1 -178.7(5) . . . . ?
O1 S1 C65 F2 -58.1(6) . . . . ?
O3 S1 C65 F2 -179.9(5) . . . . ?
O2 S1 C65 F2 60.5(6) . . . . ?
O4 S2 C66 F6 167.5(6) . . . . ?
O5 S2 C66 F6 46.4(6) . . . . ?
O6 S2 C66 F6 -70.9(6) . . . . ?
O4 S2 C66 F5 -67.4(6) . . . . ?
O5 S2 C66 F5 171.5(5) . . . . ?
O6 S2 C66 F5 54.2(5) . . . . ?
O4 S2 C66 F4 49.6(6) . . . . ?
O5 S2 C66 F4 -71.6(5) . . . . ?
O6 S2 C66 F4 171.1(5) . . . . ?
O8 S3 C67 F7 -175.7(5) . . . . ?
O9 S3 C67 F7 61.1(6) . . . . ?
O7 S3 C67 F7 -55.7(6) . . . . ?
O8 S3 C67 F8 -54.2(7) . . . . ?
O9 S3 C67 F8 -177.4(6) . . . . ?
O7 S3 C67 F8 65.8(6) . . . . ?
O8 S3 C67 F9 64.6(6) . . . . ?
O9 S3 C67 F9 -58.7(5) . . . . ?
O7 S3 C67 F9 -175.5(5) . . . . ?
C71 O11 C70 C69 -179.8(10) . . . . ?
C70 O11 C71 C72 -179.0(9) . . . . ?

_diffrn_measured_fraction_theta_max 0.999
_diffrn_reflns_theta_full        70.01
_diffrn_measured_fraction_theta_full 0.999
_refine_diff_density_max         1.845
_refine_diff_density_min         -1.779
_refine_diff_density_rms         0.158
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_CCDC4
_database_code_depnum_ccdc_archive 'CCDC 1558958'

_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;
_audit_creation_date             2017-06-06
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.03.28 svn.r3405 for OlexSys, GUI svn.r5337)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ? 
;
_chemical_formula_moiety         
'C58 H54 Ag5 F3 N17 O3 S, 0.5(C Cl3), C H Cl3, 3(C F3 O3 S), 0.75(O), 0.5(C O)'
_chemical_formula_sum            'C63 H55 Ag5 Cl4.50 F12 N17 O13.25 S4'
_chemical_formula_weight         2317.36
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, -y, -z'

_cell_length_a                   13.189(3)
_cell_length_b                   13.561(3)
_cell_length_c                   28.427(6)
_cell_angle_alpha                103.51(3)
_cell_angle_beta                 90.23(3)
_cell_angle_gamma                118.57(3)
_cell_volume                     4301.6(16)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    13646
_cell_measurement_temperature    173.15(10)
_cell_measurement_theta_max      27.4798
_cell_measurement_theta_min      1.7308
_exptl_absorpt_coefficient_mu    1.447
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5185
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.789
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             2283
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.31
_exptl_crystal_size_min          0.05
_exptl_special_details           
;
 ? 
;
_diffrn_reflns_av_R_equivalents  0.0701
_diffrn_reflns_av_unetI/netI     0.0571
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            52869
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.77
_diffrn_ambient_temperature      173.15(10)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed tube'
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         ?
_reflns_number_gt                13790
_reflns_number_total             15156
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_refine_diff_density_max         1.608
_refine_diff_density_min         -2.364
_refine_diff_density_rms         0.146
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.140
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1169
_refine_ls_number_reflns         15156
_refine_ls_number_restraints     50
_refine_ls_R_factor_all          0.0868
_refine_ls_R_factor_gt           0.0795
_refine_ls_restrained_S_all      1.158
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0757P)²+29.6736P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1949
_refine_ls_wR_factor_ref         0.2003
_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 > 2sigma(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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 S5-F13 = S5-F14 = S5-F15
 2.7 with sigma of 0.03
 S5-C62
 1.68 with sigma of 0.02
 C62-F13 = C62-F14 = C62-F15
 1.4 with sigma of 0.02
 O17-C67
 1.38 with sigma of 0.05
 F13-F14 \\sim F14-F15 \\sim F13-F15
 with sigma of 0.02
 S2-F6 \\sim S2-F4 \\sim S2-F5
 with sigma of 0.02
 F6-F4 \\sim F6-F5 \\sim F4-F5
 with sigma of 0.02
 O6-O5 \\sim O5-O4 \\sim O6-O4
 with sigma of 0.02
 C59-O6 \\sim C59-O5 \\sim C59-O4
 with sigma of 0.02
 Cl8-C65 \\sim Cl9-C65 \\sim Cl7-C65
 with sigma of 0.02
 Cl3-C63 \\sim Cl1-C63 \\sim Cl2-C63
 with sigma of 0.02
 Cl1-Cl2 \\sim Cl1-Cl3 \\sim Cl2-Cl3
 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
Uanis(F5) \\sim Ueq, Uanis(O13) \\sim Ueq, Uanis(O15) \\sim Ueq: with sigma of
0.002 and sigma for terminal atoms of 0.002
4. Others
 Sof(Cl7)=Sof(Cl8)=Sof(Cl9)=Sof(C65)=Sof(H65)=1-FVAR(1)
 Sof(Cl4)=Sof(Cl5)=Sof(Cl6)=Sof(C64)=Sof(H64)=FVAR(1)
 Fixed Sof: Cl1(0.25) Cl2(0.25) Cl3(0.25) C63(0.25) Cl10(0.5) Cl11(0.25)
 C66(0.25) S2(0.75) F4(0.75) F5(0.75) F6(0.75) O4(0.75) O5(0.75) O6(0.75)
 C59(0.75) S4(0.5) F10(0.5) F11(0.5) F12(0.5) O10(0.5) O11(0.5) O12(0.5)
 C61(0.5) S5(0.75) F13(0.75) F14(0.75) F15(0.75) O13(0.75) O14(0.75) O15(0.75)
 C62(0.75) O16(0.25) O17(0.5) C67(0.5) O18(0.25) O19(0.25)
 Fixed Uiso: F15(0.15) C62(0.1)
5.a Ternary CH refined with riding coordinates:
 C64(H64), C65(H65)
5.b Aromatic/amide H refined with riding coordinates:
 N1(H1), C3(H3), C5(H5), C6(H6), C7(H7), C8(H8), C11(H11), C12(H12), C13(H13),
 C17(H17), C18(H18), C19(H19), C23(H23), C24(H24), C25(H25), C29(H29), C30(H30),
  C31(H31), C35(H35), C36(H36), C37(H37), C41(H41), C42(H42), C43(H43),
 C47(H47), C48(H48), C49(H49), C53(H53), C54(H54), C55(H55)
5.c Idealised Me refined as rotating group:
 C15(H15A,H15B,H15C), C21(H21A,H21B,H21C), C27(H27A,H27B,H27C), C33(H33A,H33B,
 H33C), C39(H39A,H39B,H39C), C45(H45A,H45B,H45C), C51(H51A,H51B,H51C), C57(H57A,
 H57B,H57C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Ag1 Ag -0.20944(6) 0.26905(5) 0.29835(2) 0.04138(18) Uani 1 d . . . .
Ag2 Ag -0.33045(6) 0.42368(6) 0.27756(2) 0.04123(18) Uani 1 d . . . .
Ag3 Ag -0.19724(5) 0.48613(5) 0.20485(2) 0.03723(17) Uani 1 d . . . .
Ag4 Ag -0.08125(6) 0.33086(6) 0.22452(3) 0.04633(19) Uani 1 d . . . .
Ag5 Ag -0.41492(5) 0.14263(5) 0.16967(2) 0.03357(16) Uani 1 d . . . .
S3 S -0.63861(18) -0.13329(17) 0.06977(7) 0.0359(5) Uani 1 d . . . .
F7 F -0.8383(5) -0.3271(5) 0.0533(2) 0.0700(18) Uani 1 d . . . .
F8 F -0.8372(5) -0.1818(6) 0.1036(3) 0.077(2) Uani 1 d . . . .
F9 F -0.7515(6) -0.2664(6) 0.1262(2) 0.078(2) Uani 1 d . . . .
O7 O -0.5829(6) -0.0366(5) 0.1128(2) 0.0534(17) Uani 1 d . . . .
O8 O -0.5814(6) -0.2022(6) 0.0568(3) 0.0559(17) Uani 1 d . . . .
O9 O -0.6742(6) -0.1053(6) 0.0296(2) 0.0552(17) Uani 1 d . . . .
N1 N 0.0040(7) 0.4970(7) 0.3259(3) 0.054(2) Uani 1 d . . . .
H1 H 0.0334 0.4560 0.3320 0.065 Uiso 1 calc . . R .
N2 N -0.3136(6) 0.1145(6) 0.3235(2) 0.0368(15) Uani 1 d . . . .
N3 N -0.1933(7) 0.2333(7) 0.3983(3) 0.051(2) Uani 1 d . . . .
N4 N -0.2770(6) 0.3420(6) 0.3868(3) 0.0394(16) Uani 1 d . . . .
N5 N -0.3769(7) 0.4333(6) 0.3724(3) 0.0438(17) Uani 1 d . . . .
N6 N -0.4904(6) 0.2954(6) 0.3007(2) 0.0325(14) Uani 1 d . . . .
N7 N -0.5988(6) 0.1724(5) 0.2256(2) 0.0338(15) Uani 1 d . . . .
N8 N -0.4839(5) 0.2578(5) 0.1691(2) 0.0304(14) Uani 1 d . . . .
N9 N -0.3801(6) 0.3172(5) 0.1051(2) 0.0333(15) Uani 1 d . . . .
N10 N -0.2181(6) 0.5039(6) 0.1312(2) 0.0335(15) Uani 1 d . . . .
N11 N -0.0685(6) 0.6954(6) 0.1636(3) 0.0404(17) Uani 1 d . . . .
N12 N 0.0215(6) 0.5927(6) 0.1771(3) 0.0354(15) Uani 1 d . . . .
N13 N 0.1021(6) 0.4793(6) 0.1845(3) 0.0422(17) Uani 1 d . . . .
N14 N -0.0616(6) 0.3028(6) 0.1466(2) 0.0335(15) Uani 1 d . . . .
N15 N -0.2281(6) 0.1213(6) 0.1152(2) 0.0337(15) Uani 1 d . . . .
N16 N -0.3103(6) 0.0677(5) 0.1842(2) 0.0331(15) Uani 1 d . . . .
N17 N -0.4171(6) 0.0004(6) 0.2462(3) 0.0383(16) Uani 1 d . . . .
C1 C -0.0914(7) 0.4427(7) 0.2924(3) 0.0362(18) Uani 1 d . . . .
C2 C -0.1381(7) 0.5120(7) 0.2806(3) 0.0369(18) Uani 1 d . . . .
C3 C -0.0842(7) 0.6267(7) 0.3055(3) 0.0376(19) Uani 1 d . . . .
H3 H -0.1145 0.6721 0.2987 0.045 Uiso 1 calc . . R .
C4 C 0.0136(8) 0.6804(8) 0.3404(3) 0.051(2) Uani 1 d . . . .
C5 C 0.0655(11) 0.8013(9) 0.3659(4) 0.072(3) Uani 1 d . . . .
H5 H 0.0348 0.8469 0.3599 0.087 Uiso 1 calc . . R .
C6 C 0.1626(11) 0.8474(11) 0.3995(5) 0.083(4) Uani 1 d . . . .
H6 H 0.1994 0.9265 0.4155 0.100 Uiso 1 calc . . R .
C7 C 0.2082(11) 0.7806(12) 0.4106(4) 0.080(4) Uani 1 d . . . .
H7 H 0.2730 0.8146 0.4341 0.097 Uiso 1 calc . . R .
C8 C 0.1579(9) 0.6660(10) 0.3871(4) 0.064(3) Uani 1 d . . . .
H8 H 0.1885 0.6214 0.3945 0.077 Uiso 1 calc . . R .
C9 C 0.0587(8) 0.6133(8) 0.3513(3) 0.048(2) Uani 1 d . . . .
C10 C -0.4079(7) 0.0154(7) 0.2967(3) 0.0346(18) Uani 1 d . . . .
C11 C -0.4911(8) -0.0631(8) 0.3184(3) 0.0399(19) Uani 1 d . . . .
H11 H -0.5561 -0.1297 0.2997 0.048 Uiso 1 calc . . R .
C12 C -0.4745(10) -0.0393(9) 0.3686(4) 0.057(3) Uani 1 d . . . .
H12 H -0.5301 -0.0904 0.3839 0.069 Uiso 1 calc . . R .
C13 C -0.3780(10) 0.0579(9) 0.3965(4) 0.054(3) Uani 1 d . . . .
H13 H -0.3662 0.0730 0.4303 0.065 Uiso 1 calc . . R .
C14 C -0.2997(9) 0.1318(8) 0.3722(3) 0.043(2) Uani 1 d . . . .
C15 C -0.1206(12) 0.2119(11) 0.4294(4) 0.077(4) Uani 1 d . . . .
H15A H -0.1347 0.2290 0.4626 0.115 Uiso 1 calc . . GR .
H15B H -0.0399 0.2610 0.4272 0.115 Uiso 1 calc . . GR .
H15C H -0.1399 0.1316 0.4185 0.115 Uiso 1 calc . . GR .
C16 C -0.1891(9) 0.3404(8) 0.4099(3) 0.048(2) Uani 1 d . . . .
C17 C -0.0956(10) 0.4401(10) 0.4410(4) 0.064(3) Uani 1 d . . . .
H17 H -0.0346 0.4369 0.4557 0.077 Uiso 1 calc . . R .
C18 C -0.0981(11) 0.5414(10) 0.4487(4) 0.073(3) Uani 1 d . . . .
H18 H -0.0362 0.6099 0.4681 0.088 Uiso 1 calc . . R .
C19 C -0.1925(11) 0.5442(9) 0.4280(4) 0.063(3) Uani 1 d . . . .
H19 H -0.1965 0.6127 0.4347 0.075 Uiso 1 calc . . R .
C20 C -0.2805(8) 0.4415(8) 0.3971(3) 0.042(2) Uani 1 d . . . .
C21 C -0.4122(11) 0.5234(10) 0.3909(4) 0.067(3) Uani 1 d . . . .
H21A H -0.4792 0.5063 0.3701 0.100 Uiso 1 calc . . GR .
H21B H -0.3492 0.5988 0.3911 0.100 Uiso 1 calc . . GR .
H21C H -0.4309 0.5230 0.4235 0.100 Uiso 1 calc . . GR .
C22 C -0.4729(7) 0.3202(7) 0.3494(3) 0.0359(18) Uani 1 d . . . .
C23 C -0.5417(9) 0.2462(9) 0.3755(4) 0.054(2) Uani 1 d . . . .
H23 H -0.5272 0.2658 0.4094 0.065 Uiso 1 calc . . R .
C24 C -0.6346(9) 0.1403(9) 0.3492(4) 0.056(3) Uani 1 d . . . .
H24 H -0.6820 0.0863 0.3655 0.067 Uiso 1 calc . . R .
C25 C -0.6566(8) 0.1152(8) 0.3006(4) 0.047(2) Uani 1 d . . . .
H25 H -0.7208 0.0455 0.2833 0.056 Uiso 1 calc . . R .
C26 C -0.5828(7) 0.1942(7) 0.2760(3) 0.0345(18) Uani 1 d . . . .
C27 C -0.7052(8) 0.0671(8) 0.1962(4) 0.050(2) Uani 1 d . . . .
H27A H -0.7112 -0.0012 0.2034 0.074 Uiso 1 calc . . GR .
H27B H -0.7000 0.0612 0.1621 0.074 Uiso 1 calc . . GR .
H27C H -0.7728 0.0734 0.2043 0.074 Uiso 1 calc . . GR .
C28 C -0.5516(7) 0.2651(7) 0.2031(3) 0.0319(17) Uani 1 d . . . .
C29 C -0.5756(7) 0.3561(8) 0.2150(3) 0.0397(19) Uani 1 d . . . .
H29 H -0.6215 0.3606 0.2392 0.048 Uiso 1 calc . . R .
C30 C -0.5291(7) 0.4401(7) 0.1897(3) 0.0375(19) Uani 1 d . . . .
H30 H -0.5413 0.5038 0.1976 0.045 Uiso 1 calc . . R .
C31 C -0.4650(7) 0.4294(7) 0.1530(3) 0.0358(18) Uani 1 d . . . .
H31 H -0.4358 0.4841 0.1350 0.043 Uiso 1 calc . . R .
C32 C -0.4443(6) 0.3366(6) 0.1430(3) 0.0308(17) Uani 1 d . . . .
C33 C -0.4487(9) 0.2116(7) 0.0647(3) 0.048(2) Uani 1 d . . . .
H33A H -0.4970 0.2248 0.0445 0.071 Uiso 1 calc . . GR .
H33B H -0.4969 0.1474 0.0778 0.071 Uiso 1 calc . . GR .
H33C H -0.3969 0.1937 0.0455 0.071 Uiso 1 calc . . GR .
C34 C -0.2946(7) 0.4152(7) 0.0932(3) 0.0320(17) Uani 1 d . . . .
C35 C -0.2838(7) 0.4235(8) 0.0455(3) 0.041(2) Uani 1 d . . . .
H35 H -0.3331 0.3612 0.0194 0.049 Uiso 1 calc . . R .
C36 C -0.1984(9) 0.5261(9) 0.0376(4) 0.055(3) Uani 1 d . . . .
H36 H -0.1894 0.5332 0.0059 0.066 Uiso 1 calc . . R .
C37 C -0.1267(8) 0.6181(8) 0.0766(4) 0.049(2) Uani 1 d . . . .
H37 H -0.0709 0.6886 0.0716 0.058 Uiso 1 calc . . R .
C38 C -0.1388(7) 0.6043(7) 0.1224(3) 0.0349(18) Uani 1 d . . . .
C39 C -0.0696(9) 0.8062(8) 0.1703(4) 0.055(3) Uani 1 d . . . .
H39A H 0.0054 0.8657 0.1663 0.082 Uiso 1 calc . . GR .
H39B H -0.0870 0.8289 0.2024 0.082 Uiso 1 calc . . GR .
H39C H -0.1279 0.7961 0.1464 0.082 Uiso 1 calc . . GR .
C40 C 0.0174(7) 0.6931(7) 0.1913(3) 0.0348(18) Uani 1 d . . . .
C41 C 0.0933(8) 0.7869(7) 0.2301(3) 0.043(2) Uani 1 d . . . .
H41 H 0.0883 0.8547 0.2396 0.052 Uiso 1 calc . . R .
C42 C 0.1769(7) 0.7738(8) 0.2540(4) 0.047(2) Uani 1 d . . . .
H42 H 0.2284 0.8337 0.2803 0.056 Uiso 1 calc . . R .
C43 C 0.1844(7) 0.6741(7) 0.2394(4) 0.044(2) Uani 1 d . . . .
H43 H 0.2410 0.6662 0.2551 0.053 Uiso 1 calc . . R .
C44 C 0.1048(7) 0.5847(7) 0.2004(3) 0.0380(19) Uani 1 d . . . .
C45 C 0.2062(9) 0.4711(9) 0.1962(4) 0.063(3) Uani 1 d . . . .
H45A H 0.1885 0.3913 0.1851 0.094 Uiso 1 calc . . GR .
H45B H 0.2295 0.4986 0.2309 0.094 Uiso 1 calc . . GR .
H45C H 0.2684 0.5179 0.1802 0.094 Uiso 1 calc . . GR .
C46 C 0.0321(7) 0.4009(7) 0.1405(3) 0.0381(19) Uani 1 d . . . .
C47 C 0.0560(8) 0.4174(8) 0.0946(4) 0.050(2) Uani 1 d . . . .
H47 H 0.1197 0.4849 0.0910 0.060 Uiso 1 calc . . R .
C48 C -0.0185(8) 0.3296(9) 0.0543(4) 0.051(2) Uani 1 d . . . .
H48 H -0.0042 0.3385 0.0231 0.062 Uiso 1 calc . . R .
C49 C -0.1129(8) 0.2298(8) 0.0595(3) 0.044(2) Uani 1 d . . . .
H49 H -0.1626 0.1717 0.0324 0.052 Uiso 1 calc . . R .
C50 C -0.1327(7) 0.2176(7) 0.1072(3) 0.0332(17) Uani 1 d . . . .
C51 C -0.3032(8) 0.0228(8) 0.0729(3) 0.047(2) Uani 1 d . . . .
H51A H -0.3345 0.0497 0.0514 0.071 Uiso 1 calc . . GR .
H51B H -0.3658 -0.0368 0.0841 0.071 Uiso 1 calc . . GR .
H51C H -0.2579 -0.0083 0.0557 0.071 Uiso 1 calc . . GR .
C52 C -0.2199(7) 0.0871(7) 0.1584(3) 0.0347(18) Uani 1 d . . . .
C53 C -0.1314(8) 0.0696(8) 0.1713(4) 0.045(2) Uani 1 d . . . .
H53 H -0.0708 0.0827 0.1525 0.054 Uiso 1 calc . . R .
C54 C -0.1330(8) 0.0322(8) 0.2127(3) 0.046(2) Uani 1 d . . . .
H54 H -0.0714 0.0237 0.2232 0.055 Uiso 1 calc . . R .
C55 C -0.2283(8) 0.0072(7) 0.2386(3) 0.041(2) Uani 1 d . . . .
H55 H -0.2327 -0.0213 0.2657 0.050 Uiso 1 calc . . R .
C56 C -0.3151(7) 0.0253(7) 0.2233(3) 0.0362(18) Uani 1 d . . . .
C57 C -0.5275(8) -0.0936(8) 0.2169(3) 0.050(2) Uani 1 d . . . .
H57A H -0.5353 -0.1676 0.2171 0.075 Uiso 1 calc . . GR .
H57B H -0.5280 -0.0875 0.1839 0.075 Uiso 1 calc . . GR .
H57C H -0.5912 -0.0871 0.2305 0.075 Uiso 1 calc . . GR .
C60 C -0.7732(8) -0.2311(8) 0.0891(4) 0.053(2) Uani 1 d . . . .
Cl1 Cl 0.274(2) 0.119(2) 1.0723(9) 0.145(8) Uiso 0.25 d A 2 D .
Cl2 Cl 0.1425(12) 0.1870(12) 1.1182(5) 0.079(3) Uiso 0.25 d A 2 D .
Cl3 Cl 0.2591(17) 0.2844(17) 1.0534(7) 0.120(6) Uiso 0.25 d A 2 D .
C63 C 0.184(8) 0.164(7) 1.066(3) 0.16(4) Uiso 0.25 d A 2 D .
Cl4 Cl 0.4141(7) 0.2798(4) 0.8486(2) 0.0825(17) Uani 0.800(10) d B 1 . .
Cl5 Cl 0.3758(9) 0.3340(12) 0.9470(3) 0.200(6) Uani 0.800(10) d B 1 . .
Cl6 Cl 0.5997(5) 0.4638(5) 0.9216(2) 0.117(3) Uani 0.800(10) d B 1 . .
C64 C 0.4759(15) 0.3269(14) 0.9089(6) 0.067(4) Uani 0.800(10) d B 1 . .
H64 H 0.4975 0.2712 0.9154 0.081 Uiso 0.800(10) calc B 1 R .
Cl7 Cl 0.374(2) 0.262(3) 0.8626(10) 0.090(9) Uiso 0.200(10) d B 2 D .
Cl8 Cl 0.286(2) 0.239(2) 0.9421(9) 0.107(8) Uiso 0.200(10) d B 2 D .
Cl9 Cl 0.4997(19) 0.4434(18) 0.9502(7) 0.093(7) Uiso 0.200(10) d B 2 D .
C65 C 0.413(4) 0.304(4) 0.9224(11) 0.071(18) Uiso 0.200(10) d B 2 D .
H65 H 0.4543 0.2632 0.9286 0.085 Uiso 0.200(10) calc B 2 R .
Cl10 Cl 0.0167(12) 0.1170(10) 0.5200(4) 0.140(4) Uani 0.50 d . . . .
Cl11 Cl 0.0962(13) 0.0727(11) 0.4333(5) 0.075(3) Uani 0.25 d . . . .
C66 C 0.091(4) 0.049(4) 0.4911(16) 0.061(11) Uiso 0.25 d . . . .
S1 S 0.6948(4) 0.7210(3) 0.28602(11) 0.0813(11) Uani 1 d . . . .
F1 F 0.6400(10) 0.7897(8) 0.3711(3) 0.114(3) Uani 1 d . . . .
F2 F 0.8070(9) 0.8000(7) 0.3733(3) 0.113(3) Uani 1 d . . . .
F3 F 0.7819(11) 0.9255(7) 0.3487(3) 0.126(4) Uani 1 d . . . .
O1 O 0.6408(8) 0.6060(7) 0.2925(3) 0.076(2) Uani 1 d . . . .
O2 O 0.8067(13) 0.7581(10) 0.2686(5) 0.139(5) Uani 1 d . . . .
O3 O 0.6207(12) 0.7513(9) 0.2635(4) 0.117(4) Uani 1 d . . . .
C58 C 0.7269(16) 0.8117(11) 0.3474(5) 0.088(5) Uani 1 d . . . .
S2 S 0.1378(5) 0.2954(6) 0.3049(2) 0.0910(15) Uani 0.75 d C 1 D .
F4 F 0.1361(12) 0.1817(14) 0.3646(4) 0.144(6) Uani 0.75 d C 1 D .
F5 F 0.0852(14) 0.0840(12) 0.2897(6) 0.166(6) Uani 0.75 d C 1 D U
F6 F -0.0299(10) 0.1314(10) 0.3288(4) 0.105(4) Uani 0.75 d C 1 D .
O4 O 0.0737(10) 0.2871(11) 0.2668(4) 0.087(4) Uani 0.75 d C 1 D .
O5 O 0.1229(14) 0.3765(15) 0.3540(6) 0.162(8) Uani 0.75 d C 1 D .
O6 O 0.2620(9) 0.3371(13) 0.3079(5) 0.110(5) Uani 0.75 d C 1 D .
C59 C 0.0798(15) 0.178(2) 0.3241(7) 0.098(6) Uani 0.75 d C 1 D .
S4 S 0.5634(5) 0.9002(5) 0.50063(18) 0.0590(13) Uani 0.50 d D 1 . .
F10 F 0.383(2) 0.7110(15) 0.5001(6) 0.128(8) Uani 0.50 d D 1 . .
F11 F 0.4315(16) 0.7114(17) 0.4330(6) 0.124(7) Uani 0.50 d D 1 . .
F12 F 0.503(2) 0.6780(14) 0.4840(5) 0.107(7) Uani 0.50 d D 1 . .
O10 O 0.6593(16) 0.922(2) 0.4747(6) 0.098(6) Uani 0.50 d D 1 . .
O11 O 0.4867(19) 0.940(2) 0.4883(8) 0.106(8) Uani 0.50 d . 1 . .
O12 O 0.5908(15) 0.9169(14) 0.5514(5) 0.079(5) Uani 0.50 d D 1 . .
C61 C 0.481(2) 0.754(3) 0.4803(7) 0.069(7) Uani 0.50 d D 1 . .
S5 S 0.0398(6) 0.0058(6) 1.0672(2) 0.113(2) Uani 0.75 d E 1 D .
F13 F 0.2317(6) 0.0575(7) 1.0528(3) 0.0514(18) Uiso 0.75 d E 1 D .
F14 F 0.1864(17) 0.2203(14) 1.0970(6) 0.188(8) Uiso 0.75 d E 1 D .
F15 F 0.1604(14) 0.1516(13) 1.0103(5) 0.150 Uiso 0.75 d E 1 D .
O13 O 0.044(3) -0.081(3) 1.0311(12) 0.244(12) Uani 0.75 d E 1 . U
O14 O -0.0430(15) 0.0375(18) 1.0601(7) 0.135(6) Uani 0.75 d E 1 . .
O15 O 0.071(2) 0.010(2) 1.1167(9) 0.180(8) Uani 0.75 d E 1 . U
C62 C 0.1653(15) 0.1243(15) 1.0569(6) 0.100 Uiso 0.75 d E 1 D .
O16 O 0.147(3) 0.250(3) 0.2839(10) 0.046(7) Uiso 0.25 d F 2 . .
O17 O 0.380(2) 0.626(2) 0.3172(9) 0.121(8) Uiso 0.50 d . . D .
C67 C 0.4138(19) 0.6560(19) 0.2784(8) 0.057(5) Uiso 0.50 d . . D .
O18 O 0.355(4) 0.581(4) 0.4724(17) 0.111(14) Uiso 0.25 d G 2 . .
O19 O 0.318(4) 0.441(4) 0.4578(16) 0.104(13) Uiso 0.25 d H 3 . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag2 3.3264(12) . ?
Ag1 Ag4 2.7315(13) . ?
Ag1 N2 2.178(7) . ?
Ag1 C1 2.163(8) . ?
Ag2 Ag3 2.7386(13) . ?
Ag2 N6 2.223(7) . ?
Ag2 C2 2.218(8) . ?
Ag3 Ag4 3.2728(12) . ?
Ag3 N10 2.194(7) . ?
Ag3 C2 2.178(8) . ?
Ag4 N14 2.197(7) . ?
Ag4 C1 2.207(8) . ?
Ag5 O7 2.533(6) . ?
Ag5 N8 2.154(6) . ?
Ag5 N16 2.155(7) . ?
S3 O7 1.441(6) . ?
S3 O8 1.447(7) . ?
S3 O9 1.427(7) . ?
S3 C60 1.819(9) . ?
F7 C60 1.332(11) . ?
F8 C60 1.320(12) . ?
F9 C60 1.337(12) . ?
N1 H1 0.8600 . ?
N1 C1 1.345(11) . ?
N1 C9 1.380(12) . ?
N2 C10 1.360(11) . ?
N2 C14 1.345(11) . ?
N3 C14 1.443(12) . ?
N3 C15 1.471(12) . ?
N3 C16 1.385(12) . ?
N4 C16 1.342(12) . ?
N4 C20 1.337(11) . ?
N5 C20 1.393(12) . ?
N5 C21 1.494(12) . ?
N5 C22 1.432(11) . ?
N6 C22 1.339(10) . ?
N6 C26 1.344(10) . ?
N7 C26 1.387(11) . ?
N7 C27 1.491(11) . ?
N7 C28 1.416(10) . ?
N8 C28 1.337(10) . ?
N8 C32 1.342(10) . ?
N9 C32 1.427(10) . ?
N9 C33 1.475(10) . ?
N9 C34 1.390(10) . ?
N10 C34 1.363(10) . ?
N10 C38 1.344(10) . ?
N11 C38 1.405(11) . ?
N11 C39 1.477(11) . ?
N11 C40 1.394(11) . ?
N12 C40 1.354(10) . ?
N12 C44 1.341(11) . ?
N13 C44 1.377(11) . ?
N13 C45 1.473(12) . ?
N13 C46 1.405(11) . ?
N14 C46 1.364(10) . ?
N14 C50 1.350(10) . ?
N15 C50 1.382(10) . ?
N15 C51 1.478(11) . ?
N15 C52 1.430(10) . ?
N16 C52 1.350(10) . ?
N16 C56 1.354(11) . ?
N17 C10 1.399(11) . ?
N17 C56 1.422(11) . ?
N17 C57 1.469(11) . ?
C1 C2 1.441(12) . ?
C2 C3 1.359(11) . ?
C3 H3 0.9300 . ?
C3 C4 1.391(12) . ?
C4 C5 1.431(14) . ?
C4 C9 1.387(15) . ?
C5 H5 0.9300 . ?
C5 C6 1.374(17) . ?
C6 H6 0.9300 . ?
C6 C7 1.39(2) . ?
C7 H7 0.9300 . ?
C7 C8 1.351(17) . ?
C8 H8 0.9300 . ?
C8 C9 1.419(13) . ?
C10 C11 1.382(11) . ?
C11 H11 0.9300 . ?
C11 C12 1.379(13) . ?
C12 H12 0.9300 . ?
C12 C13 1.374(15) . ?
C13 H13 0.9300 . ?
C13 C14 1.373(14) . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C16 C17 1.403(14) . ?
C17 H17 0.9300 . ?
C17 C18 1.357(16) . ?
C18 H18 0.9300 . ?
C18 C19 1.396(16) . ?
C19 H19 0.9300 . ?
C19 C20 1.391(13) . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 C23 1.365(13) . ?
C23 H23 0.9300 . ?
C23 C24 1.390(14) . ?
C24 H24 0.9300 . ?
C24 C25 1.338(14) . ?
C25 H25 0.9300 . ?
C25 C26 1.393(12) . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 C29 1.385(11) . ?
C29 H29 0.9300 . ?
C29 C30 1.381(12) . ?
C30 H30 0.9300 . ?
C30 C31 1.372(12) . ?
C31 H31 0.9300 . ?
C31 C32 1.378(11) . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C34 C35 1.388(11) . ?
C35 H35 0.9300 . ?
C35 C36 1.380(13) . ?
C36 H36 0.9300 . ?
C36 C37 1.377(14) . ?
C37 H37 0.9300 . ?
C37 C38 1.360(12) . ?
C39 H39A 0.9600 . ?
C39 H39B 0.9600 . ?
C39 H39C 0.9600 . ?
C40 C41 1.399(12) . ?
C41 H41 0.9300 . ?
C41 C42 1.395(13) . ?
C42 H42 0.9300 . ?
C42 C43 1.369(13) . ?
C43 H43 0.9300 . ?
C43 C44 1.395(12) . ?
C45 H45A 0.9600 . ?
C45 H45B 0.9600 . ?
C45 H45C 0.9600 . ?
C46 C47 1.388(13) . ?
C47 H47 0.9300 . ?
C47 C48 1.390(13) . ?
C48 H48 0.9300 . ?
C48 C49 1.374(12) . ?
C49 H49 0.9300 . ?
C49 C50 1.412(12) . ?
C51 H51A 0.9600 . ?
C51 H51B 0.9600 . ?
C51 H51C 0.9600 . ?
C52 C53 1.363(12) . ?
C53 H53 0.9300 . ?
C53 C54 1.384(13) . ?
C54 H54 0.9300 . ?
C54 C55 1.397(13) . ?
C55 H55 0.9300 . ?
C55 C56 1.370(12) . ?
C57 H57A 0.9600 . ?
C57 H57B 0.9600 . ?
C57 H57C 0.9600 . ?
Cl1 C63 1.60(5) . ?
Cl2 C63 1.59(4) . ?
Cl3 C63 1.58(5) . ?
Cl4 C64 1.728(16) . ?
Cl5 C64 1.736(17) . ?
Cl6 C64 1.739(18) . ?
C64 H64 0.9800 . ?
Cl7 C65 1.66(3) . ?
Cl8 C65 1.65(3) . ?
Cl9 C65 1.66(3) . ?
C65 H65 0.9800 . ?
Cl10 C66 1.74(5) . ?
Cl10 C66 1.95(5) 2_556 ?
Cl11 C66 1.74(5) . ?
C66 Cl10 1.95(5) 2_556 ?
S1 O1 1.430(8) . ?
S1 O2 1.446(13) . ?
S1 O3 1.427(11) . ?
S1 C58 1.797(13) . ?
F1 C58 1.277(18) . ?
F2 C58 1.376(17) . ?
F3 C58 1.345(14) . ?
S2 O4 1.321(11) . ?
S2 O5 1.640(15) . ?
S2 O6 1.449(12) . ?
S2 C59 1.63(2) . ?
F4 C59 1.347(19) . ?
F5 C59 1.45(2) . ?
F6 C59 1.294(19) . ?
S4 O10 1.407(18) . ?
S4 O11 1.42(2) . ?
S4 O12 1.424(15) . ?
S4 C61 1.69(3) . ?
F10 C61 1.33(3) . ?
F11 C61 1.36(3) . ?
F12 C61 1.22(3) . ?
O11 O11 1.48(5) 2_676 ?
S5 O13 1.39(3) . ?
S5 O14 1.380(15) . ?
S5 O15 1.45(2) . ?
S5 C62 1.757(16) . ?
F13 C62 1.520(16) . ?
F14 C62 1.425(17) . ?
F15 C62 1.463(16) . ?
O17 C67 1.28(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
Ag4 Ag1 Ag2 87.62(3) . . ?
N2 Ag1 Ag2 118.76(18) . . ?
N2 Ag1 Ag4 139.42(18) . . ?
C1 Ag1 Ag2 63.6(2) . . ?
C1 Ag1 Ag4 52.0(2) . . ?
C1 Ag1 N2 165.8(3) . . ?
Ag3 Ag2 Ag1 91.25(3) . . ?
N6 Ag2 Ag1 86.56(16) . . ?
N6 Ag2 Ag3 148.90(18) . . ?
C2 Ag2 Ag1 65.3(2) . . ?
C2 Ag2 Ag3 50.8(2) . . ?
C2 Ag2 N6 148.7(3) . . ?
Ag2 Ag3 Ag4 88.59(3) . . ?
N10 Ag3 Ag2 138.51(17) . . ?
N10 Ag3 Ag4 120.10(17) . . ?
C2 Ag3 Ag2 52.1(2) . . ?
C2 Ag3 Ag4 63.5(2) . . ?
C2 Ag3 N10 165.5(3) . . ?
Ag1 Ag4 Ag3 92.53(3) . . ?
N14 Ag4 Ag1 150.79(18) . . ?
N14 Ag4 Ag3 85.78(17) . . ?
N14 Ag4 C1 148.8(3) . . ?
C1 Ag4 Ag1 50.6(2) . . ?
C1 Ag4 Ag3 67.0(2) . . ?
N8 Ag5 O7 96.1(2) . . ?
N8 Ag5 N16 164.7(2) . . ?
N16 Ag5 O7 99.1(2) . . ?
O7 S3 O8 115.3(4) . . ?
O7 S3 C60 102.7(4) . . ?
O8 S3 C60 103.6(5) . . ?
O9 S3 O7 113.9(4) . . ?
O9 S3 O8 114.3(4) . . ?
O9 S3 C60 105.2(5) . . ?
S3 O7 Ag5 156.3(4) . . ?
C1 N1 H1 117.4 . . ?
C1 N1 C9 125.3(9) . . ?
C9 N1 H1 117.4 . . ?
C10 N2 Ag1 125.1(5) . . ?
C14 N2 Ag1 114.8(6) . . ?
C14 N2 C10 117.9(8) . . ?
C14 N3 C15 115.8(8) . . ?
C16 N3 C14 118.4(8) . . ?
C16 N3 C15 119.9(8) . . ?
C20 N4 C16 118.2(8) . . ?
C20 N5 C21 119.3(8) . . ?
C20 N5 C22 118.8(7) . . ?
C22 N5 C21 113.5(8) . . ?
C22 N6 Ag2 107.5(5) . . ?
C22 N6 C26 118.6(7) . . ?
C26 N6 Ag2 132.6(5) . . ?
C26 N7 C27 119.8(7) . . ?
C26 N7 C28 120.9(6) . . ?
C28 N7 C27 113.3(7) . . ?
C28 N8 Ag5 117.0(5) . . ?
C28 N8 C32 119.2(7) . . ?
C32 N8 Ag5 122.5(5) . . ?
C32 N9 C33 114.9(7) . . ?
C34 N9 C32 116.8(6) . . ?
C34 N9 C33 117.2(7) . . ?
C34 N10 Ag3 124.0(5) . . ?
C38 N10 Ag3 116.3(5) . . ?
C38 N10 C34 119.0(7) . . ?
C38 N11 C39 117.0(7) . . ?
C40 N11 C38 122.4(7) . . ?
C40 N11 C39 119.2(7) . . ?
C44 N12 C40 118.3(7) . . ?
C44 N13 C45 119.4(7) . . ?
C44 N13 C46 119.0(7) . . ?
C46 N13 C45 114.5(7) . . ?
C46 N14 Ag4 108.2(5) . . ?
C50 N14 Ag4 131.0(5) . . ?
C50 N14 C46 119.9(7) . . ?
C50 N15 C51 119.0(7) . . ?
C50 N15 C52 118.6(7) . . ?
C52 N15 C51 113.9(7) . . ?
C52 N16 Ag5 116.1(5) . . ?
C52 N16 C56 118.8(7) . . ?
C56 N16 Ag5 123.6(5) . . ?
C10 N17 C56 118.3(7) . . ?
C10 N17 C57 117.2(7) . . ?
C56 N17 C57 116.1(7) . . ?
Ag1 C1 Ag4 77.4(3) . . ?
N1 C1 Ag1 111.5(6) . . ?
N1 C1 Ag4 114.7(6) . . ?
N1 C1 C2 117.6(8) . . ?
C2 C1 Ag1 119.4(5) . . ?
C2 C1 Ag4 109.7(5) . . ?
Ag3 C2 Ag2 77.0(3) . . ?
C1 C2 Ag2 111.6(5) . . ?
C1 C2 Ag3 119.8(6) . . ?
C3 C2 Ag2 113.4(6) . . ?
C3 C2 Ag3 111.2(6) . . ?
C3 C2 C1 117.3(8) . . ?
C2 C3 H3 118.0 . . ?
C2 C3 C4 123.9(9) . . ?
C4 C3 H3 118.0 . . ?
C3 C4 C5 121.4(11) . . ?
C9 C4 C3 118.5(8) . . ?
C9 C4 C5 120.1(10) . . ?
C4 C5 H5 121.3 . . ?
C6 C5 C4 117.5(13) . . ?
C6 C5 H5 121.3 . . ?
C5 C6 H6 118.7 . . ?
C5 C6 C7 122.7(11) . . ?
C7 C6 H6 118.7 . . ?
C6 C7 H7 120.1 . . ?
C8 C7 C6 119.8(11) . . ?
C8 C7 H7 120.1 . . ?
C7 C8 H8 119.8 . . ?
C7 C8 C9 120.4(12) . . ?
C9 C8 H8 119.8 . . ?
N1 C9 C4 117.4(8) . . ?
N1 C9 C8 123.1(10) . . ?
C4 C9 C8 119.5(9) . . ?
N2 C10 N17 115.7(7) . . ?
N2 C10 C11 121.9(8) . . ?
C11 C10 N17 122.4(8) . . ?
C10 C11 H11 121.1 . . ?
C12 C11 C10 117.8(9) . . ?
C12 C11 H11 121.1 . . ?
C11 C12 H12 119.2 . . ?
C13 C12 C11 121.6(9) . . ?
C13 C12 H12 119.2 . . ?
C12 C13 H13 121.5 . . ?
C14 C13 C12 116.9(9) . . ?
C14 C13 H13 121.5 . . ?
N2 C14 N3 115.5(8) . . ?
N2 C14 C13 123.7(9) . . ?
C13 C14 N3 120.7(8) . . ?
N3 C15 H15A 109.5 . . ?
N3 C15 H15B 109.5 . . ?
N3 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
N3 C16 C17 121.8(9) . . ?
N4 C16 N3 114.7(8) . . ?
N4 C16 C17 123.3(9) . . ?
C16 C17 H17 121.4 . . ?
C18 C17 C16 117.2(10) . . ?
C18 C17 H17 121.4 . . ?
C17 C18 H18 119.6 . . ?
C17 C18 C19 120.8(10) . . ?
C19 C18 H18 119.6 . . ?
C18 C19 H19 121.0 . . ?
C20 C19 C18 118.0(10) . . ?
C20 C19 H19 121.0 . . ?
N4 C20 N5 113.8(8) . . ?
N4 C20 C19 122.2(9) . . ?
C19 C20 N5 123.9(8) . . ?
N5 C21 H21A 109.5 . . ?
N5 C21 H21B 109.5 . . ?
N5 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
N6 C22 N5 114.1(7) . . ?
N6 C22 C23 123.5(8) . . ?
C23 C22 N5 122.4(8) . . ?
C22 C23 H23 121.5 . . ?
C22 C23 C24 117.0(9) . . ?
C24 C23 H23 121.5 . . ?
C23 C24 H24 119.7 . . ?
C25 C24 C23 120.7(9) . . ?
C25 C24 H24 119.7 . . ?
C24 C25 H25 120.2 . . ?
C24 C25 C26 119.6(9) . . ?
C26 C25 H25 120.2 . . ?
N6 C26 N7 116.8(7) . . ?
N6 C26 C25 120.6(8) . . ?
N7 C26 C25 122.6(8) . . ?
N7 C27 H27A 109.5 . . ?
N7 C27 H27B 109.5 . . ?
N7 C27 H27C 109.5 . . ?
H27A C27 H27B 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N8 C28 N7 115.6(7) . . ?
N8 C28 C29 122.2(7) . . ?
C29 C28 N7 122.2(7) . . ?
C28 C29 H29 121.0 . . ?
C30 C29 C28 118.0(8) . . ?
C30 C29 H29 121.0 . . ?
C29 C30 H30 120.1 . . ?
C31 C30 C29 119.9(8) . . ?
C31 C30 H30 120.1 . . ?
C30 C31 H31 120.4 . . ?
C30 C31 C32 119.2(8) . . ?
C32 C31 H31 120.4 . . ?
N8 C32 N9 115.3(7) . . ?
N8 C32 C31 121.4(7) . . ?
C31 C32 N9 123.2(7) . . ?
N9 C33 H33A 109.5 . . ?
N9 C33 H33B 109.5 . . ?
N9 C33 H33C 109.5 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
N10 C34 N9 116.2(7) . . ?
N10 C34 C35 120.6(7) . . ?
C35 C34 N9 123.2(7) . . ?
C34 C35 H35 120.6 . . ?
C36 C35 C34 118.7(8) . . ?
C36 C35 H35 120.6 . . ?
C35 C36 H36 120.0 . . ?
C37 C36 C35 120.1(9) . . ?
C37 C36 H36 120.0 . . ?
C36 C37 H37 120.6 . . ?
C38 C37 C36 118.9(8) . . ?
C38 C37 H37 120.6 . . ?
N10 C38 N11 116.3(7) . . ?
N10 C38 C37 122.4(8) . . ?
C37 C38 N11 121.3(8) . . ?
N11 C39 H39A 109.5 . . ?
N11 C39 H39B 109.5 . . ?
N11 C39 H39C 109.5 . . ?
H39A C39 H39B 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
N11 C40 C41 122.8(8) . . ?
N12 C40 N11 114.2(7) . . ?
N12 C40 C41 123.0(8) . . ?
C40 C41 H41 121.7 . . ?
C42 C41 C40 116.7(8) . . ?
C42 C41 H41 121.7 . . ?
C41 C42 H42 119.4 . . ?
C43 C42 C41 121.2(8) . . ?
C43 C42 H42 119.4 . . ?
C42 C43 H43 120.9 . . ?
C42 C43 C44 118.3(8) . . ?
C44 C43 H43 120.9 . . ?
N12 C44 N13 114.9(7) . . ?
N12 C44 C43 122.4(8) . . ?
N13 C44 C43 122.6(8) . . ?
N13 C45 H45A 109.5 . . ?
N13 C45 H45B 109.5 . . ?
N13 C45 H45C 109.5 . . ?
H45A C45 H45B 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
N14 C46 N13 113.8(8) . . ?
N14 C46 C47 121.9(8) . . ?
C47 C46 N13 124.3(8) . . ?
C46 C47 H47 121.1 . . ?
C46 C47 C48 117.8(8) . . ?
C48 C47 H47 121.1 . . ?
C47 C48 H48 119.3 . . ?
C49 C48 C47 121.3(9) . . ?
C49 C48 H48 119.3 . . ?
C48 C49 H49 120.8 . . ?
C48 C49 C50 118.5(8) . . ?
C50 C49 H49 120.8 . . ?
N14 C50 N15 117.7(7) . . ?
N14 C50 C49 120.7(7) . . ?
N15 C50 C49 121.6(7) . . ?
N15 C51 H51A 109.5 . . ?
N15 C51 H51B 109.5 . . ?
N15 C51 H51C 109.5 . . ?
H51A C51 H51B 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
N16 C52 N15 114.6(7) . . ?
N16 C52 C53 122.4(8) . . ?
C53 C52 N15 122.9(8) . . ?
C52 C53 H53 120.5 . . ?
C52 C53 C54 118.9(8) . . ?
C54 C53 H53 120.5 . . ?
C53 C54 H54 120.4 . . ?
C53 C54 C55 119.2(8) . . ?
C55 C54 H54 120.4 . . ?
C54 C55 H55 120.6 . . ?
C56 C55 C54 118.8(8) . . ?
C56 C55 H55 120.6 . . ?
N16 C56 N17 114.7(7) . . ?
N16 C56 C55 121.7(8) . . ?
C55 C56 N17 123.6(8) . . ?
N17 C57 H57A 109.5 . . ?
N17 C57 H57B 109.5 . . ?
N17 C57 H57C 109.5 . . ?
H57A C57 H57B 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
F7 C60 S3 111.5(7) . . ?
F7 C60 F9 106.4(8) . . ?
F8 C60 S3 112.5(7) . . ?
F8 C60 F7 107.7(8) . . ?
F8 C60 F9 107.4(9) . . ?
F9 C60 S3 111.1(7) . . ?
Cl2 C63 Cl1 107(4) . . ?
Cl3 C63 Cl1 105(4) . . ?
Cl3 C63 Cl2 110(4) . . ?
Cl4 C64 Cl5 109.8(9) . . ?
Cl4 C64 Cl6 111.6(10) . . ?
Cl4 C64 H64 108.9 . . ?
Cl5 C64 Cl6 108.8(9) . . ?
Cl5 C64 H64 108.9 . . ?
Cl6 C64 H64 108.9 . . ?
Cl7 C65 H65 106.0 . . ?
Cl8 C65 Cl7 102(2) . . ?
Cl8 C65 Cl9 117(3) . . ?
Cl8 C65 H65 106.0 . . ?
Cl9 C65 Cl7 120(3) . . ?
Cl9 C65 H65 106.0 . . ?
C66 Cl10 C66 75(2) . 2_556 ?
Cl10 C66 Cl10 105(2) . 2_556 ?
Cl10 C66 Cl11 103(2) . . ?
Cl11 C66 Cl10 105(2) . 2_556 ?
O1 S1 O2 114.5(6) . . ?
O1 S1 C58 103.0(5) . . ?
O2 S1 C58 104.8(8) . . ?
O3 S1 O1 116.3(7) . . ?
O3 S1 O2 114.3(8) . . ?
O3 S1 C58 101.4(7) . . ?
F1 C58 S1 115.7(13) . . ?
F1 C58 F2 107.4(11) . . ?
F1 C58 F3 109.0(11) . . ?
F2 C58 S1 108.7(9) . . ?
F3 C58 S1 111.5(9) . . ?
F3 C58 F2 103.8(14) . . ?
O4 S2 O5 109.3(8) . . ?
O4 S2 O6 124.0(8) . . ?
O4 S2 C59 112.9(8) . . ?
O6 S2 O5 104.7(8) . . ?
O6 S2 C59 107.2(8) . . ?
C59 S2 O5 94.2(8) . . ?
F4 C59 S2 116.9(15) . . ?
F4 C59 F5 99.5(15) . . ?
F5 C59 S2 110.4(14) . . ?
F6 C59 S2 118.0(14) . . ?
F6 C59 F4 107.3(17) . . ?
F6 C59 F5 102.2(16) . . ?
O10 S4 O11 117.7(13) . . ?
O10 S4 O12 113.3(11) . . ?
O10 S4 C61 101.5(12) . . ?
O11 S4 C61 102.9(14) . . ?
O12 S4 O11 115.9(13) . . ?
O12 S4 C61 102.2(10) . . ?
S4 O11 O11 120(2) . 2_676 ?
F10 C61 S4 113.0(18) . . ?
F10 C61 F11 97(2) . . ?
F11 C61 S4 115.9(19) . . ?
F12 C61 S4 130(2) . . ?
F12 C61 F10 94(2) . . ?
F12 C61 F11 100(2) . . ?
O13 S5 O15 115.0(17) . . ?
O13 S5 C62 96.8(15) . . ?
O14 S5 O13 119.5(16) . . ?
O14 S5 O15 116.9(13) . . ?
O14 S5 C62 100.8(11) . . ?
O15 S5 C62 102.0(12) . . ?
F13 C62 S5 91.2(9) . . ?
F14 C62 S5 104.5(12) . . ?
F14 C62 F13 124.3(14) . . ?
F14 C62 F15 111.1(12) . . ?
F15 C62 S5 116.9(14) . . ?
F15 C62 F13 108.0(11) . . ?

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
Ag1 Ag2 Ag3 Ag4 0.73(2) . . . . ?
Ag1 Ag2 Ag3 N10 137.6(3) . . . . ?
Ag1 Ag2 Ag3 C2 -56.1(3) . . . . ?
Ag1 Ag2 N6 C22 76.4(5) . . . . ?
Ag1 Ag2 N6 C26 -89.7(7) . . . . ?
Ag1 Ag2 C2 Ag3 114.0(2) . . . . ?
Ag1 Ag2 C2 C1 -3.2(5) . . . . ?
Ag1 Ag2 C2 C3 -138.2(7) . . . . ?
Ag1 Ag4 N14 C46 165.5(4) . . . . ?
Ag1 Ag4 N14 C50 -4.0(9) . . . . ?
Ag1 Ag4 C1 N1 108.1(7) . . . . ?
Ag1 Ag4 C1 C2 -117.0(6) . . . . ?
Ag1 N2 C10 N17 19.0(10) . . . . ?
Ag1 N2 C10 C11 -158.9(6) . . . . ?
Ag1 N2 C14 N3 -20.9(9) . . . . ?
Ag1 N2 C14 C13 160.9(8) . . . . ?
Ag1 C1 C2 Ag2 5.1(8) . . . . ?
Ag1 C1 C2 Ag3 -81.9(7) . . . . ?
Ag1 C1 C2 C3 138.3(7) . . . . ?
Ag2 Ag1 Ag4 Ag3 0.74(2) . . . . ?
Ag2 Ag1 Ag4 N14 -85.1(3) . . . . ?
Ag2 Ag1 Ag4 C1 57.9(3) . . . . ?
Ag2 Ag1 N2 C10 67.0(7) . . . . ?
Ag2 Ag1 N2 C14 -95.7(6) . . . . ?
Ag2 Ag1 C1 Ag4 -109.2(2) . . . . ?
Ag2 Ag1 C1 N1 139.0(7) . . . . ?
Ag2 Ag1 C1 C2 -3.5(5) . . . . ?
Ag2 Ag3 Ag4 Ag1 -0.90(3) . . . . ?
Ag2 Ag3 Ag4 N14 149.89(18) . . . . ?
Ag2 Ag3 Ag4 C1 -45.7(2) . . . . ?
Ag2 Ag3 N10 C34 -58.6(7) . . . . ?
Ag2 Ag3 N10 C38 130.9(5) . . . . ?
Ag2 Ag3 C2 C1 107.6(7) . . . . ?
Ag2 Ag3 C2 C3 -110.4(7) . . . . ?
Ag2 N6 C22 N5 15.6(8) . . . . ?
Ag2 N6 C22 C23 -166.0(8) . . . . ?
Ag2 N6 C26 N7 -16.0(10) . . . . ?
Ag2 N6 C26 C25 162.8(6) . . . . ?
Ag2 C2 C3 C4 133.6(8) . . . . ?
Ag3 Ag2 N6 C22 163.1(4) . . . . ?
Ag3 Ag2 N6 C26 -3.0(9) . . . . ?
Ag3 Ag2 C2 C1 -117.2(6) . . . . ?
Ag3 Ag2 C2 C3 107.8(7) . . . . ?
Ag3 Ag4 N14 C46 77.8(5) . . . . ?
Ag3 Ag4 N14 C50 -91.6(7) . . . . ?
Ag3 Ag4 C1 Ag1 114.3(2) . . . . ?
Ag3 Ag4 C1 N1 -137.6(7) . . . . ?
Ag3 Ag4 C1 C2 -2.7(5) . . . . ?
Ag3 N10 C34 N9 14.6(10) . . . . ?
Ag3 N10 C34 C35 -163.9(6) . . . . ?
Ag3 N10 C38 N11 -13.8(9) . . . . ?
Ag3 N10 C38 C37 166.5(7) . . . . ?
Ag3 C2 C3 C4 -141.8(8) . . . . ?
Ag4 Ag1 Ag2 Ag3 -0.88(3) . . . . ?
Ag4 Ag1 Ag2 N6 148.07(18) . . . . ?
Ag4 Ag1 Ag2 C2 -46.0(2) . . . . ?
Ag4 Ag1 N2 C10 -57.6(7) . . . . ?
Ag4 Ag1 N2 C14 139.7(5) . . . . ?
Ag4 Ag1 C1 N1 -111.9(7) . . . . ?
Ag4 Ag1 C1 C2 105.6(7) . . . . ?
Ag4 Ag3 N10 C34 69.2(6) . . . . ?
Ag4 Ag3 N10 C38 -101.3(5) . . . . ?
Ag4 Ag3 C2 Ag2 -110.7(2) . . . . ?
Ag4 Ag3 C2 C1 -3.1(5) . . . . ?
Ag4 Ag3 C2 C3 138.9(7) . . . . ?
Ag4 N14 C46 N13 12.5(8) . . . . ?
Ag4 N14 C46 C47 -169.6(7) . . . . ?
Ag4 N14 C50 N15 -10.0(11) . . . . ?
Ag4 N14 C50 C49 167.0(6) . . . . ?
Ag4 C1 C2 Ag2 91.4(5) . . . . ?
Ag4 C1 C2 Ag3 4.3(7) . . . . ?
Ag4 C1 C2 C3 -135.5(7) . . . . ?
Ag5 N8 C28 N7 -18.5(9) . . . . ?
Ag5 N8 C28 C29 162.5(6) . . . . ?
Ag5 N8 C32 N9 17.9(9) . . . . ?
Ag5 N8 C32 C31 -161.9(6) . . . . ?
Ag5 N16 C52 N15 -18.9(8) . . . . ?
Ag5 N16 C52 C53 164.2(7) . . . . ?
Ag5 N16 C56 N17 18.4(9) . . . . ?
Ag5 N16 C56 C55 -162.4(6) . . . . ?
O7 Ag5 N8 C28 90.1(6) . . . . ?
O7 Ag5 N8 C32 -103.0(6) . . . . ?
O7 Ag5 N16 C52 99.6(6) . . . . ?
O7 Ag5 N16 C56 -94.5(6) . . . . ?
O7 S3 C60 F7 179.4(7) . . . . ?
O7 S3 C60 F8 58.3(8) . . . . ?
O7 S3 C60 F9 -62.1(8) . . . . ?
O8 S3 O7 Ag5 46.7(12) . . . . ?
O8 S3 C60 F7 -60.3(8) . . . . ?
O8 S3 C60 F8 178.6(7) . . . . ?
O8 S3 C60 F9 58.2(8) . . . . ?
O9 S3 O7 Ag5 -88.3(12) . . . . ?
O9 S3 C60 F7 60.0(9) . . . . ?
O9 S3 C60 F8 -61.2(8) . . . . ?
O9 S3 C60 F9 178.5(7) . . . . ?
N1 C1 C2 Ag2 -135.2(7) . . . . ?
N1 C1 C2 Ag3 137.8(7) . . . . ?
N1 C1 C2 C3 -2.0(12) . . . . ?
N2 Ag1 Ag2 Ag3 -148.5(2) . . . . ?
N2 Ag1 Ag2 N6 0.5(3) . . . . ?
N2 Ag1 Ag2 C2 166.4(3) . . . . ?
N2 Ag1 Ag4 Ag3 134.5(3) . . . . ?
N2 Ag1 Ag4 N14 48.6(5) . . . . ?
N2 Ag1 Ag4 C1 -168.4(4) . . . . ?
N2 Ag1 C1 Ag4 147.6(10) . . . . ?
N2 Ag1 C1 N1 35.8(15) . . . . ?
N2 Ag1 C1 C2 -106.7(12) . . . . ?
N2 C10 C11 C12 -1.4(13) . . . . ?
N3 C16 C17 C18 177.9(11) . . . . ?
N4 C16 C17 C18 2.2(17) . . . . ?
N5 C22 C23 C24 177.9(9) . . . . ?
N6 Ag2 Ag3 Ag4 -84.7(3) . . . . ?
N6 Ag2 Ag3 N10 52.2(4) . . . . ?
N6 Ag2 Ag3 C2 -141.5(4) . . . . ?
N6 Ag2 C2 Ag3 141.8(4) . . . . ?
N6 Ag2 C2 C1 24.6(9) . . . . ?
N6 Ag2 C2 C3 -110.4(7) . . . . ?
N6 C22 C23 C24 -0.3(14) . . . . ?
N7 C28 C29 C30 -177.5(8) . . . . ?
N8 Ag5 O7 S3 121.3(11) . . . . ?
N8 Ag5 N16 C52 -84.5(11) . . . . ?
N8 Ag5 N16 C56 81.4(11) . . . . ?
N8 C28 C29 C30 1.3(13) . . . . ?
N9 C34 C35 C36 177.8(8) . . . . ?
N10 Ag3 Ag4 Ag1 -149.3(2) . . . . ?
N10 Ag3 Ag4 N14 1.5(3) . . . . ?
N10 Ag3 Ag4 C1 165.9(3) . . . . ?
N10 Ag3 C2 Ag2 141.4(10) . . . . ?
N10 Ag3 C2 C1 -111.0(11) . . . . ?
N10 Ag3 C2 C3 31.0(15) . . . . ?
N10 C34 C35 C36 -3.8(13) . . . . ?
N11 C40 C41 C42 -178.5(8) . . . . ?
N12 C40 C41 C42 0.9(12) . . . . ?
N13 C46 C47 C48 177.1(9) . . . . ?
N14 Ag4 C1 Ag1 145.5(4) . . . . ?
N14 Ag4 C1 N1 -106.4(8) . . . . ?
N14 Ag4 C1 C2 28.5(8) . . . . ?
N14 C46 C47 C48 -0.6(14) . . . . ?
N15 C52 C53 C54 -177.5(8) . . . . ?
N16 Ag5 O7 S3 -59.8(11) . . . . ?
N16 Ag5 N8 C28 -85.8(11) . . . . ?
N16 Ag5 N8 C32 81.0(11) . . . . ?
N16 C52 C53 C54 -0.9(13) . . . . ?
N17 C10 C11 C12 -179.1(8) . . . . ?
C1 Ag1 Ag2 Ag3 47.3(2) . . . . ?
C1 Ag1 Ag2 N6 -163.7(3) . . . . ?
C1 Ag1 Ag2 C2 2.2(3) . . . . ?
C1 Ag1 Ag4 Ag3 -57.1(3) . . . . ?
C1 Ag1 Ag4 N14 -143.0(4) . . . . ?
C1 Ag1 N2 C10 162.8(10) . . . . ?
C1 Ag1 N2 C14 0.1(15) . . . . ?
C1 Ag4 N14 C46 49.2(8) . . . . ?
C1 Ag4 N14 C50 -120.2(7) . . . . ?
C1 N1 C9 C4 -2.0(14) . . . . ?
C1 N1 C9 C8 178.6(9) . . . . ?
C1 C2 C3 C4 1.2(13) . . . . ?
C2 Ag2 Ag3 Ag4 56.8(3) . . . . ?
C2 Ag2 Ag3 N10 -166.3(4) . . . . ?
C2 Ag2 N6 C22 51.3(8) . . . . ?
C2 Ag2 N6 C26 -114.8(8) . . . . ?
C2 Ag3 Ag4 Ag1 46.7(2) . . . . ?
C2 Ag3 Ag4 N14 -162.5(3) . . . . ?
C2 Ag3 Ag4 C1 1.9(3) . . . . ?
C2 Ag3 N10 C34 169.4(10) . . . . ?
C2 Ag3 N10 C38 -1.1(14) . . . . ?
C2 C3 C4 C5 -179.1(9) . . . . ?
C2 C3 C4 C9 -0.8(14) . . . . ?
C3 C4 C5 C6 -179.4(11) . . . . ?
C3 C4 C9 N1 1.0(14) . . . . ?
C3 C4 C9 C8 -179.6(9) . . . . ?
C4 C5 C6 C7 -2(2) . . . . ?
C5 C4 C9 N1 179.3(9) . . . . ?
C5 C4 C9 C8 -1.2(15) . . . . ?
C5 C6 C7 C8 1(2) . . . . ?
C6 C7 C8 C9 -0.2(19) . . . . ?
C7 C8 C9 N1 179.6(11) . . . . ?
C7 C8 C9 C4 0.1(16) . . . . ?
C9 N1 C1 Ag1 -140.8(8) . . . . ?
C9 N1 C1 Ag4 133.7(8) . . . . ?
C9 N1 C1 C2 2.5(13) . . . . ?
C9 C4 C5 C6 2.4(17) . . . . ?
C10 N2 C14 N3 175.1(7) . . . . ?
C10 N2 C14 C13 -3.1(13) . . . . ?
C10 N17 C56 N16 -147.4(7) . . . . ?
C10 N17 C56 C55 33.5(11) . . . . ?
C10 C11 C12 C13 -1.0(15) . . . . ?
C11 C12 C13 C14 1.3(15) . . . . ?
C12 C13 C14 N2 0.8(15) . . . . ?
C12 C13 C14 N3 -177.2(9) . . . . ?
C14 N2 C10 N17 -178.8(7) . . . . ?
C14 N2 C10 C11 3.4(12) . . . . ?
C14 N3 C16 N4 -13.1(13) . . . . ?
C14 N3 C16 C17 170.8(9) . . . . ?
C15 N3 C14 N2 -124.8(10) . . . . ?
C15 N3 C14 C13 53.4(13) . . . . ?
C15 N3 C16 N4 -164.8(10) . . . . ?
C15 N3 C16 C17 19.1(16) . . . . ?
C16 N3 C14 N2 82.4(11) . . . . ?
C16 N3 C14 C13 -99.4(11) . . . . ?
C16 N4 C20 N5 -178.1(8) . . . . ?
C16 N4 C20 C19 4.6(14) . . . . ?
C16 C17 C18 C19 2.6(19) . . . . ?
C17 C18 C19 C20 -3.6(19) . . . . ?
C18 C19 C20 N4 -0.1(17) . . . . ?
C18 C19 C20 N5 -177.1(10) . . . . ?
C20 N4 C16 N3 178.2(8) . . . . ?
C20 N4 C16 C17 -5.7(15) . . . . ?
C20 N5 C22 N6 -114.6(9) . . . . ?
C20 N5 C22 C23 67.0(12) . . . . ?
C21 N5 C20 N4 161.3(9) . . . . ?
C21 N5 C20 C19 -21.4(14) . . . . ?
C21 N5 C22 N6 97.4(9) . . . . ?
C21 N5 C22 C23 -81.0(11) . . . . ?
C22 N5 C20 N4 15.2(12) . . . . ?
C22 N5 C20 C19 -167.6(9) . . . . ?
C22 N6 C26 N7 179.1(7) . . . . ?
C22 N6 C26 C25 -2.0(11) . . . . ?
C22 C23 C24 C25 -2.2(16) . . . . ?
C23 C24 C25 C26 2.6(15) . . . . ?
C24 C25 C26 N6 -0.5(13) . . . . ?
C24 C25 C26 N7 178.3(9) . . . . ?
C26 N6 C22 N5 -176.0(7) . . . . ?
C26 N6 C22 C23 2.4(12) . . . . ?
C26 N7 C28 N8 125.6(8) . . . . ?
C26 N7 C28 C29 -55.5(11) . . . . ?
C27 N7 C26 N6 -174.5(7) . . . . ?
C27 N7 C26 C25 6.7(12) . . . . ?
C27 N7 C28 N8 -81.7(9) . . . . ?
C27 N7 C28 C29 97.2(9) . . . . ?
C28 N7 C26 N6 -23.6(10) . . . . ?
C28 N7 C26 C25 157.6(8) . . . . ?
C28 N8 C32 N9 -175.5(6) . . . . ?
C28 N8 C32 C31 4.7(11) . . . . ?
C28 C29 C30 C31 2.3(13) . . . . ?
C29 C30 C31 C32 -2.4(13) . . . . ?
C30 C31 C32 N8 -1.2(12) . . . . ?
C30 C31 C32 N9 179.1(7) . . . . ?
C32 N8 C28 N7 174.1(6) . . . . ?
C32 N8 C28 C29 -4.8(12) . . . . ?
C32 N9 C34 N10 49.9(10) . . . . ?
C32 N9 C34 C35 -131.7(8) . . . . ?
C33 N9 C32 N8 66.4(9) . . . . ?
C33 N9 C32 C31 -113.8(9) . . . . ?
C33 N9 C34 N10 -168.0(7) . . . . ?
C33 N9 C34 C35 10.5(12) . . . . ?
C34 N9 C32 N8 -150.5(7) . . . . ?
C34 N9 C32 C31 29.2(11) . . . . ?
C34 N10 C38 N11 175.2(7) . . . . ?
C34 N10 C38 C37 -4.5(12) . . . . ?
C34 C35 C36 C37 -0.6(15) . . . . ?
C35 C36 C37 C38 2.4(15) . . . . ?
C36 C37 C38 N10 0.2(14) . . . . ?
C36 C37 C38 N11 -179.6(9) . . . . ?
C38 N10 C34 N9 -175.1(7) . . . . ?
C38 N10 C34 C35 6.4(11) . . . . ?
C38 N11 C40 N12 -4.1(11) . . . . ?
C38 N11 C40 C41 175.3(8) . . . . ?
C39 N11 C38 N10 -123.1(9) . . . . ?
C39 N11 C38 C37 56.6(11) . . . . ?
C39 N11 C40 N12 -170.4(8) . . . . ?
C39 N11 C40 C41 9.1(12) . . . . ?
C40 N11 C38 N10 70.4(10) . . . . ?
C40 N11 C38 C37 -109.8(10) . . . . ?
C40 N12 C44 N13 178.9(7) . . . . ?
C40 N12 C44 C43 2.1(12) . . . . ?
C40 C41 C42 C43 0.8(13) . . . . ?
C41 C42 C43 C44 -1.0(14) . . . . ?
C42 C43 C44 N12 -0.5(13) . . . . ?
C42 C43 C44 N13 -177.1(8) . . . . ?
C44 N12 C40 N11 177.1(7) . . . . ?
C44 N12 C40 C41 -2.4(12) . . . . ?
C44 N13 C46 N14 -111.3(8) . . . . ?
C44 N13 C46 C47 70.8(11) . . . . ?
C45 N13 C44 N12 161.9(9) . . . . ?
C45 N13 C44 C43 -21.2(13) . . . . ?
C45 N13 C46 N14 98.2(9) . . . . ?
C45 N13 C46 C47 -79.7(11) . . . . ?
C46 N13 C44 N12 12.9(11) . . . . ?
C46 N13 C44 C43 -170.3(8) . . . . ?
C46 N14 C50 N15 -178.4(7) . . . . ?
C46 N14 C50 C49 -1.5(11) . . . . ?
C46 C47 C48 C49 0.1(15) . . . . ?
C47 C48 C49 C50 -0.4(15) . . . . ?
C48 C49 C50 N14 1.1(13) . . . . ?
C48 C49 C50 N15 177.9(8) . . . . ?
C50 N14 C46 N13 -176.7(7) . . . . ?
C50 N14 C46 C47 1.2(12) . . . . ?
C50 N15 C52 N16 131.1(7) . . . . ?
C50 N15 C52 C53 -52.1(11) . . . . ?
C51 N15 C50 N14 -175.8(7) . . . . ?
C51 N15 C50 C49 7.3(12) . . . . ?
C51 N15 C52 N16 -81.3(9) . . . . ?
C51 N15 C52 C53 95.5(10) . . . . ?
C52 N15 C50 N14 -29.8(10) . . . . ?
C52 N15 C50 C49 153.3(8) . . . . ?
C52 N16 C56 N17 -176.0(7) . . . . ?
C52 N16 C56 C55 3.1(12) . . . . ?
C52 C53 C54 C55 3.5(14) . . . . ?
C53 C54 C55 C56 -2.8(13) . . . . ?
C54 C55 C56 N16 -0.6(13) . . . . ?
C54 C55 C56 N17 178.5(8) . . . . ?
C56 N16 C52 N15 174.4(6) . . . . ?
C56 N16 C52 C53 -2.4(12) . . . . ?
C56 N17 C10 N2 43.8(10) . . . . ?
C56 N17 C10 C11 -138.3(8) . . . . ?
C57 N17 C10 N2 -169.1(8) . . . . ?
C57 N17 C10 C11 8.7(12) . . . . ?
C57 N17 C56 N16 65.2(10) . . . . ?
C57 N17 C56 C55 -113.9(9) . . . . ?
C60 S3 O7 Ag5 158.5(11) . . . . ?
C66 Cl10 C66 Cl10 0.001(2) 2_556 . . 2_556 ?
C66 Cl10 C66 Cl11 109(3) 2_556 . . . ?
O1 S1 C58 F1 -56.4(11) . . . . ?
O1 S1 C58 F2 64.5(12) . . . . ?
O1 S1 C58 F3 178.3(12) . . . . ?
O2 S1 C58 F1 -176.5(10) . . . . ?
O2 S1 C58 F2 -55.6(12) . . . . ?
O2 S1 C58 F3 58.2(14) . . . . ?
O3 S1 C58 F1 64.3(11) . . . . ?
O3 S1 C58 F2 -174.9(10) . . . . ?
O3 S1 C58 F3 -61.0(14) . . . . ?
O4 S2 C59 F4 -176.3(13) . . . . ?
O4 S2 C59 F5 71.0(13) . . . . ?
O4 S2 C59 F6 -45.9(18) . . . . ?
O5 S2 C59 F4 -63.3(15) . . . . ?
O5 S2 C59 F5 -176.0(12) . . . . ?
O5 S2 C59 F6 67.1(16) . . . . ?
O6 S2 C59 F4 43.6(17) . . . . ?
O6 S2 C59 F5 -69.1(13) . . . . ?
O6 S2 C59 F6 173.9(13) . . . . ?
O10 S4 O11 O11 -86(3) . . . 2_676 ?
O10 S4 C61 F10 180.0(18) . . . . ?
O10 S4 C61 F11 -69(2) . . . . ?
O10 S4 C61 F12 62(2) . . . . ?
O11 S4 C61 F10 -58(2) . . . . ?
O11 S4 C61 F11 53(2) . . . . ?
O11 S4 C61 F12 -176(2) . . . . ?
O12 S4 O11 O11 53(3) . . . 2_676 ?
O12 S4 C61 F10 63(2) . . . . ?
O12 S4 C61 F11 173.6(19) . . . . ?
O12 S4 C61 F12 -55(2) . . . . ?
C61 S4 O11 O11 163(2) . . . 2_676 ?
O13 S5 C62 F13 -43.9(16) . . . . ?
O13 S5 C62 F14 -169.9(17) . . . . ?
O13 S5 C62 F15 67.0(18) . . . . ?
O14 S5 C62 F13 -165.8(11) . . . . ?
O14 S5 C62 F14 68.2(14) . . . . ?
O14 S5 C62 F15 -54.9(14) . . . . ?
O15 S5 C62 F13 73.5(12) . . . . ?
O15 S5 C62 F14 -52.5(15) . . . . ?
O15 S5 C62 F15 -175.6(14) . . . . ?
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_sq_s
_database_code_depnum_ccdc_archive 'CCDC 1558959'
_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;
_audit_creation_date             2017-02-17
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.01.04 svn.r3372 for OlexSys, GUI svn.r5292)
;
_shelxl_version_number           2013-2
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C64 H57 Ag5 N17, 3(C F3 O3 S)'
_chemical_formula_sum            'C67 H57 Ag5 F9 N17 O9 S3'
_chemical_formula_weight         2050.82
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   14.3943(4)
_cell_length_b                   31.0527(14)
_cell_length_c                   22.6971(8)
_cell_angle_alpha                90
_cell_angle_beta                 125.685(2)
_cell_angle_gamma                90
_cell_volume                     8240.3(6)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9576
_cell_measurement_temperature    173.00(10)
_cell_measurement_theta_max      71.2270
_cell_measurement_theta_min      4.2300
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    10.783
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6524
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            Pale-yellow
_exptl_crystal_density_diffrn    1.653
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       Plate
_exptl_crystal_F_000             4056
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.08
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.2739
_diffrn_reflns_av_unetI/netI     0.1910
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.973
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -37
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            33285
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.973
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         71.475
_diffrn_reflns_theta_min         3.722
_diffrn_ambient_temperature      173.00(10)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.973
_diffrn_measurement_device_type  'four-circle diffractometer'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   'micro-focus sealed X-ray tube'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9503
_reflns_number_total             15612
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    ?
_refine_diff_density_max         7.591
_refine_diff_density_min         -4.412
_refine_diff_density_rms         0.652
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.092
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1143
_refine_ls_number_reflns         15612
_refine_ls_number_restraints     319
_refine_ls_R_factor_all          0.2674
_refine_ls_R_factor_gt           0.2130
_refine_ls_restrained_S_all      1.082
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
;
 w=1/[σ²(Fo²)+(0.4000P)²+200.0000P]
 where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.5017
_refine_ls_wR_factor_ref         0.5615
_refine_special_details          
;
 ?
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C67'-F7' = C67'-F8' = C67'-F9'
 1.35 with sigma of 0.01
 F7'-F8' = F7'-F9' = F8'-F9'
 2.15 with sigma of 0.01
 O7'-C67' = O8'-C67' = O9'-C67'
 2.6 with sigma of 0.01
 S3'-F7' = S3'-F8' = S3'-F9'
 2.6 with sigma of 0.01
 C67-F7 = C67-F8 = C67-F9
 1.35 with sigma of 0.01
 F7-F8 = F7-F9 = F8-F9
 2.15 with sigma of 0.01
 S3'-C67'
 1.8 with sigma of 0.02
 C67'-F7' \\sim C67'-F8' \\sim C67'-F9'
 with sigma of 0.02
 F7'-F8' \\sim F7'-F9' \\sim F8'-F9'
 with sigma of 0.02
 S3'-O7' \\sim S3'-O8' \\sim S3'-O9'
 with sigma of 0.02
 O7'-O8' \\sim O7'-O9' \\sim O8'-O9'
 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
Uanis(N1) \\sim Ueq, Uanis(C1) \\sim Ueq, Uanis(C2) \\sim Ueq, Uanis(C8) \\sim
Ueq, Uanis(C3) \\sim Ueq, Uanis(C4) \\sim Ueq, Uanis(C5) \\sim Ueq, Uanis(C6)
\\sim Ueq, Uanis(C7') \\sim Ueq, Uanis(C8') \\sim Ueq, Uanis(C9') \\sim Ueq,
Uanis(C10') \\sim Ueq, Uanis(C11) \\sim Ueq, Uanis(C12) \\sim Ueq, Uanis(C13)
\\sim Ueq, Uanis(C14) \\sim Ueq, Uanis(C15) \\sim Ueq, Uanis(C15') \\sim Ueq:
with sigma of 0.005 and sigma for terminal atoms of 0.002
Uanis(N1') \\sim Ueq, Uanis(C1') \\sim Ueq, Uanis(C2') \\sim Ueq, Uanis(C3')
\\sim Ueq, Uanis(C4') \\sim Ueq, Uanis(C5') \\sim Ueq, Uanis(C6') \\sim Ueq,
Uanis(C7) \\sim Ueq: with sigma of 0.002 and sigma for terminal atoms of 0.002
Uanis(C9) \\sim Ueq, Uanis(C10) \\sim Ueq, Uanis(C16') \\sim Ueq, Uanis(C11')
\\sim Ueq, Uanis(C12') \\sim Ueq, Uanis(C13') \\sim Ueq, Uanis(C14') \\sim Ueq:
with sigma of 0.005 and sigma for terminal atoms of 0.002
Uanis(C16) \\sim Ueq, Uanis(O7) \\sim Ueq, Uanis(C46) \\sim Ueq, Uanis(N3)
\\sim Ueq, Uanis(C59) \\sim Ueq, Uanis(C56) \\sim Ueq, Uanis(S3') \\sim Ueq,
Uanis(S3) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.002
Uanis(C53) \\sim Ueq, Uanis(C57) \\sim Ueq, Uanis(N16) \\sim Ueq, Uanis(C65)
\\sim Ueq, Uanis(O9') \\sim Ueq, Uanis(F8') \\sim Ueq, Uanis(F9') \\sim Ueq, :
with sigma of 0.005 and sigma for terminal atoms of 0.002
4. Others
 Sof(N1')=Sof(H1')=Sof(C1')=Sof(C2')=Sof(C3')=Sof(C4')=Sof(H4')=Sof(C5')=
 Sof(H5')=Sof(C6')=Sof(H6')=Sof(C7')=Sof(H7')=Sof(C8')=Sof(C9')=Sof(C10')=
 Sof(C16')=Sof(C11')=Sof(C12')=Sof(H12')=Sof(C13')=Sof(H13')=Sof(C14')=
 Sof(H14')=Sof(C15')=Sof(H15')=1-FVAR(1)
 Sof(N1)=Sof(H1)=Sof(C2)=Sof(C3)=Sof(C8)=Sof(C9)=Sof(C10)=Sof(C1)=Sof(C4)=
 Sof(H4)=Sof(C5)=Sof(H5)=Sof(C6)=Sof(H6)=Sof(C7)=Sof(H7)=Sof(C11)=Sof(C12)=
 Sof(H12)=Sof(C13)=Sof(H13)=Sof(C14)=Sof(H14)=Sof(C15)=Sof(H15)=Sof(C16)=FVAR(1)
 Sof(S3')=Sof(F7')=Sof(F8')=Sof(F9')=Sof(O7')=Sof(O8')=Sof(O9')=Sof(C67')=1-
 FVAR(2)
 Sof(S3)=Sof(F7)=Sof(F8)=Sof(F9)=Sof(O7)=Sof(O8)=Sof(O9)=Sof(C67)=FVAR(2)
 Fixed Uiso: F7(0.08) F7'(0.06) F8(0.08) F9(0.08) O7'(0.08) C67(0.08) C67'(0.06)
5.a Aromatic/amide H refined with riding coordinates:
 N1(H1), N1'(H1'), C4(H4), C4'(H4'), C5(H5), C5'(H5'), C6(H6), C6'(H6'),
 C7(H7), C7'(H7'), C12(H12), C13(H13), C14(H14), C15(H15), C12'(H12'),
 C13'(H13'), C14'(H14'), C15'(H15'), C18(H18), C19(H19), C20(H20), C24(H24),
 C25(H25), C26(H26), C30(H30), C31(H31), C32(H32), C36(H36), C37(H37), C38(H38),
  C42(H42), C43(H43), C44(H44), C48(H48), C49(H49), C50(H50), C54(H54),
 C55(H55), C56(H56), C60(H60), C61(H61), C62(H62)
5.b Fitted hexagon refined as free rotating group:
 C2(C3,C8,C9,C10,C1), C11(C12,C13,C14,C15,C16), C16'(C11',C12',C13',C14',C15')
5.c Idealised Me refined as rotating group:
 C22(H22A,H22B,H22C), C28(H28A,H28B,H28C), C34(H34A,H34B,H34C), C40(H40A,H40B,
 H40C), C46(H46A,H46B,H46C), C52(H52A,H52B,H52C), C58(H58A,H58B,H58C), C64(H64A,
 H64B,H64C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag -0.57460(14) 0.35967(5) 0.74494(9) 0.0371(5) Uani 1 1 d . . . . .
Ag2 Ag -0.35597(14) 0.36391(5) 0.75362(9) 0.0360(5) Uani 1 1 d . . . . .
Ag3 Ag -0.49680(14) 0.36212(5) 0.60304(10) 0.0364(5) Uani 1 1 d . . . . .
Ag4 Ag -0.71555(13) 0.36674(5) 0.59545(9) 0.0356(4) Uani 1 1 d . . . . .
Ag5 Ag -0.53823(12) 0.25506(5) 0.67223(9) 0.0332(4) Uani 1 1 d . . . . .
N1 N -0.592(4) 0.5233(14) 0.701(3) 0.040(10) Uani 0.47(3) 1 d . U P A 1
H1 H -0.5651 0.5490 0.7099 0.048 Uiso 0.47(3) 1 calc R . P A 1
N1' N -0.427(5) 0.5230(18) 0.703(3) 0.065(13) Uani 0.53(3) 1 d . U P A 2
H1' H -0.4415 0.5491 0.7080 0.079 Uiso 0.53(3) 1 calc R . P A 2
N2 N -0.5151(13) 0.3234(7) 0.8440(10) 0.036(4) Uani 1 1 d . . . . .
N3 N -0.4833(16) 0.3945(6) 0.8827(11) 0.036(4) Uani 1 1 d . U . . .
N4 N -0.3253(16) 0.4030(6) 0.8863(11) 0.038(4) Uani 1 1 d . . . . .
N5 N -0.1609(19) 0.4021(6) 0.8893(12) 0.042(5) Uani 1 1 d . . . . .
N6 N -0.2169(14) 0.3314(6) 0.8517(10) 0.032(4) Uani 1 1 d . . . . .
N7 N -0.2728(13) 0.2618(6) 0.8017(11) 0.031(4) Uani 1 1 d . . . . .
N8 N -0.3856(12) 0.2643(5) 0.6750(10) 0.025(3) Uani 1 1 d . . . . .
N9 N -0.5106(15) 0.2582(6) 0.5496(11) 0.034(4) Uani 1 1 d . . . . .
N10 N -0.5631(14) 0.3269(6) 0.5012(11) 0.035(4) Uani 1 1 d . . . . .
N11 N -0.5976(17) 0.3978(6) 0.4601(12) 0.039(4) Uani 1 1 d . . . . .
N12 N -0.7566(15) 0.4071(6) 0.4595(10) 0.033(4) Uani 1 1 d . . . . .
N13 N -0.9126(16) 0.4085(7) 0.4615(12) 0.039(4) Uani 1 1 d . . . . .
N14 N -0.8605(13) 0.3361(6) 0.4971(9) 0.028(4) Uani 1 1 d . . . . .
N15 N -0.8030(14) 0.2672(6) 0.5411(11) 0.030(4) Uani 1 1 d . . . . .
N16 N -0.6882(12) 0.2648(5) 0.6701(8) 0.019(3) Uani 1 1 d . U . . .
N17 N -0.5672(14) 0.2541(6) 0.7926(11) 0.031(4) Uani 1 1 d . . . . .
C1' C -0.490(4) 0.4105(12) 0.680(2) 0.020(11) Uani 0.53(3) 1 d . U P A 2
C2 C -0.474(3) 0.4087(7) 0.677(2) 0.04(2) Uani 0.47(3) 1 d . U P A 1
C3 C -0.413(2) 0.4450(9) 0.6824(17) 0.018(8) Uani 0.47(3) 1 d G U P A 1
C8 C -0.448(2) 0.4856(7) 0.6883(16) 0.018(8) Uani 0.47(3) 1 d G U P A 1
C9 C -0.544(3) 0.4898(7) 0.6889(17) 0.027(9) Uani 0.47(3) 1 d G U P A 1
C10 C -0.604(2) 0.4534(9) 0.6835(18) 0.018(8) Uani 0.47(3) 1 d G U P A 1
C1 C -0.570(3) 0.4129(7) 0.678(2) 0.05(2) Uani 0.47(3) 1 d G U P A 1
C2' C -0.591(4) 0.4078(13) 0.673(2) 0.018(8) Uani 0.53(3) 1 d . U P A 2
C3' C -0.641(4) 0.4446(15) 0.684(3) 0.036(10) Uani 0.53(3) 1 d . U P A 2
C4 C -0.312(5) 0.4417(18) 0.687(3) 0.045(13) Uani 0.47(3) 1 d . U P A 1
H4 H -0.2838 0.4148 0.6869 0.054 Uiso 0.47(3) 1 calc R . P A 1
C4' C -0.752(4) 0.4403(16) 0.680(3) 0.044(11) Uani 0.53(3) 1 d . U P A 2
H4' H -0.7880 0.4141 0.6730 0.052 Uiso 0.53(3) 1 calc R . P A 2
C5 C -0.255(4) 0.4793(15) 0.691(3) 0.034(10) Uani 0.47(3) 1 d . U P A 1
H5 H -0.1970 0.4780 0.6841 0.041 Uiso 0.47(3) 1 calc R . P A 1
C5' C -0.793(5) 0.4793(17) 0.687(3) 0.050(12) Uani 0.53(3) 1 d . U P A 2
H5' H -0.8621 0.4775 0.6825 0.060 Uiso 0.53(3) 1 calc R . P A 2
C6 C -0.286(7) 0.519(3) 0.704(5) 0.071(19) Uani 0.47(3) 1 d . U P A 1
H6 H -0.2395 0.5426 0.7146 0.085 Uiso 0.47(3) 1 calc R . P A 1
C6' C -0.751(7) 0.516(3) 0.700(5) 0.080(18) Uani 0.53(3) 1 d . U P A 2
H6' H -0.7798 0.5386 0.7109 0.096 Uiso 0.53(3) 1 calc R . P A 2
C7 C -0.375(5) 0.5235(17) 0.703(3) 0.036(10) Uani 0.47(3) 1 d . U P A 1
H7 H -0.3946 0.5504 0.7107 0.043 Uiso 0.47(3) 1 calc R . P A 1
C7' C -0.645(7) 0.522(2) 0.696(4) 0.067(17) Uani 0.53(3) 1 d . U P A 2
H7' H -0.6161 0.5496 0.6988 0.080 Uiso 0.53(3) 1 calc R . P A 2
C8' C -0.599(3) 0.4859(12) 0.689(2) 0.025(8) Uani 0.53(3) 1 d . U P A 2
C9' C -0.486(5) 0.4892(15) 0.699(3) 0.041(11) Uani 0.53(3) 1 d . U P A 2
C10' C -0.445(3) 0.4532(11) 0.6863(18) 0.018(7) Uani 0.53(3) 1 d . U P A 2
C11 C -0.706(3) 0.4685(9) 0.6838(19) 0.034(11) Uani 0.47(3) 1 d . U P A 1
C12 C -0.796(3) 0.4483(8) 0.6796(19) 0.027(9) Uani 0.47(3) 1 d G U P A 1
H12 H -0.8077 0.4189 0.6702 0.033 Uiso 0.47(3) 1 calc R . P A 1
C13 C -0.868(3) 0.4720(11) 0.689(2) 0.062(17) Uani 0.47(3) 1 d G U P A 1
H13 H -0.9279 0.4585 0.6864 0.074 Uiso 0.47(3) 1 calc R . P A 1
C14 C -0.850(3) 0.5159(11) 0.703(3) 0.053(14) Uani 0.47(3) 1 d G U P A 1
H14 H -0.8981 0.5318 0.7097 0.063 Uiso 0.47(3) 1 calc R . P A 1
C15 C -0.760(3) 0.5361(8) 0.708(2) 0.059(16) Uani 0.47(3) 1 d G U P A 1
H15 H -0.7480 0.5655 0.7169 0.071 Uiso 0.47(3) 1 calc R . P A 1
C16 C -0.688(3) 0.5124(9) 0.698(2) 0.037(11) Uani 0.47(3) 1 d G U P A 1
C16' C -0.347(4) 0.5122(13) 0.699(3) 0.070(19) Uani 0.53(3) 1 d . U P A 2
C11' C -0.351(3) 0.4681(12) 0.688(2) 0.054(13) Uani 0.53(3) 1 d G U P A 2
C12' C -0.267(4) 0.4486(11) 0.685(3) 0.056(14) Uani 0.53(3) 1 d G U P A 2
H12' H -0.2694 0.4191 0.6768 0.067 Uiso 0.53(3) 1 calc R . P A 2
C13' C -0.179(4) 0.4732(16) 0.693(3) 0.10(3) Uani 0.53(3) 1 d G U P A 2
H13' H -0.1226 0.4601 0.6914 0.119 Uiso 0.53(3) 1 calc R . P A 2
C14' C -0.175(4) 0.5173(16) 0.705(3) 0.11(3) Uani 0.53(3) 1 d G U P A 2
H14' H -0.1161 0.5337 0.7109 0.128 Uiso 0.53(3) 1 calc R . P A 2
C15' C -0.259(5) 0.5368(11) 0.708(3) 0.071(18) Uani 0.53(3) 1 d G U P A 2
H15' H -0.2565 0.5663 0.7159 0.086 Uiso 0.53(3) 1 calc R . P A 2
C17 C -0.5007(16) 0.2811(7) 0.8536(11) 0.027(4) Uani 1 1 d . . . . .
C18 C -0.413(2) 0.2629(9) 0.9251(16) 0.043(6) Uani 1 1 d . . . . .
H18 H -0.4040 0.2333 0.9330 0.052 Uiso 1 1 calc R . . . .
C19 C -0.346(2) 0.2916(9) 0.9793(15) 0.045(6) Uani 1 1 d . . . . .
H19 H -0.2842 0.2816 1.0241 0.053 Uiso 1 1 calc R . . . .
C20 C -0.367(3) 0.3359(10) 0.9690(16) 0.053(7) Uani 1 1 d . . . . .
H20 H -0.3230 0.3549 1.0075 0.063 Uiso 1 1 calc R . . . .
C21 C -0.4524(19) 0.3512(7) 0.9026(13) 0.036(5) Uani 1 1 d . . . . .
C22 C -0.578(2) 0.4120(11) 0.883(2) 0.063(8) Uani 1 1 d . . . . .
H22A H -0.6280 0.3890 0.8758 0.095 Uiso 1 1 calc GR . . . .
H22B H -0.6193 0.4327 0.8447 0.095 Uiso 1 1 calc GR . . . .
H22C H -0.5475 0.4257 0.9288 0.095 Uiso 1 1 calc GR . . . .
C23 C -0.403(2) 0.4219(7) 0.8875(12) 0.033(5) Uani 1 1 d . . . . .
C24 C -0.419(3) 0.4671(9) 0.881(2) 0.067(10) Uani 1 1 d . . . . .
H24 H -0.4812 0.4801 0.8773 0.081 Uiso 1 1 calc R . . . .
C25 C -0.340(3) 0.4900(8) 0.882(2) 0.069(10) Uani 1 1 d . . . . .
H25 H -0.3460 0.5199 0.8800 0.083 Uiso 1 1 calc R . . . .
C26 C -0.245(3) 0.4710(11) 0.885(2) 0.071(9) Uani 1 1 d . . . . .
H26 H -0.1914 0.4872 0.8836 0.085 Uiso 1 1 calc R . . . .
C27 C -0.241(2) 0.4259(7) 0.8889(12) 0.036(5) Uani 1 1 d . . . . .
C28 C -0.054(3) 0.4234(10) 0.904(2) 0.062(8) Uani 1 1 d . . . . .
H28A H -0.0737 0.4507 0.8793 0.093 Uiso 1 1 calc GR . . . .
H28B H -0.0214 0.4051 0.8858 0.093 Uiso 1 1 calc GR . . . .
H28C H 0.0012 0.4276 0.9549 0.093 Uiso 1 1 calc GR . . . .
C29 C -0.150(2) 0.3584(9) 0.9065(18) 0.052(7) Uani 1 1 d . . . . .
C30 C -0.082(2) 0.3433(10) 0.9760(16) 0.054(7) Uani 1 1 d . . . . .
H30 H -0.0371 0.3626 1.0139 0.064 Uiso 1 1 calc R . . . .
C31 C -0.079(2) 0.2993(10) 0.9913(16) 0.048(6) Uani 1 1 d . . . . .
H31 H -0.0373 0.2893 1.0389 0.058 Uiso 1 1 calc R . . . .
C32 C -0.1413(17) 0.2706(8) 0.9316(12) 0.031(5) Uani 1 1 d . . . . .
H32 H -0.1380 0.2409 0.9384 0.037 Uiso 1 1 calc R . . . .
C33 C -0.2084(15) 0.2889(7) 0.8616(12) 0.029(4) Uani 1 1 d . . . . .
C34 C -0.2907(19) 0.2176(7) 0.8102(14) 0.038(5) Uani 1 1 d . . . . .
H34A H -0.2240 0.2012 0.8246 0.057 Uiso 1 1 calc GR . . . .
H34B H -0.3555 0.2067 0.7650 0.057 Uiso 1 1 calc GR . . . .
H34C H -0.3045 0.2152 0.8466 0.057 Uiso 1 1 calc GR . . . .
C35 C -0.2863(17) 0.2729(6) 0.7342(12) 0.028(4) Uani 1 1 d . . . . .
C36 C -0.1985(16) 0.2921(7) 0.7355(12) 0.028(4) Uani 1 1 d . . . . .
H36 H -0.1290 0.2988 0.7790 0.033 Uiso 1 1 calc R . . . .
C37 C -0.2180(17) 0.3005(8) 0.6723(16) 0.043(6) Uani 1 1 d . . . . .
H37 H -0.1598 0.3133 0.6720 0.052 Uiso 1 1 calc R . . . .
C38 C -0.319(2) 0.2914(7) 0.6071(14) 0.036(5) Uani 1 1 d . . . . .
H38 H -0.3302 0.2977 0.5632 0.043 Uiso 1 1 calc R . . . .
C39 C -0.405(2) 0.2714(6) 0.6104(15) 0.038(5) Uani 1 1 d . . . . .
C40 C -0.527(2) 0.2117(6) 0.5392(12) 0.036(5) Uani 1 1 d . . . . .
H40A H -0.5250 0.2032 0.4993 0.055 Uiso 1 1 calc GR . . . .
H40B H -0.5994 0.2041 0.5292 0.055 Uiso 1 1 calc GR . . . .
H40C H -0.4668 0.1973 0.5825 0.055 Uiso 1 1 calc GR . . . .
C41 C -0.5816(15) 0.2846(7) 0.4889(11) 0.026(4) Uani 1 1 d . . . . .
C42 C -0.6666(17) 0.2665(8) 0.4265(11) 0.031(4) Uani 1 1 d . . . . .
H42 H -0.6804 0.2370 0.4209 0.037 Uiso 1 1 calc R . . . .
C43 C -0.737(2) 0.2981(9) 0.3669(12) 0.042(6) Uani 1 1 d . . . . .
H43 H -0.7972 0.2881 0.3216 0.050 Uiso 1 1 calc R . . . .
C44 C -0.716(2) 0.3403(9) 0.3762(15) 0.048(6) Uani 1 1 d . . . . .
H44 H -0.7580 0.3592 0.3375 0.057 Uiso 1 1 calc R . . . .
C45 C -0.6272(15) 0.3561(7) 0.4479(12) 0.032(5) Uani 1 1 d . . . . .
C46 C -0.490(2) 0.4130(8) 0.4751(14) 0.042(5) Uani 1 1 d . U . . .
H46A H -0.4428 0.3888 0.4831 0.063 Uiso 1 1 calc GR . . . .
H46B H -0.4519 0.4308 0.5176 0.063 Uiso 1 1 calc GR . . . .
H46C H -0.5053 0.4294 0.4346 0.063 Uiso 1 1 calc GR . . . .
C47 C -0.6624(19) 0.4272(7) 0.4708(12) 0.031(4) Uani 1 1 d . . . . .
C48 C -0.639(2) 0.4694(8) 0.4850(18) 0.050(7) Uani 1 1 d . . . . .
H48 H -0.5789 0.4820 0.4862 0.060 Uiso 1 1 calc R . . . .
C49 C -0.706(3) 0.4930(9) 0.498(3) 0.076(12) Uani 1 1 d . . . . .
H49 H -0.6870 0.5215 0.5126 0.091 Uiso 1 1 calc R . . . .
C50 C -0.804(2) 0.4746(9) 0.4882(19) 0.056(8) Uani 1 1 d . . . . .
H50 H -0.8534 0.4910 0.4928 0.067 Uiso 1 1 calc R . . . .
C51 C -0.8222(18) 0.4321(6) 0.4721(13) 0.034(5) Uani 1 1 d . . . . .
C52 C -0.998(2) 0.4293(10) 0.466(2) 0.065(9) Uani 1 1 d . . . . .
H52A H -0.9612 0.4480 0.5075 0.097 Uiso 1 1 calc GR . . . .
H52B H -1.0415 0.4079 0.4706 0.097 Uiso 1 1 calc GR . . . .
H52C H -1.0482 0.4459 0.4228 0.097 Uiso 1 1 calc GR . . . .
C53 C -0.9284(17) 0.3639(7) 0.4413(12) 0.028(4) Uani 1 1 d . U . . .
C54 C -1.0035(19) 0.3509(9) 0.3707(14) 0.044(6) Uani 1 1 d . . . . .
H54 H -1.0489 0.3704 0.3335 0.052 Uiso 1 1 calc R . . . .
C55 C -1.008(2) 0.3073(8) 0.3576(14) 0.042(5) Uani 1 1 d . . . . .
H55 H -1.0573 0.2971 0.3103 0.051 Uiso 1 1 calc R . . . .
C56 C -0.9417(18) 0.2784(7) 0.4132(12) 0.031(4) Uani 1 1 d . U . . .
H56 H -0.9437 0.2491 0.4040 0.038 Uiso 1 1 calc R . . . .
C57 C -0.8701(16) 0.2949(6) 0.4848(11) 0.025(4) Uani 1 1 d . U . . .
C58 C -0.7929(19) 0.2221(8) 0.5295(13) 0.039(5) Uani 1 1 d . . . . .
H58A H -0.8629 0.2075 0.5132 0.058 Uiso 1 1 calc GR . . . .
H58B H -0.7309 0.2094 0.5741 0.058 Uiso 1 1 calc GR . . . .
H58C H -0.7783 0.2194 0.4935 0.058 Uiso 1 1 calc GR . . . .
C59 C -0.7897(15) 0.2756(5) 0.6082(10) 0.019(3) Uani 1 1 d . U . . .
C60 C -0.8784(15) 0.2932(7) 0.6081(11) 0.025(4) Uani 1 1 d . . . . .
H60 H -0.9470 0.3012 0.5651 0.030 Uiso 1 1 calc R . . . .
C61 C -0.8605(16) 0.2983(7) 0.6757(11) 0.029(4) Uani 1 1 d . . . . .
H61 H -0.9179 0.3098 0.6782 0.035 Uiso 1 1 calc R . . . .
C62 C -0.7559(18) 0.2862(7) 0.7389(14) 0.035(5) Uani 1 1 d . . . . .
H62 H -0.7431 0.2898 0.7838 0.042 Uiso 1 1 calc R . . . .
C63 C -0.6727(18) 0.2691(7) 0.7349(14) 0.033(5) Uani 1 1 d . . . . .
C64 C -0.558(2) 0.2077(7) 0.8031(13) 0.041(5) Uani 1 1 d . . . . .
H64A H -0.4817 0.1987 0.8222 0.061 Uiso 1 1 calc GR . . . .
H64B H -0.6110 0.1937 0.7574 0.061 Uiso 1 1 calc GR . . . .
H64C H -0.5760 0.2001 0.8365 0.061 Uiso 1 1 calc GR . . . .
S1 S -0.8832(5) 0.16835(19) 0.3447(3) 0.0371(12) Uani 1 1 d . . . . .
F1 F -0.866(2) 0.1131(8) 0.2650(15) 0.094(8) Uani 1 1 d . . . . .
F2 F -1.0260(16) 0.1108(9) 0.2543(12) 0.090(8) Uani 1 1 d . . . . .
F3 F -0.873(2) 0.0846(6) 0.3469(14) 0.085(6) Uani 1 1 d . . . . .
O1 O -0.9323(19) 0.1995(8) 0.2859(12) 0.064(6) Uani 1 1 d . . . . .
O2 O -0.7615(13) 0.1694(7) 0.3925(10) 0.054(5) Uani 1 1 d . . . . .
O3 O -0.9421(17) 0.1675(6) 0.3786(12) 0.052(5) Uani 1 1 d . . . . .
C65 C -0.913(3) 0.1166(9) 0.3013(16) 0.051(6) Uani 1 1 d . U . . .
S2 S -0.1929(4) 0.16629(17) 0.0028(3) 0.0326(11) Uani 1 1 d . . . . .
F4 F -0.0414(14) 0.1132(7) 0.0980(11) 0.074(6) Uani 1 1 d . . . . .
F5 F -0.2023(16) 0.1105(6) 0.0856(10) 0.064(5) Uani 1 1 d . . . . .
F6 F -0.1863(18) 0.0829(5) 0.0058(13) 0.076(6) Uani 1 1 d . . . . .
O4 O -0.1464(18) 0.1990(6) 0.0581(13) 0.054(5) Uani 1 1 d . . . . .
O5 O -0.3134(14) 0.1646(8) -0.0418(14) 0.073(7) Uani 1 1 d . . . . .
O6 O -0.1370(15) 0.1643(5) -0.0318(10) 0.039(4) Uani 1 1 d . . . . .
C66 C -0.1509(18) 0.1156(7) 0.0523(14) 0.037(5) Uani 1 1 d . . . . .
S3 S -0.5108(12) 0.1277(4) 0.6740(7) 0.065(3) Uani 0.672(16) 1 d . U P B 1
S3' S -0.5788(14) 0.1243(5) 0.6767(9) 0.041(5) Uani 0.328(16) 1 d D U P B 2
F7 F -0.550(2) 0.1236(8) 0.5464(17) 0.080 Uiso 0.672(16) 1 d D U P B 1
F7' F -0.668(3) 0.1048(14) 0.7454(17) 0.060 Uiso 0.328(16) 1 d D U P B 2
F8 F -0.6894(19) 0.1025(9) 0.5495(17) 0.080 Uiso 0.672(16) 1 d D U P B 1
F8' F -0.771(3) 0.1472(12) 0.654(2) 0.073(15) Uani 0.328(16) 1 d D U P B 2
F9 F -0.543(2) 0.0617(7) 0.5910(17) 0.080 Uiso 0.672(16) 1 d D U P B 1
F9' F -0.761(3) 0.0800(13) 0.637(2) 0.090(18) Uani 0.328(16) 1 d D U P B 2
O7 O -0.544(5) 0.0977(17) 0.708(3) 0.103(14) Uani 0.672(16) 1 d . U P B 1
O7' O -0.480(2) 0.1198(19) 0.739(3) 0.080 Uiso 0.328(16) 1 d D U P B 2
O8 O -0.395(4) 0.127(2) 0.698(3) 0.12(2) Uani 0.672(16) 1 d . . P B 1
O8' O -0.569(5) 0.0997(19) 0.635(3) 0.14(4) Uiso 0.328(16) 1 d D U P B 2
O9 O -0.544(3) 0.1707(9) 0.6674(19) 0.049(8) Uani 0.672(16) 1 d . . P B 1
O9' O -0.573(4) 0.1627(14) 0.657(3) 0.027(14) Uani 0.328(16) 1 d D U P B 2
C67 C -0.574(2) 0.1030(8) 0.5886(13) 0.080 Uiso 0.672(16) 1 d D U P B 1
C67' C -0.6982(19) 0.1138(8) 0.6782(14) 0.060 Uiso 0.328(16) 1 d D U P B 2


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag2 3.039(2) . ?
Ag1 Ag4 2.765(2) . ?
Ag1 N2 2.193(18) . ?
Ag1 C1 2.28(3) . ?
Ag1 C2' 2.12(4) . ?
Ag2 Ag3 2.777(2) . ?
Ag2 N6 2.188(18) . ?
Ag2 C1' 2.20(5) . ?
Ag2 C2 2.10(4) . ?
Ag3 Ag4 3.055(2) . ?
Ag3 N10 2.21(2) . ?
Ag3 C1' 2.25(5) . ?
Ag3 C2 2.09(3) . ?
Ag4 N14 2.193(17) . ?
Ag4 C1 2.32(3) . ?
Ag4 C2' 2.06(5) . ?
Ag5 N8 2.179(15) . ?
Ag5 N16 2.152(14) . ?
N1 H1 0.8600 . ?
N1 C9 1.37(5) . ?
N1 C16 1.38(6) . ?
N1' H1' 0.8600 . ?
N1' C9' 1.32(8) . ?
N1' C16' 1.25(7) . ?
N2 C17 1.33(3) . ?
N2 C21 1.39(3) . ?
N3 C21 1.41(3) . ?
N3 C22 1.47(3) . ?
N3 C23 1.38(3) . ?
N4 C23 1.28(3) . ?
N4 C27 1.37(3) . ?
N5 C27 1.37(3) . ?
N5 C28 1.53(4) . ?
N5 C29 1.39(4) . ?
N6 C29 1.33(4) . ?
N6 C33 1.33(3) . ?
N7 C33 1.40(3) . ?
N7 C34 1.43(3) . ?
N7 C35 1.47(3) . ?
N8 C35 1.30(3) . ?
N8 C39 1.34(3) . ?
N9 C39 1.39(3) . ?
N9 C40 1.46(3) . ?
N9 C41 1.40(3) . ?
N10 C41 1.34(3) . ?
N10 C45 1.35(3) . ?
N11 C45 1.34(3) . ?
N11 C46 1.45(3) . ?
N11 C47 1.42(3) . ?
N12 C47 1.37(3) . ?
N12 C51 1.37(3) . ?
N13 C51 1.39(3) . ?
N13 C52 1.44(3) . ?
N13 C53 1.43(3) . ?
N14 C53 1.36(3) . ?
N14 C57 1.30(3) . ?
N15 C57 1.37(3) . ?
N15 C58 1.45(3) . ?
N15 C59 1.44(3) . ?
N16 C59 1.35(2) . ?
N16 C63 1.36(3) . ?
N17 C17 1.41(3) . ?
N17 C63 1.38(3) . ?
N17 C64 1.45(3) . ?
C1' C2' 1.38(8) . ?
C1' C10' 1.44(5) . ?
C2 C3 1.3900 . ?
C2 C1 1.3900 . ?
C3 C8 1.3900 . ?
C3 C4 1.40(7) . ?
C8 C9 1.3900 . ?
C8 C7 1.48(6) . ?
C9 C10 1.3900 . ?
C10 C1 1.3900 . ?
C10 C11 1.54(4) . ?
C2' C3' 1.45(5) . ?
C3' C4' 1.54(7) . ?
C3' C8' 1.39(6) . ?
C4 H4 0.9300 . ?
C4 C5 1.40(7) . ?
C4' H4' 0.9300 . ?
C4' C5' 1.40(7) . ?
C5 H5 0.9300 . ?
C5 C6 1.40(10) . ?
C5' H5' 0.9300 . ?
C5' C6' 1.24(10) . ?
C6 H6 0.9300 . ?
C6 C7 1.28(11) . ?
C6' H6' 0.9300 . ?
C6' C7' 1.58(11) . ?
C7 H7 0.9300 . ?
C7' H7' 0.9300 . ?
C7' C8' 1.37(8) . ?
C8' C9' 1.51(6) . ?
C9' C10' 1.38(6) . ?
C10' C11' 1.41(5) . ?
C11 C12 1.3900 . ?
C11 C16 1.3900 . ?
C12 H12 0.9300 . ?
C12 C13 1.3900 . ?
C13 H13 0.9300 . ?
C13 C14 1.3900 . ?
C14 H14 0.9300 . ?
C14 C15 1.3900 . ?
C15 H15 0.9300 . ?
C15 C16 1.3900 . ?
C16' C11' 1.3900 . ?
C16' C15' 1.3900 . ?
C11' C12' 1.3900 . ?
C12' H12' 0.9300 . ?
C12' C13' 1.3900 . ?
C13' H13' 0.9300 . ?
C13' C14' 1.3900 . ?
C14' H14' 0.9300 . ?
C14' C15' 1.3900 . ?
C15' H15' 0.9300 . ?
C17 C18 1.47(4) . ?
C18 H18 0.9300 . ?
C18 C19 1.36(4) . ?
C19 H19 0.9300 . ?
C19 C20 1.40(4) . ?
C20 H20 0.9300 . ?
C20 C21 1.36(4) . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C23 C24 1.42(3) . ?
C24 H24 0.9300 . ?
C24 C25 1.34(5) . ?
C25 H25 0.9300 . ?
C25 C26 1.46(5) . ?
C26 H26 0.9300 . ?
C26 C27 1.40(4) . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
C29 C30 1.37(4) . ?
C30 H30 0.9300 . ?
C30 C31 1.40(4) . ?
C31 H31 0.9300 . ?
C31 C32 1.42(4) . ?
C32 H32 0.9300 . ?
C32 C33 1.41(3) . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 0.9600 . ?
C35 C36 1.38(3) . ?
C36 H36 0.9300 . ?
C36 C37 1.32(4) . ?
C37 H37 0.9300 . ?
C37 C38 1.37(4) . ?
C38 H38 0.9300 . ?
C38 C39 1.43(3) . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C41 C42 1.34(3) . ?
C42 H42 0.9300 . ?
C42 C43 1.49(3) . ?
C43 H43 0.9300 . ?
C43 C44 1.33(4) . ?
C44 H44 0.9300 . ?
C44 C45 1.45(4) . ?
C46 H46A 0.9600 . ?
C46 H46B 0.9600 . ?
C46 H46C 0.9600 . ?
C47 C48 1.35(4) . ?
C48 H48 0.9300 . ?
C48 C49 1.37(4) . ?
C49 H49 0.9300 . ?
C49 C50 1.42(4) . ?
C50 H50 0.9300 . ?
C50 C51 1.35(3) . ?
C52 H52A 0.9600 . ?
C52 H52B 0.9600 . ?
C52 H52C 0.9600 . ?
C53 C54 1.37(3) . ?
C54 H54 0.9300 . ?
C54 C55 1.38(4) . ?
C55 H55 0.9300 . ?
C55 C56 1.38(4) . ?
C56 H56 0.9300 . ?
C56 C57 1.42(3) . ?
C58 H58A 0.9600 . ?
C58 H58B 0.9600 . ?
C58 H58C 0.9600 . ?
C59 C60 1.39(3) . ?
C60 H60 0.9300 . ?
C60 C61 1.41(3) . ?
C61 H61 0.9300 . ?
C61 C62 1.40(3) . ?
C62 H62 0.9300 . ?
C62 C63 1.36(3) . ?
C64 H64A 0.9600 . ?
C64 H64B 0.9600 . ?
C64 H64C 0.9600 . ?
S1 O1 1.45(2) . ?
S1 O2 1.424(16) . ?
S1 O3 1.44(2) . ?
S1 C65 1.80(3) . ?
F1 C65 1.35(4) . ?
F2 C65 1.34(3) . ?
F3 C65 1.30(4) . ?
S2 O4 1.440(19) . ?
S2 O5 1.410(17) . ?
S2 O6 1.417(16) . ?
S2 C66 1.82(2) . ?
F4 C66 1.29(3) . ?
F5 C66 1.34(3) . ?
F6 C66 1.33(3) . ?
S3 O7 1.45(6) . ?
S3 O8 1.42(4) . ?
S3 O9 1.40(3) . ?
S3 C67 1.77(3) . ?
S3' O7' 1.30(3) . ?
S3' O8' 1.29(4) . ?
S3' O9' 1.29(3) . ?
S3' C67' 1.769(13) . ?
F7 C67 1.352(10) . ?
F7' C67' 1.347(8) . ?
F8 C67 1.352(10) . ?
F8' C67' 1.345(8) . ?
F9 C67 1.349(10) . ?
F9' C67' 1.347(9) . ?

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
Ag4 Ag1 Ag2 93.84(7) . . ?
N2 Ag1 Ag2 100.7(4) . . ?
N2 Ag1 Ag4 150.1(5) . . ?
N2 Ag1 C1 155.9(11) . . ?
C1 Ag1 Ag2 64.9(8) . . ?
C1 Ag1 Ag4 53.7(9) . . ?
C2' Ag1 Ag2 70.5(12) . . ?
C2' Ag1 Ag4 47.8(13) . . ?
C2' Ag1 N2 162.1(14) . . ?
Ag3 Ag2 Ag1 86.24(6) . . ?
N6 Ag2 Ag1 110.1(4) . . ?
N6 Ag2 Ag3 145.2(5) . . ?
N6 Ag2 C1' 162.5(14) . . ?
C1' Ag2 Ag1 64.4(15) . . ?
C1' Ag2 Ag3 52.3(13) . . ?
C2 Ag2 Ag1 70.5(9) . . ?
C2 Ag2 Ag3 48.4(9) . . ?
C2 Ag2 N6 165.4(10) . . ?
Ag2 Ag3 Ag4 93.26(7) . . ?
N10 Ag3 Ag2 149.1(5) . . ?
N10 Ag3 Ag4 99.3(4) . . ?
N10 Ag3 C1' 159.2(13) . . ?
C1' Ag3 Ag2 50.6(11) . . ?
C1' Ag3 Ag4 66.1(14) . . ?
C2 Ag3 Ag2 48.5(10) . . ?
C2 Ag3 Ag4 71.7(9) . . ?
C2 Ag3 N10 162.2(11) . . ?
Ag1 Ag4 Ag3 86.14(6) . . ?
N14 Ag4 Ag1 142.8(4) . . ?
N14 Ag4 Ag3 112.0(5) . . ?
N14 Ag4 C1 164.8(10) . . ?
C1 Ag4 Ag1 52.4(9) . . ?
C1 Ag4 Ag3 64.1(8) . . ?
C2' Ag4 Ag1 49.6(11) . . ?
C2' Ag4 Ag3 68.1(12) . . ?
C2' Ag4 N14 166.9(11) . . ?
N16 Ag5 N8 164.4(6) . . ?
C9 N1 H1 122.7 . . ?
C9 N1 C16 115(4) . . ?
C16 N1 H1 122.7 . . ?
C9' N1' H1' 124.3 . . ?
C16' N1' H1' 124.3 . . ?
C16' N1' C9' 111(5) . . ?
C17 N2 Ag1 127.3(15) . . ?
C17 N2 C21 120.4(19) . . ?
C21 N2 Ag1 108.0(16) . . ?
C21 N3 C22 118(2) . . ?
C23 N3 C21 118.0(18) . . ?
C23 N3 C22 120(2) . . ?
C23 N4 C27 121(2) . . ?
C27 N5 C28 121(2) . . ?
C27 N5 C29 119(2) . . ?
C29 N5 C28 115(2) . . ?
C29 N6 Ag2 113.0(17) . . ?
C33 N6 Ag2 124.6(15) . . ?
C33 N6 C29 121(2) . . ?
C33 N7 C34 121.2(19) . . ?
C33 N7 C35 118.8(16) . . ?
C34 N7 C35 116.3(19) . . ?
C35 N8 Ag5 122.7(15) . . ?
C35 N8 C39 120.0(18) . . ?
C39 N8 Ag5 115.2(13) . . ?
C39 N9 C40 115.5(18) . . ?
C39 N9 C41 123.4(18) . . ?
C41 N9 C40 117.6(18) . . ?
C41 N10 Ag3 128.2(15) . . ?
C41 N10 C45 121.4(19) . . ?
C45 N10 Ag3 104.9(15) . . ?
C45 N11 C46 121.9(18) . . ?
C45 N11 C47 119.5(19) . . ?
C47 N11 C46 118(2) . . ?
C47 N12 C51 115.4(19) . . ?
C51 N13 C52 120(2) . . ?
C51 N13 C53 121.5(17) . . ?
C53 N13 C52 118.2(19) . . ?
C53 N14 Ag4 114.3(14) . . ?
C57 N14 Ag4 124.4(13) . . ?
C57 N14 C53 119.7(18) . . ?
C57 N15 C58 122.1(19) . . ?
C57 N15 C59 117.2(16) . . ?
C59 N15 C58 113.7(18) . . ?
C59 N16 Ag5 121.4(12) . . ?
C59 N16 C63 119.7(16) . . ?
C63 N16 Ag5 117.4(13) . . ?
C17 N17 C64 118.9(18) . . ?
C63 N17 C17 118.2(18) . . ?
C63 N17 C64 115.5(19) . . ?
Ag2 C1' Ag3 77.1(16) . . ?
C2' C1' Ag2 116(3) . . ?
C2' C1' Ag3 108(3) . . ?
C2' C1' C10' 117(4) . . ?
C10' C1' Ag2 113(3) . . ?
C10' C1' Ag3 121(4) . . ?
Ag3 C2 Ag2 83.0(7) . . ?
C3 C2 Ag2 107.5(17) . . ?
C3 C2 Ag3 115.2(18) . . ?
C3 C2 C1 120.0 . . ?
C1 C2 Ag2 112.5(16) . . ?
C1 C2 Ag3 112.4(15) . . ?
C2 C3 C8 120.0 . . ?
C2 C3 C4 121(3) . . ?
C8 C3 C4 119(3) . . ?
C3 C8 C9 120.0 . . ?
C3 C8 C7 120(3) . . ?
C9 C8 C7 120(3) . . ?
N1 C9 C8 134(3) . . ?
N1 C9 C10 105(3) . . ?
C10 C9 C8 120.0 . . ?
C9 C10 C1 120.0 . . ?
C9 C10 C11 108(2) . . ?
C1 C10 C11 132(2) . . ?
Ag1 C1 Ag4 74.0(6) . . ?
C2 C1 Ag1 110.9(15) . . ?
C2 C1 Ag4 111.8(15) . . ?
C10 C1 Ag1 116.0(17) . . ?
C10 C1 Ag4 115.4(16) . . ?
C10 C1 C2 120.00(6) . . ?
Ag4 C2' Ag1 82.7(18) . . ?
C1' C2' Ag1 109(2) . . ?
C1' C2' Ag4 118(3) . . ?
C1' C2' C3' 122(4) . . ?
C3' C2' Ag1 105(3) . . ?
C3' C2' Ag4 111(3) . . ?
C2' C3' C4' 121(4) . . ?
C8' C3' C2' 120(4) . . ?
C8' C3' C4' 118(4) . . ?
C3 C4 H4 120.3 . . ?
C3 C4 C5 119(5) . . ?
C5 C4 H4 120.3 . . ?
C3' C4' H4' 122.7 . . ?
C5' C4' C3' 115(4) . . ?
C5' C4' H4' 122.7 . . ?
C4 C5 H5 120.2 . . ?
C6 C5 C4 120(6) . . ?
C6 C5 H5 120.2 . . ?
C4' C5' H5' 115.7 . . ?
C6' C5' C4' 129(6) . . ?
C6' C5' H5' 115.7 . . ?
C5 C6 H6 118.7 . . ?
C7 C6 C5 123(8) . . ?
C7 C6 H6 118.7 . . ?
C5' C6' H6' 121.0 . . ?
C5' C6' C7' 118(7) . . ?
C7' C6' H6' 121.0 . . ?
C8 C7 H7 120.4 . . ?
C6 C7 C8 119(6) . . ?
C6 C7 H7 120.4 . . ?
C6' C7' H7' 121.9 . . ?
C8' C7' C6' 116(6) . . ?
C8' C7' H7' 121.9 . . ?
C3' C8' C9' 117(4) . . ?
C7' C8' C3' 124(5) . . ?
C7' C8' C9' 119(5) . . ?
N1' C9' C8' 131(5) . . ?
N1' C9' C10' 108(5) . . ?
C10' C9' C8' 118(4) . . ?
C9' C10' C1' 123(4) . . ?
C9' C10' C11' 105(4) . . ?
C11' C10' C1' 132(4) . . ?
C12 C11 C10 135(2) . . ?
C12 C11 C16 120.0 . . ?
C16 C11 C10 105(2) . . ?
C11 C12 H12 120.0 . . ?
C11 C12 C13 120.0 . . ?
C13 C12 H12 120.0 . . ?
C12 C13 H13 120.0 . . ?
C14 C13 C12 120.0 . . ?
C14 C13 H13 120.0 . . ?
C13 C14 H14 120.0 . . ?
C13 C14 C15 120.0 . . ?
C15 C14 H14 120.0 . . ?
C14 C15 H15 120.0 . . ?
C14 C15 C16 120.0 . . ?
C16 C15 H15 120.0 . . ?
N1 C16 C11 107(3) . . ?
N1 C16 C15 133(3) . . ?
C15 C16 C11 120.0 . . ?
N1' C16' C11' 110(4) . . ?
N1' C16' C15' 130(4) . . ?
C11' C16' C15' 120.0 . . ?
C16' C11' C10' 105(3) . . ?
C16' C11' C12' 120.0 . . ?
C12' C11' C10' 135(3) . . ?
C11' C12' H12' 120.0 . . ?
C13' C12' C11' 120.0 . . ?
C13' C12' H12' 120.0 . . ?
C12' C13' H13' 120.0 . . ?
C12' C13' C14' 120.0 . . ?
C14' C13' H13' 120.0 . . ?
C13' C14' H14' 120.0 . . ?
C15' C14' C13' 120.0 . . ?
C15' C14' H14' 120.0 . . ?
C16' C15' H15' 120.0 . . ?
C14' C15' C16' 120.0 . . ?
C14' C15' H15' 120.0 . . ?
N2 C17 N17 118.3(18) . . ?
N2 C17 C18 121(2) . . ?
N17 C17 C18 121(2) . . ?
C17 C18 H18 121.8 . . ?
C19 C18 C17 116(2) . . ?
C19 C18 H18 121.8 . . ?
C18 C19 H19 119.3 . . ?
C18 C19 C20 121(3) . . ?
C20 C19 H19 119.3 . . ?
C19 C20 H20 120.1 . . ?
C21 C20 C19 120(3) . . ?
C21 C20 H20 120.1 . . ?
N2 C21 N3 112(2) . . ?
C20 C21 N2 121(2) . . ?
C20 C21 N3 127(2) . . ?
N3 C22 H22A 109.5 . . ?
N3 C22 H22B 109.5 . . ?
N3 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
N3 C23 C24 121(2) . . ?
N4 C23 N3 114.6(19) . . ?
N4 C23 C24 123(2) . . ?
C23 C24 H24 122.1 . . ?
C25 C24 C23 116(3) . . ?
C25 C24 H24 122.1 . . ?
C24 C25 H25 118.0 . . ?
C24 C25 C26 124(3) . . ?
C26 C25 H25 118.0 . . ?
C25 C26 H26 123.2 . . ?
C27 C26 C25 114(3) . . ?
C27 C26 H26 123.2 . . ?
N4 C27 N5 116(2) . . ?
N4 C27 C26 121(2) . . ?
N5 C27 C26 122(2) . . ?
N5 C28 H28A 109.5 . . ?
N5 C28 H28B 109.5 . . ?
N5 C28 H28C 109.5 . . ?
H28A C28 H28B 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
N6 C29 N5 117(3) . . ?
N6 C29 C30 120(3) . . ?
C30 C29 N5 123(3) . . ?
C29 C30 H30 119.4 . . ?
C29 C30 C31 121(3) . . ?
C31 C30 H30 119.4 . . ?
C30 C31 H31 121.2 . . ?
C30 C31 C32 118(3) . . ?
C32 C31 H31 121.2 . . ?
C31 C32 H32 121.4 . . ?
C33 C32 C31 117(2) . . ?
C33 C32 H32 121.4 . . ?
N6 C33 N7 119.4(19) . . ?
N6 C33 C32 122(2) . . ?
N7 C33 C32 118.9(19) . . ?
N7 C34 H34A 109.5 . . ?
N7 C34 H34B 109.5 . . ?
N7 C34 H34C 109.5 . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
N8 C35 N7 115.3(18) . . ?
N8 C35 C36 124(2) . . ?
C36 C35 N7 121.1(19) . . ?
C35 C36 H36 121.6 . . ?
C37 C36 C35 117(2) . . ?
C37 C36 H36 121.6 . . ?
C36 C37 H37 118.1 . . ?
C36 C37 C38 123.8(19) . . ?
C38 C37 H37 118.1 . . ?
C37 C38 H38 122.0 . . ?
C37 C38 C39 116(2) . . ?
C39 C38 H38 122.0 . . ?
N8 C39 N9 116.5(19) . . ?
N8 C39 C38 120(2) . . ?
N9 C39 C38 124(2) . . ?
N9 C40 H40A 109.5 . . ?
N9 C40 H40B 109.5 . . ?
N9 C40 H40C 109.5 . . ?
H40A C40 H40B 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
N10 C41 N9 115.2(18) . . ?
N10 C41 C42 125.5(19) . . ?
C42 C41 N9 119(2) . . ?
C41 C42 H42 123.2 . . ?
C41 C42 C43 114(2) . . ?
C43 C42 H42 123.2 . . ?
C42 C43 H43 118.9 . . ?
C44 C43 C42 122(2) . . ?
C44 C43 H43 118.9 . . ?
C43 C44 H44 120.6 . . ?
C43 C44 C45 119(2) . . ?
C45 C44 H44 120.6 . . ?
N10 C45 C44 118(2) . . ?
N11 C45 N10 120(2) . . ?
N11 C45 C44 122(2) . . ?
N11 C46 H46A 109.5 . . ?
N11 C46 H46B 109.5 . . ?
N11 C46 H46C 109.5 . . ?
H46A C46 H46B 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
N12 C47 N11 110.7(19) . . ?
C48 C47 N11 124(2) . . ?
C48 C47 N12 125(2) . . ?
C47 C48 H48 121.4 . . ?
C47 C48 C49 117(2) . . ?
C49 C48 H48 121.4 . . ?
C48 C49 H49 119.5 . . ?
C48 C49 C50 121(3) . . ?
C50 C49 H49 119.5 . . ?
C49 C50 H50 121.5 . . ?
C51 C50 C49 117(2) . . ?
C51 C50 H50 121.5 . . ?
N12 C51 N13 110.8(19) . . ?
C50 C51 N12 124(2) . . ?
C50 C51 N13 125(2) . . ?
N13 C52 H52A 109.5 . . ?
N13 C52 H52B 109.5 . . ?
N13 C52 H52C 109.5 . . ?
H52A C52 H52B 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
N14 C53 N13 114.8(19) . . ?
N14 C53 C54 123(2) . . ?
C54 C53 N13 122(2) . . ?
C53 C54 H54 121.7 . . ?
C53 C54 C55 117(2) . . ?
C55 C54 H54 121.7 . . ?
C54 C55 H55 119.3 . . ?
C54 C55 C56 121(2) . . ?
C56 C55 H55 119.3 . . ?
C55 C56 H56 121.1 . . ?
C55 C56 C57 118(2) . . ?
C57 C56 H56 121.1 . . ?
N14 C57 N15 119.5(18) . . ?
N14 C57 C56 121.1(18) . . ?
N15 C57 C56 119.2(18) . . ?
N15 C58 H58A 109.5 . . ?
N15 C58 H58B 109.5 . . ?
N15 C58 H58C 109.5 . . ?
H58A C58 H58B 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
N16 C59 N15 116.6(16) . . ?
N16 C59 C60 122.4(17) . . ?
C60 C59 N15 120.9(17) . . ?
C59 C60 H60 121.3 . . ?
C59 C60 C61 117.4(18) . . ?
C61 C60 H60 121.3 . . ?
C60 C61 H61 120.3 . . ?
C62 C61 C60 119.3(18) . . ?
C62 C61 H61 120.3 . . ?
C61 C62 H62 119.9 . . ?
C63 C62 C61 120(2) . . ?
C63 C62 H62 119.9 . . ?
N16 C63 N17 112.8(18) . . ?
C62 C63 N16 121(2) . . ?
C62 C63 N17 126(2) . . ?
N17 C64 H64A 109.5 . . ?
N17 C64 H64B 109.5 . . ?
N17 C64 H64C 109.5 . . ?
H64A C64 H64B 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
O1 S1 C65 105.0(14) . . ?
O2 S1 O1 114.1(14) . . ?
O2 S1 O3 116.0(13) . . ?
O2 S1 C65 103.6(13) . . ?
O3 S1 O1 112.3(13) . . ?
O3 S1 C65 104.4(13) . . ?
F1 C65 S1 111(2) . . ?
F2 C65 S1 110(2) . . ?
F2 C65 F1 108(3) . . ?
F3 C65 S1 113(2) . . ?
F3 C65 F1 106(3) . . ?
F3 C65 F2 108(3) . . ?
O4 S2 C66 104.7(13) . . ?
O5 S2 O4 113.9(14) . . ?
O5 S2 O6 117.3(15) . . ?
O5 S2 C66 103.7(12) . . ?
O6 S2 O4 112.9(11) . . ?
O6 S2 C66 102.2(10) . . ?
F4 C66 S2 111.1(17) . . ?
F4 C66 F5 111(2) . . ?
F4 C66 F6 108(2) . . ?
F5 C66 S2 110.9(16) . . ?
F6 C66 S2 109.6(18) . . ?
F6 C66 F5 105.8(19) . . ?
O7 S3 C67 100(2) . . ?
O8 S3 O7 117(3) . . ?
O8 S3 C67 99(3) . . ?
O9 S3 O7 118(3) . . ?
O9 S3 O8 108(3) . . ?
O9 S3 C67 111.9(18) . . ?
O7' S3' C67' 115(2) . . ?
O8' S3' O7' 102(2) . . ?
O8' S3' C67' 115(2) . . ?
O9' S3' O7' 103(2) . . ?
O9' S3' O8' 104(2) . . ?
O9' S3' C67' 115.6(19) . . ?
F7 C67 S3 113(2) . . ?
F8 C67 S3 112(2) . . ?
F8 C67 F7 105.3(11) . . ?
F9 C67 S3 115(2) . . ?
F9 C67 F7 105.3(11) . . ?
F9 C67 F8 105.5(11) . . ?
F7' C67' S3' 112.5(9) . . ?
F8' C67' S3' 112.8(9) . . ?
F8' C67' F7' 106.2(9) . . ?
F8' C67' F9' 106.0(9) . . ?
F9' C67' S3' 112.7(9) . . ?
F9' C67' F7' 106.0(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
Ag1 N2 C17 N17 -27(2) . . . . ?
Ag1 N2 C17 C18 149.8(15) . . . . ?
Ag1 N2 C21 N3 25(2) . . . . ?
Ag1 N2 C21 C20 -151(2) . . . . ?
Ag1 C2' C3' C4' -52(5) . . . . ?
Ag1 C2' C3' C8' 136(4) . . . . ?
Ag2 N6 C29 N5 -15(3) . . . . ?
Ag2 N6 C29 C30 161(2) . . . . ?
Ag2 N6 C33 N7 17(3) . . . . ?
Ag2 N6 C33 C32 -158.9(14) . . . . ?
Ag2 C1' C2' Ag1 3(4) . . . . ?
Ag2 C1' C2' Ag4 -88(3) . . . . ?
Ag2 C1' C2' C3' 127(3) . . . . ?
Ag2 C1' C10' C9' -126(4) . . . . ?
Ag2 C1' C10' C11' 48(6) . . . . ?
Ag2 C2 C3 C8 -130(2) . . . . ?
Ag2 C2 C3 C4 46(4) . . . . ?
Ag2 C2 C1 Ag1 -11.6(14) . . . . ?
Ag2 C2 C1 Ag4 -92.1(13) . . . . ?
Ag2 C2 C1 C10 128(2) . . . . ?
Ag3 N10 C41 N9 -29(2) . . . . ?
Ag3 N10 C41 C42 145.2(18) . . . . ?
Ag3 N10 C45 N11 32(2) . . . . ?
Ag3 N10 C45 C44 -156.6(18) . . . . ?
Ag3 C1' C2' Ag1 87(2) . . . . ?
Ag3 C1' C2' Ag4 -4(3) . . . . ?
Ag3 C1' C2' C3' -149(3) . . . . ?
Ag3 C1' C10' C9' 146(4) . . . . ?
Ag3 C1' C10' C11' -40(6) . . . . ?
Ag3 C2 C3 C8 139(2) . . . . ?
Ag3 C2 C3 C4 -45(4) . . . . ?
Ag3 C2 C1 Ag1 80.0(13) . . . . ?
Ag3 C2 C1 Ag4 -0.4(14) . . . . ?
Ag3 C2 C1 C10 -140(2) . . . . ?
Ag4 N14 C53 N13 -16(2) . . . . ?
Ag4 N14 C53 C54 162.2(17) . . . . ?
Ag4 N14 C57 N15 16(3) . . . . ?
Ag4 N14 C57 C56 -158.1(15) . . . . ?
Ag4 C2' C3' C4' 36(5) . . . . ?
Ag4 C2' C3' C8' -136(4) . . . . ?
Ag5 N8 C35 N7 20(2) . . . . ?
Ag5 N8 C35 C36 -158.5(15) . . . . ?
Ag5 N8 C39 N9 -21(2) . . . . ?
Ag5 N8 C39 C38 159.7(15) . . . . ?
Ag5 N16 C59 N15 19(2) . . . . ?
Ag5 N16 C59 C60 -162.3(14) . . . . ?
Ag5 N16 C63 N17 -18(2) . . . . ?
Ag5 N16 C63 C62 162.7(16) . . . . ?
N1 C9 C10 C1 -174(3) . . . . ?
N1 C9 C10 C11 7(3) . . . . ?
N1' C9' C10' C1' 179(4) . . . . ?
N1' C9' C10' C11' 4(5) . . . . ?
N1' C16' C11' C10' -1(4) . . . . ?
N1' C16' C11' C12' -177(5) . . . . ?
N1' C16' C15' C14' 176(6) . . . . ?
N2 C17 C18 C19 -2(3) . . . . ?
N3 C23 C24 C25 -175(3) . . . . ?
N4 C23 C24 C25 -7(5) . . . . ?
N5 C29 C30 C31 176(2) . . . . ?
N6 C29 C30 C31 1(4) . . . . ?
N7 C35 C36 C37 179.2(19) . . . . ?
N8 C35 C36 C37 -2(3) . . . . ?
N9 C41 C42 C43 178.8(19) . . . . ?
N10 C41 C42 C43 5(3) . . . . ?
N11 C47 C48 C49 -177(3) . . . . ?
N12 C47 C48 C49 8(5) . . . . ?
N13 C53 C54 C55 177.8(19) . . . . ?
N14 C53 C54 C55 0(3) . . . . ?
N15 C59 C60 C61 176.7(17) . . . . ?
N16 C59 C60 C61 -2(3) . . . . ?
N17 C17 C18 C19 174.0(19) . . . . ?
C1' C2' C3' C4' -177(4) . . . . ?
C1' C2' C3' C8' 11(6) . . . . ?
C1' C10' C11' C16' -177(4) . . . . ?
C1' C10' C11' C12' -1(7) . . . . ?
C2 C3 C8 C9 0.0 . . . . ?
C2 C3 C8 C7 173(4) . . . . ?
C2 C3 C4 C5 179(4) . . . . ?
C3 C2 C1 Ag1 -140(2) . . . . ?
C3 C2 C1 Ag4 140(2) . . . . ?
C3 C2 C1 C10 0.0 . . . . ?
C3 C8 C9 N1 172(4) . . . . ?
C3 C8 C9 C10 0.0 . . . . ?
C3 C8 C7 C6 5(7) . . . . ?
C3 C4 C5 C6 12(8) . . . . ?
C8 C3 C4 C5 -5(7) . . . . ?
C8 C9 C10 C1 0.0 . . . . ?
C8 C9 C10 C11 -179(2) . . . . ?
C9 N1 C16 C11 1(4) . . . . ?
C9 N1 C16 C15 179(3) . . . . ?
C9 C8 C7 C6 178(5) . . . . ?
C9 C10 C1 Ag1 138(2) . . . . ?
C9 C10 C1 Ag4 -139(2) . . . . ?
C9 C10 C1 C2 0.0 . . . . ?
C9 C10 C11 C12 179(3) . . . . ?
C9 C10 C11 C16 -7(3) . . . . ?
C10 C11 C12 C13 173(4) . . . . ?
C10 C11 C16 N1 3(3) . . . . ?
C10 C11 C16 C15 -175(3) . . . . ?
C1 C2 C3 C8 0.0 . . . . ?
C1 C2 C3 C4 176(4) . . . . ?
C1 C10 C11 C12 1(5) . . . . ?
C1 C10 C11 C16 175(2) . . . . ?
C2' C1' C10' C9' 12(6) . . . . ?
C2' C1' C10' C11' -174(4) . . . . ?
C2' C3' C4' C5' -176(4) . . . . ?
C2' C3' C8' C7' 177(5) . . . . ?
C2' C3' C8' C9' -13(6) . . . . ?
C3' C4' C5' C6' -3(9) . . . . ?
C3' C8' C9' N1' 177(6) . . . . ?
C3' C8' C9' C10' 15(6) . . . . ?
C4 C3 C8 C9 -176(4) . . . . ?
C4 C3 C8 C7 -3(5) . . . . ?
C4 C5 C6 C7 -11(11) . . . . ?
C4' C3' C8' C7' 5(7) . . . . ?
C4' C3' C8' C9' 175(4) . . . . ?
C4' C5' C6' C7' 10(11) . . . . ?
C5 C6 C7 C8 2(11) . . . . ?
C5' C6' C7' C8' -9(10) . . . . ?
C6' C7' C8' C3' 1(9) . . . . ?
C6' C7' C8' C9' -169(5) . . . . ?
C7 C8 C9 N1 0(4) . . . . ?
C7 C8 C9 C10 -173(4) . . . . ?
C7' C8' C9' N1' -12(8) . . . . ?
C7' C8' C9' C10' -175(5) . . . . ?
C8' C3' C4' C5' -5(6) . . . . ?
C8' C9' C10' C1' -14(6) . . . . ?
C8' C9' C10' C11' 170(4) . . . . ?
C9' N1' C16' C11' 4(6) . . . . ?
C9' N1' C16' C15' -173(4) . . . . ?
C9' C10' C11' C16' -2(4) . . . . ?
C9' C10' C11' C12' 173(4) . . . . ?
C10' C1' C2' Ag1 -133(3) . . . . ?
C10' C1' C2' Ag4 135(3) . . . . ?
C10' C1' C2' C3' -10(5) . . . . ?
C10' C11' C12' C13' -175(5) . . . . ?
C11 C10 C1 Ag1 -44(3) . . . . ?
C11 C10 C1 Ag4 40(3) . . . . ?
C11 C10 C1 C2 178(3) . . . . ?
C11 C12 C13 C14 0.0 . . . . ?
C12 C11 C16 N1 178(4) . . . . ?
C12 C11 C16 C15 0.0 . . . . ?
C12 C13 C14 C15 0.0 . . . . ?
C13 C14 C15 C16 0.0 . . . . ?
C14 C15 C16 N1 -178(5) . . . . ?
C14 C15 C16 C11 0.0 . . . . ?
C16 N1 C9 C8 -178(3) . . . . ?
C16 N1 C9 C10 -5(4) . . . . ?
C16 C11 C12 C13 0.0 . . . . ?
C16' N1' C9' C8' -168(5) . . . . ?
C16' N1' C9' C10' -5(7) . . . . ?
C16' C11' C12' C13' 0.0 . . . . ?
C11' C16' C15' C14' 0.0 . . . . ?
C11' C12' C13' C14' 0.0 . . . . ?
C12' C13' C14' C15' 0.0 . . . . ?
C13' C14' C15' C16' 0.0 . . . . ?
C15' C16' C11' C10' 176(4) . . . . ?
C15' C16' C11' C12' 0.0 . . . . ?
C17 N2 C21 N3 -176.9(18) . . . . ?
C17 N2 C21 C20 7(3) . . . . ?
C17 N17 C63 N16 130.3(19) . . . . ?
C17 N17 C63 C62 -50(3) . . . . ?
C17 C18 C19 C20 7(3) . . . . ?
C18 C19 C20 C21 -4(4) . . . . ?
C19 C20 C21 N2 -3(4) . . . . ?
C19 C20 C21 N3 -178(2) . . . . ?
C21 N2 C17 N17 179.2(18) . . . . ?
C21 N2 C17 C18 -4(3) . . . . ?
C21 N3 C23 N4 22(3) . . . . ?
C21 N3 C23 C24 -168(3) . . . . ?
C22 N3 C21 N2 88(3) . . . . ?
C22 N3 C21 C20 -96(3) . . . . ?
C22 N3 C23 N4 -180(2) . . . . ?
C22 N3 C23 C24 -10(4) . . . . ?
C23 N3 C21 N2 -113(2) . . . . ?
C23 N3 C21 C20 62(3) . . . . ?
C23 N4 C27 N5 178(2) . . . . ?
C23 N4 C27 C26 -8(4) . . . . ?
C23 C24 C25 C26 3(6) . . . . ?
C24 C25 C26 C27 -2(6) . . . . ?
C25 C26 C27 N4 4(4) . . . . ?
C25 C26 C27 N5 177(3) . . . . ?
C27 N4 C23 N3 178(2) . . . . ?
C27 N4 C23 C24 9(4) . . . . ?
C27 N5 C29 N6 88(3) . . . . ?
C27 N5 C29 C30 -87(3) . . . . ?
C28 N5 C27 N4 -171(2) . . . . ?
C28 N5 C27 C26 15(4) . . . . ?
C28 N5 C29 N6 -117(3) . . . . ?
C28 N5 C29 C30 68(4) . . . . ?
C29 N5 C27 N4 -17(3) . . . . ?
C29 N5 C27 C26 169(3) . . . . ?
C29 N6 C33 N7 -175(2) . . . . ?
C29 N6 C33 C32 9(3) . . . . ?
C29 C30 C31 C32 5(4) . . . . ?
C30 C31 C32 C33 -4(3) . . . . ?
C31 C32 C33 N6 -3(3) . . . . ?
C31 C32 C33 N7 -178.6(18) . . . . ?
C33 N6 C29 N5 175.8(19) . . . . ?
C33 N6 C29 C30 -9(4) . . . . ?
C33 N7 C35 N8 -143.1(17) . . . . ?
C33 N7 C35 C36 36(3) . . . . ?
C34 N7 C33 N6 -163.2(18) . . . . ?
C34 N7 C33 C32 13(3) . . . . ?
C34 N7 C35 N8 58(2) . . . . ?
C34 N7 C35 C36 -123(2) . . . . ?
C35 N7 C33 N6 39(3) . . . . ?
C35 N7 C33 C32 -144.4(18) . . . . ?
C35 N8 C39 N9 175.2(17) . . . . ?
C35 N8 C39 C38 -4(3) . . . . ?
C35 C36 C37 C38 0(4) . . . . ?
C36 C37 C38 C39 0(4) . . . . ?
C37 C38 C39 N8 2(3) . . . . ?
C37 C38 C39 N9 -177(2) . . . . ?
C39 N8 C35 N7 -177.0(16) . . . . ?
C39 N8 C35 C36 4(3) . . . . ?
C39 N9 C41 N10 -22(3) . . . . ?
C39 N9 C41 C42 164(2) . . . . ?
C40 N9 C39 N8 -71(2) . . . . ?
C40 N9 C39 C38 109(2) . . . . ?
C40 N9 C41 N10 -179.9(18) . . . . ?
C40 N9 C41 C42 6(3) . . . . ?
C41 N9 C39 N8 131(2) . . . . ?
C41 N9 C39 C38 -49(3) . . . . ?
C41 N10 C45 N11 -172.2(19) . . . . ?
C41 N10 C45 C44 -1(3) . . . . ?
C41 C42 C43 C44 -1(3) . . . . ?
C42 C43 C44 C45 -4(4) . . . . ?
C43 C44 C45 N10 5(4) . . . . ?
C43 C44 C45 N11 176(2) . . . . ?
C45 N10 C41 N9 -178.4(19) . . . . ?
C45 N10 C41 C42 -4(3) . . . . ?
C45 N11 C47 N12 -6(3) . . . . ?
C45 N11 C47 C48 178(2) . . . . ?
C46 N11 C45 N10 63(3) . . . . ?
C46 N11 C45 C44 -108(3) . . . . ?
C46 N11 C47 N12 -176(2) . . . . ?
C46 N11 C47 C48 9(4) . . . . ?
C47 N11 C45 N10 -106(3) . . . . ?
C47 N11 C45 C44 83(3) . . . . ?
C47 N12 C51 N13 -177.9(19) . . . . ?
C47 N12 C51 C50 6(4) . . . . ?
C47 C48 C49 C50 -7(6) . . . . ?
C48 C49 C50 C51 5(6) . . . . ?
C49 C50 C51 N12 -5(5) . . . . ?
C49 C50 C51 N13 179(3) . . . . ?
C51 N12 C47 N11 176.8(19) . . . . ?
C51 N12 C47 C48 -8(3) . . . . ?
C51 N13 C53 N14 80(3) . . . . ?
C51 N13 C53 C54 -98(3) . . . . ?
C52 N13 C51 N12 -175(2) . . . . ?
C52 N13 C51 C50 1(4) . . . . ?
C52 N13 C53 N14 -104(3) . . . . ?
C52 N13 C53 C54 78(3) . . . . ?
C53 N13 C51 N12 1(3) . . . . ?
C53 N13 C51 C50 177(3) . . . . ?
C53 N14 C57 N15 -179.1(18) . . . . ?
C53 N14 C57 C56 7(3) . . . . ?
C53 C54 C55 C56 1(3) . . . . ?
C54 C55 C56 C57 2(3) . . . . ?
C55 C56 C57 N14 -6(3) . . . . ?
C55 C56 C57 N15 -179.9(19) . . . . ?
C57 N14 C53 N13 178.2(17) . . . . ?
C57 N14 C53 C54 -4(3) . . . . ?
C57 N15 C59 N16 -147.4(17) . . . . ?
C57 N15 C59 C60 34(2) . . . . ?
C58 N15 C57 N14 -167.6(18) . . . . ?
C58 N15 C57 C56 7(3) . . . . ?
C58 N15 C59 N16 61(2) . . . . ?
C58 N15 C59 C60 -117.5(19) . . . . ?
C59 N15 C57 N14 43(3) . . . . ?
C59 N15 C57 C56 -142.1(18) . . . . ?
C59 N16 C63 N17 176.1(16) . . . . ?
C59 N16 C63 C62 -4(3) . . . . ?
C59 C60 C61 C62 1(3) . . . . ?
C60 C61 C62 C63 -1(3) . . . . ?
C61 C62 C63 N16 2(3) . . . . ?
C61 C62 C63 N17 -177(2) . . . . ?
C63 N16 C59 N15 -175.3(16) . . . . ?
C63 N16 C59 C60 3(3) . . . . ?
C63 N17 C17 N2 -27(3) . . . . ?
C63 N17 C17 C18 156.3(19) . . . . ?
C64 N17 C17 N2 -175.7(18) . . . . ?
C64 N17 C17 C18 8(3) . . . . ?
C64 N17 C63 N16 -80(2) . . . . ?
C64 N17 C63 C62 99(3) . . . . ?
O1 S1 C65 F1 60(2) . . . . ?
O1 S1 C65 F2 -60(2) . . . . ?
O1 S1 C65 F3 179(2) . . . . ?
O2 S1 C65 F1 -60(2) . . . . ?
O2 S1 C65 F2 180(2) . . . . ?
O2 S1 C65 F3 59(2) . . . . ?
O3 S1 C65 F1 178(2) . . . . ?
O3 S1 C65 F2 58(2) . . . . ?
O3 S1 C65 F3 -63(2) . . . . ?
O4 S2 C66 F4 -58(2) . . . . ?
O4 S2 C66 F5 65.9(19) . . . . ?
O4 S2 C66 F6 -177.6(16) . . . . ?
O5 S2 C66 F4 -178(2) . . . . ?
O5 S2 C66 F5 -54(2) . . . . ?
O5 S2 C66 F6 63(2) . . . . ?
O6 S2 C66 F4 60(2) . . . . ?
O6 S2 C66 F5 -176.1(17) . . . . ?
O6 S2 C66 F6 -59.7(18) . . . . ?
O7 S3 C67 F7 -176(3) . . . . ?
O7 S3 C67 F8 65(3) . . . . ?
O7 S3 C67 F9 -56(3) . . . . ?
O7' S3' C67' F7' 3(3) . . . . ?
O7' S3' C67' F8' 123(3) . . . . ?
O7' S3' C67' F9' -117(3) . . . . ?
O8 S3 C67 F7 -57(3) . . . . ?
O8 S3 C67 F8 -175(3) . . . . ?
O8 S3 C67 F9 64(3) . . . . ?
O8' S3' C67' F7' 122(3) . . . . ?
O8' S3' C67' F8' -118(3) . . . . ?
O8' S3' C67' F9' 2(3) . . . . ?
O9 S3 C67 F7 57(2) . . . . ?
O9 S3 C67 F8 -61(2) . . . . ?
O9 S3 C67 F9 178(2) . . . . ?
O9' S3' C67' F7' -117(3) . . . . ?
O9' S3' C67' F8' 3(3) . . . . ?
O9' S3' C67' F9' 124(3) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_y_CCDC5
_database_code_depnum_ccdc_archive 'CCDC 1558955'

_audit_update_record             
;
2017-06-28 deposited with the CCDC.
2017-12-04 downloaded from the CCDC.
;
_audit_creation_date             2017-06-05
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.03.28 svn.r3405 for OlexSys, GUI svn.r5337)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C56 H53 Ag5 N17, 2(C F3 O3 S)'
_chemical_formula_sum            'C58 H53 Ag5 F6 N17 O6 S2'
_chemical_formula_weight         1801.64
_chemical_absolute_configuration ad
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           1
_space_group_name_H-M_alt        'P 1'
_space_group_name_Hall           'P 1'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'

_cell_length_a                   12.278(3)
_cell_length_b                   25.145(5)
_cell_length_c                   12.408(3)
_cell_angle_alpha                90.00(3)
_cell_angle_beta                 117.31(3)
_cell_angle_gamma                90.00(3)
_cell_volume                     3403.6(12)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    12843
_cell_measurement_temperature    173.1500
_cell_measurement_theta_max      31.3642
_cell_measurement_theta_min      1.8667
_exptl_absorpt_coefficient_mu    1.551
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6445
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.758
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1778
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.11
_exptl_special_details           
;
 ?
;
_diffrn_reflns_av_R_equivalents  0.1303
_diffrn_reflns_av_unetI/netI     0.0842
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       29
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            17911
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         0.81
_diffrn_ambient_temperature      173.1500
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.931
_diffrn_measured_fraction_theta_max 0.931
_diffrn_measurement_details      
;
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 4.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 180.0000
	             XTD: 45.0552
	          2theta: -20.3977
scan:
	Number of images: 240
	           Slice: -110.0000 - 10.0000
	     Image width: 0.5000
	        Exp time: 4.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 0.0000
	             XTD: 45.0552
	          2theta: -20.3977
;
_diffrn_measurement_device       
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_device_details 
;
AFC10: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_number_total             7969
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      0.0678
_diffrn_orient_matrix_UB_12      0.0227
_diffrn_orient_matrix_UB_13      -0.0574
_diffrn_orient_matrix_UB_21      -0.0190
_diffrn_orient_matrix_UB_22      0.0337
_diffrn_orient_matrix_UB_23      -0.0091
_diffrn_orient_matrix_UB_31      0.0690
_diffrn_orient_matrix_UB_32      0.0481
_diffrn_orient_matrix_UB_33      0.0340
_diffrn_radiation_detector       CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Rotating Anode'
_diffrn_source_current           24.0000
_diffrn_source_power             1.2000
_diffrn_source_voltage           50.0000
_diffrn_special_details          
;
 ?
;
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         ?
_reflns_number_gt                15934
_reflns_number_total             17911
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XH (Sheldrick, 2008)'
_computing_structure_solution    
;
????
;
_refine_diff_density_max         2.377
_refine_diff_density_min         -1.447
_refine_diff_density_rms         0.169
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.21(5)
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1673
_refine_ls_number_reflns         17911
_refine_ls_number_restraints     184
_refine_ls_R_factor_all          0.0954
_refine_ls_R_factor_gt           0.0889
_refine_ls_restrained_S_all      1.025
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.1002P)²+36.2450P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2180
_refine_ls_wR_factor_ref         0.2260
_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 > 2sigma(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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Rigid bond restraints
 C57, C58, C85, C84, C108, C109, C109, C110, S2, C114, S3, C115
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
3. Uiso/Uaniso restraints and constraints
C57 \\sim C58 \\sim C85 \\sim C84 \\sim C108 \\sim C109 \\sim C109 \\sim C110
\\sim S2 \\sim C114 \\sim S3 \\sim C115: within 2A with sigma of 0.01 and sigma
for terminal atoms of 0.02
Uanis(C51) \\sim Ueq, Uanis(C57) \\sim Ueq, Uanis(C58) \\sim Ueq, Uanis(N18)
\\sim Ueq, Uanis(C107) \\sim Ueq, Uanis(C43) \\sim Ueq, Uanis(C113) \\sim Ueq,
Uanis(C2) \\sim Ueq, Uanis(F3) \\sim Ueq, Uanis(C110) \\sim Ueq, Uanis(C84)
\\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.005
Uanis(C59) \\sim Ueq, Uanis(C64) \\sim Ueq, Uanis(C63) \\sim Ueq, Uanis(C61)
\\sim Ueq, Uanis(C87) \\sim Ueq, Uanis(C86) \\sim Ueq, Uanis(N18) \\sim Ueq,
Uanis(C111) \\sim Ueq, Uanis(C55) \\sim Ueq, Uanis(N23) \\sim Ueq: with sigma
of 0.005 and sigma for terminal atoms of 0.005
Uanis(C3) \\sim Ueq, Uanis(C8) \\sim Ueq: with sigma of 0.001 and sigma for
terminal atoms of 0.001
4.a Aromatic/amide H refined with riding coordinates:
 N1(H1), C4(H4), C5(H5), C6(H6), C7(H7), C10(H10), C11(H11), C12(H12),
 C16(H16), C17(H17), C18(H18), C22(H22), C23(H23), C24(H24), C28(H28), C29(H29),
  C30(H30), C34(H34), C35(H35), C36(H36), C40(H40), C41(H41), C42(H42),
 C46(H46), C47(H47), C48(H48), C52(H52), C53(H53), C54(H54), N18(H18A),
 C60(H60), C61(H61), C62(H62), C63(H63), C66(H66), C67(H67), C68(H68), C72(H72),
  C73(H73), C74(H74), C78(H78), C79(H79), C80(H80), C86(H86), C85(H85),
 C84(H84), C90(H90), C91(H91), C92(H92), C96(H96), C97(H97), C98(H98),
 C102(H102), C103(H103), C104(H104), C108(H108), C109(H109), C110(H110)
4.b Fitted hexagon refined as free rotating group:
 C3(C4,C5,C6,C7,C8), C64(C59,C60,C61,C62,C63), C83(N25,C87,C86,C85,C84)
4.c Idealised Me refined as rotating group:
 C14(H14A,H14B,H14C), C20(H20A,H20B,H20C), C26(H26A,H26B,H26C), C32(H32A,H32B,
 H32C), C38(H38A,H38B,H38C), C44(H44A,H44B,H44C), C50(H50A,H50B,H50C), C56(H56A,
 H56B,H56C), C70(H70A,H70B,H70C), C76(H76A,H76B,H76C), C82(H82A,H82B,H82C),
 C88(H88A,H88B,H88C), C94(H94A,H94B,H94C), C100(H10A,H10B,H10C), C106(H10D,H10E,
 H10F), C112(H11A,H11B,H11C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Ag1 Ag -1.61744(12) 0.73057(6) -0.45226(11) 0.0388(3) Uani 1 d . . . .
Ag2 Ag -1.61792(12) 0.61797(6) -0.45269(11) 0.0386(3) Uani 1 d . . . .
Ag3 Ag -1.84478(11) 0.61813(5) -0.70414(11) 0.0374(3) Uani 1 d . . . .
Ag4 Ag -1.84501(12) 0.73070(5) -0.70427(11) 0.0376(3) Uani 1 d . . . .
Ag5 Ag -1.54610(12) 0.67422(6) -0.71570(12) 0.0378(3) Uani 1 d . . . .
N1 N -1.9594(10) 0.6748(5) -0.5727(10) 0.023(3) Uani 1 d . . . .
H1 H -2.0320 0.6747 -0.6327 0.027 Uiso 1 calc . . R .
N2 N -1.5127(14) 0.8029(6) -0.4465(15) 0.042(4) Uani 1 d . . . .
N3 N -1.4060(14) 0.7658(6) -0.5391(14) 0.039(4) Uani 1 d . . . .
N4 N -1.4032(16) 0.6755(6) -0.5277(12) 0.044(4) Uani 1 d . . . .
N5 N -1.4064(14) 0.5812(8) -0.5383(14) 0.049(5) Uani 1 d . . . .
N6 N -1.5176(14) 0.5452(7) -0.4465(14) 0.044(4) Uani 1 d . . . .
N7 N -1.6174(15) 0.5160(8) -0.3431(15) 0.049(4) Uani 1 d . . . .
N8 N -1.7958(15) 0.5147(7) -0.5160(15) 0.050(4) Uani 1 d . . . .
N9 N -1.9603(15) 0.5174(7) -0.7050(15) 0.044(4) Uani 1 d . . . .
N10 N -1.8322(14) 0.5456(6) -0.7874(14) 0.041(4) Uani 1 d . . . .
N11 N -1.7149(13) 0.5825(7) -0.8726(13) 0.037(3) Uani 1 d . . . .
N12 N -1.7246(15) 0.6759(7) -0.8748(15) 0.042(4) Uani 1 d . . . .
N13 N -1.7142(13) 0.7671(7) -0.8738(13) 0.040(4) Uani 1 d . . . .
N14 N -1.8308(14) 0.8029(6) -0.7853(14) 0.040(4) Uani 1 d . . . .
N15 N -1.9571(14) 0.8315(6) -0.7019(14) 0.039(4) Uani 1 d . . . .
N16 N -1.7979(13) 0.8340(6) -0.5220(13) 0.038(4) Uani 1 d . . . .
N17 N -1.617(2) 0.8341(7) -0.3419(16) 0.059(5) Uani 1 d . . . .
C1 C -1.8587(19) 0.6763(7) -0.5873(16) 0.041(4) Uani 1 d . . . .
C2 C -1.7551(14) 0.6750(6) -0.4670(13) 0.030(3) Uani 1 d . . . U
C3 C -1.8112(8) 0.6747(5) -0.3884(8) 0.039(4) Uani 1 d . . . U
C4 C -1.7559(7) 0.6753(5) -0.2623(8) 0.035(4) Uani 1 d . . G .
H4 H -1.6710 0.6761 -0.2182 0.042 Uiso 1 calc . . R .
C5 C -1.8277(11) 0.6747(6) -0.2024(7) 0.057(5) Uani 1 d . . G .
H5 H -1.7907 0.6751 -0.1180 0.068 Uiso 1 calc . . R .
C6 C -1.9547(10) 0.6734(6) -0.2684(10) 0.062(6) Uani 1 d . . G .
H6 H -2.0027 0.6730 -0.2283 0.074 Uiso 1 calc . . R .
C7 C -2.0100(7) 0.6728(5) -0.3944(10) 0.061(6) Uani 1 d . . G .
H7 H -2.0950 0.6720 -0.4386 0.073 Uiso 1 calc . . R .
C8 C -1.9382(8) 0.6734(4) -0.4544(7) 0.010(2) Uani 1 d . . G U
C9 C -1.563(2) 0.8433(8) -0.411(2) 0.045(5) Uani 1 d . . . .
C10 C -1.539(2) 0.8963(8) -0.435(2) 0.059(6) Uani 1 d . . . .
H10 H -1.5655 0.9249 -0.4065 0.071 Uiso 1 calc . . R .
C11 C -1.476(2) 0.9059(9) -0.502(2) 0.061(6) Uani 1 d . . . .
H11 H -1.4639 0.9403 -0.5222 0.073 Uiso 1 calc . . R .
C12 C -1.4310(17) 0.8628(9) -0.537(2) 0.051(5) Uani 1 d . . . .
H12 H -1.3888 0.8673 -0.5822 0.062 Uiso 1 calc . . R .
C13 C -1.4503(18) 0.8109(8) -0.5030(17) 0.039(4) Uani 1 d . . . .
C14 C -1.331(2) 0.7748(8) -0.5996(17) 0.050(5) Uani 1 d . . . .
H14A H -1.3778 0.7941 -0.6734 0.074 Uiso 1 calc . . GR .
H14B H -1.3065 0.7412 -0.6181 0.074 Uiso 1 calc . . GR .
H14C H -1.2600 0.7949 -0.5476 0.074 Uiso 1 calc . . GR .
C15 C -1.3728(19) 0.7227(9) -0.464(2) 0.051(5) Uani 1 d . . . .
C16 C -1.3161(14) 0.7226(8) -0.3418(14) 0.037(4) Uani 1 d . . . .
H16 H -1.2943 0.7547 -0.3001 0.044 Uiso 1 calc . . R .
C17 C -1.288(2) 0.6716(12) -0.272(3) 0.075(8) Uani 1 d . . . .
H17 H -1.2532 0.6707 -0.1880 0.090 Uiso 1 calc . . R .
C18 C -1.3151(19) 0.6275(10) -0.3390(16) 0.051(5) Uani 1 d . . . .
H18 H -1.2933 0.5949 -0.2992 0.061 Uiso 1 calc . . R .
C19 C -1.3748(14) 0.6277(8) -0.4653(17) 0.041(5) Uani 1 d . . . .
C20 C -1.333(2) 0.5705(10) -0.6064(18) 0.054(5) Uani 1 d . . . .
H20A H -1.2928 0.6026 -0.6103 0.081 Uiso 1 calc . . GR .
H20B H -1.3872 0.5587 -0.6870 0.081 Uiso 1 calc . . GR .
H20C H -1.2730 0.5436 -0.5649 0.081 Uiso 1 calc . . GR .
C21 C -1.4484(17) 0.5365(8) -0.5018(18) 0.044(5) Uani 1 d . . . .
C22 C -1.4294(17) 0.4852(9) -0.5400(18) 0.049(5) Uani 1 d . . . .
H22 H -1.3869 0.4803 -0.5850 0.059 Uiso 1 calc . . R .
C23 C -1.4788(19) 0.4439(9) -0.505(2) 0.052(5) Uani 1 d . . . .
H23 H -1.4665 0.4093 -0.5238 0.063 Uiso 1 calc . . R .
C24 C -1.549(2) 0.4518(9) -0.440(2) 0.057(6) Uani 1 d . . . .
H24 H -1.5827 0.4236 -0.4180 0.068 Uiso 1 calc . . R .
C25 C -1.562(2) 0.5044(10) -0.413(2) 0.054(6) Uani 1 d . . . .
C26 C -1.547(2) 0.5299(11) -0.2087(19) 0.074(8) Uani 1 d . . . .
H26A H -1.4609 0.5285 -0.1835 0.111 Uiso 1 calc . . GR .
H26B H -1.5677 0.5049 -0.1623 0.111 Uiso 1 calc . . GR .
H26C H -1.5694 0.5651 -0.1959 0.111 Uiso 1 calc . . GR .
C27 C -1.7464(16) 0.5217(6) -0.3971(16) 0.037(4) Uani 1 d . . . .
C28 C -1.818(2) 0.5328(6) -0.340(2) 0.052(5) Uani 1 d . . . .
H28 H -1.7820 0.5370 -0.2560 0.062 Uiso 1 calc . . R .
C29 C -1.9447(18) 0.5376(8) -0.410(2) 0.058(6) Uani 1 d . . . .
H29 H -1.9934 0.5441 -0.3723 0.069 Uiso 1 calc . . R .
C30 C -1.9977(16) 0.5330(6) -0.5318(18) 0.037(4) Uani 1 d . . . .
H30 H -2.0819 0.5362 -0.5796 0.045 Uiso 1 calc . . R .
C31 C -1.915(2) 0.5226(8) -0.584(2) 0.060(7) Uani 1 d . . . .
C32 C -2.085(2) 0.5279(9) -0.785(2) 0.068(7) Uani 1 d . . . .
H32A H -2.0993 0.5244 -0.8670 0.102 Uiso 1 calc . . GR .
H32B H -2.1052 0.5634 -0.7713 0.102 Uiso 1 calc . . GR .
H32C H -2.1359 0.5030 -0.7693 0.102 Uiso 1 calc . . GR .
C33 C -1.8792(16) 0.5026(8) -0.7607(16) 0.036(4) Uani 1 d . . . .
C34 C -1.855(2) 0.4527(8) -0.7651(18) 0.048(5) Uani 1 d . . . .
H34 H -1.8886 0.4258 -0.7384 0.057 Uiso 1 calc . . R .
C35 C -1.7731(17) 0.4428(8) -0.8138(18) 0.044(5) Uani 1 d . . . .
H35 H -1.7515 0.4080 -0.8207 0.053 Uiso 1 calc . . R .
C36 C -1.7232(18) 0.4856(7) -0.8525(19) 0.044(5) Uani 1 d . . . .
H36 H -1.6702 0.4798 -0.8859 0.052 Uiso 1 calc . . R .
C37 C -1.7584(16) 0.5361(8) -0.8375(16) 0.036(4) Uani 1 d . . . .
C38 C -1.6417(18) 0.5708(11) -0.939(2) 0.065(7) Uani 1 d . . . .
H38A H -1.6801 0.5426 -0.9960 0.098 Uiso 1 calc . . GR .
H38B H -1.5602 0.5604 -0.8820 0.098 Uiso 1 calc . . GR .
H38C H -1.6380 0.6021 -0.9815 0.098 Uiso 1 calc . . GR .
C39 C -1.7860(17) 0.6262(7) -0.9093(15) 0.035(4) Uani 1 d . . . .
C40 C -1.9161(16) 0.6276(8) -0.9791(13) 0.037(4) Uani 1 d . . . .
H40 H -1.9602 0.5960 -1.0031 0.045 Uiso 1 calc . . R .
C41 C -1.9750(18) 0.6743(8) -1.010(2) 0.049(5) Uani 1 d . . . .
H41 H -2.0598 0.6743 -1.0561 0.059 Uiso 1 calc . . R .
C42 C -1.9144(18) 0.7227(9) -0.9756(15) 0.048(5) Uani 1 d . . . .
H42 H -1.9575 0.7546 -0.9975 0.058 Uiso 1 calc . . R .
C43 C -1.7884(15) 0.7222(7) -0.9079(14) 0.032(4) Uani 1 d . . . U
C44 C -1.643(2) 0.7808(9) -0.942(2) 0.064(7) Uani 1 d . . . .
H44A H -1.6982 0.7921 -1.0223 0.096 Uiso 1 calc . . GR .
H44B H -1.5982 0.7501 -0.9453 0.096 Uiso 1 calc . . GR .
H44C H -1.5862 0.8091 -0.9001 0.096 Uiso 1 calc . . GR .
C45 C -1.7558(15) 0.8131(6) -0.8404(15) 0.031(4) Uani 1 d . . . .
C46 C -1.7182(17) 0.8627(8) -0.8509(16) 0.042(5) Uani 1 d . . . .
H46 H -1.6652 0.8686 -0.8844 0.051 Uiso 1 calc . . R .
C47 C -1.7636(18) 0.9047(10) -0.8085(19) 0.051(5) Uani 1 d . . . .
H47 H -1.7386 0.9392 -0.8125 0.062 Uiso 1 calc . . R .
C48 C -1.847(2) 0.8962(8) -0.759(2) 0.061(7) Uani 1 d . . . .
H48 H -1.8773 0.9238 -0.7312 0.073 Uiso 1 calc . . R .
C49 C -1.8786(18) 0.8454(7) -0.7570(16) 0.037(4) Uani 1 d . . . .
C50 C -2.087(2) 0.8235(12) -0.788(3) 0.078(8) Uani 1 d . . . .
H50A H -2.1362 0.8483 -0.7701 0.116 Uiso 1 calc . . GR .
H50B H -2.1107 0.7879 -0.7804 0.116 Uiso 1 calc . . GR .
H50C H -2.0990 0.8293 -0.8690 0.116 Uiso 1 calc . . GR .
C51 C -1.9193(17) 0.8280(7) -0.5864(16) 0.039(4) Uani 1 d . . . U
C52 C -1.996(2) 0.8166(8) -0.532(2) 0.055(6) Uani 1 d . . . .
H52 H -2.0799 0.8124 -0.5786 0.066 Uiso 1 calc . . R .
C53 C -1.9429(19) 0.8119(7) -0.4068(19) 0.047(5) Uani 1 d . . . .
H53 H -1.9918 0.8054 -0.3691 0.056 Uiso 1 calc . . R .
C54 C -1.817(2) 0.8169(7) -0.337(2) 0.054(6) Uani 1 d . . . .
H54 H -1.7793 0.8128 -0.2535 0.065 Uiso 1 calc . . R .
C55 C -1.7482(18) 0.8283(8) -0.3981(17) 0.043(4) Uani 1 d . . . U
C56 C -1.547(2) 0.8192(12) -0.210(2) 0.075(8) Uani 1 d . . . .
H56A H -1.5788 0.7866 -0.1960 0.112 Uiso 1 calc . . GR .
H56B H -1.5543 0.8469 -0.1610 0.112 Uiso 1 calc . . GR .
H56C H -1.4619 0.8144 -0.1900 0.112 Uiso 1 calc . . GR .
Ag6 Ag -0.74970(18) 0.11845(7) 0.6888(2) 0.0696(6) Uani 1 d B . . .
Ag7 Ag -0.75032(18) 0.23065(7) 0.6883(2) 0.0692(6) Uani 1 d B . . .
Ag8 Ag -0.9975(2) 0.23069(7) 0.45873(17) 0.0693(6) Uani 1 d . . . .
Ag9 Ag -0.9976(2) 0.11828(7) 0.45846(17) 0.0699(6) Uani 1 d B . . .
Ag10 Ag -1.01923(14) 0.17486(6) 0.75323(13) 0.0464(4) Uani 1 d . . . .
N18 N -0.8717(16) 0.1743(7) 0.3376(17) 0.057(4) Uani 1 d . . . U
H18A H -0.9268 0.1736 0.2630 0.068 Uiso 1 calc A . R .
N19 N -0.7455(16) 0.0455(7) 0.7941(19) 0.056(5) Uani 1 d . . . .
N20 N -0.8487(16) 0.0824(6) 0.8926(16) 0.048(4) Uani 1 d . . . .
N21 N -0.8351(14) 0.1747(6) 0.8952(16) 0.049(4) Uani 1 d . . . .
N22 N -0.8485(16) 0.2686(6) 0.8905(19) 0.058(5) Uani 1 d . . . .
N23 N -0.7466(16) 0.3043(7) 0.7898(16) 0.051(4) Uani 1 d . . . U
N24 N -0.6324(16) 0.3325(8) 0.689(2) 0.064(6) Uani 1 d . . . .
N26 N -0.993(2) 0.3312(8) 0.3441(18) 0.072(6) Uani 1 d B . . .
N27 N -1.0806(17) 0.3038(7) 0.4698(14) 0.049(4) Uani 1 d B . . .
N28 N -1.1710(15) 0.2696(6) 0.5811(11) 0.041(4) Uani 1 d B . . .
N29 N -1.1702(12) 0.1755(5) 0.5720(10) 0.024(3) Uani 1 d B . . .
N30 N -1.1753(18) 0.0797(7) 0.5777(13) 0.053(5) Uani 1 d B . . .
N31 N -1.0793(18) 0.0450(7) 0.4701(15) 0.056(5) Uani 1 d . . . .
N32 N -0.991(2) 0.0207(8) 0.3422(19) 0.072(6) Uani 1 d . . . .
N33 N -0.8147(17) 0.0176(7) 0.5047(15) 0.048(4) Uani 1 d . . . .
N34 N -0.6347(16) 0.0154(8) 0.693(2) 0.065(6) Uani 1 d . . . .
C57 C -0.889(2) 0.1752(9) 0.437(2) 0.062(5) Uani 1 d B 1 . U
C58 C -0.7677(18) 0.1739(8) 0.5530(18) 0.046(4) Uani 1 d . . . U
C64 C -0.7495(9) 0.1748(5) 0.3802(9) 0.032(3) Uani 1 d B . . U
C59 C -0.6733(9) 0.1752(5) 0.5046(8) 0.034(3) Uani 1 d B . G U
C60 C -0.5468(9) 0.1748(6) 0.5489(10) 0.057(5) Uani 1 d . . G .
H60 H -0.4958 0.1751 0.6321 0.069 Uiso 1 calc B . R .
C61 C -0.4964(10) 0.1740(9) 0.4688(17) 0.140(15) Uani 1 d B . G U
H61 H -0.4118 0.1737 0.4985 0.168 Uiso 1 calc . . R .
C62 C -0.5726(17) 0.1736(11) 0.3445(15) 0.111(12) Uani 1 d . . G .
H62 H -0.5390 0.1730 0.2909 0.133 Uiso 1 calc B . R .
C63 C -0.6992(16) 0.1740(9) 0.3001(9) 0.127(13) Uani 1 d B . G U
H63 H -0.7501 0.1737 0.2169 0.153 Uiso 1 calc . . R .
C65 C -0.7043(19) 0.0041(8) 0.744(2) 0.053(6) Uani 1 d B . . .
C66 C -0.731(2) -0.0473(10) 0.767(2) 0.061(6) Uani 1 d . . . .
H66 H -0.6999 -0.0760 0.7415 0.073 Uiso 1 calc B . R .
C67 C -0.800(2) -0.0570(8) 0.825(2) 0.067(8) Uani 1 d B . . .
H67 H -0.8222 -0.0918 0.8310 0.081 Uiso 1 calc . . R .
C68 C -0.836(2) -0.0177(8) 0.8726(19) 0.051(5) Uani 1 d . . . .
H68 H -0.8789 -0.0242 0.9166 0.062 Uiso 1 calc B . R .
C69 C -0.805(2) 0.0374(10) 0.852(2) 0.058(6) Uani 1 d B . . .
C70 C -0.916(2) 0.0783(8) 0.961(2) 0.065(6) Uani 1 d . . . .
H70A H -0.9904 0.0589 0.9154 0.097 Uiso 1 calc . . GR .
H70B H -0.9352 0.1133 0.9785 0.097 Uiso 1 calc . . GR .
H70C H -0.8670 0.0601 1.0362 0.097 Uiso 1 calc . . GR .
C71 C -0.766(2) 0.1313(9) 0.933(2) 0.067(7) Uani 1 d . . . .
C72 C -0.647(2) 0.1257(8) 0.988(2) 0.060(6) Uani 1 d . . . .
H72 H -0.6087 0.0927 1.0073 0.071 Uiso 1 calc . . R .
C73 C -0.5813(17) 0.1744(10) 1.016(2) 0.061(6) Uani 1 d . . . .
H73 H -0.4962 0.1742 1.0582 0.073 Uiso 1 calc . . R .
C74 C -0.647(2) 0.2244(9) 0.980(2) 0.066(7) Uani 1 d . . . .
H74 H -0.6086 0.2572 0.9889 0.079 Uiso 1 calc . . R .
C75 C -0.7708(19) 0.2177(8) 0.931(2) 0.055(6) Uani 1 d . . . .
C76 C -0.914(3) 0.2730(10) 0.967(2) 0.070(7) Uani 1 d . . . .
H76A H -0.9193 0.2384 0.9965 0.105 Uiso 1 calc . . GR .
H76B H -0.9945 0.2869 0.9183 0.105 Uiso 1 calc . . GR .
H76C H -0.8689 0.2964 1.0336 0.105 Uiso 1 calc . . GR .
C77 C -0.808(2) 0.3126(9) 0.852(2) 0.058(6) Uani 1 d B . . .
C78 C -0.839(2) 0.3664(9) 0.8698(17) 0.055(6) Uani 1 d . . . .
H78 H -0.8784 0.3726 0.9176 0.067 Uiso 1 calc B . R .
C79 C -0.814(2) 0.4046(8) 0.820(2) 0.068(8) Uani 1 d B . . .
H79 H -0.8453 0.4381 0.8218 0.081 Uiso 1 calc . . R .
C80 C -0.739(2) 0.3986(9) 0.761(2) 0.059(6) Uani 1 d . . . .
H80 H -0.7125 0.4282 0.7351 0.071 Uiso 1 calc B . R .
C81 C -0.707(2) 0.3464(8) 0.743(2) 0.056(6) Uani 1 d B . . .
C82 C -0.505(3) 0.3272(15) 0.779(4) 0.129(16) Uani 1 d B . . .
H82A H -0.4961 0.3358 0.8577 0.194 Uiso 1 calc . . GR .
H82B H -0.4554 0.3509 0.7590 0.194 Uiso 1 calc . . GR .
H82C H -0.4784 0.2912 0.7788 0.194 Uiso 1 calc . . GR .
C83 C -0.6869(12) 0.3275(6) 0.5660(10) 0.063(6) Uani 1 d B . . .
N25 N -0.8139(12) 0.3317(6) 0.5110(11) 0.051(4) Uani 1 d . . G .
C87 C -0.8814(10) 0.3261(7) 0.3860(12) 0.062(6) Uani 1 d B . G U
C86 C -0.8219(15) 0.3164(7) 0.3160(9) 0.077(7) Uani 1 d . . G U
H86 H -0.8671 0.3127 0.2324 0.093 Uiso 1 calc B . R .
C85 C -0.6949(15) 0.3122(8) 0.3709(14) 0.073(6) Uani 1 d B . G U
H85 H -0.6551 0.3057 0.3241 0.088 Uiso 1 calc . . R .
C84 C -0.6274(11) 0.3177(7) 0.4959(15) 0.087(6) Uani 1 d . . G U
H84 H -0.5424 0.3149 0.5327 0.105 Uiso 1 calc B . R .
C88 C -1.093(4) 0.3242(13) 0.208(3) 0.118(15) Uani 1 d . . . .
H88A H -1.1714 0.3176 0.2053 0.176 Uiso 1 calc . . GR .
H88B H -1.0715 0.2947 0.1725 0.176 Uiso 1 calc . . GR .
H88C H -1.0976 0.3560 0.1634 0.176 Uiso 1 calc . . GR .
C89 C -1.046(2) 0.3460(8) 0.4230(18) 0.047(5) Uani 1 d . . . .
C90 C -1.069(2) 0.3978(8) 0.444(2) 0.061(6) Uani 1 d B . . .
H90 H -1.0558 0.4263 0.4038 0.073 Uiso 1 calc . . R .
C91 C -1.113(2) 0.4053(8) 0.529(3) 0.067(7) Uani 1 d . . . .
H91 H -1.1194 0.4396 0.5535 0.080 Uiso 1 calc B . R .
C92 C -1.147(2) 0.3645(8) 0.573(2) 0.053(6) Uani 1 d B . . .
H92 H -1.1794 0.3707 0.6270 0.063 Uiso 1 calc . . R .
C93 C -1.135(2) 0.3117(9) 0.5423(19) 0.050(5) Uani 1 d . . . .
C94 C -1.2348(17) 0.2757(9) 0.661(2) 0.050(5) Uani 1 d . . . .
H94A H -1.2024 0.3062 0.7126 0.076 Uiso 1 calc B . GR .
H94B H -1.2208 0.2445 0.7102 0.076 Uiso 1 calc . . GR .
H94C H -1.3213 0.2803 0.6109 0.076 Uiso 1 calc . . GR .
C95 C -1.210(2) 0.2197(8) 0.506(2) 0.056(6) Uani 1 d . . . .
C96 C -1.275(2) 0.2237(9) 0.3778(19) 0.065(7) Uani 1 d B . . .
H96 H -1.2984 0.2553 0.3341 0.078 Uiso 1 calc . . R .
C97 C -1.297(2) 0.1729(8) 0.3278(17) 0.060(7) Uani 1 d . . . .
H97 H -1.3314 0.1711 0.2437 0.072 Uiso 1 calc B . R .
C98 C -1.276(3) 0.1274(9) 0.385(2) 0.071(8) Uani 1 d B . . .
H98 H -1.3071 0.0953 0.3451 0.086 Uiso 1 calc . . R .
C99 C -1.204(2) 0.1314(10) 0.509(2) 0.065(7) Uani 1 d . . . .
C100 C -1.2302(19) 0.0743(9) 0.6635(18) 0.052(5) Uani 1 d . . . .
H10A H -1.3170 0.0801 0.6201 0.077 Uiso 1 calc B . GR .
H10B H -1.1941 0.1002 0.7271 0.077 Uiso 1 calc . . GR .
H10C H -1.2144 0.0393 0.6979 0.077 Uiso 1 calc . . GR .
C101 C -1.1356(19) 0.0355(9) 0.5421(18) 0.049(5) Uani 1 d B . . .
C102 C -1.148(2) -0.0147(10) 0.5746(18) 0.053(5) Uani 1 d . . . .
H102 H -1.1847 -0.0211 0.6240 0.063 Uiso 1 calc B . R .
C103 C -1.104(2) -0.0566(9) 0.533(2) 0.058(6) Uani 1 d B . . .
H103 H -1.1024 -0.0909 0.5612 0.070 Uiso 1 calc . . R .
C104 C -1.062(2) -0.0470(10) 0.451(3) 0.067(7) Uani 1 d . . . .
H104 H -1.0461 -0.0751 0.4114 0.081 Uiso 1 calc B . R .
C105 C -1.044(2) 0.0036(9) 0.4263(19) 0.053(6) Uani 1 d B . . .
C106 C -1.092(3) 0.0268(14) 0.211(2) 0.099(11) Uani 1 d B . . .
H10D H -1.0998 -0.0058 0.1676 0.148 Uiso 1 calc . . GR .
H10E H -1.0704 0.0550 0.1719 0.148 Uiso 1 calc . . GR .
H10F H -1.1682 0.0350 0.2107 0.148 Uiso 1 calc . . GR .
C107 C -0.866(2) 0.0229(9) 0.394(2) 0.058(5) Uani 1 d B . . U
C108 C -0.820(3) 0.0343(10) 0.314(3) 0.075(5) Uani 1 d . . . U
H108 H -0.8683 0.0406 0.2314 0.089 Uiso 1 calc B . R .
C109 C -0.709(3) 0.0350(11) 0.363(3) 0.078(5) Uani 1 d B . . U
H109 H -0.6722 0.0378 0.3121 0.093 Uiso 1 calc . . R .
C110 C -0.624(3) 0.0318(13) 0.499(3) 0.093(7) Uani 1 d . . . U
H110 H -0.5395 0.0360 0.5326 0.111 Uiso 1 calc B . R .
C111 C -0.687(2) 0.0218(9) 0.566(2) 0.056(5) Uani 1 d B . . U
C112 C -0.506(3) 0.0280(15) 0.776(4) 0.134(17) Uani 1 d B . . .
H11A H -0.5029 0.0520 0.8377 0.202 Uiso 1 calc . . GR .
H11B H -0.4684 0.0443 0.7318 0.202 Uiso 1 calc . . GR .
H11C H -0.4632 -0.0042 0.8135 0.202 Uiso 1 calc . . GR .
S1 S -1.1087(6) 0.5011(3) -0.1696(5) 0.0691(19) Uani 1 d . . . .
F1 F -1.274(2) 0.4415(11) -0.154(3) 0.154(10) Uani 1 d . . . .
F2 F -1.119(3) 0.4392(8) -0.0061(18) 0.130(8) Uani 1 d . . . .
F3 F -1.132(2) 0.3972(10) -0.163(2) 0.126(7) Uani 1 d . . . U
O1 O -1.1419(18) 0.5477(7) -0.1183(16) 0.080(6) Uani 1 d . . . .
O2 O -1.1647(18) 0.4991(10) -0.2987(16) 0.092(7) Uani 1 d . . . .
O3 O -0.985(2) 0.4940(11) -0.117(2) 0.110(8) Uani 1 d . . . .
C113 C -1.166(2) 0.4435(11) -0.127(2) 0.064(6) Uani 1 d . . . U
S2 S -0.1081(6) 0.8473(3) 0.8297(6) 0.0674(17) Uani 1 d . . . U
F4 F -0.143(3) 0.9481(9) 0.835(2) 0.171(13) Uani 1 d . . . .
F5 F -0.126(3) 0.9139(14) 0.987(2) 0.219(18) Uani 1 d . . . .
F6 F -0.2770(19) 0.9073(13) 0.832(3) 0.170(13) Uani 1 d . . . .
O4 O -0.1405(19) 0.8009(8) 0.886(2) 0.089(6) Uani 1 d . . . .
O5 O -0.1640(18) 0.8488(8) 0.7041(16) 0.076(5) Uani 1 d . . . .
O6 O 0.015(2) 0.8489(8) 0.889(2) 0.124(10) Uani 1 d . . . .
C114 C -0.157(3) 0.9055(13) 0.878(2) 0.076(5) Uani 1 d . . . U
S3 S -0.4670(6) 0.3487(3) 0.1905(6) 0.077(2) Uani 1 d . . . U
F7 F -0.448(3) 0.4492(6) 0.182(2) 0.154(10) Uani 1 d . . . .
F8 F -0.465(3) 0.4094(14) 0.024(2) 0.196(15) Uani 1 d . . . .
F9 F -0.2990(17) 0.4077(10) 0.183(2) 0.133(8) Uani 1 d . . . .
O7 O -0.608(2) 0.3460(10) 0.127(2) 0.118(9) Uani 1 d . . . .
O8 O -0.407(2) 0.3495(11) 0.3198(18) 0.122(10) Uani 1 d . . . .
O9 O -0.4100(19) 0.3040(8) 0.1516(19) 0.092(6) Uani 1 d . . . .
C115 C -0.423(3) 0.4097(13) 0.138(3) 0.083(5) Uani 1 d . . . U
S4 S 0.5343(7) 1.0001(4) 0.1897(7) 0.084(2) Uani 1 d . . . .
F10 F 0.530(3) 0.9419(8) 0.021(2) 0.141(10) Uani 1 d . . . .
F11 F 0.546(2) 0.8978(8) 0.185(2) 0.141(9) Uani 1 d . . . .
F12 F 0.6976(19) 0.9398(7) 0.175(3) 0.143(10) Uani 1 d . . . .
O10 O 0.585(2) 1.0438(9) 0.157(3) 0.109(8) Uani 1 d . . . .
O11 O 0.398(2) 0.9963(14) 0.135(2) 0.154(14) Uani 1 d . . . .
O12 O 0.598(3) 1.0022(14) 0.320(2) 0.183(16) Uani 1 d . . . .
C116 C 0.586(3) 0.9394(12) 0.146(4) 0.089(9) Uani 1 d . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag2 2.831(2) . ?
Ag1 Ag4 3.093(2) . ?
Ag1 N2 2.209(16) . ?
Ag1 C2 2.136(16) . ?
Ag2 Ag3 3.085(2) . ?
Ag2 N6 2.187(17) . ?
Ag2 C2 2.157(16) . ?
Ag3 Ag4 2.831(2) . ?
Ag3 N10 2.137(16) . ?
Ag3 C1 2.120(16) . ?
Ag4 N14 2.120(17) . ?
Ag4 C1 2.057(18) . ?
Ag5 N4 2.183(14) . ?
Ag5 N12 2.175(17) . ?
N1 H1 0.8600 . ?
N1 C1 1.33(2) . ?
N1 C8 1.369(14) . ?
N2 C9 1.36(2) . ?
N2 C13 1.27(2) . ?
N3 C13 1.42(2) . ?
N3 C14 1.44(2) . ?
N3 C15 1.36(3) . ?
N4 C15 1.38(2) . ?
N4 C19 1.38(3) . ?
N5 C19 1.42(2) . ?
N5 C20 1.51(2) . ?
N5 C21 1.40(3) . ?
N6 C21 1.33(3) . ?
N6 C25 1.32(3) . ?
N7 C25 1.36(3) . ?
N7 C26 1.53(2) . ?
N7 C27 1.42(2) . ?
N8 C27 1.33(2) . ?
N8 C31 1.32(3) . ?
N9 C31 1.35(3) . ?
N9 C32 1.42(3) . ?
N9 C33 1.50(2) . ?
N10 C33 1.34(2) . ?
N10 C37 1.33(2) . ?
N11 C37 1.43(2) . ?
N11 C38 1.50(2) . ?
N11 C39 1.35(2) . ?
N12 C39 1.42(2) . ?
N12 C43 1.36(2) . ?
N13 C43 1.39(2) . ?
N13 C44 1.51(3) . ?
N13 C45 1.40(2) . ?
N14 C45 1.40(2) . ?
N14 C49 1.34(2) . ?
N15 C49 1.46(2) . ?
N15 C50 1.47(3) . ?
N15 C51 1.29(2) . ?
N16 C51 1.34(2) . ?
N16 C55 1.38(2) . ?
N17 C9 1.33(3) . ?
N17 C55 1.43(3) . ?
N17 C56 1.50(3) . ?
C1 C2 1.45(2) . ?
C2 C3 1.429(17) . ?
C3 C4 1.3900 . ?
C3 C8 1.3900 . ?
C4 H4 0.9300 . ?
C4 C5 1.3900 . ?
C5 H5 0.9300 . ?
C5 C6 1.3900 . ?
C6 H6 0.9300 . ?
C6 C7 1.3900 . ?
C7 H7 0.9300 . ?
C7 C8 1.3900 . ?
C9 C10 1.43(3) . ?
C10 H10 0.9300 . ?
C10 C11 1.39(3) . ?
C11 H11 0.9300 . ?
C11 C12 1.37(3) . ?
C12 H12 0.9300 . ?
C12 C13 1.42(3) . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 C16 1.35(3) . ?
C16 H16 0.9300 . ?
C16 C17 1.50(3) . ?
C17 H17 0.9300 . ?
C17 C18 1.33(3) . ?
C18 H18 0.9300 . ?
C18 C19 1.39(3) . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C21 C22 1.43(3) . ?
C22 H22 0.9300 . ?
C22 C23 1.37(3) . ?
C23 H23 0.9300 . ?
C23 C24 1.43(3) . ?
C24 H24 0.9300 . ?
C24 C25 1.39(3) . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C27 C28 1.39(3) . ?
C28 H28 0.9300 . ?
C28 C29 1.40(3) . ?
C29 H29 0.9300 . ?
C29 C30 1.35(3) . ?
C30 H30 0.9300 . ?
C30 C31 1.46(3) . ?
C32 H32A 0.9600 . ?
C32 H32B 0.9600 . ?
C32 H32C 0.9600 . ?
C33 C34 1.30(3) . ?
C34 H34 0.9300 . ?
C34 C35 1.41(3) . ?
C35 H35 0.9300 . ?
C35 C36 1.43(3) . ?
C36 H36 0.9300 . ?
C36 C37 1.38(2) . ?
C38 H38A 0.9600 . ?
C38 H38B 0.9600 . ?
C38 H38C 0.9600 . ?
C39 C40 1.43(3) . ?
C40 H40 0.9300 . ?
C40 C41 1.34(3) . ?
C41 H41 0.9300 . ?
C41 C42 1.39(3) . ?
C42 H42 0.9300 . ?
C42 C43 1.38(3) . ?
C44 H44A 0.9600 . ?
C44 H44B 0.9600 . ?
C44 H44C 0.9600 . ?
C45 C46 1.36(3) . ?
C46 H46 0.9300 . ?
C46 C47 1.40(3) . ?
C47 H47 0.9300 . ?
C47 C48 1.43(3) . ?
C48 H48 0.9300 . ?
C48 C49 1.34(3) . ?
C50 H50A 0.9600 . ?
C50 H50B 0.9600 . ?
C50 H50C 0.9600 . ?
C51 C52 1.42(3) . ?
C52 H52 0.9300 . ?
C52 C53 1.38(3) . ?
C53 H53 0.9300 . ?
C53 C54 1.39(3) . ?
C54 H54 0.9300 . ?
C54 C55 1.39(3) . ?
C56 H56A 0.9600 . ?
C56 H56B 0.9600 . ?
C56 H56C 0.9600 . ?
Ag6 Ag7 2.821(2) . ?
Ag6 Ag9 3.074(3) . ?
Ag6 N19 2.24(2) . ?
Ag6 C58 2.12(2) . ?
Ag7 Ag8 3.064(3) . ?
Ag7 N23 2.229(18) . ?
Ag7 C58 2.138(19) . ?
Ag8 Ag9 2.826(2) . ?
Ag8 N27 2.137(18) . ?
Ag8 C57 2.03(2) . ?
Ag9 N31 2.134(19) . ?
Ag9 C57 2.05(2) . ?
Ag10 N21 2.136(15) . ?
Ag10 N29 2.160(12) . ?
N18 H18A 0.8600 . ?
N18 C57 1.35(3) . ?
N18 C64 1.34(2) . ?
N19 C65 1.42(3) . ?
N19 C69 1.25(3) . ?
N20 C69 1.44(3) . ?
N20 C70 1.44(3) . ?
N20 C71 1.53(3) . ?
N21 C71 1.33(3) . ?
N21 C75 1.29(3) . ?
N22 C75 1.54(3) . ?
N22 C76 1.49(3) . ?
N22 C77 1.38(3) . ?
N23 C77 1.32(3) . ?
N23 C81 1.40(3) . ?
N24 C81 1.40(3) . ?
N24 C82 1.45(3) . ?
N24 C83 1.37(2) . ?
N26 C87 1.23(3) . ?
N26 C88 1.58(4) . ?
N26 C89 1.45(3) . ?
N27 C89 1.37(3) . ?
N27 C93 1.36(3) . ?
N28 C93 1.32(3) . ?
N28 C94 1.53(3) . ?
N28 C95 1.50(2) . ?
N29 C95 1.33(2) . ?
N29 C99 1.31(2) . ?
N30 C99 1.50(3) . ?
N30 C100 1.50(3) . ?
N30 C101 1.37(3) . ?
N31 C101 1.38(3) . ?
N31 C105 1.34(3) . ?
N32 C105 1.52(3) . ?
N32 C106 1.54(4) . ?
N32 C107 1.37(3) . ?
N33 C107 1.23(3) . ?
N33 C111 1.40(3) . ?
N34 C65 1.31(3) . ?
N34 C111 1.41(3) . ?
N34 C112 1.47(3) . ?
C57 C58 1.52(3) . ?
C58 C59 1.53(2) . ?
C64 C59 1.3900 . ?
C64 C63 1.3900 . ?
C59 C60 1.3900 . ?
C60 H60 0.9300 . ?
C60 C61 1.3900 . ?
C61 H61 0.9300 . ?
C61 C62 1.3900 . ?
C62 H62 0.9300 . ?
C62 C63 1.3900 . ?
C63 H63 0.9300 . ?
C65 C66 1.39(3) . ?
C66 H66 0.9300 . ?
C66 C67 1.37(4) . ?
C67 H67 0.9300 . ?
C67 C68 1.33(3) . ?
C68 H68 0.9300 . ?
C68 C69 1.49(3) . ?
C70 H70A 0.9600 . ?
C70 H70B 0.9600 . ?
C70 H70C 0.9600 . ?
C71 C72 1.30(3) . ?
C72 H72 0.9300 . ?
C72 C73 1.42(3) . ?
C73 H73 0.9300 . ?
C73 C74 1.45(3) . ?
C74 H74 0.9300 . ?
C74 C75 1.37(3) . ?
C76 H76A 0.9600 . ?
C76 H76B 0.9600 . ?
C76 H76C 0.9600 . ?
C77 C78 1.45(3) . ?
C78 H78 0.9300 . ?
C78 C79 1.26(3) . ?
C79 H79 0.9300 . ?
C79 C80 1.42(4) . ?
C80 H80 0.9300 . ?
C80 C81 1.42(3) . ?
C82 H82A 0.9600 . ?
C82 H82B 0.9600 . ?
C82 H82C 0.9600 . ?
C83 N25 1.3900 . ?
C83 C84 1.3900 . ?
N25 C87 1.3900 . ?
C87 C86 1.3900 . ?
C86 H86 0.9300 . ?
C86 C85 1.3900 . ?
C85 H85 0.9300 . ?
C85 C84 1.3900 . ?
C84 H84 0.9300 . ?
C88 H88A 0.9600 . ?
C88 H88B 0.9600 . ?
C88 H88C 0.9600 . ?
C89 C90 1.38(3) . ?
C90 H90 0.9300 . ?
C90 C91 1.40(3) . ?
C91 H91 0.9300 . ?
C91 C92 1.32(3) . ?
C92 H92 0.9300 . ?
C92 C93 1.41(3) . ?
C94 H94A 0.9600 . ?
C94 H94B 0.9600 . ?
C94 H94C 0.9600 . ?
C95 C96 1.42(3) . ?
C96 H96 0.9300 . ?
C96 C97 1.39(3) . ?
C97 H97 0.9300 . ?
C97 C98 1.30(3) . ?
C98 H98 0.9300 . ?
C98 C99 1.39(3) . ?
C100 H10A 0.9600 . ?
C100 H10B 0.9600 . ?
C100 H10C 0.9600 . ?
C101 C102 1.36(3) . ?
C102 H102 0.9300 . ?
C102 C103 1.39(3) . ?
C103 H103 0.9300 . ?
C103 C104 1.35(4) . ?
C104 H104 0.9300 . ?
C104 C105 1.35(3) . ?
C106 H10D 0.9600 . ?
C106 H10E 0.9600 . ?
C106 H10F 0.9600 . ?
C107 C108 1.38(4) . ?
C108 H108 0.9300 . ?
C108 C109 1.20(4) . ?
C109 H109 0.9300 . ?
C109 C110 1.53(4) . ?
C110 H110 0.9300 . ?
C110 C111 1.40(4) . ?
C112 H11A 0.9600 . ?
C112 H11B 0.9600 . ?
C112 H11C 0.9600 . ?
S1 O1 1.479(16) . ?
S1 O2 1.424(19) . ?
S1 O3 1.37(2) . ?
S1 C113 1.79(3) . ?
F1 C113 1.21(3) . ?
F2 C113 1.35(3) . ?
F3 C113 1.37(3) . ?
S2 O4 1.51(2) . ?
S2 O5 1.385(18) . ?
S2 O6 1.34(2) . ?
S2 C114 1.79(3) . ?
F4 C114 1.24(4) . ?
F5 C114 1.25(3) . ?
F6 C114 1.32(3) . ?
S3 O7 1.54(2) . ?
S3 O8 1.43(2) . ?
S3 O9 1.51(2) . ?
S3 C115 1.84(4) . ?
F7 C115 1.23(3) . ?
F8 C115 1.27(4) . ?
F9 C115 1.37(3) . ?
S4 O10 1.41(2) . ?
S4 O11 1.50(2) . ?
S4 O12 1.44(3) . ?
S4 C116 1.83(3) . ?
F10 C116 1.38(4) . ?
F11 C116 1.34(4) . ?
F12 C116 1.25(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
Ag2 Ag1 Ag4 89.94(6) . . ?
N2 Ag1 Ag2 145.5(4) . . ?
N2 Ag1 Ag4 105.9(4) . . ?
C2 Ag1 Ag2 49.0(4) . . ?
C2 Ag1 Ag4 66.5(4) . . ?
C2 Ag1 N2 165.4(6) . . ?
Ag1 Ag2 Ag3 90.04(7) . . ?
N6 Ag2 Ag1 146.7(5) . . ?
N6 Ag2 Ag3 105.6(4) . . ?
C2 Ag2 Ag1 48.4(4) . . ?
C2 Ag2 Ag3 66.9(4) . . ?
C2 Ag2 N6 164.8(6) . . ?
Ag4 Ag3 Ag2 90.12(6) . . ?
N10 Ag3 Ag2 104.8(4) . . ?
N10 Ag3 Ag4 148.6(4) . . ?
C1 Ag3 Ag2 68.2(5) . . ?
C1 Ag3 Ag4 46.4(5) . . ?
C1 Ag3 N10 164.9(6) . . ?
Ag3 Ag4 Ag1 89.90(7) . . ?
N14 Ag4 Ag1 104.3(4) . . ?
N14 Ag4 Ag3 148.9(4) . . ?
C1 Ag4 Ag1 67.3(6) . . ?
C1 Ag4 Ag3 48.3(4) . . ?
C1 Ag4 N14 162.8(6) . . ?
N12 Ag5 N4 161.9(6) . . ?
C1 N1 H1 122.7 . . ?
C1 N1 C8 114.6(12) . . ?
C8 N1 H1 122.7 . . ?
C9 N2 Ag1 106.3(13) . . ?
C13 N2 Ag1 127.1(13) . . ?
C13 N2 C9 122.6(17) . . ?
C13 N3 C14 117.9(15) . . ?
C15 N3 C13 117.2(16) . . ?
C15 N3 C14 114.6(16) . . ?
C15 N4 Ag5 119.9(14) . . ?
C15 N4 C19 119.6(15) . . ?
C19 N4 Ag5 117.3(11) . . ?
C19 N5 C20 116.3(17) . . ?
C21 N5 C19 119.3(16) . . ?
C21 N5 C20 116.2(17) . . ?
C21 N6 Ag2 127.0(15) . . ?
C25 N6 Ag2 110.8(14) . . ?
C25 N6 C21 119.1(19) . . ?
C25 N7 C26 123.6(19) . . ?
C25 N7 C27 119.9(17) . . ?
C27 N7 C26 116.2(17) . . ?
C31 N8 C27 119.8(19) . . ?
C31 N9 C32 122(2) . . ?
C31 N9 C33 120.9(16) . . ?
C32 N9 C33 117.5(18) . . ?
C33 N10 Ag3 115.8(13) . . ?
C37 N10 Ag3 126.3(12) . . ?
C37 N10 C33 115.7(16) . . ?
C37 N11 C38 114.2(17) . . ?
C39 N11 C37 119.6(15) . . ?
C39 N11 C38 115.6(17) . . ?
C39 N12 Ag5 115.6(13) . . ?
C43 N12 Ag5 119.5(11) . . ?
C43 N12 C39 120.7(16) . . ?
C43 N13 C44 119.0(14) . . ?
C43 N13 C45 118.9(15) . . ?
C45 N13 C44 111.1(16) . . ?
C45 N14 Ag4 127.2(12) . . ?
C49 N14 Ag4 114.7(13) . . ?
C49 N14 C45 116.5(16) . . ?
C49 N15 C50 115.1(17) . . ?
C51 N15 C49 124.0(16) . . ?
C51 N15 C50 120.9(19) . . ?
C51 N16 C55 117.1(17) . . ?
C9 N17 C55 119.4(18) . . ?
C9 N17 C56 122(2) . . ?
C55 N17 C56 118(2) . . ?
Ag4 C1 Ag3 85.3(6) . . ?
N1 C1 Ag3 116.4(12) . . ?
N1 C1 Ag4 119.8(13) . . ?
N1 C1 C2 106.9(14) . . ?
C2 C1 Ag3 112.4(12) . . ?
C2 C1 Ag4 115.1(13) . . ?
Ag1 C2 Ag2 82.6(6) . . ?
C1 C2 Ag1 111.0(12) . . ?
C1 C2 Ag2 112.5(10) . . ?
C3 C2 Ag1 123.8(9) . . ?
C3 C2 Ag2 122.9(10) . . ?
C3 C2 C1 103.5(13) . . ?
C4 C3 C2 128.9(9) . . ?
C4 C3 C8 120.0 . . ?
C8 C3 C2 111.1(9) . . ?
C3 C4 H4 120.0 . . ?
C5 C4 C3 120.0 . . ?
C5 C4 H4 120.0 . . ?
C4 C5 H5 120.0 . . ?
C4 C5 C6 120.0 . . ?
C6 C5 H5 120.0 . . ?
C5 C6 H6 120.0 . . ?
C7 C6 C5 120.0 . . ?
C7 C6 H6 120.0 . . ?
C6 C7 H7 120.0 . . ?
C8 C7 C6 120.0 . . ?
C8 C7 H7 120.0 . . ?
N1 C8 C3 104.0(8) . . ?
N1 C8 C7 136.0(8) . . ?
C7 C8 C3 120.0 . . ?
N2 C9 C10 117.1(19) . . ?
N17 C9 N2 121.3(18) . . ?
N17 C9 C10 121.1(18) . . ?
C9 C10 H10 119.4 . . ?
C11 C10 C9 121.1(18) . . ?
C11 C10 H10 119.4 . . ?
C10 C11 H11 121.2 . . ?
C12 C11 C10 118(2) . . ?
C12 C11 H11 121.2 . . ?
C11 C12 H12 120.5 . . ?
C11 C12 C13 119(2) . . ?
C13 C12 H12 120.5 . . ?
N2 C13 N3 117.6(17) . . ?
N2 C13 C12 122.3(18) . . ?
N3 C13 C12 120.0(16) . . ?
N3 C14 H14A 109.5 . . ?
N3 C14 H14B 109.5 . . ?
N3 C14 H14C 109.5 . . ?
H14A C14 H14B 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
N3 C15 N4 112.0(18) . . ?
C16 C15 N3 127.5(18) . . ?
C16 C15 N4 120(2) . . ?
C15 C16 H16 119.5 . . ?
C15 C16 C17 121.0(18) . . ?
C17 C16 H16 119.5 . . ?
C16 C17 H17 122.3 . . ?
C18 C17 C16 115(2) . . ?
C18 C17 H17 122.3 . . ?
C17 C18 H18 118.3 . . ?
C17 C18 C19 123(2) . . ?
C19 C18 H18 118.3 . . ?
N4 C19 N5 115.7(16) . . ?
N4 C19 C18 120.0(16) . . ?
C18 C19 N5 124(2) . . ?
N5 C20 H20A 109.5 . . ?
N5 C20 H20B 109.5 . . ?
N5 C20 H20C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
N5 C21 C22 118.5(18) . . ?
N6 C21 N5 116.9(18) . . ?
N6 C21 C22 124(2) . . ?
C21 C22 H22 122.8 . . ?
C23 C22 C21 114(2) . . ?
C23 C22 H22 122.8 . . ?
C22 C23 H23 118.7 . . ?
C22 C23 C24 123(2) . . ?
C24 C23 H23 118.7 . . ?
C23 C24 H24 122.0 . . ?
C25 C24 C23 116(2) . . ?
C25 C24 H24 122.0 . . ?
N6 C25 N7 116(2) . . ?
N6 C25 C24 124(2) . . ?
N7 C25 C24 121(2) . . ?
N7 C26 H26A 109.5 . . ?
N7 C26 H26B 109.5 . . ?
N7 C26 H26C 109.5 . . ?
H26A C26 H26B 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
N8 C27 N7 110.7(16) . . ?
N8 C27 C28 121.6(18) . . ?
C28 C27 N7 127.7(18) . . ?
C27 C28 H28 120.6 . . ?
C27 C28 C29 119(2) . . ?
C29 C28 H28 120.6 . . ?
C28 C29 H29 119.3 . . ?
C30 C29 C28 121.3(18) . . ?
C30 C29 H29 119.3 . . ?
C29 C30 H30 122.1 . . ?
C29 C30 C31 115.8(18) . . ?
C31 C30 H30 122.1 . . ?
N8 C31 N9 118.0(19) . . ?
N8 C31 C30 122(2) . . ?
N9 C31 C30 120(2) . . ?
N9 C32 H32A 109.5 . . ?
N9 C32 H32B 109.5 . . ?
N9 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
N10 C33 N9 111.6(16) . . ?
C34 C33 N9 118.4(19) . . ?
C34 C33 N10 129.6(19) . . ?
C33 C34 H34 122.8 . . ?
C33 C34 C35 114(2) . . ?
C35 C34 H34 122.8 . . ?
C34 C35 H35 119.7 . . ?
C34 C35 C36 120.6(19) . . ?
C36 C35 H35 119.7 . . ?
C35 C36 H36 122.0 . . ?
C37 C36 C35 116.1(17) . . ?
C37 C36 H36 122.0 . . ?
N10 C37 N11 115.1(16) . . ?
N10 C37 C36 123.2(18) . . ?
C36 C37 N11 121.6(16) . . ?
N11 C38 H38A 109.5 . . ?
N11 C38 H38B 109.5 . . ?
N11 C38 H38C 109.5 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
N11 C39 N12 116.4(16) . . ?
N11 C39 C40 126.6(17) . . ?
N12 C39 C40 117.0(16) . . ?
C39 C40 H40 120.0 . . ?
C41 C40 C39 120.1(16) . . ?
C41 C40 H40 120.0 . . ?
C40 C41 H41 118.7 . . ?
C40 C41 C42 122.6(18) . . ?
C42 C41 H41 118.7 . . ?
C41 C42 H42 121.0 . . ?
C43 C42 C41 118.1(19) . . ?
C43 C42 H42 121.0 . . ?
N12 C43 N13 113.5(15) . . ?
N12 C43 C42 121.5(18) . . ?
C42 C43 N13 124.9(18) . . ?
N13 C44 H44A 109.5 . . ?
N13 C44 H44B 109.5 . . ?
N13 C44 H44C 109.5 . . ?
H44A C44 H44B 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
N14 C45 N13 113.8(15) . . ?
C46 C45 N13 122.9(17) . . ?
C46 C45 N14 123.0(16) . . ?
C45 C46 H46 121.8 . . ?
C45 C46 C47 116(2) . . ?
C47 C46 H46 121.8 . . ?
C46 C47 H47 118.9 . . ?
C46 C47 C48 122(2) . . ?
C48 C47 H47 118.9 . . ?
C47 C48 H48 122.4 . . ?
C49 C48 C47 115(2) . . ?
C49 C48 H48 122.4 . . ?
N14 C49 N15 113.2(16) . . ?
C48 C49 N14 126(2) . . ?
C48 C49 N15 120.0(19) . . ?
N15 C50 H50A 109.5 . . ?
N15 C50 H50B 109.5 . . ?
N15 C50 H50C 109.5 . . ?
H50A C50 H50B 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
N15 C51 N16 112.9(17) . . ?
N15 C51 C52 124.5(18) . . ?
N16 C51 C52 122.6(18) . . ?
C51 C52 H52 120.7 . . ?
C53 C52 C51 119(2) . . ?
C53 C52 H52 120.7 . . ?
C52 C53 H53 119.9 . . ?
C52 C53 C54 120.3(19) . . ?
C54 C53 H53 119.9 . . ?
C53 C54 H54 121.3 . . ?
C53 C54 C55 117(2) . . ?
C55 C54 H54 121.3 . . ?
N16 C55 N17 110.8(17) . . ?
N16 C55 C54 123.9(19) . . ?
C54 C55 N17 125.2(19) . . ?
N17 C56 H56A 109.5 . . ?
N17 C56 H56B 109.5 . . ?
N17 C56 H56C 109.5 . . ?
H56A C56 H56B 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
Ag7 Ag6 Ag9 89.93(9) . . ?
N19 Ag6 Ag7 145.0(5) . . ?
N19 Ag6 Ag9 106.8(4) . . ?
C58 Ag6 Ag7 48.8(5) . . ?
C58 Ag6 Ag9 64.2(6) . . ?
C58 Ag6 N19 165.8(7) . . ?
Ag6 Ag7 Ag8 90.17(8) . . ?
N23 Ag7 Ag6 146.2(5) . . ?
N23 Ag7 Ag8 106.2(5) . . ?
C58 Ag7 Ag6 48.2(6) . . ?
C58 Ag7 Ag8 64.6(6) . . ?
C58 Ag7 N23 165.3(8) . . ?
Ag9 Ag8 Ag7 90.03(9) . . ?
N27 Ag8 Ag7 103.8(4) . . ?
N27 Ag8 Ag9 149.3(5) . . ?
C57 Ag8 Ag7 72.1(7) . . ?
C57 Ag8 Ag9 46.4(7) . . ?
C57 Ag8 N27 164.2(8) . . ?
Ag8 Ag9 Ag6 89.87(9) . . ?
N31 Ag9 Ag6 103.5(5) . . ?
N31 Ag9 Ag8 149.7(6) . . ?
C57 Ag9 Ag6 72.2(7) . . ?
C57 Ag9 Ag8 45.7(7) . . ?
C57 Ag9 N31 164.5(8) . . ?
N21 Ag10 N29 159.5(7) . . ?
C57 N18 H18A 127.5 . . ?
C64 N18 H18A 127.5 . . ?
C64 N18 C57 105.0(17) . . ?
C65 N19 Ag6 105.2(16) . . ?
C69 N19 Ag6 127.2(16) . . ?
C69 N19 C65 123(2) . . ?
C69 N20 C71 116.6(19) . . ?
C70 N20 C69 124.3(18) . . ?
C70 N20 C71 109.8(18) . . ?
C71 N21 Ag10 123.8(13) . . ?
C75 N21 Ag10 122.1(14) . . ?
C75 N21 C71 112.0(17) . . ?
C76 N22 C75 106.5(19) . . ?
C77 N22 C75 120.9(18) . . ?
C77 N22 C76 122.5(17) . . ?
C77 N23 Ag7 126.4(15) . . ?
C77 N23 C81 121.7(19) . . ?
C81 N23 Ag7 108.4(13) . . ?
C81 N24 C82 112(3) . . ?
C83 N24 C81 117.7(17) . . ?
C83 N24 C82 131(3) . . ?
C87 N26 C88 128(2) . . ?
C87 N26 C89 119.9(19) . . ?
C89 N26 C88 112(2) . . ?
C89 N27 Ag8 112.8(14) . . ?
C93 N27 Ag8 124.3(15) . . ?
C93 N27 C89 120.7(18) . . ?
C93 N28 C94 120.8(16) . . ?
C93 N28 C95 120.6(16) . . ?
C95 N28 C94 111.9(16) . . ?
C95 N29 Ag10 123.0(12) . . ?
C99 N29 Ag10 120.0(15) . . ?
C99 N29 C95 114.4(17) . . ?
C99 N30 C100 114.2(18) . . ?
C101 N30 C99 123.2(17) . . ?
C101 N30 C100 119.9(18) . . ?
C101 N31 Ag9 125.8(14) . . ?
C105 N31 Ag9 113.3(15) . . ?
C105 N31 C101 118.8(19) . . ?
C105 N32 C106 111(2) . . ?
C107 N32 C105 116(2) . . ?
C107 N32 C106 133(2) . . ?
C107 N33 C111 118(2) . . ?
C65 N34 C111 120.3(19) . . ?
C65 N34 C112 116(3) . . ?
C111 N34 C112 123(3) . . ?
Ag8 C57 Ag9 87.8(9) . . ?
N18 C57 Ag8 121.3(17) . . ?
N18 C57 Ag9 119.4(16) . . ?
N18 C57 C58 111.2(19) . . ?
C58 C57 Ag8 108.1(14) . . ?
C58 C57 Ag9 106.2(15) . . ?
Ag6 C58 Ag7 83.0(7) . . ?
C57 C58 Ag6 117.5(15) . . ?
C57 C58 Ag7 115.2(13) . . ?
C57 C58 C59 102.9(15) . . ?
C59 C58 Ag6 120.3(13) . . ?
C59 C58 Ag7 118.2(12) . . ?
N18 C64 C59 119.9(12) . . ?
N18 C64 C63 120.1(12) . . ?
C59 C64 C63 120.0 . . ?
C64 C59 C58 101.0(11) . . ?
C60 C59 C58 139.0(11) . . ?
C60 C59 C64 120.0 . . ?
C59 C60 H60 120.0 . . ?
C61 C60 C59 120.0 . . ?
C61 C60 H60 120.0 . . ?
C60 C61 H61 120.0 . . ?
C60 C61 C62 120.0 . . ?
C62 C61 H61 120.0 . . ?
C61 C62 H62 120.0 . . ?
C63 C62 C61 120.0 . . ?
C63 C62 H62 120.0 . . ?
C64 C63 H63 120.0 . . ?
C62 C63 C64 120.0 . . ?
C62 C63 H63 120.0 . . ?
N34 C65 N19 120(2) . . ?
N34 C65 C66 124(2) . . ?
C66 C65 N19 116(2) . . ?
C65 C66 H66 119.0 . . ?
C67 C66 C65 122(2) . . ?
C67 C66 H66 119.0 . . ?
C66 C67 H67 119.3 . . ?
C68 C67 C66 121(2) . . ?
C68 C67 H67 119.3 . . ?
C67 C68 H68 121.8 . . ?
C67 C68 C69 116(2) . . ?
C69 C68 H68 121.8 . . ?
N19 C69 N20 119(2) . . ?
N19 C69 C68 121(2) . . ?
N20 C69 C68 120(2) . . ?
N20 C70 H70A 109.5 . . ?
N20 C70 H70B 109.5 . . ?
N20 C70 H70C 109.5 . . ?
H70A C70 H70B 109.5 . . ?
H70A C70 H70C 109.5 . . ?
H70B C70 H70C 109.5 . . ?
N21 C71 N20 108.9(18) . . ?
C72 C71 N20 120(2) . . ?
C72 C71 N21 131(2) . . ?
C71 C72 H72 123.0 . . ?
C71 C72 C73 114(2) . . ?
C73 C72 H72 123.0 . . ?
C72 C73 H73 119.9 . . ?
C72 C73 C74 120.1(19) . . ?
C74 C73 H73 119.9 . . ?
C73 C74 H74 123.9 . . ?
C75 C74 C73 112.1(19) . . ?
C75 C74 H74 123.9 . . ?
N21 C75 N22 113.3(17) . . ?
N21 C75 C74 129(2) . . ?
C74 C75 N22 116.1(18) . . ?
N22 C76 H76A 109.5 . . ?
N22 C76 H76B 109.5 . . ?
N22 C76 H76C 109.5 . . ?
H76A C76 H76B 109.5 . . ?
H76A C76 H76C 109.5 . . ?
H76B C76 H76C 109.5 . . ?
N22 C77 C78 122(2) . . ?
N23 C77 N22 117.7(19) . . ?
N23 C77 C78 120(2) . . ?
C77 C78 H78 120.1 . . ?
C79 C78 C77 120(2) . . ?
C79 C78 H78 120.1 . . ?
C78 C79 H79 118.8 . . ?
C78 C79 C80 122(2) . . ?
C80 C79 H79 118.8 . . ?
C79 C80 H80 120.8 . . ?
C79 C80 C81 118(2) . . ?
C81 C80 H80 120.8 . . ?
N23 C81 N24 115.9(19) . . ?
N23 C81 C80 117(2) . . ?
N24 C81 C80 127(2) . . ?
N24 C82 H82A 109.5 . . ?
N24 C82 H82B 109.5 . . ?
N24 C82 H82C 109.5 . . ?
H82A C82 H82B 109.5 . . ?
H82A C82 H82C 109.5 . . ?
H82B C82 H82C 109.5 . . ?
N24 C83 N25 113.9(12) . . ?
N24 C83 C84 126.1(12) . . ?
N25 C83 C84 120.0 . . ?
C87 N25 C83 120.0 . . ?
N26 C87 N25 116.1(14) . . ?
N26 C87 C86 123.9(14) . . ?
C86 C87 N25 120.0 . . ?
C87 C86 H86 120.0 . . ?
C87 C86 C85 120.0 . . ?
C85 C86 H86 120.0 . . ?
C86 C85 H85 120.0 . . ?
C84 C85 C86 120.0 . . ?
C84 C85 H85 120.0 . . ?
C83 C84 H84 120.0 . . ?
C85 C84 C83 120.0 . . ?
C85 C84 H84 120.0 . . ?
N26 C88 H88A 109.5 . . ?
N26 C88 H88B 109.5 . . ?
N26 C88 H88C 109.5 . . ?
H88A C88 H88B 109.5 . . ?
H88A C88 H88C 109.5 . . ?
H88B C88 H88C 109.5 . . ?
N27 C89 N26 114.3(17) . . ?
N27 C89 C90 121.2(19) . . ?
C90 C89 N26 124(2) . . ?
C89 C90 H90 121.5 . . ?
C89 C90 C91 117(2) . . ?
C91 C90 H90 121.5 . . ?
C90 C91 H91 119.5 . . ?
C92 C91 C90 121.0(18) . . ?
C92 C91 H91 119.5 . . ?
C91 C92 H92 119.2 . . ?
C91 C92 C93 122(2) . . ?
C93 C92 H92 119.2 . . ?
N27 C93 C92 118(2) . . ?
N28 C93 N27 118.1(18) . . ?
N28 C93 C92 124(2) . . ?
N28 C94 H94A 109.5 . . ?
N28 C94 H94B 109.5 . . ?
N28 C94 H94C 109.5 . . ?
H94A C94 H94B 109.5 . . ?
H94A C94 H94C 109.5 . . ?
H94B C94 H94C 109.5 . . ?
N29 C95 N28 112.9(17) . . ?
N29 C95 C96 127.4(17) . . ?
C96 C95 N28 119.4(17) . . ?
C95 C96 H96 125.4 . . ?
C97 C96 C95 109(2) . . ?
C97 C96 H96 125.4 . . ?
C96 C97 H97 116.0 . . ?
C98 C97 C96 128(2) . . ?
C98 C97 H97 116.0 . . ?
C97 C98 H98 123.0 . . ?
C97 C98 C99 114(2) . . ?
C99 C98 H98 123.0 . . ?
N29 C99 N30 118(2) . . ?
N29 C99 C98 126(2) . . ?
C98 C99 N30 115.6(18) . . ?
N30 C100 H10A 109.5 . . ?
N30 C100 H10B 109.5 . . ?
N30 C100 H10C 109.5 . . ?
H10A C100 H10B 109.5 . . ?
H10A C100 H10C 109.5 . . ?
H10B C100 H10C 109.5 . . ?
N30 C101 N31 115(2) . . ?
C102 C101 N30 124(2) . . ?
C102 C101 N31 121(2) . . ?
C101 C102 H102 120.6 . . ?
C101 C102 C103 119(2) . . ?
C103 C102 H102 120.6 . . ?
C102 C103 H103 120.3 . . ?
C104 C103 C102 119(2) . . ?
C104 C103 H103 120.3 . . ?
C103 C104 H104 120.2 . . ?
C105 C104 C103 120(2) . . ?
C105 C104 H104 120.2 . . ?
N31 C105 N32 112.2(19) . . ?
N31 C105 C104 122(2) . . ?
C104 C105 N32 125.8(19) . . ?
N32 C106 H10D 109.5 . . ?
N32 C106 H10E 109.5 . . ?
N32 C106 H10F 109.5 . . ?
H10D C106 H10E 109.5 . . ?
H10D C106 H10F 109.5 . . ?
H10E C106 H10F 109.5 . . ?
N32 C107 C108 115(2) . . ?
N33 C107 N32 114(2) . . ?
N33 C107 C108 131(3) . . ?
C107 C108 H108 123.9 . . ?
C109 C108 C107 112(3) . . ?
C109 C108 H108 123.9 . . ?
C108 C109 H109 116.6 . . ?
C108 C109 C110 127(3) . . ?
C110 C109 H109 116.6 . . ?
C109 C110 H110 123.6 . . ?
C111 C110 C109 113(3) . . ?
C111 C110 H110 123.6 . . ?
N33 C111 N34 114.7(19) . . ?
C110 C111 N33 118(2) . . ?
C110 C111 N34 127(2) . . ?
N34 C112 H11A 109.5 . . ?
N34 C112 H11B 109.5 . . ?
N34 C112 H11C 109.5 . . ?
H11A C112 H11B 109.5 . . ?
H11A C112 H11C 109.5 . . ?
H11B C112 H11C 109.5 . . ?
O1 S1 C113 107.1(12) . . ?
O2 S1 O1 115.1(13) . . ?
O2 S1 C113 104.5(13) . . ?
O3 S1 O1 111.3(14) . . ?
O3 S1 O2 113.1(15) . . ?
O3 S1 C113 104.7(15) . . ?
F1 C113 S1 119(2) . . ?
F1 C113 F2 99(3) . . ?
F1 C113 F3 109(3) . . ?
F2 C113 S1 111.6(19) . . ?
F2 C113 F3 105(2) . . ?
F3 C113 S1 112(2) . . ?
O4 S2 C114 106.1(14) . . ?
O5 S2 O4 116.4(12) . . ?
O5 S2 C114 106.6(13) . . ?
O6 S2 O4 103.6(14) . . ?
O6 S2 O5 118.2(17) . . ?
O6 S2 C114 104.8(13) . . ?
F4 C114 S2 115(3) . . ?
F4 C114 F5 107(3) . . ?
F4 C114 F6 97(3) . . ?
F5 C114 S2 121(3) . . ?
F5 C114 F6 101(3) . . ?
F6 C114 S2 111(2) . . ?
O7 S3 C115 107.3(14) . . ?
O8 S3 O7 117.2(18) . . ?
O8 S3 O9 106.9(15) . . ?
O8 S3 C115 107.4(15) . . ?
O9 S3 O7 112.4(12) . . ?
O9 S3 C115 104.8(13) . . ?
F7 C115 S3 110(3) . . ?
F7 C115 F8 116(3) . . ?
F7 C115 F9 108(3) . . ?
F8 C115 S3 111(2) . . ?
F8 C115 F9 105(3) . . ?
F9 C115 S3 106(2) . . ?
O10 S4 O11 118.2(18) . . ?
O10 S4 O12 102(2) . . ?
O10 S4 C116 107.7(16) . . ?
O11 S4 C116 106.5(16) . . ?
O12 S4 O11 115(2) . . ?
O12 S4 C116 106.2(19) . . ?
F10 C116 S4 104(2) . . ?
F11 C116 S4 108(3) . . ?
F11 C116 F10 112(3) . . ?
F12 C116 S4 113(2) . . ?
F12 C116 F10 104(3) . . ?
F12 C116 F11 116(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
Ag1 Ag2 Ag3 Ag4 -0.05(6) . . . . ?
Ag1 Ag2 Ag3 N10 152.0(5) . . . . ?
Ag1 Ag2 Ag3 C1 -42.0(6) . . . . ?
Ag1 Ag2 N6 C21 -39.6(19) . . . . ?
Ag1 Ag2 N6 C25 160.5(12) . . . . ?
Ag1 Ag2 C2 C1 109.7(13) . . . . ?
Ag1 Ag2 C2 C3 -125.7(12) . . . . ?
Ag1 Ag4 N14 C45 79.0(14) . . . . ?
Ag1 Ag4 N14 C49 -85.7(12) . . . . ?
Ag1 Ag4 C1 Ag3 -111.7(6) . . . . ?
Ag1 Ag4 C1 N1 130.4(13) . . . . ?
Ag1 Ag4 C1 C2 0.8(10) . . . . ?
Ag1 N2 C9 N17 28(3) . . . . ?
Ag1 N2 C9 C10 -160.9(17) . . . . ?
Ag1 N2 C13 N3 -24(3) . . . . ?
Ag1 N2 C13 C12 152.1(15) . . . . ?
Ag1 C2 C3 C4 -50.5(16) . . . . ?
Ag1 C2 C3 C8 129.7(9) . . . . ?
Ag2 Ag1 Ag4 Ag3 -0.05(6) . . . . ?
Ag2 Ag1 Ag4 N14 -152.0(5) . . . . ?
Ag2 Ag1 Ag4 C1 43.9(5) . . . . ?
Ag2 Ag1 N2 C9 -160.6(11) . . . . ?
Ag2 Ag1 N2 C13 42(2) . . . . ?
Ag2 Ag1 C2 C1 -111.2(12) . . . . ?
Ag2 Ag1 C2 C3 124.8(14) . . . . ?
Ag2 Ag3 Ag4 Ag1 0.04(5) . . . . ?
Ag2 Ag3 Ag4 N14 118.4(8) . . . . ?
Ag2 Ag3 Ag4 C1 -59.0(8) . . . . ?
Ag2 Ag3 N10 C33 85.3(13) . . . . ?
Ag2 Ag3 N10 C37 -77.2(16) . . . . ?
Ag2 Ag3 C1 Ag4 112.6(7) . . . . ?
Ag2 Ag3 C1 N1 -126.3(14) . . . . ?
Ag2 Ag3 C1 C2 -2.6(11) . . . . ?
Ag2 N6 C21 N5 20(2) . . . . ?
Ag2 N6 C21 C22 -151.4(15) . . . . ?
Ag2 N6 C25 N7 -27(2) . . . . ?
Ag2 N6 C25 C24 157.0(19) . . . . ?
Ag2 C2 C3 C4 53.8(15) . . . . ?
Ag2 C2 C3 C8 -126.0(9) . . . . ?
Ag3 Ag2 N6 C21 75.7(15) . . . . ?
Ag3 Ag2 N6 C25 -84.2(14) . . . . ?
Ag3 Ag2 C2 Ag1 -112.3(5) . . . . ?
Ag3 Ag2 C2 C1 -2.6(11) . . . . ?
Ag3 Ag2 C2 C3 122.0(12) . . . . ?
Ag3 Ag4 N14 C45 -35.8(18) . . . . ?
Ag3 Ag4 N14 C49 159.5(9) . . . . ?
Ag3 Ag4 C1 N1 -117.9(16) . . . . ?
Ag3 Ag4 C1 C2 112.6(14) . . . . ?
Ag3 N10 C33 N9 15.5(19) . . . . ?
Ag3 N10 C33 C34 -156.9(18) . . . . ?
Ag3 N10 C37 N11 -21(2) . . . . ?
Ag3 N10 C37 C36 157.4(14) . . . . ?
Ag3 C1 C2 Ag1 94.3(11) . . . . ?
Ag3 C1 C2 Ag2 3.8(15) . . . . ?
Ag3 C1 C2 C3 -130.9(11) . . . . ?
Ag4 Ag1 Ag2 Ag3 0.04(5) . . . . ?
Ag4 Ag1 Ag2 N6 119.5(7) . . . . ?
Ag4 Ag1 Ag2 C2 -58.2(5) . . . . ?
Ag4 Ag1 N2 C9 85.0(13) . . . . ?
Ag4 Ag1 N2 C13 -72.6(17) . . . . ?
Ag4 Ag1 C2 Ag2 112.0(4) . . . . ?
Ag4 Ag1 C2 C1 0.8(9) . . . . ?
Ag4 Ag1 C2 C3 -123.1(13) . . . . ?
Ag4 Ag3 N10 C33 -158.7(9) . . . . ?
Ag4 Ag3 N10 C37 39(2) . . . . ?
Ag4 Ag3 C1 N1 121.0(16) . . . . ?
Ag4 Ag3 C1 C2 -115.2(15) . . . . ?
Ag4 N14 C45 N13 19(2) . . . . ?
Ag4 N14 C45 C46 -155.7(13) . . . . ?
Ag4 N14 C49 N15 -14.5(19) . . . . ?
Ag4 N14 C49 C48 155.6(17) . . . . ?
Ag4 C1 C2 Ag1 -1.2(14) . . . . ?
Ag4 C1 C2 Ag2 -91.7(11) . . . . ?
Ag4 C1 C2 C3 133.6(11) . . . . ?
Ag5 N4 C15 N3 -22(2) . . . . ?
Ag5 N4 C15 C16 158.9(15) . . . . ?
Ag5 N4 C19 N5 22(2) . . . . ?
Ag5 N4 C19 C18 -160.0(14) . . . . ?
Ag5 N12 C39 N11 -23.5(19) . . . . ?
Ag5 N12 C39 C40 156.5(12) . . . . ?
Ag5 N12 C43 N13 28.2(19) . . . . ?
Ag5 N12 C43 C42 -155.6(13) . . . . ?
N1 C1 C2 Ag1 -136.9(12) . . . . ?
N1 C1 C2 Ag2 132.7(12) . . . . ?
N1 C1 C2 C3 -2.0(16) . . . . ?
N2 Ag1 Ag2 Ag3 -118.8(8) . . . . ?
N2 Ag1 Ag2 N6 0.7(11) . . . . ?
N2 Ag1 Ag2 C2 -177.1(9) . . . . ?
N2 Ag1 Ag4 Ag3 148.9(5) . . . . ?
N2 Ag1 Ag4 N14 -3.1(6) . . . . ?
N2 Ag1 Ag4 C1 -167.2(7) . . . . ?
N2 Ag1 C2 Ag2 173(2) . . . . ?
N2 Ag1 C2 C1 62(3) . . . . ?
N2 Ag1 C2 C3 -62(3) . . . . ?
N2 C9 C10 C11 5(3) . . . . ?
N3 C15 C16 C17 179(2) . . . . ?
N4 Ag5 N12 C39 -86(2) . . . . ?
N4 Ag5 N12 C43 71(3) . . . . ?
N4 C15 C16 C17 -2(3) . . . . ?
N5 C21 C22 C23 -177.0(17) . . . . ?
N6 Ag2 Ag3 Ag4 -150.3(5) . . . . ?
N6 Ag2 Ag3 N10 1.8(7) . . . . ?
N6 Ag2 Ag3 C1 167.8(7) . . . . ?
N6 Ag2 C2 Ag1 -175.2(19) . . . . ?
N6 Ag2 C2 C1 -65(3) . . . . ?
N6 Ag2 C2 C3 59(3) . . . . ?
N6 C21 C22 C23 -6(3) . . . . ?
N7 C27 C28 C29 179.1(18) . . . . ?
N8 C27 C28 C29 -1(3) . . . . ?
N9 C33 C34 C35 -177.1(16) . . . . ?
N10 Ag3 Ag4 Ag1 -119.6(8) . . . . ?
N10 Ag3 Ag4 N14 -1.2(11) . . . . ?
N10 Ag3 Ag4 C1 -178.6(11) . . . . ?
N10 Ag3 C1 Ag4 177(2) . . . . ?
N10 Ag3 C1 N1 -62(3) . . . . ?
N10 Ag3 C1 C2 62(3) . . . . ?
N10 C33 C34 C35 -5(3) . . . . ?
N11 C39 C40 C41 -179.6(18) . . . . ?
N12 Ag5 N4 C15 -74(3) . . . . ?
N12 Ag5 N4 C19 86(2) . . . . ?
N12 C39 C40 C41 1(2) . . . . ?
N13 C45 C46 C47 -177.2(16) . . . . ?
N14 Ag4 C1 Ag3 -175.4(19) . . . . ?
N14 Ag4 C1 N1 67(3) . . . . ?
N14 Ag4 C1 C2 -63(3) . . . . ?
N14 C45 C46 C47 -3(3) . . . . ?
N15 C51 C52 C53 177.5(17) . . . . ?
N16 C51 C52 C53 0(3) . . . . ?
N17 C9 C10 C11 177(2) . . . . ?
C1 Ag3 Ag4 Ag1 59.0(8) . . . . ?
C1 Ag3 Ag4 N14 177.4(11) . . . . ?
C1 Ag3 N10 C33 25(3) . . . . ?
C1 Ag3 N10 C37 -137(3) . . . . ?
C1 Ag4 N14 C45 138(2) . . . . ?
C1 Ag4 N14 C49 -27(3) . . . . ?
C1 N1 C8 C3 0.6(14) . . . . ?
C1 N1 C8 C7 178.3(12) . . . . ?
C1 C2 C3 C4 -177.7(10) . . . . ?
C1 C2 C3 C8 2.5(14) . . . . ?
C2 Ag1 Ag2 Ag3 58.3(5) . . . . ?
C2 Ag1 Ag2 N6 177.7(9) . . . . ?
C2 Ag1 Ag4 Ag3 -44.5(5) . . . . ?
C2 Ag1 Ag4 N14 163.5(6) . . . . ?
C2 Ag1 Ag4 C1 -0.6(7) . . . . ?
C2 Ag1 N2 C9 28(3) . . . . ?
C2 Ag1 N2 C13 -129(2) . . . . ?
C2 Ag2 Ag3 Ag4 43.7(5) . . . . ?
C2 Ag2 Ag3 N10 -164.2(7) . . . . ?
C2 Ag2 Ag3 C1 1.8(7) . . . . ?
C2 Ag2 N6 C21 134(2) . . . . ?
C2 Ag2 N6 C25 -26(3) . . . . ?
C2 C3 C4 C5 -179.8(14) . . . . ?
C2 C3 C8 N1 -1.9(11) . . . . ?
C2 C3 C8 C7 179.9(12) . . . . ?
C3 C4 C5 C6 0.0 . . . . ?
C4 C3 C8 N1 178.2(9) . . . . ?
C4 C3 C8 C7 0.0 . . . . ?
C4 C5 C6 C7 0.0 . . . . ?
C5 C6 C7 C8 0.0 . . . . ?
C6 C7 C8 N1 -177.5(13) . . . . ?
C6 C7 C8 C3 0.0 . . . . ?
C8 N1 C1 Ag3 127.5(11) . . . . ?
C8 N1 C1 Ag4 -132.2(11) . . . . ?
C8 N1 C1 C2 1.0(18) . . . . ?
C8 C3 C4 C5 0.0 . . . . ?
C9 N2 C13 N3 -178.1(18) . . . . ?
C9 N2 C13 C12 -2(3) . . . . ?
C9 N17 C55 N16 -1(2) . . . . ?
C9 N17 C55 C54 177.8(18) . . . . ?
C9 C10 C11 C12 -4(3) . . . . ?
C10 C11 C12 C13 0(3) . . . . ?
C11 C12 C13 N2 4(3) . . . . ?
C11 C12 C13 N3 179.4(19) . . . . ?
C13 N2 C9 N17 -174(2) . . . . ?
C13 N2 C9 C10 -2(3) . . . . ?
C13 N3 C15 N4 142.8(18) . . . . ?
C13 N3 C15 C16 -38(3) . . . . ?
C14 N3 C13 N2 -177.9(17) . . . . ?
C14 N3 C13 C12 6(3) . . . . ?
C14 N3 C15 N4 -73(2) . . . . ?
C14 N3 C15 C16 107(2) . . . . ?
C15 N3 C13 N2 -35(3) . . . . ?
C15 N3 C13 C12 149.5(18) . . . . ?
C15 N4 C19 N5 -178.3(17) . . . . ?
C15 N4 C19 C18 0(3) . . . . ?
C15 C16 C17 C18 4(3) . . . . ?
C16 C17 C18 C19 -5(3) . . . . ?
C17 C18 C19 N4 3(3) . . . . ?
C17 C18 C19 N5 -179(2) . . . . ?
C19 N4 C15 N3 179.3(17) . . . . ?
C19 N4 C15 C16 0(3) . . . . ?
C19 N5 C21 N6 35(2) . . . . ?
C19 N5 C21 C22 -153.0(16) . . . . ?
C20 N5 C19 N4 69(2) . . . . ?
C20 N5 C19 C18 -109(2) . . . . ?
C20 N5 C21 N6 -177.1(16) . . . . ?
C20 N5 C21 C22 -6(2) . . . . ?
C21 N5 C19 N4 -143.6(17) . . . . ?
C21 N5 C19 C18 39(3) . . . . ?
C21 N6 C25 N7 171.4(18) . . . . ?
C21 N6 C25 C24 -5(3) . . . . ?
C21 C22 C23 C24 3(3) . . . . ?
C22 C23 C24 C25 -1(3) . . . . ?
C23 C24 C25 N6 2(3) . . . . ?
C23 C24 C25 N7 -174(2) . . . . ?
C25 N6 C21 N5 178.1(18) . . . . ?
C25 N6 C21 C22 7(3) . . . . ?
C25 N7 C27 N8 0(3) . . . . ?
C25 N7 C27 C28 179(2) . . . . ?
C26 N7 C25 N6 -76(3) . . . . ?
C26 N7 C25 C24 101(3) . . . . ?
C26 N7 C27 N8 172.6(18) . . . . ?
C26 N7 C27 C28 -8(3) . . . . ?
C27 N7 C25 N6 97(2) . . . . ?
C27 N7 C25 C24 -87(3) . . . . ?
C27 N8 C31 N9 177.0(17) . . . . ?
C27 N8 C31 C30 -7(3) . . . . ?
C27 C28 C29 C30 -2(3) . . . . ?
C28 C29 C30 C31 0(3) . . . . ?
C29 C30 C31 N8 4(3) . . . . ?
C29 C30 C31 N9 179.9(17) . . . . ?
C31 N8 C27 N7 -174.6(18) . . . . ?
C31 N8 C27 C28 6(3) . . . . ?
C31 N9 C33 N10 -90(2) . . . . ?
C31 N9 C33 C34 83(2) . . . . ?
C32 N9 C31 N8 -176.7(19) . . . . ?
C32 N9 C31 C30 7(3) . . . . ?
C32 N9 C33 N10 87(2) . . . . ?
C32 N9 C33 C34 -99(2) . . . . ?
C33 N9 C31 N8 1(3) . . . . ?
C33 N9 C31 C30 -175.2(17) . . . . ?
C33 N10 C37 N11 176.3(15) . . . . ?
C33 N10 C37 C36 -5(3) . . . . ?
C33 C34 C35 C36 1(3) . . . . ?
C34 C35 C36 C37 1(3) . . . . ?
C35 C36 C37 N10 2(3) . . . . ?
C35 C36 C37 N11 180.0(16) . . . . ?
C37 N10 C33 N9 179.9(15) . . . . ?
C37 N10 C33 C34 7(3) . . . . ?
C37 N11 C39 N12 143.5(15) . . . . ?
C37 N11 C39 C40 -36(2) . . . . ?
C38 N11 C37 N10 -174.6(16) . . . . ?
C38 N11 C37 C36 7(2) . . . . ?
C38 N11 C39 N12 -74(2) . . . . ?
C38 N11 C39 C40 106(2) . . . . ?
C39 N11 C37 N10 -32(2) . . . . ?
C39 N11 C37 C36 149.8(18) . . . . ?
C39 N12 C43 N13 -176.0(14) . . . . ?
C39 N12 C43 C42 0(2) . . . . ?
C39 C40 C41 C42 -1(3) . . . . ?
C40 C41 C42 C43 1(3) . . . . ?
C41 C42 C43 N12 0(3) . . . . ?
C41 C42 C43 N13 175.4(18) . . . . ?
C43 N12 C39 N11 179.8(15) . . . . ?
C43 N12 C39 C40 0(2) . . . . ?
C43 N13 C45 N14 32(2) . . . . ?
C43 N13 C45 C46 -153.9(17) . . . . ?
C44 N13 C43 N12 73(2) . . . . ?
C44 N13 C43 C42 -103(2) . . . . ?
C44 N13 C45 N14 175.4(16) . . . . ?
C44 N13 C45 C46 -10(2) . . . . ?
C45 N13 C43 N12 -145.7(15) . . . . ?
C45 N13 C43 C42 38(2) . . . . ?
C45 N14 C49 N15 179.0(14) . . . . ?
C45 N14 C49 C48 -11(3) . . . . ?
C45 C46 C47 C48 -1(3) . . . . ?
C46 C47 C48 C49 0(3) . . . . ?
C47 C48 C49 N14 7(3) . . . . ?
C47 C48 C49 N15 176.1(17) . . . . ?
C49 N14 C45 N13 -176.6(15) . . . . ?
C49 N14 C45 C46 9(2) . . . . ?
C49 N15 C51 N16 -5(2) . . . . ?
C49 N15 C51 C52 177.3(17) . . . . ?
C50 N15 C49 N14 -90(2) . . . . ?
C50 N15 C49 C48 100(2) . . . . ?
C50 N15 C51 N16 177.2(18) . . . . ?
C50 N15 C51 C52 0(3) . . . . ?
C51 N15 C49 N14 93(2) . . . . ?
C51 N15 C49 C48 -78(2) . . . . ?
C51 N16 C55 N17 178.3(15) . . . . ?
C51 N16 C55 C54 0(3) . . . . ?
C51 C52 C53 C54 -2(3) . . . . ?
C52 C53 C54 C55 2(3) . . . . ?
C53 C54 C55 N16 -1(3) . . . . ?
C53 C54 C55 N17 -179.2(17) . . . . ?
C55 N16 C51 N15 -176.9(15) . . . . ?
C55 N16 C51 C52 0(2) . . . . ?
C55 N17 C9 N2 -96(2) . . . . ?
C55 N17 C9 C10 93(3) . . . . ?
C56 N17 C9 N2 72(3) . . . . ?
C56 N17 C9 C10 -100(3) . . . . ?
C56 N17 C55 N16 -169.0(18) . . . . ?
C56 N17 C55 C54 9(3) . . . . ?
Ag6 Ag7 Ag8 Ag9 -0.01(8) . . . . ?
Ag6 Ag7 Ag8 N27 152.3(5) . . . . ?
Ag6 Ag7 Ag8 C57 -43.6(7) . . . . ?
Ag6 Ag7 N23 C77 -42(2) . . . . ?
Ag6 Ag7 N23 C81 159.5(11) . . . . ?
Ag6 Ag7 C58 C57 117.1(17) . . . . ?
Ag6 Ag7 C58 C59 -120.8(16) . . . . ?
Ag6 Ag9 N31 C101 78.2(18) . . . . ?
Ag6 Ag9 N31 C105 -84.8(16) . . . . ?
Ag6 Ag9 C57 Ag8 -108.1(7) . . . . ?
Ag6 Ag9 C57 N18 126.7(19) . . . . ?
Ag6 Ag9 C57 C58 0.1(11) . . . . ?
Ag6 N19 C65 N34 27(2) . . . . ?
Ag6 N19 C65 C66 -160.3(17) . . . . ?
Ag6 N19 C69 N20 -23(3) . . . . ?
Ag6 N19 C69 C68 153.6(16) . . . . ?
Ag6 C58 C59 C64 130.8(11) . . . . ?
Ag6 C58 C59 C60 -46(2) . . . . ?
Ag7 Ag6 Ag9 Ag8 -0.01(8) . . . . ?
Ag7 Ag6 Ag9 N31 -152.5(5) . . . . ?
Ag7 Ag6 Ag9 C57 42.9(7) . . . . ?
Ag7 Ag6 N19 C65 -159.7(10) . . . . ?
Ag7 Ag6 N19 C69 43(2) . . . . ?
Ag7 Ag6 C58 C57 -114.8(16) . . . . ?
Ag7 Ag6 C58 C59 118.7(15) . . . . ?
Ag7 Ag8 Ag9 Ag6 0.01(7) . . . . ?
Ag7 Ag8 Ag9 N31 117.3(9) . . . . ?
Ag7 Ag8 Ag9 C57 -64.8(9) . . . . ?
Ag7 Ag8 N27 C89 85.7(13) . . . . ?
Ag7 Ag8 N27 C93 -77.6(16) . . . . ?
Ag7 Ag8 C57 Ag9 108.0(7) . . . . ?
Ag7 Ag8 C57 N18 -128.5(19) . . . . ?
Ag7 Ag8 C57 C58 1.6(13) . . . . ?
Ag7 N23 C77 N22 21(3) . . . . ?
Ag7 N23 C77 C78 -153.8(15) . . . . ?
Ag7 N23 C81 N24 -26(2) . . . . ?
Ag7 N23 C81 C80 157.4(15) . . . . ?
Ag7 C58 C59 C64 -130.4(11) . . . . ?
Ag7 C58 C59 C60 52(2) . . . . ?
Ag8 Ag7 N23 C77 74.4(19) . . . . ?
Ag8 Ag7 N23 C81 -84.4(14) . . . . ?
Ag8 Ag7 C58 Ag6 -115.4(6) . . . . ?
Ag8 Ag7 C58 C57 1.7(13) . . . . ?
Ag8 Ag7 C58 C59 123.8(15) . . . . ?
Ag8 Ag9 N31 C101 -36(2) . . . . ?
Ag8 Ag9 N31 C105 161.2(12) . . . . ?
Ag8 Ag9 C57 N18 -125(2) . . . . ?
Ag8 Ag9 C57 C58 108.2(15) . . . . ?
Ag8 N27 C89 N26 18(2) . . . . ?
Ag8 N27 C89 C90 -166.5(18) . . . . ?
Ag8 N27 C93 N28 -20(3) . . . . ?
Ag8 N27 C93 C92 158.1(15) . . . . ?
Ag8 C57 C58 Ag6 92.8(14) . . . . ?
Ag8 C57 C58 Ag7 -2.5(19) . . . . ?
Ag8 C57 C58 C59 -132.5(13) . . . . ?
Ag9 Ag6 Ag7 Ag8 0.01(7) . . . . ?
Ag9 Ag6 Ag7 N23 120.5(8) . . . . ?
Ag9 Ag6 Ag7 C58 -54.7(7) . . . . ?
Ag9 Ag6 N19 C65 84.8(13) . . . . ?
Ag9 Ag6 N19 C69 -72.3(19) . . . . ?
Ag9 Ag6 C58 Ag7 115.0(6) . . . . ?
Ag9 Ag6 C58 C57 0.2(12) . . . . ?
Ag9 Ag6 C58 C59 -126.3(14) . . . . ?
Ag9 Ag8 N27 C89 -159.7(10) . . . . ?
Ag9 Ag8 N27 C93 37(2) . . . . ?
Ag9 Ag8 C57 N18 124(2) . . . . ?
Ag9 Ag8 C57 C58 -106.3(17) . . . . ?
Ag9 N31 C101 N30 21(3) . . . . ?
Ag9 N31 C101 C102 -157.7(16) . . . . ?
Ag9 N31 C105 N32 -19(2) . . . . ?
Ag9 N31 C105 C104 164(2) . . . . ?
Ag9 C57 C58 Ag6 -0.2(17) . . . . ?
Ag9 C57 C58 Ag7 -95.5(14) . . . . ?
Ag9 C57 C58 C59 134.4(13) . . . . ?
Ag10 N21 C71 N20 -19(3) . . . . ?
Ag10 N21 C71 C72 156(2) . . . . ?
Ag10 N21 C75 N22 17(3) . . . . ?
Ag10 N21 C75 C74 -151(2) . . . . ?
Ag10 N29 C95 N28 -19(2) . . . . ?
Ag10 N29 C95 C96 156(2) . . . . ?
Ag10 N29 C99 N30 24(3) . . . . ?
Ag10 N29 C99 C98 -163(2) . . . . ?
N18 C57 C58 Ag6 -131.6(16) . . . . ?
N18 C57 C58 Ag7 133.1(16) . . . . ?
N18 C57 C58 C59 3(2) . . . . ?
N18 C64 C59 C58 1.0(17) . . . . ?
N18 C64 C59 C60 178.9(15) . . . . ?
N18 C64 C63 C62 -178.9(15) . . . . ?
N19 Ag6 Ag7 Ag8 -120.2(8) . . . . ?
N19 Ag6 Ag7 N23 0.2(11) . . . . ?
N19 Ag6 Ag7 C58 -174.9(11) . . . . ?
N19 Ag6 Ag9 Ag8 148.9(5) . . . . ?
N19 Ag6 Ag9 N31 -3.7(7) . . . . ?
N19 Ag6 Ag9 C57 -168.2(8) . . . . ?
N19 Ag6 C58 Ag7 168(2) . . . . ?
N19 Ag6 C58 C57 53(3) . . . . ?
N19 Ag6 C58 C59 -73(3) . . . . ?
N19 C65 C66 C67 5(3) . . . . ?
N20 C71 C72 C73 178(2) . . . . ?
N21 Ag10 N29 C95 -80(2) . . . . ?
N21 Ag10 N29 C99 80(2) . . . . ?
N21 C71 C72 C73 3(4) . . . . ?
N22 C77 C78 C79 -171(2) . . . . ?
N23 Ag7 Ag8 Ag9 -150.0(5) . . . . ?
N23 Ag7 Ag8 N27 2.3(7) . . . . ?
N23 Ag7 Ag8 C57 166.4(9) . . . . ?
N23 Ag7 C58 Ag6 -169(2) . . . . ?
N23 Ag7 C58 C57 -52(4) . . . . ?
N23 Ag7 C58 C59 70(3) . . . . ?
N23 C77 C78 C79 4(3) . . . . ?
N24 C83 N25 C87 -178.6(15) . . . . ?
N24 C83 C84 C85 178.4(17) . . . . ?
N26 C87 C86 C85 178.8(19) . . . . ?
N26 C89 C90 C91 -176(2) . . . . ?
N27 Ag8 Ag9 Ag6 -118.0(9) . . . . ?
N27 Ag8 Ag9 N31 -0.6(13) . . . . ?
N27 Ag8 Ag9 C57 177.2(13) . . . . ?
N27 Ag8 C57 Ag9 -175(2) . . . . ?
N27 Ag8 C57 N18 -51(4) . . . . ?
N27 Ag8 C57 C58 79(3) . . . . ?
N27 C89 C90 C91 9(3) . . . . ?
N28 C95 C96 C97 178(2) . . . . ?
N29 Ag10 N21 C71 -82(3) . . . . ?
N29 Ag10 N21 C75 81(3) . . . . ?
N29 C95 C96 C97 3(4) . . . . ?
N30 C101 C102 C103 -180(2) . . . . ?
N31 Ag9 C57 Ag8 176(2) . . . . ?
N31 Ag9 C57 N18 51(4) . . . . ?
N31 Ag9 C57 C58 -76(3) . . . . ?
N31 C101 C102 C103 -1(3) . . . . ?
N32 C107 C108 C109 -179(2) . . . . ?
N33 C107 C108 C109 6(4) . . . . ?
N34 C65 C66 C67 177(2) . . . . ?
C57 Ag8 Ag9 Ag6 64.8(9) . . . . ?
C57 Ag8 Ag9 N31 -177.8(13) . . . . ?
C57 Ag8 N27 C89 13(4) . . . . ?
C57 Ag8 N27 C93 -151(3) . . . . ?
C57 Ag9 N31 C101 150(3) . . . . ?
C57 Ag9 N31 C105 -13(4) . . . . ?
C57 N18 C64 C59 1(2) . . . . ?
C57 N18 C64 C63 179.8(14) . . . . ?
C57 C58 C59 C64 -2.2(16) . . . . ?
C57 C58 C59 C60 -179.4(14) . . . . ?
C58 Ag6 Ag7 Ag8 54.7(7) . . . . ?
C58 Ag6 Ag7 N23 175.1(11) . . . . ?
C58 Ag6 Ag9 Ag8 -43.0(5) . . . . ?
C58 Ag6 Ag9 N31 164.4(8) . . . . ?
C58 Ag6 Ag9 C57 -0.1(9) . . . . ?
C58 Ag6 N19 C65 36(3) . . . . ?
C58 Ag6 N19 C69 -121(3) . . . . ?
C58 Ag7 Ag8 Ag9 42.3(6) . . . . ?
C58 Ag7 Ag8 N27 -165.3(8) . . . . ?
C58 Ag7 Ag8 C57 -1.2(10) . . . . ?
C58 Ag7 N23 C77 124(3) . . . . ?
C58 Ag7 N23 C81 -35(3) . . . . ?
C58 C59 C60 C61 177(2) . . . . ?
C64 N18 C57 Ag8 126.3(16) . . . . ?
C64 N18 C57 Ag9 -126.7(16) . . . . ?
C64 N18 C57 C58 -2(2) . . . . ?
C64 C59 C60 C61 0.0 . . . . ?
C59 C64 C63 C62 0.0 . . . . ?
C59 C60 C61 C62 0.0 . . . . ?
C60 C61 C62 C63 0.0 . . . . ?
C61 C62 C63 C64 0.0 . . . . ?
C63 C64 C59 C58 -177.9(14) . . . . ?
C63 C64 C59 C60 0.0 . . . . ?
C65 N19 C69 N20 -176.3(19) . . . . ?
C65 N19 C69 C68 0(3) . . . . ?
C65 N34 C111 N33 3(3) . . . . ?
C65 N34 C111 C110 -177(3) . . . . ?
C65 C66 C67 C68 -6(4) . . . . ?
C66 C67 C68 C69 4(3) . . . . ?
C67 C68 C69 N19 -1(3) . . . . ?
C67 C68 C69 N20 175(2) . . . . ?
C69 N19 C65 N34 -175(2) . . . . ?
C69 N19 C65 C66 -2(3) . . . . ?
C69 N20 C71 N21 141(2) . . . . ?
C69 N20 C71 C72 -35(3) . . . . ?
C70 N20 C69 N19 -179(2) . . . . ?
C70 N20 C69 C68 5(3) . . . . ?
C70 N20 C71 N21 -71(2) . . . . ?
C70 N20 C71 C72 113(3) . . . . ?
C71 N20 C69 N19 -36(3) . . . . ?
C71 N20 C69 C68 147.6(19) . . . . ?
C71 N21 C75 N22 -179(2) . . . . ?
C71 N21 C75 C74 14(4) . . . . ?
C71 C72 C73 C74 -2(4) . . . . ?
C72 C73 C74 C75 7(4) . . . . ?
C73 C74 C75 N21 -13(4) . . . . ?
C73 C74 C75 N22 180(2) . . . . ?
C75 N21 C71 N20 177(2) . . . . ?
C75 N21 C71 C72 -8(4) . . . . ?
C75 N22 C77 N23 36(3) . . . . ?
C75 N22 C77 C78 -149(2) . . . . ?
C76 N22 C75 N21 73(2) . . . . ?
C76 N22 C75 C74 -117(2) . . . . ?
C76 N22 C77 N23 177(2) . . . . ?
C76 N22 C77 C78 -8(3) . . . . ?
C77 N22 C75 N21 -140(2) . . . . ?
C77 N22 C75 C74 29(3) . . . . ?
C77 N23 C81 N24 174(2) . . . . ?
C77 N23 C81 C80 -3(3) . . . . ?
C77 C78 C79 C80 -9(3) . . . . ?
C78 C79 C80 C81 9(3) . . . . ?
C79 C80 C81 N23 -3(3) . . . . ?
C79 C80 C81 N24 -179(2) . . . . ?
C81 N23 C77 N22 177.1(19) . . . . ?
C81 N23 C77 C78 2(3) . . . . ?
C81 N24 C83 N25 -6(2) . . . . ?
C81 N24 C83 C84 175.2(15) . . . . ?
C82 N24 C81 N23 -84(3) . . . . ?
C82 N24 C81 C80 92(3) . . . . ?
C82 N24 C83 N25 175(2) . . . . ?
C82 N24 C83 C84 -3(3) . . . . ?
C83 N24 C81 N23 98(2) . . . . ?
C83 N24 C81 C80 -86(3) . . . . ?
C83 N25 C87 N26 -178.9(18) . . . . ?
C83 N25 C87 C86 0.0 . . . . ?
N25 C83 C84 C85 0.0 . . . . ?
N25 C87 C86 C85 0.0 . . . . ?
C87 N26 C89 N27 -93(2) . . . . ?
C87 N26 C89 C90 92(3) . . . . ?
C87 C86 C85 C84 0.0 . . . . ?
C86 C85 C84 C83 0.0 . . . . ?
C84 C83 N25 C87 0.0 . . . . ?
C88 N26 C87 N25 -176(2) . . . . ?
C88 N26 C87 C86 5(3) . . . . ?
C88 N26 C89 N27 88(3) . . . . ?
C88 N26 C89 C90 -87(3) . . . . ?
C89 N26 C87 N25 4(3) . . . . ?
C89 N26 C87 C86 -174.6(15) . . . . ?
C89 N27 C93 N28 177.4(19) . . . . ?
C89 N27 C93 C92 -4(3) . . . . ?
C89 C90 C91 C92 -9(4) . . . . ?
C90 C91 C92 C93 3(4) . . . . ?
C91 C92 C93 N27 4(3) . . . . ?
C91 C92 C93 N28 -178(2) . . . . ?
C93 N27 C89 N26 -178.0(19) . . . . ?
C93 N27 C89 C90 -3(3) . . . . ?
C93 N28 C95 N29 140(2) . . . . ?
C93 N28 C95 C96 -36(3) . . . . ?
C94 N28 C93 N27 -178.9(17) . . . . ?
C94 N28 C93 C92 3(3) . . . . ?
C94 N28 C95 N29 -69(2) . . . . ?
C94 N28 C95 C96 116(2) . . . . ?
C95 N28 C93 N27 -30(3) . . . . ?
C95 N28 C93 C92 151(2) . . . . ?
C95 N29 C99 N30 -173(2) . . . . ?
C95 N29 C99 C98 0(4) . . . . ?
C95 C96 C97 C98 7(4) . . . . ?
C96 C97 C98 C99 -12(5) . . . . ?
C97 C98 C99 N29 8(4) . . . . ?
C97 C98 C99 N30 -178(2) . . . . ?
C99 N29 C95 N28 179.1(18) . . . . ?
C99 N29 C95 C96 -6(3) . . . . ?
C99 N30 C101 N31 24(3) . . . . ?
C99 N30 C101 C102 -157(2) . . . . ?
C100 N30 C99 N29 59(3) . . . . ?
C100 N30 C99 C98 -114(2) . . . . ?
C100 N30 C101 N31 -175.8(17) . . . . ?
C100 N30 C101 C102 3(3) . . . . ?
C101 N30 C99 N29 -139(2) . . . . ?
C101 N30 C99 C98 47(3) . . . . ?
C101 N31 C105 N32 176.4(19) . . . . ?
C101 N31 C105 C104 0(4) . . . . ?
C101 C102 C103 C104 -7(3) . . . . ?
C102 C103 C104 C105 11(4) . . . . ?
C103 C104 C105 N31 -8(4) . . . . ?
C103 C104 C105 N32 176(2) . . . . ?
C105 N31 C101 N30 -176(2) . . . . ?
C105 N31 C101 C102 4(3) . . . . ?
C105 N32 C107 N33 -9(3) . . . . ?
C105 N32 C107 C108 174.9(19) . . . . ?
C106 N32 C105 N31 -88(3) . . . . ?
C106 N32 C105 C104 89(3) . . . . ?
C106 N32 C107 N33 178(2) . . . . ?
C106 N32 C107 C108 2(4) . . . . ?
C107 N32 C105 N31 98(2) . . . . ?
C107 N32 C105 C104 -86(3) . . . . ?
C107 N33 C111 N34 179.8(19) . . . . ?
C107 N33 C111 C110 0(3) . . . . ?
C107 C108 C109 C110 -8(4) . . . . ?
C108 C109 C110 C111 7(4) . . . . ?
C109 C110 C111 N33 -2(4) . . . . ?
C109 C110 C111 N34 179(2) . . . . ?
C111 N33 C107 N32 -177.1(19) . . . . ?
C111 N33 C107 C108 -2(4) . . . . ?
C111 N34 C65 N19 -96(3) . . . . ?
C111 N34 C65 C66 91(3) . . . . ?
C112 N34 C65 N19 75(3) . . . . ?
C112 N34 C65 C66 -97(3) . . . . ?
C112 N34 C111 N33 -168(2) . . . . ?
C112 N34 C111 C110 11(4) . . . . ?
O1 S1 C113 F1 56(3) . . . . ?
O1 S1 C113 F2 -58(2) . . . . ?
O1 S1 C113 F3 -175.5(18) . . . . ?
O2 S1 C113 F1 -67(3) . . . . ?
O2 S1 C113 F2 179.0(19) . . . . ?
O2 S1 C113 F3 62(2) . . . . ?
O3 S1 C113 F1 174(3) . . . . ?
O3 S1 C113 F2 60(2) . . . . ?
O3 S1 C113 F3 -57(2) . . . . ?
O4 S2 C114 F4 -177(3) . . . . ?
O4 S2 C114 F5 52(3) . . . . ?
O4 S2 C114 F6 -67(3) . . . . ?
O5 S2 C114 F4 -52(3) . . . . ?
O5 S2 C114 F5 176(3) . . . . ?
O5 S2 C114 F6 58(3) . . . . ?
O6 S2 C114 F4 74(3) . . . . ?
O6 S2 C114 F5 -58(4) . . . . ?
O6 S2 C114 F6 -176(3) . . . . ?
O7 S3 C115 F7 71(3) . . . . ?
O7 S3 C115 F8 -59(3) . . . . ?
O7 S3 C115 F9 -173(2) . . . . ?
O8 S3 C115 F7 -56(3) . . . . ?
O8 S3 C115 F8 174(3) . . . . ?
O8 S3 C115 F9 61(2) . . . . ?
O9 S3 C115 F7 -169(2) . . . . ?
O9 S3 C115 F8 60(3) . . . . ?
O9 S3 C115 F9 -53(2) . . . . ?
O10 S4 C116 F10 -66(3) . . . . ?
O10 S4 C116 F11 175(2) . . . . ?
O10 S4 C116 F12 45(3) . . . . ?
O11 S4 C116 F10 61(3) . . . . ?
O11 S4 C116 F11 -57(3) . . . . ?
O11 S4 C116 F12 173(3) . . . . ?
O12 S4 C116 F10 -175(3) . . . . ?
O12 S4 C116 F11 67(3) . . . . ?
O12 S4 C116 F12 -63(4) . . . . ?
_olex2_submission_special_instructions 'No special instructions were received'

# SQUEEZE RESULTS ?
# Note: Data are Listed for all Voids in the P1 Unit Cell
# i.e. Centre of Gravity, Solvent Accessible Volume,
# Recovered number of Electrons in the Void and
# Details about the Squeezed Material
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.673 0.676 0.062 168 85 ' '
2 0.758 0.173 0.974 172 82 ' '
_platon_squeeze_details          ?
