# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# 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_publication_text
_database_code_depnum_ccdc_archive 'CCDC 1424889'
_audit_update_record             
;
2015-09-16 deposited with the CCDC.
2016-06-06 downloaded from the CCDC.
;




_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C81 H64 Ag Cl N2 O2'
_chemical_formula_sum            'C81 H64 Ag Cl N2 O2'
_chemical_formula_weight         1240.66

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 2/n'
_symmetry_space_group_name_HALL  '-P 2yac'

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

_cell_length_a                   11.8068(6)
_cell_length_b                   14.7394(7)
_cell_length_c                   22.520(1)
_cell_angle_alpha                90.00
_cell_angle_beta                 101.746(5)
_cell_angle_gamma                90.00
_cell_volume                     3837.0(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    6561
_cell_measurement_theta_min      2.80
_cell_measurement_theta_max      27.81

_exptl_crystal_description       rod
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.48
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.16
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.074
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1288
_exptl_absorpt_coefficient_mu    0.340
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8540
_exptl_absorpt_correction_T_max  0.9477
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd., 2009
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  
;  
Oxford Diffraction Xcalibur (TM) Single Crystal X-ray Diffractometer 
with Sapphire CCD Detector.
;
_diffrn_measurement_method       
;
Rotation method data acquisition using omega scans.
;
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         0
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        0
_diffrn_reflns_number            14778
_diffrn_reflns_av_R_equivalents  0.0306
_diffrn_reflns_av_sigmaI/netI    0.0419
_diffrn_reflns_limit_h_min       -7
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.97
_diffrn_reflns_theta_max         25.19
_reflns_number_total             6778
_reflns_number_gt                4444
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       
;
CrysAlis CCD (Oxford Diffraction Ltd., 2009)
;
_computing_cell_refinement       
;
CrysAlis RED (Oxford Diffraction Ltd., 2009)
;
_computing_data_reduction        
;
CrysAlis RED (Oxford Diffraction Ltd., 2009)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'PLATON (Spek, 2003)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'

_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)+(0.1672P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6778
_refine_ls_number_parameters     398
_refine_ls_number_restraints     26
_refine_ls_R_factor_all          0.1074
_refine_ls_R_factor_gt           0.0720
_refine_ls_wR_factor_ref         0.2379
_refine_ls_wR_factor_gt          0.2084
_refine_ls_goodness_of_fit_ref   1.022
_refine_ls_restrained_S_all      1.040
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.2500 0.2630(4) 0.2500 0.0355(12) Uani 1 2 d S . .
C2 C 0.2341(3) 0.4101(3) 0.21931(19) 0.0413(9) Uani 1 1 d . . .
C3 C 0.1875(3) 0.2886(3) 0.13993(17) 0.0377(9) Uani 1 1 d . . .
C4 C 0.0721(3) 0.2983(3) 0.11089(17) 0.0360(8) Uani 1 1 d . . .
C5 C -0.0254(3) 0.3387(3) 0.13704(18) 0.0400(9) Uani 1 1 d . . .
H5 H -0.0005 0.3593 0.1791 0.048 Uiso 1 1 calc R . .
C6 C -0.1189(3) 0.2659(3) 0.12943(19) 0.0424(10) Uani 1 1 d . . .
C7 C -0.1688(4) 0.2313(3) 0.1760(2) 0.0535(12) Uani 1 1 d . . .
H7 H -0.1451 0.2508 0.2159 0.064 Uiso 1 1 calc R . .
C8 C -0.2556(4) 0.1662(4) 0.1602(3) 0.0669(14) Uani 1 1 d . . .
H8 H -0.2900 0.1416 0.1902 0.080 Uiso 1 1 calc R . .
C9 C -0.2917(4) 0.1377(4) 0.1010(3) 0.0644(14) Uani 1 1 d . . .
H9 H -0.3503 0.0947 0.0915 0.077 Uiso 1 1 calc R . .
C10 C -0.2407(4) 0.1730(3) 0.0552(2) 0.0551(12) Uani 1 1 d . . .
H10 H -0.2642 0.1533 0.0154 0.066 Uiso 1 1 calc R . .
C11 C -0.1545(3) 0.2377(3) 0.0701(2) 0.0441(10) Uani 1 1 d . . .
C12 C -0.0918(3) 0.2841(3) 0.02588(19) 0.0428(10) Uani 1 1 d . . .
H12 H -0.1166 0.2628 -0.0160 0.051 Uiso 1 1 calc R . .
C13 C -0.1126(3) 0.3852(3) 0.0334(2) 0.0444(10) Uani 1 1 d . . .
C14 C -0.1614(4) 0.4448(4) -0.0110(2) 0.0551(12) Uani 1 1 d . . .
H14 H -0.1837 0.4248 -0.0509 0.066 Uiso 1 1 calc R . .
C15 C -0.1778(4) 0.5343(4) 0.0029(3) 0.0680(15) Uani 1 1 d . . .
H15 H -0.2100 0.5748 -0.0275 0.082 Uiso 1 1 calc R . .
C16 C -0.1460(4) 0.5640(4) 0.0628(3) 0.0698(15) Uani 1 1 d . . .
H16 H -0.1596 0.6238 0.0725 0.084 Uiso 1 1 calc R . .
C17 C -0.0939(4) 0.5043(3) 0.1081(3) 0.0572(12) Uani 1 1 d . . .
H17 H -0.0702 0.5244 0.1479 0.069 Uiso 1 1 calc R . .
C18 C -0.0777(3) 0.4148(3) 0.0935(2) 0.0440(10) Uani 1 1 d . . .
C19 C 0.0371(3) 0.2694(3) 0.05131(18) 0.0405(9) Uani 1 1 d . . .
C20 C 0.1154(3) 0.2295(3) 0.01983(18) 0.0431(10) Uani 1 1 d . . .
C21 C 0.2305(3) 0.2226(3) 0.04905(18) 0.0413(9) Uani 1 1 d . . .
C22 C 0.2655(3) 0.2512(3) 0.10902(19) 0.0400(9) Uani 1 1 d . . .
C23 C 0.3955(3) 0.2380(3) 0.1334(2) 0.0453(10) Uani 1 1 d . . .
H23 H 0.4211 0.2578 0.1756 0.054 Uiso 1 1 calc R . .
C24 C 0.4179(3) 0.1366(3) 0.1238(2) 0.0512(12) Uani 1 1 d . . .
C25 C 0.4675(4) 0.0757(4) 0.1674(3) 0.0647(14) Uani 1 1 d . . .
H25 H 0.4917 0.0936 0.2075 0.078 Uiso 1 1 calc R . .
C26 C 0.4808(5) -0.0136(4) 0.1501(4) 0.0832(19) Uani 1 1 d . . .
H26 H 0.5116 -0.0563 0.1793 0.100 Uiso 1 1 calc R . .
C27 C 0.4494(5) -0.0397(4) 0.0908(4) 0.088(2) Uani 1 1 d . . .
H27 H 0.4621 -0.0990 0.0797 0.106 Uiso 1 1 calc R . .
C28 C 0.3986(4) 0.0224(4) 0.0470(3) 0.0720(15) Uani 1 1 d . . .
H28 H 0.3756 0.0042 0.0068 0.086 Uiso 1 1 calc R . .
C29 C 0.3825(4) 0.1103(3) 0.0630(2) 0.0535(12) Uani 1 1 d . . .
C30 C 0.3284(4) 0.1856(3) 0.0214(2) 0.0508(11) Uani 1 1 d . . .
H30 H 0.3031 0.1663 -0.0208 0.061 Uiso 1 1 calc R . .
C31 C 0.4190(4) 0.2625(3) 0.0296(2) 0.0513(11) Uani 1 1 d . . .
C32 C 0.4637(4) 0.3033(4) -0.0164(3) 0.0678(14) Uani 1 1 d . . .
H32 H 0.4387 0.2857 -0.0566 0.081 Uiso 1 1 calc R . .
C33 C 0.5451(5) 0.3699(5) -0.0013(3) 0.084(2) Uani 1 1 d . . .
H33 H 0.5763 0.3972 -0.0316 0.101 Uiso 1 1 calc R . .
C34 C 0.5816(5) 0.3970(4) 0.0578(4) 0.0793(18) Uani 1 1 d . . .
H34 H 0.6368 0.4426 0.0671 0.095 Uiso 1 1 calc R . .
C35 C 0.5364(4) 0.3567(4) 0.1041(3) 0.0641(14) Uani 1 1 d . . .
H35 H 0.5606 0.3749 0.1443 0.077 Uiso 1 1 calc R . .
C36 C 0.4547(3) 0.2892(3) 0.0887(2) 0.0482(10) Uani 1 1 d . . .
C37 C 0.0497(8) 0.1095(5) -0.0472(4) 0.121(2) Uani 1 1 d DU . .
H37A H -0.0218 0.0989 -0.0334 0.145 Uiso 1 1 calc R . .
H37B H 0.1097 0.0723 -0.0230 0.145 Uiso 1 1 calc R . .
C38 C 0.0350(12) 0.0845(9) -0.1115(5) 0.174(4) Uani 1 1 d DU . .
H38A H -0.0184 0.1270 -0.1354 0.209 Uiso 1 1 calc R . .
H38B H -0.0003 0.0248 -0.1171 0.209 Uiso 1 1 calc R . .
C39 C 0.1456(17) 0.0828(14) -0.1364(8) 0.261(7) Uani 1 1 d DU . .
H39A H 0.1952 0.0379 -0.1126 0.314 Uiso 1 1 calc R . .
H39B H 0.1825 0.1411 -0.1260 0.314 Uiso 1 1 calc R . .
C40 C 0.1528(17) 0.0652(15) -0.2022(8) 0.270(7) Uani 1 1 d DU . .
H40A H 0.1110 0.1116 -0.2275 0.405 Uiso 1 1 calc R . .
H40B H 0.1195 0.0071 -0.2145 0.405 Uiso 1 1 calc R . .
H40C H 0.2323 0.0659 -0.2059 0.405 Uiso 1 1 calc R . .
C41 C 0.2193(4) 0.4857(4) 0.1755(2) 0.0634(13) Uani 1 1 d . . .
H41A H 0.1432 0.4832 0.1504 0.095 Uiso 1 1 calc R . .
H41B H 0.2760 0.4808 0.1505 0.095 Uiso 1 1 calc R . .
H41C H 0.2291 0.5423 0.1970 0.095 Uiso 1 1 calc R . .
N1 N 0.2248(2) 0.3189(2) 0.20160(14) 0.0362(7) Uani 1 1 d . . .
Cl1 Cl 0.2818(4) -0.0342(2) 0.2697(3) 0.118(2) Uani 0.50 1 d P . .
O1 O 0.0810(3) 0.2035(2) -0.03969(13) 0.0558(8) Uani 1 1 d . . .
Ag1 Ag 0.2500 0.12115(4) 0.2500 0.0673(3) Uani 1 2 d S . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.351(5) 2 ?
C1 N1 1.351(5) . ?
C1 Ag1 2.090(5) . ?
C2 C2 1.356(8) 2 ?
C2 N1 1.401(5) . ?
C2 C41 1.475(6) . ?
C3 C22 1.377(5) . ?
C3 C4 1.394(5) . ?
C3 N1 1.440(5) . ?
C4 C19 1.388(5) . ?
C4 C5 1.517(5) . ?
C5 C6 1.524(6) . ?
C5 C18 1.534(6) . ?
C5 H5 0.9800 . ?
C6 C11 1.381(6) . ?
C6 C7 1.401(6) . ?
C7 C8 1.396(7) . ?
C7 H7 0.9300 . ?
C8 C9 1.380(8) . ?
C8 H8 0.9300 . ?
C9 C10 1.396(7) . ?
C9 H9 0.9300 . ?
C10 C11 1.386(6) . ?
C10 H10 0.9300 . ?
C11 C12 1.519(6) . ?
C12 C13 1.524(6) . ?
C12 C19 1.528(5) . ?
C12 H12 0.9800 . ?
C13 C14 1.367(6) . ?
C13 C18 1.403(6) . ?
C14 C15 1.380(8) . ?
C14 H14 0.9300 . ?
C15 C16 1.395(8) . ?
C15 H15 0.9300 . ?
C16 C17 1.392(8) . ?
C16 H16 0.9300 . ?
C17 C18 1.382(7) . ?
C17 H17 0.9300 . ?
C19 C20 1.403(6) . ?
C20 O1 1.373(5) . ?
C20 C21 1.388(6) . ?
C21 C22 1.395(6) . ?
C21 C30 1.521(5) . ?
C22 C23 1.534(5) . ?
C23 C36 1.536(6) . ?
C23 C24 1.541(6) . ?
C23 H23 0.9800 . ?
C24 C25 1.371(7) . ?
C24 C29 1.401(7) . ?
C25 C26 1.390(9) . ?
C25 H25 0.9300 . ?
C26 C27 1.366(10) . ?
C26 H26 0.9300 . ?
C27 C28 1.388(9) . ?
C27 H27 0.9300 . ?
C28 C29 1.368(7) . ?
C28 H28 0.9300 . ?
C29 C30 1.508(7) . ?
C30 C31 1.544(6) . ?
C30 H30 0.9800 . ?
C31 C36 1.369(7) . ?
C31 C32 1.390(7) . ?
C32 C33 1.367(8) . ?
C32 H32 0.9300 . ?
C33 C34 1.373(10) . ?
C33 H33 0.9300 . ?
C34 C35 1.397(8) . ?
C34 H34 0.9300 . ?
C35 C36 1.380(6) . ?
C35 H35 0.9300 . ?
C37 O1 1.435(8) . ?
C37 C38 1.471(12) . ?
C37 H37A 0.9700 . ?
C37 H37B 0.9700 . ?
C38 C39 1.522(14) . ?
C38 H38A 0.9700 . ?
C38 H38B 0.9700 . ?
C39 C40 1.523(15) . ?
C39 H39A 0.9700 . ?
C39 H39B 0.9700 . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
Cl1 Cl1 1.040(10) 2 ?
Cl1 Ag1 2.348(3) . ?
Ag1 Cl1 2.348(3) 2 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N1 C1 N1 104.8(5) 2 . ?
N1 C1 Ag1 127.6(2) 2 . ?
N1 C1 Ag1 127.6(2) . . ?
C2 C2 N1 106.2(2) 2 . ?
C2 C2 C41 130.7(3) 2 . ?
N1 C2 C41 122.9(4) . . ?
C22 C3 C4 119.7(4) . . ?
C22 C3 N1 120.4(3) . . ?
C4 C3 N1 119.9(3) . . ?
C19 C4 C3 119.5(3) . . ?
C19 C4 C5 113.3(3) . . ?
C3 C4 C5 127.2(3) . . ?
C4 C5 C6 105.6(3) . . ?
C4 C5 C18 106.1(3) . . ?
C6 C5 C18 104.8(3) . . ?
C4 C5 H5 113.2 . . ?
C6 C5 H5 113.2 . . ?
C18 C5 H5 113.2 . . ?
C11 C6 C7 121.6(4) . . ?
C11 C6 C5 113.0(3) . . ?
C7 C6 C5 125.3(4) . . ?
C8 C7 C6 117.3(4) . . ?
C8 C7 H7 121.4 . . ?
C6 C7 H7 121.4 . . ?
C9 C8 C7 121.5(4) . . ?
C9 C8 H8 119.2 . . ?
C7 C8 H8 119.2 . . ?
C8 C9 C10 120.3(4) . . ?
C8 C9 H9 119.8 . . ?
C10 C9 H9 119.8 . . ?
C11 C10 C9 119.0(5) . . ?
C11 C10 H10 120.5 . . ?
C9 C10 H10 120.5 . . ?
C6 C11 C10 120.3(4) . . ?
C6 C11 C12 113.9(3) . . ?
C10 C11 C12 125.7(4) . . ?
C11 C12 C13 104.9(3) . . ?
C11 C12 C19 105.7(3) . . ?
C13 C12 C19 105.6(3) . . ?
C11 C12 H12 113.3 . . ?
C13 C12 H12 113.3 . . ?
C19 C12 H12 113.3 . . ?
C14 C13 C18 120.2(4) . . ?
C14 C13 C12 126.9(4) . . ?
C18 C13 C12 112.9(4) . . ?
C13 C14 C15 120.4(5) . . ?
C13 C14 H14 119.8 . . ?
C15 C14 H14 119.8 . . ?
C14 C15 C16 119.8(5) . . ?
C14 C15 H15 120.1 . . ?
C16 C15 H15 120.1 . . ?
C17 C16 C15 120.2(5) . . ?
C17 C16 H16 119.9 . . ?
C15 C16 H16 119.9 . . ?
C18 C17 C16 119.3(5) . . ?
C18 C17 H17 120.3 . . ?
C16 C17 H17 120.3 . . ?
C17 C18 C13 120.0(4) . . ?
C17 C18 C5 127.0(4) . . ?
C13 C18 C5 113.0(4) . . ?
C4 C19 C20 121.3(4) . . ?
C4 C19 C12 113.3(3) . . ?
C20 C19 C12 125.3(4) . . ?
O1 C20 C21 120.6(4) . . ?
O1 C20 C19 121.0(4) . . ?
C21 C20 C19 118.2(4) . . ?
C20 C21 C22 120.4(4) . . ?
C20 C21 C30 125.8(4) . . ?
C22 C21 C30 113.9(3) . . ?
C3 C22 C21 120.9(3) . . ?
C3 C22 C23 126.4(4) . . ?
C21 C22 C23 112.7(3) . . ?
C22 C23 C36 105.0(3) . . ?
C22 C23 C24 105.1(3) . . ?
C36 C23 C24 105.7(3) . . ?
C22 C23 H23 113.4 . . ?
C36 C23 H23 113.4 . . ?
C24 C23 H23 113.4 . . ?
C25 C24 C29 121.1(5) . . ?
C25 C24 C23 126.5(5) . . ?
C29 C24 C23 112.4(4) . . ?
C24 C25 C26 118.4(6) . . ?
C24 C25 H25 120.8 . . ?
C26 C25 H25 120.8 . . ?
C27 C26 C25 121.1(6) . . ?
C27 C26 H26 119.5 . . ?
C25 C26 H26 119.5 . . ?
C26 C27 C28 120.1(6) . . ?
C26 C27 H27 120.0 . . ?
C28 C27 H27 120.0 . . ?
C29 C28 C27 120.0(6) . . ?
C29 C28 H28 120.0 . . ?
C27 C28 H28 120.0 . . ?
C28 C29 C24 119.3(5) . . ?
C28 C29 C30 126.7(5) . . ?
C24 C29 C30 114.0(4) . . ?
C29 C30 C21 105.7(4) . . ?
C29 C30 C31 105.7(4) . . ?
C21 C30 C31 104.7(4) . . ?
C29 C30 H30 113.3 . . ?
C21 C30 H30 113.3 . . ?
C31 C30 H30 113.3 . . ?
C36 C31 C32 120.7(5) . . ?
C36 C31 C30 113.2(4) . . ?
C32 C31 C30 126.0(5) . . ?
C33 C32 C31 118.7(6) . . ?
C33 C32 H32 120.7 . . ?
C31 C32 H32 120.7 . . ?
C32 C33 C34 121.0(5) . . ?
C32 C33 H33 119.5 . . ?
C34 C33 H33 119.5 . . ?
C33 C34 C35 120.5(5) . . ?
C33 C34 H34 119.7 . . ?
C35 C34 H34 119.7 . . ?
C36 C35 C34 118.2(6) . . ?
C36 C35 H35 120.9 . . ?
C34 C35 H35 120.9 . . ?
C31 C36 C35 120.8(4) . . ?
C31 C36 C23 114.0(4) . . ?
C35 C36 C23 125.2(5) . . ?
O1 C37 C38 109.5(8) . . ?
O1 C37 H37A 109.8 . . ?
C38 C37 H37A 109.8 . . ?
O1 C37 H37B 109.8 . . ?
C38 C37 H37B 109.8 . . ?
H37A C37 H37B 108.2 . . ?
C37 C38 C39 115.3(11) . . ?
C37 C38 H38A 108.4 . . ?
C39 C38 H38A 108.4 . . ?
C37 C38 H38B 108.4 . . ?
C39 C38 H38B 108.4 . . ?
H38A C38 H38B 107.5 . . ?
C38 C39 C40 125.6(18) . . ?
C38 C39 H39A 105.9 . . ?
C40 C39 H39A 105.9 . . ?
C38 C39 H39B 105.9 . . ?
C40 C39 H39B 105.9 . . ?
H39A C39 H39B 106.2 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C2 C41 H41A 109.5 . . ?
C2 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
C2 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C1 N1 C2 111.4(3) . . ?
C1 N1 C3 124.2(3) . . ?
C2 N1 C3 124.3(3) . . ?
Cl1 Cl1 Ag1 77.20(12) 2 . ?
C20 O1 C37 113.7(5) . . ?
C1 Ag1 Cl1 167.20(12) . . ?
C1 Ag1 Cl1 167.20(12) . 2 ?
Cl1 Ag1 Cl1 25.6(2) . 2 ?

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
C22 C3 C4 C19 0.6(6) . . . . ?
N1 C3 C4 C19 179.6(4) . . . . ?
C22 C3 C4 C5 -179.1(4) . . . . ?
N1 C3 C4 C5 -0.2(6) . . . . ?
C19 C4 C5 C6 55.7(4) . . . . ?
C3 C4 C5 C6 -124.5(4) . . . . ?
C19 C4 C5 C18 -55.1(4) . . . . ?
C3 C4 C5 C18 124.7(4) . . . . ?
C4 C5 C6 C11 -56.1(4) . . . . ?
C18 C5 C6 C11 55.7(4) . . . . ?
C4 C5 C6 C7 125.8(4) . . . . ?
C18 C5 C6 C7 -122.4(4) . . . . ?
C11 C6 C7 C8 0.5(7) . . . . ?
C5 C6 C7 C8 178.4(4) . . . . ?
C6 C7 C8 C9 -0.5(8) . . . . ?
C7 C8 C9 C10 0.7(8) . . . . ?
C8 C9 C10 C11 -0.7(8) . . . . ?
C7 C6 C11 C10 -0.6(6) . . . . ?
C5 C6 C11 C10 -178.8(4) . . . . ?
C7 C6 C11 C12 179.0(4) . . . . ?
C5 C6 C11 C12 0.8(5) . . . . ?
C9 C10 C11 C6 0.7(7) . . . . ?
C9 C10 C11 C12 -178.8(4) . . . . ?
C6 C11 C12 C13 -57.0(4) . . . . ?
C10 C11 C12 C13 122.6(5) . . . . ?
C6 C11 C12 C19 54.4(5) . . . . ?
C10 C11 C12 C19 -126.1(5) . . . . ?
C11 C12 C13 C14 -123.4(4) . . . . ?
C19 C12 C13 C14 125.2(4) . . . . ?
C11 C12 C13 C18 55.4(4) . . . . ?
C19 C12 C13 C18 -56.0(4) . . . . ?
C18 C13 C14 C15 -0.6(6) . . . . ?
C12 C13 C14 C15 178.1(4) . . . . ?
C13 C14 C15 C16 -1.0(7) . . . . ?
C14 C15 C16 C17 2.4(7) . . . . ?
C15 C16 C17 C18 -2.1(7) . . . . ?
C16 C17 C18 C13 0.6(6) . . . . ?
C16 C17 C18 C5 -178.2(4) . . . . ?
C14 C13 C18 C17 0.8(6) . . . . ?
C12 C13 C18 C17 -178.1(4) . . . . ?
C14 C13 C18 C5 179.7(4) . . . . ?
C12 C13 C18 C5 0.8(4) . . . . ?
C4 C5 C18 C17 -126.2(4) . . . . ?
C6 C5 C18 C17 122.3(4) . . . . ?
C4 C5 C18 C13 54.9(4) . . . . ?
C6 C5 C18 C13 -56.5(4) . . . . ?
C3 C4 C19 C20 0.7(6) . . . . ?
C5 C4 C19 C20 -179.5(4) . . . . ?
C3 C4 C19 C12 179.7(4) . . . . ?
C5 C4 C19 C12 -0.5(5) . . . . ?
C11 C12 C19 C4 -54.5(5) . . . . ?
C13 C12 C19 C4 56.3(4) . . . . ?
C11 C12 C19 C20 124.5(4) . . . . ?
C13 C12 C19 C20 -124.7(4) . . . . ?
C4 C19 C20 O1 -178.0(4) . . . . ?
C12 C19 C20 O1 3.1(7) . . . . ?
C4 C19 C20 C21 -2.4(6) . . . . ?
C12 C19 C20 C21 178.7(4) . . . . ?
O1 C20 C21 C22 178.4(4) . . . . ?
C19 C20 C21 C22 2.7(6) . . . . ?
O1 C20 C21 C30 -1.4(7) . . . . ?
C19 C20 C21 C30 -177.1(4) . . . . ?
C4 C3 C22 C21 -0.3(6) . . . . ?
N1 C3 C22 C21 -179.2(4) . . . . ?
C4 C3 C22 C23 178.3(4) . . . . ?
N1 C3 C22 C23 -0.7(6) . . . . ?
C20 C21 C22 C3 -1.5(6) . . . . ?
C30 C21 C22 C3 178.4(4) . . . . ?
C20 C21 C22 C23 179.8(4) . . . . ?
C30 C21 C22 C23 -0.4(5) . . . . ?
C3 C22 C23 C36 -122.9(5) . . . . ?
C21 C22 C23 C36 55.7(5) . . . . ?
C3 C22 C23 C24 125.9(4) . . . . ?
C21 C22 C23 C24 -55.5(5) . . . . ?
C22 C23 C24 C25 -124.2(4) . . . . ?
C36 C23 C24 C25 125.1(4) . . . . ?
C22 C23 C24 C29 56.6(4) . . . . ?
C36 C23 C24 C29 -54.1(4) . . . . ?
C29 C24 C25 C26 -0.8(6) . . . . ?
C23 C24 C25 C26 -180.0(4) . . . . ?
C24 C25 C26 C27 2.5(8) . . . . ?
C25 C26 C27 C28 -2.9(9) . . . . ?
C26 C27 C28 C29 1.5(8) . . . . ?
C27 C28 C29 C24 0.1(7) . . . . ?
C27 C28 C29 C30 -179.6(4) . . . . ?
C25 C24 C29 C28 -0.5(6) . . . . ?
C23 C24 C29 C28 178.8(4) . . . . ?
C25 C24 C29 C30 179.3(4) . . . . ?
C23 C24 C29 C30 -1.4(5) . . . . ?
C28 C29 C30 C21 125.1(5) . . . . ?
C24 C29 C30 C21 -54.7(5) . . . . ?
C28 C29 C30 C31 -124.2(5) . . . . ?
C24 C29 C30 C31 56.0(4) . . . . ?
C20 C21 C30 C29 -124.2(5) . . . . ?
C22 C21 C30 C29 55.9(5) . . . . ?
C20 C21 C30 C31 124.3(5) . . . . ?
C22 C21 C30 C31 -55.5(5) . . . . ?
C29 C30 C31 C36 -55.0(5) . . . . ?
C21 C30 C31 C36 56.4(5) . . . . ?
C29 C30 C31 C32 124.8(5) . . . . ?
C21 C30 C31 C32 -123.7(5) . . . . ?
C36 C31 C32 C33 0.8(8) . . . . ?
C30 C31 C32 C33 -179.0(5) . . . . ?
C31 C32 C33 C34 -0.8(9) . . . . ?
C32 C33 C34 C35 0.3(9) . . . . ?
C33 C34 C35 C36 0.1(8) . . . . ?
C32 C31 C36 C35 -0.4(7) . . . . ?
C30 C31 C36 C35 179.4(4) . . . . ?
C32 C31 C36 C23 179.2(4) . . . . ?
C30 C31 C36 C23 -0.9(5) . . . . ?
C34 C35 C36 C31 0.0(7) . . . . ?
C34 C35 C36 C23 -179.7(4) . . . . ?
C22 C23 C36 C31 -55.2(5) . . . . ?
C24 C23 C36 C31 55.6(5) . . . . ?
C22 C23 C36 C35 124.4(5) . . . . ?
C24 C23 C36 C35 -124.8(5) . . . . ?
O1 C37 C38 C39 69.1(15) . . . . ?
C37 C38 C39 C40 -175.8(16) . . . . ?
N1 C1 N1 C2 0.03(18) 2 . . . ?
Ag1 C1 N1 C2 -179.97(18) . . . . ?
N1 C1 N1 C3 -177.1(3) 2 . . . ?
Ag1 C1 N1 C3 2.9(3) . . . . ?
C2 C2 N1 C1 -0.1(5) 2 . . . ?
C41 C2 N1 C1 175.6(3) . . . . ?
C2 C2 N1 C3 177.0(4) 2 . . . ?
C41 C2 N1 C3 -7.3(6) . . . . ?
C22 C3 N1 C1 -75.3(4) . . . . ?
C4 C3 N1 C1 105.8(4) . . . . ?
C22 C3 N1 C2 108.0(4) . . . . ?
C4 C3 N1 C2 -70.9(5) . . . . ?
C21 C20 O1 C37 88.9(6) . . . . ?
C19 C20 O1 C37 -95.6(6) . . . . ?
C38 C37 O1 C20 -169.7(7) . . . . ?
N1 C1 Ag1 Cl1 -29.2(8) 2 . . . ?
N1 C1 Ag1 Cl1 150.8(8) . . . . ?
N1 C1 Ag1 Cl1 150.8(8) 2 . . 2 ?
N1 C1 Ag1 Cl1 -29.2(8) . . . 2 ?
Cl1 Cl1 Ag1 C1 180.000(2) 2 . . . ?

_diffrn_measured_fraction_theta_max 0.981
_diffrn_reflns_theta_full        25.19
_diffrn_measured_fraction_theta_full 0.981
_refine_diff_density_max         0.758
_refine_diff_density_min         -0.595
_refine_diff_density_rms         0.116
