# Electronic Supplementary Material (ESI) for ChemComm.
# 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_riv17a7
_database_code_depnum_ccdc_archive 'CCDC 1583283'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C42 H32 Ag F3 N2 O3 S'
_chemical_formula_sum            'C42 H32 Ag F3 N2 O3 S'
_chemical_formula_weight         809.62

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'
S S 0.3331 0.5567 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           11
_space_group_name_H-M_alt        'P 21/m'
_space_group_name_Hall           '-P 2yb'

_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. 
;

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

_cell_length_a                   9.4002(2)
_cell_length_b                   20.3414(5)
_cell_length_c                   9.8392(2)
_cell_angle_alpha                90
_cell_angle_beta                 104.7623(9)
_cell_angle_gamma                90
_cell_volume                     1819.28(7)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9256
_cell_measurement_theta_min      4.35
_cell_measurement_theta_max      73.32

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.478
_exptl_crystal_F_000             824
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.151
_exptl_crystal_size_mid          0.129
_exptl_crystal_size_min          0.086
_exptl_absorpt_coefficient_mu    5.466
_shelx_estimated_absorpt_T_min   0.492
_shelx_estimated_absorpt_T_max   0.651
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.5087
_exptl_absorpt_correction_T_max  0.7839
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            13008
_diffrn_reflns_av_unetI/netI     0.0284
_diffrn_reflns_av_R_equivalents  0.0345
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_theta_min         4.347
_diffrn_reflns_theta_max         74.176
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measured_fraction_theta_full 0.989
_diffrn_reflns_Laue_measured_fraction_max 0.981
_diffrn_reflns_Laue_measured_fraction_full 0.989
_diffrn_reflns_point_group_measured_fraction_max 0.981
_diffrn_reflns_point_group_measured_fraction_full 0.989
_reflns_number_total             3746
_reflns_number_gt                3578
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick 2015)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0431P)²+1.2090P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         3746
_refine_ls_number_parameters     274
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0330
_refine_ls_R_factor_gt           0.0317
_refine_ls_wR_factor_ref         0.0856
_refine_ls_wR_factor_gt          0.0847
_refine_ls_goodness_of_fit_ref   1.070
_refine_ls_restrained_S_all      1.070
_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_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
Ag Ag 0.65645(2) 0.7500 0.52356(2) 0.03891(10) Uani 1 2 d S T P . .
N1 N 0.42777(16) 0.69728(8) 0.25952(15) 0.0210(3) Uani 1 1 d . . . . .
C1 C 0.4912(3) 0.7500 0.3346(3) 0.0219(5) Uani 1 2 d S T P . .
C2 C 0.3215(2) 0.71703(11) 0.14041(19) 0.0264(4) Uani 1 1 d . . . . .
H2 H 0.2607 0.6892 0.0722 0.032 Uiso 1 1 calc R U . . .
C3 C 0.4569(2) 0.62873(10) 0.31764(18) 0.0222(4) Uani 1 1 d . . . . .
C11 C 0.4180(2) 0.63204(10) 0.4611(2) 0.0247(4) Uani 1 1 d . . . . .
C12 C 0.2770(2) 0.65420(11) 0.4617(2) 0.0310(4) Uani 1 1 d . . . . .
H12 H 0.2073 0.6630 0.3751 0.037 Uiso 1 1 calc R U . . .
C13 C 0.2377(3) 0.66350(12) 0.5872(3) 0.0401(5) Uani 1 1 d . . . . .
H13 H 0.1417 0.6785 0.5861 0.048 Uiso 1 1 calc R U . . .
C14 C 0.3388(3) 0.65088(14) 0.7138(3) 0.0461(6) Uani 1 1 d . . . . .
H14 H 0.3124 0.6574 0.7998 0.055 Uiso 1 1 calc R U . . .
C15 C 0.4770(3) 0.62897(14) 0.7149(2) 0.0449(6) Uani 1 1 d . . . . .
H15 H 0.5458 0.6201 0.8020 0.054 Uiso 1 1 calc R U . . .
C16 C 0.5180(2) 0.61951(12) 0.5888(2) 0.0322(4) Uani 1 1 d . . . . .
H16 H 0.6142 0.6045 0.5908 0.039 Uiso 1 1 calc R U . . .
C21 C 0.6175(2) 0.60896(10) 0.32919(18) 0.0237(4) Uani 1 1 d . . . . .
C22 C 0.6617(2) 0.54623(11) 0.3790(2) 0.0296(4) Uani 1 1 d . . . . .
H22 H 0.5940 0.5181 0.4076 0.035 Uiso 1 1 calc R U . . .
C23 C 0.8033(2) 0.52415(13) 0.3875(2) 0.0358(5) Uani 1 1 d . . . . .
H23 H 0.8321 0.4813 0.4222 0.043 Uiso 1 1 calc R U . . .
C24 C 0.9023(2) 0.56434(14) 0.3458(2) 0.0405(5) Uani 1 1 d . . . . .
H24 H 1.0000 0.5497 0.3535 0.049 Uiso 1 1 calc R U . . .
C25 C 0.8592(2) 0.62580(14) 0.2929(3) 0.0398(5) Uani 1 1 d . . . . .
H25 H 0.9270 0.6533 0.2629 0.048 Uiso 1 1 calc R U . . .
C26 C 0.7169(2) 0.64819(11) 0.2830(2) 0.0305(4) Uani 1 1 d . . . . .
H26 H 0.6877 0.6904 0.2447 0.037 Uiso 1 1 calc R U . . .
C31 C 0.3620(2) 0.57889(10) 0.21604(19) 0.0242(4) Uani 1 1 d . . . . .
C32 C 0.3819(2) 0.57217(12) 0.0806(2) 0.0318(4) Uani 1 1 d . . . . .
H32 H 0.4491 0.6002 0.0509 0.038 Uiso 1 1 calc R U . . .
C33 C 0.3048(3) 0.52510(13) -0.0107(2) 0.0396(5) Uani 1 1 d . . . . .
H33 H 0.3182 0.5215 -0.1029 0.047 Uiso 1 1 calc R U . . .
C34 C 0.2085(3) 0.48326(13) 0.0317(3) 0.0418(5) Uani 1 1 d . . . . .
H34 H 0.1547 0.4514 -0.0316 0.050 Uiso 1 1 calc R U . . .
C35 C 0.1907(3) 0.48798(13) 0.1664(3) 0.0393(5) Uani 1 1 d . . . . .
H35 H 0.1263 0.4587 0.1967 0.047 Uiso 1 1 calc R U . . .
C36 C 0.2673(2) 0.53567(11) 0.2577(2) 0.0293(4) Uani 1 1 d . . . . .
H36 H 0.2545 0.5386 0.3502 0.035 Uiso 1 1 calc R U . . .
S1 S 0.93091(12) 0.76665(6) 0.79790(12) 0.0437(4) Uani 0.5 1 d . . P A -1
F1 F 0.9327(7) 0.7628(8) 1.0593(5) 0.130(5) Uani 0.5 1 d . . P A -1
F2 F 0.9172(16) 0.6700(4) 0.9724(9) 0.195(5) Uani 0.5 1 d . . P A -1
F3 F 0.7368(6) 0.7249(6) 0.9304(7) 0.180(8) Uani 0.5 1 d . . P A -1
O1 O 0.8485(6) 0.7234(2) 0.6895(5) 0.0774(15) Uani 0.5 1 d . . P A -1
O2 O 0.8873(9) 0.8314(3) 0.7764(12) 0.150(4) Uani 0.5 1 d . . P A -1
O3 O 1.0819(4) 0.7571(11) 0.8381(4) 0.083(3) Uani 0.5 1 d . . P A -1
C4 C 0.8750(8) 0.7289(5) 0.9485(8) 0.084(4) Uani 0.5 1 d . . P A -1


_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
Ag C1 2.097(3) . ?
Ag O1 2.172(4) . ?
N1 C1 1.352(2) . ?
N1 C2 1.391(2) . ?
N1 C3 1.506(2) . ?
C1 N1 1.352(2) 4_575 ?
C2 C2 1.341(4) 4_575 ?
C3 C21 1.539(2) . ?
C3 C31 1.539(3) . ?
C3 C11 1.547(2) . ?
C11 C16 1.388(3) . ?
C11 C12 1.402(3) . ?
C12 C13 1.388(3) . ?
C13 C14 1.385(4) . ?
C14 C15 1.371(4) . ?
C15 C16 1.403(3) . ?
C21 C26 1.390(3) . ?
C21 C22 1.392(3) . ?
C22 C23 1.387(3) . ?
C23 C24 1.378(4) . ?
C24 C25 1.375(4) . ?
C25 C26 1.393(3) . ?
C31 C36 1.385(3) . ?
C31 C32 1.399(3) . ?
C32 C33 1.384(3) . ?
C33 C34 1.382(4) . ?
C34 C35 1.381(3) . ?
C35 C36 1.392(3) . ?
S1 O2 1.380(7) . ?
S1 O3 1.386(6) . ?
S1 O1 1.446(4) . ?
S1 C4 1.860(7) . ?
F1 C4 1.287(12) . ?
F2 C4 1.265(13) . ?
F3 C4 1.267(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
C1 Ag O1 162.31(13) . . ?
C1 N1 C2 110.70(17) . . ?
C1 N1 C3 120.99(15) . . ?
C2 N1 C3 127.54(16) . . ?
N1 C1 N1 105.0(2) . 4_575 ?
N1 C1 Ag 127.49(11) . . ?
N1 C1 Ag 127.49(11) 4_575 . ?
C2 C2 N1 106.78(11) 4_575 . ?
N1 C3 C21 110.50(15) . . ?
N1 C3 C31 110.14(14) . . ?
C21 C3 C31 105.74(15) . . ?
N1 C3 C11 104.12(14) . . ?
C21 C3 C11 113.55(15) . . ?
C31 C3 C11 112.88(15) . . ?
C16 C11 C12 118.54(18) . . ?
C16 C11 C3 123.74(17) . . ?
C12 C11 C3 117.51(17) . . ?
C13 C12 C11 120.9(2) . . ?
C14 C13 C12 119.8(2) . . ?
C15 C14 C13 119.9(2) . . ?
C14 C15 C16 120.7(2) . . ?
C11 C16 C15 120.0(2) . . ?
C26 C21 C22 118.43(18) . . ?
C26 C21 C3 123.67(18) . . ?
C22 C21 C3 117.72(17) . . ?
C23 C22 C21 120.9(2) . . ?
C24 C23 C22 120.0(2) . . ?
C25 C24 C23 119.7(2) . . ?
C24 C25 C26 120.6(2) . . ?
C21 C26 C25 120.2(2) . . ?
C36 C31 C32 118.18(19) . . ?
C36 C31 C3 122.37(17) . . ?
C32 C31 C3 119.14(17) . . ?
C33 C32 C31 120.7(2) . . ?
C34 C33 C32 120.4(2) . . ?
C35 C34 C33 119.7(2) . . ?
C34 C35 C36 119.9(2) . . ?
C31 C36 C35 121.1(2) . . ?
O2 S1 O3 114.8(10) . . ?
O2 S1 O1 112.7(4) . . ?
O3 S1 O1 116.3(7) . . ?
O2 S1 C4 112.5(6) . . ?
O3 S1 C4 101.0(5) . . ?
O1 S1 C4 97.4(3) . . ?
S1 O1 Ag 126.1(3) . . ?
F2 C4 F3 103.1(10) . . ?
F2 C4 F1 107.7(10) . . ?
F3 C4 F1 110.5(8) . . ?
F2 C4 S1 113.6(7) . . ?
F3 C4 S1 113.7(7) . . ?
F1 C4 S1 108.1(7) . . ?

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
C2 N1 C1 N1 -2.0(3) . . . 4_575 ?
C3 N1 C1 N1 -172.74(11) . . . 4_575 ?
C2 N1 C1 Ag 179.57(15) . . . . ?
C3 N1 C1 Ag 8.9(3) . . . . ?
O1 Ag C1 N1 33.9(6) . . . . ?
O1 Ag C1 N1 -144.1(5) . . . 4_575 ?
C1 N1 C2 C2 1.30(16) . . . 4_575 ?
C3 N1 C2 C2 171.24(13) . . . 4_575 ?
C1 N1 C3 C21 -68.0(2) . . . . ?
C2 N1 C3 C21 123.01(18) . . . . ?
C1 N1 C3 C31 175.57(17) . . . . ?
C2 N1 C3 C31 6.6(2) . . . . ?
C1 N1 C3 C11 54.3(2) . . . . ?
C2 N1 C3 C11 -114.72(19) . . . . ?
N1 C3 C11 C16 -119.3(2) . . . . ?
C21 C3 C11 C16 1.0(3) . . . . ?
C31 C3 C11 C16 121.3(2) . . . . ?
N1 C3 C11 C12 55.3(2) . . . . ?
C21 C3 C11 C12 175.56(19) . . . . ?
C31 C3 C11 C12 -64.1(2) . . . . ?
C16 C11 C12 C13 0.0(3) . . . . ?
C3 C11 C12 C13 -174.9(2) . . . . ?
C11 C12 C13 C14 0.1(4) . . . . ?
C12 C13 C14 C15 -0.3(4) . . . . ?
C13 C14 C15 C16 0.4(4) . . . . ?
C12 C11 C16 C15 0.1(3) . . . . ?
C3 C11 C16 C15 174.6(2) . . . . ?
C14 C15 C16 C11 -0.3(4) . . . . ?
N1 C3 C21 C26 -3.9(2) . . . . ?
C31 C3 C21 C26 115.3(2) . . . . ?
C11 C3 C21 C26 -120.4(2) . . . . ?
N1 C3 C21 C22 -178.87(16) . . . . ?
C31 C3 C21 C22 -59.7(2) . . . . ?
C11 C3 C21 C22 64.6(2) . . . . ?
C26 C21 C22 C23 2.4(3) . . . . ?
C3 C21 C22 C23 177.69(18) . . . . ?
C21 C22 C23 C24 -0.3(3) . . . . ?
C22 C23 C24 C25 -1.4(4) . . . . ?
C23 C24 C25 C26 0.9(4) . . . . ?
C22 C21 C26 C25 -2.8(3) . . . . ?
C3 C21 C26 C25 -177.83(19) . . . . ?
C24 C25 C26 C21 1.2(4) . . . . ?
N1 C3 C31 C36 -124.37(19) . . . . ?
C21 C3 C31 C36 116.2(2) . . . . ?
C11 C3 C31 C36 -8.5(3) . . . . ?
N1 C3 C31 C32 62.1(2) . . . . ?
C21 C3 C31 C32 -57.3(2) . . . . ?
C11 C3 C31 C32 178.02(18) . . . . ?
C36 C31 C32 C33 2.3(3) . . . . ?
C3 C31 C32 C33 176.1(2) . . . . ?
C31 C32 C33 C34 -1.0(4) . . . . ?
C32 C33 C34 C35 -0.8(4) . . . . ?
C33 C34 C35 C36 1.4(4) . . . . ?
C32 C31 C36 C35 -1.8(3) . . . . ?
C3 C31 C36 C35 -175.4(2) . . . . ?
C34 C35 C36 C31 -0.1(4) . . . . ?
O2 S1 O1 Ag -8.1(7) . . . . ?
O3 S1 O1 Ag -143.6(7) . . . . ?
C4 S1 O1 Ag 110.2(5) . . . . ?
C1 Ag O1 S1 158.8(2) . . . . ?
O2 S1 C4 F2 -178.3(8) . . . . ?
O3 S1 C4 F2 -55.3(12) . . . . ?
O1 S1 C4 F2 63.4(9) . . . . ?
O2 S1 C4 F3 64.2(9) . . . . ?
O3 S1 C4 F3 -172.9(11) . . . . ?
O1 S1 C4 F3 -54.2(9) . . . . ?
O2 S1 C4 F1 -58.8(9) . . . . ?
O3 S1 C4 F1 64.1(12) . . . . ?
O1 S1 C4 F1 -177.2(8) . . . . ?

_refine_diff_density_max         1.541
_refine_diff_density_min         -0.841
_refine_diff_density_rms         0.064

####################################################################### 
# 
# 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_riv17c8
_database_code_depnum_ccdc_archive 'CCDC 1583284'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C32 H12 B F24, C50 H44 Ag N2, 1.5(C9 H12)'
_chemical_formula_sum            'C95.50 H74 Ag B F24 N2'
_chemical_formula_weight         1824.24

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'
B B 0.0090 0.0039 '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'
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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   13.0012(3)
_cell_length_b                   16.8587(4)
_cell_length_c                   20.2367(5)
_cell_angle_alpha                93.9117(15)
_cell_angle_beta                 100.4578(16)
_cell_angle_gamma                99.6917(14)
_cell_volume                     4277.23(18)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9851
_cell_measurement_theta_min      3.52
_cell_measurement_theta_max      72.85

_exptl_crystal_description       plate
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.416
_exptl_crystal_F_000             1858
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.464
_exptl_crystal_size_mid          0.277
_exptl_crystal_size_min          0.028
_exptl_absorpt_coefficient_mu    2.767
_shelx_estimated_absorpt_T_min   0.360
_shelx_estimated_absorpt_T_max   0.927
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.4537
_exptl_absorpt_correction_T_max  0.9851
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            30571
_diffrn_reflns_av_unetI/netI     0.0466
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         2.232
_diffrn_reflns_theta_max         74.037
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.959
_diffrn_measured_fraction_theta_full 0.968
_diffrn_reflns_Laue_measured_fraction_max 0.959
_diffrn_reflns_Laue_measured_fraction_full 0.968
_diffrn_reflns_point_group_measured_fraction_max 0.959
_diffrn_reflns_point_group_measured_fraction_full 0.968
_reflns_number_total             16677
_reflns_number_gt                13630
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014 (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1181P)²+1.3067P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         16677
_refine_ls_number_parameters     1151
_refine_ls_number_restraints     18
_refine_ls_R_factor_all          0.0681
_refine_ls_R_factor_gt           0.0581
_refine_ls_wR_factor_ref         0.1820
_refine_ls_wR_factor_gt          0.1707
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_restrained_S_all      1.046
_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_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
Ag Ag -0.04521(2) 0.32069(2) 0.26366(2) 0.05654(10) Uani 1 1 d . . . . .
N1 N 0.12160(17) 0.30133(13) 0.38953(12) 0.0344(4) Uani 1 1 d . . . . .
N2 N 0.14719(19) 0.23080(14) 0.30381(13) 0.0410(5) Uani 1 1 d . . . . .
C1 C 0.0837(2) 0.28068(16) 0.32279(15) 0.0376(5) Uani 1 1 d . . . . .
C2 C 0.2074(2) 0.26453(17) 0.41225(15) 0.0418(6) Uani 1 1 d . . . . .
H2 H 0.247228 0.269535 0.457087 0.050 Uiso 1 1 calc R U . . .
C3 C 0.2232(2) 0.22049(19) 0.35843(16) 0.0464(6) Uani 1 1 d . . . . .
H3 H 0.276469 0.188312 0.357918 0.056 Uiso 1 1 calc R U . . .
C4 C 0.07488(18) 0.35766(14) 0.43108(14) 0.0324(5) Uani 1 1 d . . . . .
C5 C 0.1185(2) 0.17837(17) 0.23724(16) 0.0436(6) Uani 1 1 d . . . . .
C11 C 0.07764(19) 0.43567(15) 0.39466(14) 0.0343(5) Uani 1 1 d . . . . .
C12 C 0.1723(2) 0.46850(18) 0.37443(17) 0.0444(6) Uani 1 1 d . . . . .
H12 H 0.232270 0.442713 0.383373 0.053 Uiso 1 1 calc R U . . .
C13 C 0.1792(3) 0.5381(2) 0.34159(19) 0.0508(7) Uani 1 1 d . . . . .
H13 H 0.243631 0.559501 0.328059 0.061 Uiso 1 1 calc R U . . .
C14 C 0.0925(3) 0.57672(18) 0.32829(18) 0.0490(7) Uani 1 1 d . . . . .
H14 H 0.097549 0.624680 0.306083 0.059 Uiso 1 1 calc R U . . .
C15 C -0.0010(2) 0.54475(17) 0.34767(17) 0.0457(6) Uani 1 1 d . . . . .
H15 H -0.060585 0.570895 0.338667 0.055 Uiso 1 1 calc R U . . .
C16 C -0.0089(2) 0.47431(15) 0.38041(14) 0.0369(5) Uani 1 1 d . . . . .
H16 H -0.073980 0.452657 0.393026 0.044 Uiso 1 1 calc R U . . .
C21 C 0.14194(18) 0.37277(15) 0.50338(14) 0.0338(5) Uani 1 1 d . . . . .
C22 C 0.1356(2) 0.30954(17) 0.54497(15) 0.0403(6) Uani 1 1 d . . . . .
H22 H 0.090839 0.259025 0.527982 0.048 Uiso 1 1 calc R U . . .
C23 C 0.1935(2) 0.31980(19) 0.61026(16) 0.0447(6) Uani 1 1 d . . . . .
H23 H 0.188825 0.276234 0.637630 0.054 Uiso 1 1 calc R U . . .
C24 C 0.2585(2) 0.3934(2) 0.63612(16) 0.0467(6) Uani 1 1 d . . . . .
H24 H 0.298881 0.400330 0.680901 0.056 Uiso 1 1 calc R U . . .
C25 C 0.2640(2) 0.45688(18) 0.59589(16) 0.0434(6) Uani 1 1 d . . . . .
H25 H 0.307350 0.507742 0.613499 0.052 Uiso 1 1 calc R U . . .
C26 C 0.20630(19) 0.44641(15) 0.52984(15) 0.0367(5) Uani 1 1 d . . . . .
H26 H 0.211056 0.490123 0.502631 0.044 Uiso 1 1 calc R U . . .
C31 C -0.03863(19) 0.31791(15) 0.43682(14) 0.0356(5) Uani 1 1 d . . . . .
C32 C -0.0895(2) 0.24162(16) 0.40608(17) 0.0456(6) Uani 1 1 d . . . . .
H32 H -0.055190 0.211678 0.378120 0.055 Uiso 1 1 calc R U . . .
C33 C -0.1904(3) 0.20899(19) 0.4161(2) 0.0579(8) Uani 1 1 d . . . . .
H33 H -0.224906 0.157144 0.394349 0.070 Uiso 1 1 calc R U . . .
C34 C -0.2413(3) 0.2512(2) 0.4574(2) 0.0573(8) Uani 1 1 d . . . . .
H34 H -0.310427 0.228702 0.463755 0.069 Uiso 1 1 calc R U . . .
C35 C -0.1908(2) 0.32592(19) 0.48916(18) 0.0473(7) Uani 1 1 d . . . . .
H35 H -0.225022 0.355164 0.517655 0.057 Uiso 1 1 calc R U . . .
C36 C -0.0901(2) 0.35872(16) 0.47974(15) 0.0396(6) Uani 1 1 d . . . . .
H36 H -0.055287 0.409834 0.502820 0.048 Uiso 1 1 calc R U . . .
C41 C 0.1115(3) 0.23012(19) 0.17790(16) 0.0469(6) Uani 1 1 d . . . . .
C42 C 0.1484(3) 0.3132(2) 0.18486(18) 0.0545(8) Uani 1 1 d . . . . .
H42 H 0.173830 0.341317 0.228655 0.065 Uiso 1 1 calc R U . . .
C43 C 0.1484(4) 0.3556(2) 0.1281(2) 0.0673(10) Uani 1 1 d . . . . .
H43 H 0.174068 0.412313 0.133310 0.081 Uiso 1 1 calc R U . . .
C44 C 0.1112(4) 0.3154(3) 0.0642(2) 0.0790(13) Uani 1 1 d . . . . .
H44 H 0.109521 0.344596 0.025573 0.095 Uiso 1 1 calc R U . . .
C45 C 0.0767(4) 0.2333(3) 0.0566(2) 0.0741(11) Uani 1 1 d . . . . .
H45 H 0.051314 0.205615 0.012642 0.089 Uiso 1 1 calc R U . . .
C46 C 0.0787(3) 0.1903(2) 0.11267(18) 0.0589(8) Uani 1 1 d . . . . .
H46 H 0.057447 0.133148 0.106702 0.071 Uiso 1 1 calc R U . . .
C51 C 0.2107(3) 0.1326(2) 0.23224(16) 0.0504(7) Uani 1 1 d . . . . .
C52 C 0.3097(3) 0.1771(2) 0.2301(2) 0.0610(9) Uani 1 1 d . . . . .
H52 H 0.319610 0.234388 0.232587 0.073 Uiso 1 1 calc R U . . .
C53 C 0.3945(4) 0.1384(3) 0.2243(2) 0.0731(11) Uani 1 1 d . . . . .
H53 H 0.462065 0.169541 0.222983 0.088 Uiso 1 1 calc R U . . .
C54 C 0.3815(4) 0.0554(3) 0.2205(2) 0.0773(13) Uani 1 1 d . . . . .
H54 H 0.440139 0.029532 0.217333 0.093 Uiso 1 1 calc R U . . .
C55 C 0.2847(4) 0.0105(3) 0.2213(2) 0.0778(13) Uani 1 1 d . . . . .
H55 H 0.275771 -0.046788 0.218229 0.093 Uiso 1 1 calc R U . . .
C56 C 0.1966(4) 0.0486(2) 0.2267(2) 0.0634(9) Uani 1 1 d . . . . .
H56 H 0.128745 0.017046 0.226427 0.076 Uiso 1 1 calc R U . . .
C61 C 0.0135(3) 0.12244(18) 0.24182(18) 0.0505(7) Uani 1 1 d . . . . .
C62 C -0.0819(3) 0.1220(2) 0.1987(2) 0.0666(10) Uani 1 1 d . . . . .
H62 H -0.084031 0.154429 0.162132 0.080 Uiso 1 1 calc R U . . .
C63 C -0.1758(4) 0.0737(3) 0.2087(3) 0.0881(15) Uani 1 1 d . . . . .
H63 H -0.240782 0.073361 0.178269 0.106 Uiso 1 1 calc R U . . .
C64 C -0.1752(5) 0.0272(3) 0.2616(3) 0.0932(17) Uani 1 1 d . . . . .
H64 H -0.239211 -0.005434 0.267711 0.112 Uiso 1 1 calc R U . . .
C65 C -0.0817(5) 0.0282(3) 0.3055(3) 0.0818(13) Uani 1 1 d . . . . .
H65 H -0.080921 -0.003497 0.342566 0.098 Uiso 1 1 calc R U . . .
C66 C 0.0124(4) 0.0754(2) 0.2964(2) 0.0651(9) Uani 1 1 d . . . . .
H66 H 0.076740 0.075787 0.327512 0.078 Uiso 1 1 calc R U . . .
C71 C -0.2535(3) 0.3179(3) 0.2205(3) 0.0778(13) Uani 1 1 d . . . . .
C72 C -0.1787(4) 0.3862(3) 0.2144(3) 0.0802(14) Uani 1 1 d . . . . .
H72 H -0.184412 0.438094 0.239260 0.096 Uiso 1 1 calc R U . . .
C73 C -0.1332(4) 0.3929(3) 0.1568(3) 0.0834(14) Uani 1 1 d . . . . .
C74 C -0.1606(4) 0.3285(3) 0.1053(3) 0.0837(13) Uani 1 1 d . . . . .
H74 H -0.128986 0.331572 0.066572 0.100 Uiso 1 1 calc R U . . .
C75 C -0.2342(4) 0.2602(3) 0.1109(3) 0.0753(12) Uani 1 1 d . . . . .
C76 C -0.2789(4) 0.2564(3) 0.1679(3) 0.0804(13) Uani 1 1 d . . . . .
H76 H -0.329334 0.209722 0.171091 0.096 Uiso 1 1 calc R U . . .
C77 C -0.3071(5) 0.3163(4) 0.2799(3) 0.1043(19) Uani 1 1 d . . . . .
H77A H -0.257768 0.346550 0.319549 0.125 Uiso 1 1 calc R U . . .
H77B H -0.328161 0.260194 0.289099 0.125 Uiso 1 1 calc R U . . .
H77C H -0.370325 0.341230 0.270160 0.125 Uiso 1 1 calc R U . . .
C78 C -0.0603(5) 0.4692(3) 0.1476(4) 0.113(2) Uani 1 1 d . . . . .
H78A H -0.073154 0.514715 0.175796 0.136 Uiso 1 1 calc R U . . .
H78B H -0.074283 0.479736 0.100085 0.136 Uiso 1 1 calc R U . . .
H78C H 0.013877 0.462689 0.160972 0.136 Uiso 1 1 calc R U . . .
C79 C -0.2653(6) 0.1920(4) 0.0547(3) 0.108(2) Uani 1 1 d . . . . .
H79A H -0.203770 0.166360 0.051497 0.130 Uiso 1 1 calc R U . . .
H79B H -0.288981 0.213415 0.011826 0.130 Uiso 1 1 calc R U . . .
H79C H -0.323213 0.151824 0.064112 0.130 Uiso 1 1 calc R U . . .
F101 F 0.47294(19) -0.14191(11) 0.62244(11) 0.0628(5) Uani 1 1 d . . . . .
F102 F 0.47243(18) -0.12115(11) 0.51927(11) 0.0605(5) Uani 1 1 d . . . . .
F103 F 0.60827(16) -0.06880(12) 0.59624(16) 0.0758(7) Uani 1 1 d . . . . .
F104 F 0.13402(17) -0.01017(15) 0.52302(16) 0.0816(8) Uani 1 1 d . . . . .
F105 F 0.14885(19) 0.10858(17) 0.56502(19) 0.0979(10) Uani 1 1 d . . . . .
F106 F 0.1978(2) 0.0857(3) 0.47222(19) 0.1412(19) Uani 1 1 d . . . . .
F111 F 0.41630(15) 0.39729(12) 0.46865(11) 0.0551(5) Uani 1 1 d . . . . .
F112 F 0.58376(16) 0.41054(15) 0.47579(12) 0.0684(6) Uani 1 1 d . . . . .
F113 F 0.4855(2) 0.29155(13) 0.45991(11) 0.0725(7) Uani 1 1 d . . . . .
F114 F 0.6274(3) 0.5158(2) 0.7769(2) 0.1389(18) Uani 1 1 d . . . . .
F115 F 0.4741(3) 0.5273(2) 0.7379(3) 0.146(2) Uani 1 1 d . . . . .
F116 F 0.5961(5) 0.57529(16) 0.6928(2) 0.163(2) Uani 1 1 d . . . . .
F121 F 0.9470(11) 0.2260(6) 0.6208(7) 0.118(5) Uani 0.5 1 d . . P A 1
F122 F 0.8338(7) 0.1281(10) 0.5875(6) 0.143(7) Uani 0.5 1 d . . P A 1
F123 F 0.9610(12) 0.1237(12) 0.6657(7) 0.153(7) Uani 0.5 1 d . . P A 1
F124 F 0.915(2) 0.3576(12) 0.8773(7) 0.206(10) Uani 0.5 1 d . . P B 1
F125 F 0.8395(10) 0.2739(15) 0.9195(7) 0.127(8) Uani 0.5 1 d . . P B 1
F126 F 0.9737(10) 0.2514(14) 0.8919(5) 0.174(7) Uani 0.5 1 d . . P B 1
F12A F 0.8945(13) 0.0872(6) 0.6455(8) 0.134(5) Uani 0.5 1 d . . P A 2
F12B F 0.9853(10) 0.1985(13) 0.6495(9) 0.186(9) Uani 0.5 1 d . . P A 2
F12C F 0.8473(11) 0.1652(11) 0.5821(4) 0.135(7) Uani 0.5 1 d . . P A 2
F12D F 0.8611(17) 0.2447(17) 0.9187(6) 0.184(11) Uani 0.5 1 d . . P B 2
F12E F 0.9889(5) 0.3103(7) 0.8766(5) 0.098(3) Uani 0.5 1 d . . P B 2
F12F F 0.8599(9) 0.3638(11) 0.8827(9) 0.161(9) Uani 0.5 1 d . . P B 2
F131 F 0.5845(6) 0.0670(5) 0.9261(4) 0.0570(13) Uani 0.5 1 d . . P C 1
F132 F 0.4116(16) 0.0007(9) 0.8995(11) 0.177(10) Uani 0.5 1 d . . P C 1
F133 F 0.4654(10) 0.0899(10) 0.9766(5) 0.092(3) Uani 0.5 1 d . . P C 1
F134 F 0.2070(9) 0.2909(8) 0.7814(7) 0.097(4) Uani 0.5 1 d . . P C 1
F135 F 0.2146(16) 0.2621(16) 0.8781(11) 0.160(9) Uani 0.5 1 d . . P C 1
F136 F 0.1375(5) 0.1715(5) 0.7998(7) 0.167(5) Uani 0.5 1 d . . P C 1
F13A F 0.5529(9) 0.0708(9) 0.9322(8) 0.156(7) Uani 0.5 1 d . . P D 2
F13B F 0.4422(13) -0.0088(8) 0.8885(9) 0.090(3) Uani 0.5 1 d . . P D 2
F13C F 0.4207(17) 0.0711(13) 0.9656(9) 0.191(10) Uani 0.5 1 d . . P D 2
F13D F 0.2894(7) 0.3645(5) 0.8305(7) 0.158(5) Uani 0.5 1 d . . P D 2
F13E F 0.2150(10) 0.2793(11) 0.8907(10) 0.098(3) Uani 0.5 1 d . . P D 2
F13F F 0.1717(8) 0.2672(11) 0.7848(9) 0.126(6) Uani 0.5 1 d . . P D 2
C101 C 0.4696(2) 0.12418(16) 0.64829(15) 0.0375(5) Uani 1 1 d . . . . .
C102 C 0.5107(2) 0.05394(15) 0.63759(15) 0.0392(6) Uani 1 1 d . . . . .
H102 H 0.579465 0.050896 0.661813 0.047 Uiso 1 1 calc R U . . .
C103 C 0.4542(2) -0.01167(16) 0.59262(16) 0.0420(6) Uani 1 1 d . . . . .
C104 C 0.3524(2) -0.01080(17) 0.55742(16) 0.0447(6) Uani 1 1 d . . . . .
H104 H 0.313981 -0.055397 0.526476 0.054 Uiso 1 1 calc R U . . .
C105 C 0.3081(2) 0.05739(17) 0.56880(16) 0.0443(6) Uani 1 1 d . . . . .
C106 C 0.3661(2) 0.12327(17) 0.61320(16) 0.0420(6) Uani 1 1 d . . . . .
H106 H 0.334253 0.169162 0.619864 0.050 Uiso 1 1 calc R U . . .
C107 C 0.5024(2) -0.08481(17) 0.58251(18) 0.0486(7) Uani 1 1 d . . . . .
C108 C 0.1987(3) 0.0607(2) 0.5320(2) 0.0583(9) Uani 1 1 d . . . . .
C111 C 0.5240(2) 0.28732(16) 0.66718(15) 0.0375(5) Uani 1 1 d . . . . .
C112 C 0.5118(2) 0.29037(15) 0.59752(15) 0.0376(5) Uani 1 1 d . . . . .
H112 H 0.501238 0.241277 0.569106 0.045 Uiso 1 1 calc R U . . .
C113 C 0.51463(19) 0.36310(16) 0.56808(15) 0.0379(6) Uani 1 1 d . . . . .
C114 C 0.5295(2) 0.43555(16) 0.60805(17) 0.0431(6) Uani 1 1 d . . . . .
H114 H 0.530526 0.485125 0.588292 0.052 Uiso 1 1 calc R U . . .
C115 C 0.5428(2) 0.43447(16) 0.67708(17) 0.0430(6) Uani 1 1 d . . . . .
C116 C 0.5402(2) 0.36151(16) 0.70631(16) 0.0400(6) Uani 1 1 d . . . . .
H116 H 0.549594 0.362437 0.754041 0.048 Uiso 1 1 calc R U . . .
C117 C 0.5003(2) 0.36427(18) 0.49386(17) 0.0455(6) Uani 1 1 d . . . . .
C118 C 0.5591(3) 0.51253(19) 0.7211(2) 0.0564(8) Uani 1 1 d . . . . .
C121 C 0.6609(2) 0.20648(14) 0.72325(15) 0.0360(5) Uani 1 1 d . . . . .
C122 C 0.7208(2) 0.18478(15) 0.67629(15) 0.0391(6) Uani 1 1 d . . . . .
H122 H 0.685116 0.164592 0.631561 0.047 Uiso 1 1 calc R U . . .
C123 C 0.8309(2) 0.19184(16) 0.69299(16) 0.0418(6) Uani 1 1 d . . . . .
C124 C 0.8862(2) 0.2244(2) 0.75646(18) 0.0498(7) Uani 1 1 d . . . . .
H124 H 0.961425 0.229816 0.767763 0.060 Uiso 1 1 calc R U . . .
C125 C 0.8291(2) 0.2492(2) 0.80360(18) 0.0517(7) Uani 1 1 d . . . . .
C126 C 0.7183(2) 0.23904(17) 0.78657(16) 0.0429(6) Uani 1 1 d . . . . .
H126 H 0.680754 0.255146 0.819785 0.051 Uiso 1 1 calc R U . . .
C127 C 0.8907(3) 0.1641(2) 0.6422(2) 0.0572(8) Uani 1 1 d . . . . .
C128 C 0.8857(3) 0.2865(4) 0.8719(3) 0.0896(17) Uani 1 1 d . . . . .
C131 C 0.4722(2) 0.19464(17) 0.76600(16) 0.0418(6) Uani 1 1 d . . . . .
C132 C 0.5028(7) 0.1397(5) 0.8112(4) 0.033(2) Uiso 0.5 1 d . . P C 1
H132 H 0.562988 0.115972 0.807042 0.040 Uiso 0.5 1 calc R U P C 1
C133 C 0.4469(5) 0.1189(5) 0.8623(3) 0.0375(16) Uiso 0.5 1 d . . P C 1
C134 C 0.3556(5) 0.1494(5) 0.8659(3) 0.0436(13) Uiso 0.5 1 d . . P C 1
H134 H 0.316408 0.136197 0.900244 0.052 Uiso 0.5 1 calc R U P C 1
C135 C 0.3223(5) 0.2002(4) 0.8178(3) 0.0455(13) Uiso 0.5 1 d . . P C 1
C136 C 0.3854(3) 0.2315(3) 0.7720(2) 0.0639(10) Uani 1 1 d . . . . .
H136 H 0.369551 0.274977 0.746865 0.077 Uiso 1 1 calc R U . C 1
C137 C 0.4799(7) 0.0623(5) 0.9122(4) 0.0442(17) Uiso 0.5 1 d . . P C 1
C138 C 0.2204(7) 0.2313(5) 0.8193(5) 0.0671(19) Uiso 0.5 1 d . . P C 1
C13B C 0.4907(8) 0.1456(6) 0.8183(5) 0.047(3) Uiso 0.5 1 d . . P D 2
H13B H 0.546875 0.116057 0.818508 0.056 Uiso 0.5 1 calc R U P D 2
C13C C 0.4346(6) 0.1368(5) 0.8690(4) 0.0440(19) Uiso 0.5 1 d . . P D 2
C13D C 0.3570(6) 0.1801(5) 0.8750(4) 0.0488(15) Uiso 0.5 1 d . . P D 2
H13D H 0.318131 0.172658 0.910249 0.059 Uiso 0.5 1 calc R U P D 2
C13E C 0.3350(6) 0.2358(5) 0.8287(4) 0.0523(15) Uiso 0.5 1 d . . P D 2
C13G C 0.4608(8) 0.0783(7) 0.9183(5) 0.064(3) Uiso 0.5 1 d . . P D 2
C13H C 0.2540(8) 0.2904(6) 0.8358(6) 0.076(2) Uiso 0.5 1 d . . P D 2
B B 0.5318(2) 0.20261(17) 0.70144(16) 0.0365(6) Uani 1 1 d . . . . .
C11S C 0.4003(12) 0.5950(9) 1.0199(5) 0.1721(18) Uiso 0.6 1 d DG U P E 1
C12S C 0.4720(11) 0.6600(7) 1.0063(6) 0.1721(18) Uiso 0.6 1 d G U P E 1
H12S H 0.500939 0.704132 1.039975 0.207 Uiso 0.6 1 calc R U P E 1
C13S C 0.5013(9) 0.6604(7) 0.9436(7) 0.1721(18) Uiso 0.6 1 d DG U P E 1
C14S C 0.4589(11) 0.5958(9) 0.8944(5) 0.1721(18) Uiso 0.6 1 d G U P E 1
H14S H 0.478894 0.596046 0.851515 0.207 Uiso 0.6 1 calc R U P E 1
C15S C 0.3873(10) 0.5308(7) 0.9079(6) 0.1721(18) Uiso 0.6 1 d DG U P E 1
C16S C 0.3580(10) 0.5304(7) 0.9706(7) 0.1721(18) Uiso 0.6 1 d G U P E 1
H16S H 0.309023 0.486001 0.979870 0.207 Uiso 0.6 1 calc R U P E 1
C17S C 0.3822(15) 0.5913(11) 1.0913(6) 0.1721(18) Uiso 0.6 1 d D U P E 1
H17A H 0.450907 0.599035 1.122634 0.207 Uiso 0.6 1 calc R U P E 1
H17B H 0.340235 0.538367 1.095268 0.207 Uiso 0.6 1 calc R U P E 1
H17C H 0.343613 0.633940 1.102485 0.207 Uiso 0.6 1 calc R U P E 1
C18S C 0.5838(13) 0.7224(10) 0.9215(9) 0.1721(18) Uiso 0.6 1 d D U P E 1
H18A H 0.558753 0.773993 0.919103 0.207 Uiso 0.6 1 calc R U P E 1
H18B H 0.594823 0.703333 0.876957 0.207 Uiso 0.6 1 calc R U P E 1
H18C H 0.651020 0.729881 0.954265 0.207 Uiso 0.6 1 calc R U P E 1
C19S C 0.3385(14) 0.4593(9) 0.8553(8) 0.1721(18) Uiso 0.6 1 d D U P E 1
H19A H 0.364182 0.410840 0.870313 0.207 Uiso 0.6 1 calc R U P E 1
H19B H 0.359088 0.470682 0.812204 0.207 Uiso 0.6 1 calc R U P E 1
H19C H 0.260804 0.450353 0.849579 0.207 Uiso 0.6 1 calc R U P E 1
C21S C 0.2962(7) 0.5694(6) 1.0768(5) 0.1721(18) Uiso 0.4 1 d DG U P F 2
C22S C 0.3774(8) 0.6263(6) 1.0622(6) 0.1721(18) Uiso 0.4 1 d DG U P F 2
H22S H 0.405898 0.673955 1.092101 0.207 Uiso 0.4 1 calc R U P F 2
C23S C 0.4170(9) 0.6133(7) 1.0038(6) 0.1721(18) Uiso 0.4 1 d DG U P F 2
C24S C 0.3753(9) 0.5435(7) 0.9600(6) 0.1721(18) Uiso 0.4 1 d DG U P F 2
H24S H 0.402313 0.534672 0.920054 0.207 Uiso 0.4 1 calc R U P F 2
C25S C 0.2941(9) 0.4867(6) 0.9746(6) 0.1721(18) Uiso 0.4 1 d DG U P F 2
C26S C 0.2546(8) 0.4996(6) 1.0330(6) 0.1721(18) Uiso 0.4 1 d DG U P F 2
H26S H 0.199095 0.460728 1.043011 0.207 Uiso 0.4 1 calc R U P F 2
C27S C 0.2535(11) 0.5836(9) 1.1402(6) 0.1721(18) Uiso 0.4 1 d D U P F 2
H27A H 0.215103 0.532259 1.150674 0.207 Uiso 0.4 1 calc R U P F 2
H27B H 0.204931 0.622152 1.133302 0.207 Uiso 0.4 1 calc R U P F 2
H27C H 0.312690 0.605457 1.177756 0.207 Uiso 0.4 1 calc R U P F 2
C28S C 0.5042(12) 0.6732(10) 0.9865(9) 0.1721(18) Uiso 0.4 1 d D U P F 2
H28A H 0.521102 0.653567 0.943723 0.207 Uiso 0.4 1 calc R U P F 2
H28B H 0.481086 0.725281 0.981950 0.207 Uiso 0.4 1 calc R U P F 2
H28C H 0.567571 0.679887 1.022400 0.207 Uiso 0.4 1 calc R U P F 2
C29S C 0.2504(13) 0.4114(8) 0.9262(8) 0.1721(18) Uiso 0.4 1 d D U P F 2
H29A H 0.210787 0.370486 0.948854 0.207 Uiso 0.4 1 calc R U P F 2
H29B H 0.309190 0.390307 0.911509 0.207 Uiso 0.4 1 calc R U P F 2
H29C H 0.202670 0.424659 0.886836 0.207 Uiso 0.4 1 calc R U P F 2
C31S C -0.0795(4) -0.0102(5) 0.0001(4) 0.0870(9) Uiso 0.5 1 d DG U P G -1
C32S C -0.0799(4) 0.0316(4) -0.0568(3) 0.0870(9) Uiso 0.5 1 d G U P G -1
H32S H -0.144349 0.044522 -0.079936 0.104 Uiso 0.5 1 calc R U P G -1
C33S C 0.0141(6) 0.0543(4) -0.0800(3) 0.0870(9) Uiso 0.5 1 d DG U P G -1
C34S C 0.1084(4) 0.0353(4) -0.0462(4) 0.0870(9) Uiso 0.5 1 d G U P G -1
H34S H 0.172614 0.050913 -0.061963 0.104 Uiso 0.5 1 calc R U P G -1
C35S C 0.1088(4) -0.0064(5) 0.0108(4) 0.0870(9) Uiso 0.5 1 d DG U P G -1
C36S C 0.0149(5) -0.0292(5) 0.0339(3) 0.0870(9) Uiso 0.5 1 d G U P G -1
H36S H 0.015152 -0.057719 0.072789 0.104 Uiso 0.5 1 calc R U P G -1
C37S C -0.1858(7) -0.0327(7) 0.0200(6) 0.0870(9) Uiso 0.5 1 d D U P G -1
H37A H -0.230768 0.006362 0.004983 0.104 Uiso 0.5 1 calc R U P G -1
H37B H -0.175686 -0.032288 0.069201 0.104 Uiso 0.5 1 calc R U P G -1
H37C H -0.220348 -0.086972 -0.001279 0.104 Uiso 0.5 1 calc R U P G -1
C38S C 0.0235(9) 0.0985(6) -0.1416(5) 0.0870(9) Uiso 0.5 1 d D U P G -1
H38A H 0.053908 0.155714 -0.127590 0.104 Uiso 0.5 1 calc R U P G -1
H38B H -0.047200 0.093889 -0.170137 0.104 Uiso 0.5 1 calc R U P G -1
H38C H 0.069850 0.074640 -0.167240 0.104 Uiso 0.5 1 calc R U P G -1
C39S C 0.2157(7) -0.0203(7) 0.0458(6) 0.0870(9) Uiso 0.5 1 d D U P G -1
H39A H 0.247969 -0.049295 0.013781 0.104 Uiso 0.5 1 calc R U P G -1
H39B H 0.206711 -0.052577 0.083570 0.104 Uiso 0.5 1 calc R U P G -1
H39C H 0.261919 0.031865 0.062973 0.104 Uiso 0.5 1 calc R U P G -1


_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
Ag C1 2.112(3) . ?
Ag C72 2.323(4) . ?
Ag C71 2.682(4) . ?
Ag C73 2.719(5) . ?
N1 C1 1.351(4) . ?
N1 C2 1.388(3) . ?
N1 C4 1.499(3) . ?
N2 C1 1.356(3) . ?
N2 C3 1.384(4) . ?
N2 C5 1.510(4) . ?
C2 C3 1.342(4) . ?
C4 C21 1.542(4) . ?
C4 C31 1.543(3) . ?
C4 C11 1.549(3) . ?
C5 C41 1.530(4) . ?
C5 C61 1.545(5) . ?
C5 C51 1.546(4) . ?
C11 C16 1.388(3) . ?
C11 C12 1.405(4) . ?
C12 C13 1.385(4) . ?
C13 C14 1.388(4) . ?
C14 C15 1.380(5) . ?
C15 C16 1.397(4) . ?
C21 C26 1.387(3) . ?
C21 C22 1.403(4) . ?
C22 C23 1.381(4) . ?
C23 C24 1.388(4) . ?
C24 C25 1.388(5) . ?
C25 C26 1.393(4) . ?
C31 C32 1.391(4) . ?
C31 C36 1.400(4) . ?
C32 C33 1.391(4) . ?
C33 C34 1.386(5) . ?
C34 C35 1.374(5) . ?
C35 C36 1.384(4) . ?
C41 C42 1.391(5) . ?
C41 C46 1.397(4) . ?
C42 C43 1.394(5) . ?
C43 C44 1.381(6) . ?
C44 C45 1.371(6) . ?
C45 C46 1.386(5) . ?
C51 C52 1.385(5) . ?
C51 C56 1.390(5) . ?
C52 C53 1.391(5) . ?
C53 C54 1.375(7) . ?
C54 C55 1.359(7) . ?
C55 C56 1.420(5) . ?
C61 C62 1.378(5) . ?
C61 C66 1.403(5) . ?
C62 C63 1.404(6) . ?
C63 C64 1.369(8) . ?
C64 C65 1.366(8) . ?
C65 C66 1.392(6) . ?
C71 C76 1.387(7) . ?
C71 C72 1.404(8) . ?
C71 C77 1.495(8) . ?
C72 C73 1.402(8) . ?
C73 C74 1.404(7) . ?
C73 C78 1.508(8) . ?
C74 C75 1.393(7) . ?
C75 C76 1.383(8) . ?
C75 C79 1.510(6) . ?
F101 C107 1.349(4) . ?
F102 C107 1.340(4) . ?
F103 C107 1.330(4) . ?
F104 C108 1.321(4) . ?
F105 C108 1.334(5) . ?
F106 C108 1.305(5) . ?
F111 C117 1.343(3) . ?
F112 C117 1.348(3) . ?
F113 C117 1.330(4) . ?
F114 C118 1.295(5) . ?
F115 C118 1.271(5) . ?
F116 C118 1.301(5) . ?
F121 C127 1.317(8) . ?
F122 C127 1.265(9) . ?
F123 C127 1.273(8) . ?
F124 C128 1.186(17) . ?
F125 C128 1.238(15) . ?
F126 C128 1.384(12) . ?
F12A C127 1.312(9) . ?
F12B C127 1.247(9) . ?
F12C C127 1.246(9) . ?
F12D C128 1.273(19) . ?
F12E C128 1.318(8) . ?
F12F C128 1.411(15) . ?
F12F C27S 1.851(18) 2_667 ?
F131 C137 1.326(11) . ?
F132 C137 1.225(16) . ?
F133 C137 1.408(14) . ?
F134 C138 1.321(17) . ?
F135 C138 1.28(2) . ?
F136 C138 1.326(11) . ?
F13A C13G 1.209(15) . ?
F13B C13G 1.511(16) . ?
F13C C13G 1.174(18) . ?
F13D C13H 1.275(13) . ?
F13E C13H 1.31(2) . ?
F13F C13H 1.329(18) . ?
C101 C102 1.398(4) . ?
C101 C106 1.399(4) . ?
C101 B 1.640(4) . ?
C102 C103 1.392(4) . ?
C103 C104 1.388(4) . ?
C103 C107 1.492(4) . ?
C104 C105 1.393(4) . ?
C105 C106 1.395(4) . ?
C105 C108 1.493(4) . ?
C111 C112 1.395(4) . ?
C111 C116 1.397(4) . ?
C111 B 1.640(4) . ?
C112 C113 1.397(3) . ?
C113 C114 1.383(4) . ?
C113 C117 1.481(4) . ?
C114 C115 1.378(5) . ?
C115 C116 1.399(4) . ?
C115 C118 1.500(4) . ?
C121 C126 1.385(4) . ?
C121 C122 1.400(4) . ?
C121 B 1.646(4) . ?
C122 C123 1.393(4) . ?
C123 C124 1.380(5) . ?
C123 C127 1.492(5) . ?
C124 C125 1.394(5) . ?
C125 C126 1.397(4) . ?
C125 C128 1.484(6) . ?
C131 C136 1.396(4) . ?
C131 C13B 1.398(10) . ?
C131 C132 1.400(8) . ?
C131 B 1.638(4) . ?
C132 C133 1.400(11) . ?
C133 C134 1.382(10) . ?
C133 C137 1.493(10) . ?
C134 C135 1.398(9) . ?
C135 C136 1.416(7) . ?
C135 C138 1.510(11) . ?
C136 C13E 1.425(8) . ?
C13B C13C 1.366(13) . ?
C13C C13D 1.359(12) . ?
C13C C13G 1.486(13) . ?
C13D C13E 1.397(10) . ?
C13E C13H 1.528(12) . ?
C11S C12S 1.3900 . ?
C11S C16S 1.3900 . ?
C11S C17S 1.511(9) . ?
C12S C13S 1.3900 . ?
C13S C14S 1.3900 . ?
C13S C18S 1.518(9) . ?
C14S C15S 1.3900 . ?
C15S C16S 1.3900 . ?
C15S C19S 1.519(9) . ?
C21S C22S 1.3900 . ?
C21S C26S 1.3900 . ?
C21S C27S 1.507(6) . ?
C22S C23S 1.3900 . ?
C23S C24S 1.3900 . ?
C23S C28S 1.495(6) . ?
C24S C25S 1.3900 . ?
C25S C26S 1.3900 . ?
C25S C29S 1.509(6) . ?
C31S C32S 1.3900 . ?
C31S C36S 1.3900 . ?
C31S C37S 1.505(8) . ?
C32S C33S 1.3900 . ?
C33S C34S 1.3900 . ?
C33S C38S 1.510(8) . ?
C34S C35S 1.3900 . ?
C35S C36S 1.3900 . ?
C35S C39S 1.504(8) . ?

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 Ag C72 168.86(13) . . ?
C1 Ag C71 152.65(14) . . ?
C72 Ag C71 31.55(17) . . ?
C1 Ag C73 152.47(15) . . ?
C72 Ag C73 31.04(18) . . ?
C71 Ag C73 53.89(17) . . ?
C1 N1 C2 111.0(2) . . ?
C1 N1 C4 122.6(2) . . ?
C2 N1 C4 126.4(2) . . ?
C1 N2 C3 110.7(2) . . ?
C1 N2 C5 122.4(2) . . ?
C3 N2 C5 125.1(2) . . ?
N1 C1 N2 104.7(2) . . ?
N1 C1 Ag 126.09(19) . . ?
N2 C1 Ag 129.2(2) . . ?
C3 C2 N1 106.5(3) . . ?
C2 C3 N2 107.1(2) . . ?
N1 C4 C21 108.88(19) . . ?
N1 C4 C31 110.1(2) . . ?
C21 C4 C31 106.8(2) . . ?
N1 C4 C11 105.5(2) . . ?
C21 C4 C11 112.6(2) . . ?
C31 C4 C11 112.9(2) . . ?
N2 C5 C41 111.0(2) . . ?
N2 C5 C61 103.6(2) . . ?
C41 C5 C61 115.1(3) . . ?
N2 C5 C51 107.7(2) . . ?
C41 C5 C51 105.8(3) . . ?
C61 C5 C51 113.5(2) . . ?
C16 C11 C12 118.3(2) . . ?
C16 C11 C4 123.4(2) . . ?
C12 C11 C4 118.2(2) . . ?
C13 C12 C11 120.7(3) . . ?
C12 C13 C14 120.5(3) . . ?
C15 C14 C13 119.3(3) . . ?
C14 C15 C16 120.6(3) . . ?
C11 C16 C15 120.6(3) . . ?
C26 C21 C22 118.4(3) . . ?
C26 C21 C4 123.2(2) . . ?
C22 C21 C4 118.4(2) . . ?
C23 C22 C21 120.9(3) . . ?
C22 C23 C24 120.3(3) . . ?
C25 C24 C23 119.3(3) . . ?
C24 C25 C26 120.4(3) . . ?
C21 C26 C25 120.7(3) . . ?
C32 C31 C36 118.1(2) . . ?
C32 C31 C4 124.0(2) . . ?
C36 C31 C4 117.7(2) . . ?
C31 C32 C33 120.3(3) . . ?
C34 C33 C32 120.8(3) . . ?
C35 C34 C33 119.4(3) . . ?
C34 C35 C36 120.2(3) . . ?
C35 C36 C31 121.2(3) . . ?
C42 C41 C46 118.2(3) . . ?
C42 C41 C5 123.5(3) . . ?
C46 C41 C5 117.9(3) . . ?
C41 C42 C43 120.5(3) . . ?
C44 C43 C42 120.2(4) . . ?
C45 C44 C43 119.8(4) . . ?
C44 C45 C46 120.4(4) . . ?
C45 C46 C41 120.8(3) . . ?
C52 C51 C56 119.1(3) . . ?
C52 C51 C5 118.5(3) . . ?
C56 C51 C5 122.4(3) . . ?
C51 C52 C53 120.5(4) . . ?
C54 C53 C52 120.5(5) . . ?
C55 C54 C53 120.0(4) . . ?
C54 C55 C56 120.5(4) . . ?
C51 C56 C55 119.4(4) . . ?
C62 C61 C66 117.9(4) . . ?
C62 C61 C5 123.3(3) . . ?
C66 C61 C5 118.5(3) . . ?
C61 C62 C63 120.3(4) . . ?
C64 C63 C62 121.1(5) . . ?
C65 C64 C63 119.3(5) . . ?
C64 C65 C66 120.5(5) . . ?
C65 C66 C61 120.8(4) . . ?
C76 C71 C72 117.3(5) . . ?
C76 C71 C77 122.9(5) . . ?
C72 C71 C77 119.7(5) . . ?
C76 C71 Ag 101.8(3) . . ?
C72 C71 Ag 60.0(2) . . ?
C77 C71 Ag 108.9(3) . . ?
C73 C72 C71 121.4(4) . . ?
C73 C72 Ag 90.3(3) . . ?
C71 C72 Ag 88.5(3) . . ?
C72 C73 C74 119.0(5) . . ?
C72 C73 C78 121.4(5) . . ?
C74 C73 C78 119.6(6) . . ?
C72 C73 Ag 58.7(2) . . ?
C74 C73 Ag 101.7(3) . . ?
C78 C73 Ag 111.1(3) . . ?
C75 C74 C73 120.1(6) . . ?
C76 C75 C74 119.2(5) . . ?
C76 C75 C79 120.9(5) . . ?
C74 C75 C79 119.9(5) . . ?
C75 C76 C71 122.9(5) . . ?
C128 F12F C27S 139.3(9) . 2_667 ?
C102 C101 C106 115.9(3) . . ?
C102 C101 B 124.2(2) . . ?
C106 C101 B 119.7(2) . . ?
C103 C102 C101 122.2(3) . . ?
C104 C103 C102 120.9(3) . . ?
C104 C103 C107 119.1(3) . . ?
C102 C103 C107 120.0(3) . . ?
C103 C104 C105 118.0(3) . . ?
C104 C105 C106 120.5(3) . . ?
C104 C105 C108 119.7(3) . . ?
C106 C105 C108 119.8(3) . . ?
C105 C106 C101 122.4(3) . . ?
F103 C107 F102 107.1(3) . . ?
F103 C107 F101 106.2(3) . . ?
F102 C107 F101 105.4(2) . . ?
F103 C107 C103 113.0(2) . . ?
F102 C107 C103 112.7(3) . . ?
F101 C107 C103 111.9(3) . . ?
F106 C108 F104 106.7(4) . . ?
F106 C108 F105 106.9(4) . . ?
F104 C108 F105 103.5(3) . . ?
F106 C108 C105 112.8(3) . . ?
F104 C108 C105 112.8(3) . . ?
F105 C108 C105 113.4(3) . . ?
C112 C111 C116 116.2(2) . . ?
C112 C111 B 121.6(2) . . ?
C116 C111 B 121.9(3) . . ?
C111 C112 C113 122.3(3) . . ?
C114 C113 C112 120.2(3) . . ?
C114 C113 C117 118.7(2) . . ?
C112 C113 C117 121.0(3) . . ?
C115 C114 C113 118.7(2) . . ?
C114 C115 C116 120.8(3) . . ?
C114 C115 C118 119.4(3) . . ?
C116 C115 C118 119.8(3) . . ?
C111 C116 C115 121.7(3) . . ?
F113 C117 F111 106.2(3) . . ?
F113 C117 F112 107.4(3) . . ?
F111 C117 F112 104.5(2) . . ?
F113 C117 C113 114.1(2) . . ?
F111 C117 C113 112.0(3) . . ?
F112 C117 C113 112.0(3) . . ?
F115 C118 F114 106.3(4) . . ?
F115 C118 F116 105.7(4) . . ?
F114 C118 F116 104.0(4) . . ?
F115 C118 C115 113.3(3) . . ?
F114 C118 C115 113.5(3) . . ?
F116 C118 C115 113.2(4) . . ?
C126 C121 C122 116.0(2) . . ?
C126 C121 B 122.3(3) . . ?
C122 C121 B 121.4(3) . . ?
C123 C122 C121 122.1(3) . . ?
C124 C123 C122 120.7(3) . . ?
C124 C123 C127 119.1(3) . . ?
C122 C123 C127 120.2(3) . . ?
C123 C124 C125 118.4(3) . . ?
C124 C125 C126 120.0(3) . . ?
C124 C125 C128 120.2(3) . . ?
C126 C125 C128 119.9(3) . . ?
C121 C126 C125 122.7(3) . . ?
F12C C127 F12B 107.9(11) . . ?
F122 C127 F123 110.6(10) . . ?
F12C C127 F12A 102.3(9) . . ?
F12B C127 F12A 105.1(11) . . ?
F122 C127 F121 101.8(9) . . ?
F123 C127 F121 102.7(9) . . ?
F12C C127 C123 114.9(6) . . ?
F12B C127 C123 115.7(7) . . ?
F122 C127 C123 115.4(5) . . ?
F123 C127 C123 114.0(6) . . ?
F12A C127 C123 109.7(6) . . ?
F121 C127 C123 111.0(6) . . ?
F124 C128 F125 104.7(15) . . ?
F12D C128 F12E 114.2(12) . . ?
F124 C128 F126 108.0(13) . . ?
F125 C128 F126 100.1(11) . . ?
F12D C128 F12F 108.7(14) . . ?
F12E C128 F12F 97.4(9) . . ?
F124 C128 C125 115.9(9) . . ?
F125 C128 C125 117.4(8) . . ?
F12D C128 C125 112.7(11) . . ?
F12E C128 C125 113.8(6) . . ?
F126 C128 C125 109.3(7) . . ?
F12F C128 C125 108.7(7) . . ?
C136 C131 C13B 110.0(5) . . ?
C136 C131 C132 120.2(5) . . ?
C136 C131 B 122.7(3) . . ?
C13B C131 B 127.0(5) . . ?
C132 C131 B 116.5(4) . . ?
C133 C132 C131 121.4(7) . . ?
C134 C133 C132 119.5(7) . . ?
C134 C133 C137 118.1(6) . . ?
C132 C133 C137 122.4(7) . . ?
C133 C134 C135 118.3(6) . . ?
C134 C135 C136 123.1(6) . . ?
C134 C135 C138 118.9(6) . . ?
C136 C135 C138 117.6(6) . . ?
C131 C136 C135 116.1(4) . . ?
C131 C136 C13E 127.4(4) . . ?
F132 C137 F131 127.2(13) . . ?
F132 C137 F133 100.5(14) . . ?
F131 C137 F133 98.8(8) . . ?
F132 C137 C133 106.5(11) . . ?
F131 C137 C133 112.1(7) . . ?
F133 C137 C133 109.8(9) . . ?
F135 C138 F134 102.8(13) . . ?
F135 C138 F136 107.3(13) . . ?
F134 C138 F136 108.6(10) . . ?
F135 C138 C135 113.6(11) . . ?
F134 C138 C135 114.1(8) . . ?
F136 C138 C135 110.0(7) . . ?
C13C C13B C131 125.2(9) . . ?
C13D C13C C13B 121.5(8) . . ?
C13D C13C C13G 120.3(8) . . ?
C13B C13C C13G 118.1(9) . . ?
C13C C13D C13E 119.4(7) . . ?
C13D C13E C136 114.7(6) . . ?
C13D C13E C13H 121.7(7) . . ?
C136 C13E C13H 123.4(7) . . ?
F13C C13G F13A 110.6(14) . . ?
F13C C13G C13C 122.0(13) . . ?
F13A C13G C13C 116.9(10) . . ?
F13C C13G F13B 100.8(15) . . ?
F13A C13G F13B 84.2(12) . . ?
C13C C13G F13B 115.0(10) . . ?
F13D C13H F13E 113.3(13) . . ?
F13D C13H F13F 105.9(12) . . ?
F13E C13H F13F 105.3(12) . . ?
F13D C13H C13E 113.0(8) . . ?
F13E C13H C13E 111.1(11) . . ?
F13F C13H C13E 107.7(10) . . ?
C131 B C111 112.8(2) . . ?
C131 B C101 103.8(2) . . ?
C111 B C101 111.1(2) . . ?
C131 B C121 112.4(2) . . ?
C111 B C121 103.0(2) . . ?
C101 B C121 114.0(2) . . ?
C12S C11S C16S 120.0 . . ?
C12S C11S C17S 118.3(12) . . ?
C16S C11S C17S 121.1(12) . . ?
C13S C12S C11S 120.0 . . ?
C14S C13S C12S 120.0 . . ?
C14S C13S C18S 112.4(12) . . ?
C12S C13S C18S 127.5(12) . . ?
C13S C14S C15S 120.0 . . ?
C16S C15S C14S 120.0 . . ?
C16S C15S C19S 118.3(12) . . ?
C14S C15S C19S 121.6(12) . . ?
C15S C16S C11S 120.0 . . ?
C22S C21S C26S 120.0 . . ?
C22S C21S C27S 119.9(5) . . ?
C26S C21S C27S 120.1(5) . . ?
C21S C22S C23S 120.0 . . ?
C22S C23S C24S 120.0 . . ?
C22S C23S C28S 121.4(5) . . ?
C24S C23S C28S 118.6(5) . . ?
C25S C24S C23S 120.0 . . ?
C24S C25S C26S 120.0 . . ?
C24S C25S C29S 118.9(5) . . ?
C26S C25S C29S 121.1(5) . . ?
C25S C26S C21S 120.0 . . ?
C32S C31S C36S 120.0 . . ?
C32S C31S C37S 115.4(6) . . ?
C36S C31S C37S 124.6(6) . . ?
C33S C32S C31S 120.0 . . ?
C34S C33S C32S 120.0 . . ?
C34S C33S C38S 115.0(6) . . ?
C32S C33S C38S 124.9(6) . . ?
C33S C34S C35S 120.0 . . ?
C34S C35S C36S 120.0 . . ?
C34S C35S C39S 116.0(6) . . ?
C36S C35S C39S 123.9(6) . . ?
C35S C36S C31S 120.0 . . ?

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
C2 N1 C1 N2 -0.3(3) . . . . ?
C4 N1 C1 N2 179.0(2) . . . . ?
C2 N1 C1 Ag -179.6(2) . . . . ?
C4 N1 C1 Ag -0.3(4) . . . . ?
C3 N2 C1 N1 0.3(3) . . . . ?
C5 N2 C1 N1 165.6(2) . . . . ?
C3 N2 C1 Ag 179.5(2) . . . . ?
C5 N2 C1 Ag -15.1(4) . . . . ?
C72 Ag C1 N1 25.2(10) . . . . ?
C71 Ag C1 N1 -77.3(4) . . . . ?
C73 Ag C1 N1 123.8(3) . . . . ?
C72 Ag C1 N2 -153.9(9) . . . . ?
C71 Ag C1 N2 103.6(4) . . . . ?
C73 Ag C1 N2 -55.4(4) . . . . ?
C1 N1 C2 C3 0.2(3) . . . . ?
C4 N1 C2 C3 -179.1(2) . . . . ?
N1 C2 C3 N2 0.0(3) . . . . ?
C1 N2 C3 C2 -0.1(4) . . . . ?
C5 N2 C3 C2 -165.0(3) . . . . ?
C1 N1 C4 C21 -175.9(2) . . . . ?
C2 N1 C4 C21 3.3(3) . . . . ?
C1 N1 C4 C31 67.3(3) . . . . ?
C2 N1 C4 C31 -113.4(3) . . . . ?
C1 N1 C4 C11 -54.8(3) . . . . ?
C2 N1 C4 C11 124.4(3) . . . . ?
C1 N2 C5 C41 62.7(4) . . . . ?
C3 N2 C5 C41 -134.1(3) . . . . ?
C1 N2 C5 C61 -61.4(3) . . . . ?
C3 N2 C5 C61 101.8(3) . . . . ?
C1 N2 C5 C51 178.1(3) . . . . ?
C3 N2 C5 C51 -18.7(4) . . . . ?
N1 C4 C11 C16 132.0(3) . . . . ?
C21 C4 C11 C16 -109.4(3) . . . . ?
C31 C4 C11 C16 11.7(4) . . . . ?
N1 C4 C11 C12 -47.3(3) . . . . ?
C21 C4 C11 C12 71.3(3) . . . . ?
C31 C4 C11 C12 -167.6(2) . . . . ?
C16 C11 C12 C13 0.5(5) . . . . ?
C4 C11 C12 C13 179.9(3) . . . . ?
C11 C12 C13 C14 0.2(5) . . . . ?
C12 C13 C14 C15 -0.5(6) . . . . ?
C13 C14 C15 C16 0.1(5) . . . . ?
C12 C11 C16 C15 -1.0(4) . . . . ?
C4 C11 C16 C15 179.7(3) . . . . ?
C14 C15 C16 C11 0.7(5) . . . . ?
N1 C4 C21 C26 110.3(3) . . . . ?
C31 C4 C21 C26 -130.9(2) . . . . ?
C11 C4 C21 C26 -6.4(3) . . . . ?
N1 C4 C21 C22 -71.3(3) . . . . ?
C31 C4 C21 C22 47.5(3) . . . . ?
C11 C4 C21 C22 172.0(2) . . . . ?
C26 C21 C22 C23 -1.2(4) . . . . ?
C4 C21 C22 C23 -179.7(2) . . . . ?
C21 C22 C23 C24 0.6(4) . . . . ?
C22 C23 C24 C25 0.6(4) . . . . ?
C23 C24 C25 C26 -1.1(4) . . . . ?
C22 C21 C26 C25 0.7(4) . . . . ?
C4 C21 C26 C25 179.1(2) . . . . ?
C24 C25 C26 C21 0.5(4) . . . . ?
N1 C4 C31 C32 -1.4(4) . . . . ?
C21 C4 C31 C32 -119.5(3) . . . . ?
C11 C4 C31 C32 116.2(3) . . . . ?
N1 C4 C31 C36 173.5(2) . . . . ?
C21 C4 C31 C36 55.5(3) . . . . ?
C11 C4 C31 C36 -68.8(3) . . . . ?
C36 C31 C32 C33 2.5(5) . . . . ?
C4 C31 C32 C33 177.4(3) . . . . ?
C31 C32 C33 C34 -0.9(6) . . . . ?
C32 C33 C34 C35 -0.5(6) . . . . ?
C33 C34 C35 C36 0.2(6) . . . . ?
C34 C35 C36 C31 1.5(5) . . . . ?
C32 C31 C36 C35 -2.8(4) . . . . ?
C4 C31 C36 C35 -178.1(3) . . . . ?
N2 C5 C41 C42 12.4(4) . . . . ?
C61 C5 C41 C42 129.6(3) . . . . ?
C51 C5 C41 C42 -104.1(4) . . . . ?
N2 C5 C41 C46 -175.8(3) . . . . ?
C61 C5 C41 C46 -58.6(4) . . . . ?
C51 C5 C41 C46 67.6(4) . . . . ?
C46 C41 C42 C43 2.5(6) . . . . ?
C5 C41 C42 C43 174.2(4) . . . . ?
C41 C42 C43 C44 0.3(7) . . . . ?
C42 C43 C44 C45 -1.6(8) . . . . ?
C43 C44 C45 C46 0.2(8) . . . . ?
C44 C45 C46 C41 2.7(7) . . . . ?
C42 C41 C46 C45 -4.0(6) . . . . ?
C5 C41 C46 C45 -176.1(4) . . . . ?
N2 C5 C51 C52 -63.9(4) . . . . ?
C41 C5 C51 C52 54.9(4) . . . . ?
C61 C5 C51 C52 -177.9(3) . . . . ?
N2 C5 C51 C56 119.2(3) . . . . ?
C41 C5 C51 C56 -122.0(3) . . . . ?
C61 C5 C51 C56 5.2(5) . . . . ?
C56 C51 C52 C53 -1.8(6) . . . . ?
C5 C51 C52 C53 -178.8(4) . . . . ?
C51 C52 C53 C54 0.1(7) . . . . ?
C52 C53 C54 C55 1.1(7) . . . . ?
C53 C54 C55 C56 -0.6(7) . . . . ?
C52 C51 C56 C55 2.2(6) . . . . ?
C5 C51 C56 C55 179.1(3) . . . . ?
C54 C55 C56 C51 -1.1(7) . . . . ?
N2 C5 C61 C62 117.3(3) . . . . ?
C41 C5 C61 C62 -4.0(5) . . . . ?
C51 C5 C61 C62 -126.2(4) . . . . ?
N2 C5 C61 C66 -56.2(3) . . . . ?
C41 C5 C61 C66 -177.5(3) . . . . ?
C51 C5 C61 C66 60.3(4) . . . . ?
C66 C61 C62 C63 -1.9(6) . . . . ?
C5 C61 C62 C63 -175.4(4) . . . . ?
C61 C62 C63 C64 0.9(8) . . . . ?
C62 C63 C64 C65 0.4(8) . . . . ?
C63 C64 C65 C66 -0.6(8) . . . . ?
C64 C65 C66 C61 -0.4(7) . . . . ?
C62 C61 C66 C65 1.6(6) . . . . ?
C5 C61 C66 C65 175.5(3) . . . . ?
C1 Ag C71 C76 -86.2(5) . . . . ?
C72 Ag C71 C76 114.9(5) . . . . ?
C73 Ag C71 C76 81.9(4) . . . . ?
C1 Ag C71 C72 158.9(3) . . . . ?
C73 Ag C71 C72 -33.0(3) . . . . ?
C1 Ag C71 C77 44.9(5) . . . . ?
C72 Ag C71 C77 -114.0(5) . . . . ?
C73 Ag C71 C77 -147.0(4) . . . . ?
C76 C71 C72 C73 1.4(6) . . . . ?
C77 C71 C72 C73 -174.7(4) . . . . ?
Ag C71 C72 C73 89.4(4) . . . . ?
C76 C71 C72 Ag -88.1(4) . . . . ?
C77 C71 C72 Ag 95.8(4) . . . . ?
C1 Ag C72 C73 117.5(8) . . . . ?
C71 Ag C72 C73 -121.5(4) . . . . ?
C1 Ag C72 C71 -121.0(8) . . . . ?
C73 Ag C72 C71 121.5(4) . . . . ?
C71 C72 C73 C74 -2.2(6) . . . . ?
Ag C72 C73 C74 86.2(4) . . . . ?
C71 C72 C73 C78 174.6(4) . . . . ?
Ag C72 C73 C78 -97.0(5) . . . . ?
C71 C72 C73 Ag -88.4(4) . . . . ?
C1 Ag C73 C72 -158.3(3) . . . . ?
C71 Ag C73 C72 33.5(3) . . . . ?
C1 Ag C73 C74 84.8(4) . . . . ?
C72 Ag C73 C74 -117.0(5) . . . . ?
C71 Ag C73 C74 -83.4(4) . . . . ?
C1 Ag C73 C78 -43.5(6) . . . . ?
C72 Ag C73 C78 114.7(6) . . . . ?
C71 Ag C73 C78 148.3(5) . . . . ?
C72 C73 C74 C75 1.7(7) . . . . ?
C78 C73 C74 C75 -175.1(5) . . . . ?
Ag C73 C74 C75 62.2(5) . . . . ?
C73 C74 C75 C76 -0.5(7) . . . . ?
C73 C74 C75 C79 178.6(5) . . . . ?
C74 C75 C76 C71 -0.4(7) . . . . ?
C79 C75 C76 C71 -179.4(5) . . . . ?
C72 C71 C76 C75 -0.1(6) . . . . ?
C77 C71 C76 C75 175.9(5) . . . . ?
Ag C71 C76 C75 -62.2(5) . . . . ?
C106 C101 C102 C103 2.7(4) . . . . ?
B C101 C102 C103 179.0(3) . . . . ?
C101 C102 C103 C104 -1.7(4) . . . . ?
C101 C102 C103 C107 179.3(3) . . . . ?
C102 C103 C104 C105 -0.5(4) . . . . ?
C107 C103 C104 C105 178.6(3) . . . . ?
C103 C104 C105 C106 1.4(4) . . . . ?
C103 C104 C105 C108 -180.0(3) . . . . ?
C104 C105 C106 C101 -0.4(4) . . . . ?
C108 C105 C106 C101 -178.9(3) . . . . ?
C102 C101 C106 C105 -1.7(4) . . . . ?
B C101 C106 C105 -178.2(3) . . . . ?
C104 C103 C107 F103 155.4(3) . . . . ?
C102 C103 C107 F103 -25.5(4) . . . . ?
C104 C103 C107 F102 33.9(4) . . . . ?
C102 C103 C107 F102 -147.0(3) . . . . ?
C104 C103 C107 F101 -84.7(4) . . . . ?
C102 C103 C107 F101 94.4(3) . . . . ?
C104 C105 C108 F106 -84.8(5) . . . . ?
C106 C105 C108 F106 93.8(5) . . . . ?
C104 C105 C108 F104 36.2(5) . . . . ?
C106 C105 C108 F104 -145.2(3) . . . . ?
C104 C105 C108 F105 153.4(3) . . . . ?
C106 C105 C108 F105 -28.0(4) . . . . ?
C116 C111 C112 C113 -0.5(4) . . . . ?
B C111 C112 C113 -174.1(2) . . . . ?
C111 C112 C113 C114 -0.2(4) . . . . ?
C111 C112 C113 C117 -179.3(2) . . . . ?
C112 C113 C114 C115 0.9(4) . . . . ?
C117 C113 C114 C115 180.0(2) . . . . ?
C113 C114 C115 C116 -0.7(4) . . . . ?
C113 C114 C115 C118 180.0(3) . . . . ?
C112 C111 C116 C115 0.6(4) . . . . ?
B C111 C116 C115 174.2(2) . . . . ?
C114 C115 C116 C111 0.0(4) . . . . ?
C118 C115 C116 C111 179.2(3) . . . . ?
C114 C113 C117 F113 -179.3(3) . . . . ?
C112 C113 C117 F113 -0.2(4) . . . . ?
C114 C113 C117 F111 -58.6(3) . . . . ?
C112 C113 C117 F111 120.5(3) . . . . ?
C114 C113 C117 F112 58.4(3) . . . . ?
C112 C113 C117 F112 -122.5(3) . . . . ?
C114 C115 C118 F115 97.1(5) . . . . ?
C116 C115 C118 F115 -82.1(5) . . . . ?
C114 C115 C118 F114 -141.5(4) . . . . ?
C116 C115 C118 F114 39.2(5) . . . . ?
C114 C115 C118 F116 -23.2(5) . . . . ?
C116 C115 C118 F116 157.6(4) . . . . ?
C126 C121 C122 C123 3.0(4) . . . . ?
B C121 C122 C123 176.5(2) . . . . ?
C121 C122 C123 C124 -3.0(4) . . . . ?
C121 C122 C123 C127 176.9(3) . . . . ?
C122 C123 C124 C125 0.7(4) . . . . ?
C127 C123 C124 C125 -179.3(3) . . . . ?
C123 C124 C125 C126 1.5(5) . . . . ?
C123 C124 C125 C128 -178.4(4) . . . . ?
C122 C121 C126 C125 -0.7(4) . . . . ?
B C121 C126 C125 -174.2(3) . . . . ?
C124 C125 C126 C121 -1.5(5) . . . . ?
C128 C125 C126 C121 178.4(4) . . . . ?
C124 C123 C127 F12C -153.5(10) . . . . ?
C122 C123 C127 F12C 26.5(10) . . . . ?
C124 C123 C127 F12B -26.6(15) . . . . ?
C122 C123 C127 F12B 153.4(15) . . . . ?
C124 C123 C127 F122 173.7(10) . . . . ?
C122 C123 C127 F122 -6.3(10) . . . . ?
C124 C123 C127 F123 44.1(12) . . . . ?
C122 C123 C127 F123 -135.8(12) . . . . ?
C124 C123 C127 F12A 91.9(10) . . . . ?
C122 C123 C127 F12A -88.1(10) . . . . ?
C124 C123 C127 F121 -71.3(8) . . . . ?
C122 C123 C127 F121 108.8(8) . . . . ?
C27S F12F C128 F12D -90(3) 2_667 . . . ?
C27S F12F C128 F12E 151(2) 2_667 . . . ?
C27S F12F C128 C125 33(3) 2_667 . . . ?
C124 C125 C128 F124 88.0(17) . . . . ?
C126 C125 C128 F124 -91.8(17) . . . . ?
C124 C125 C128 F125 -147.3(13) . . . . ?
C126 C125 C128 F125 32.9(14) . . . . ?
C124 C125 C128 F12D -116.8(14) . . . . ?
C126 C125 C128 F12D 63.3(15) . . . . ?
C124 C125 C128 F12E 15.3(10) . . . . ?
C126 C125 C128 F12E -164.6(8) . . . . ?
C124 C125 C128 F126 -34.3(12) . . . . ?
C126 C125 C128 F126 145.9(10) . . . . ?
C124 C125 C128 F12F 122.6(10) . . . . ?
C126 C125 C128 F12F -57.3(11) . . . . ?
C136 C131 C132 C133 1.3(9) . . . . ?
B C131 C132 C133 -170.4(6) . . . . ?
C131 C132 C133 C134 3.9(11) . . . . ?
C131 C132 C133 C137 -178.2(6) . . . . ?
C132 C133 C134 C135 0.1(11) . . . . ?
C137 C133 C134 C135 -177.8(7) . . . . ?
C133 C134 C135 C136 -9.7(11) . . . . ?
C133 C134 C135 C138 177.5(7) . . . . ?
C132 C131 C136 C135 -10.0(7) . . . . ?
B C131 C136 C135 161.2(4) . . . . ?
C13B C131 C136 C13E 13.2(8) . . . . ?
B C131 C136 C13E -172.7(5) . . . . ?
C134 C135 C136 C131 14.6(9) . . . . ?
C138 C135 C136 C131 -172.6(6) . . . . ?
C134 C133 C137 F132 66.7(15) . . . . ?
C132 C133 C137 F132 -111.2(15) . . . . ?
C134 C133 C137 F131 -150.0(7) . . . . ?
C132 C133 C137 F131 32.1(11) . . . . ?
C134 C133 C137 F133 -41.3(10) . . . . ?
C132 C133 C137 F133 140.9(9) . . . . ?
C134 C135 C138 F135 49.6(16) . . . . ?
C136 C135 C138 F135 -123.6(14) . . . . ?
C134 C135 C138 F134 167.0(9) . . . . ?
C136 C135 C138 F134 -6.2(12) . . . . ?
C134 C135 C138 F136 -70.7(11) . . . . ?
C136 C135 C138 F136 116.1(10) . . . . ?
C136 C131 C13B C13C -1.9(11) . . . . ?
B C131 C13B C13C -175.6(7) . . . . ?
C131 C13B C13C C13D -3.8(14) . . . . ?
C131 C13B C13C C13G 176.4(8) . . . . ?
C13B C13C C13D C13E -0.9(12) . . . . ?
C13G C13C C13D C13E 178.9(8) . . . . ?
C13C C13D C13E C136 10.3(11) . . . . ?
C13C C13D C13E C13H -175.7(8) . . . . ?
C131 C136 C13E C13D -17.8(10) . . . . ?
C131 C136 C13E C13H 168.3(7) . . . . ?
C13D C13C C13G F13C -5(2) . . . . ?
C13B C13C C13G F13C 175.2(17) . . . . ?
C13D C13C C13G F13A -145.9(13) . . . . ?
C13B C13C C13G F13A 33.8(16) . . . . ?
C13D C13C C13G F13B 117.7(11) . . . . ?
C13B C13C C13G F13B -62.6(13) . . . . ?
C13D C13E C13H F13D 131.3(11) . . . . ?
C136 C13E C13H F13D -55.2(14) . . . . ?
C13D C13E C13H F13E 2.7(14) . . . . ?
C136 C13E C13H F13E 176.2(10) . . . . ?
C13D C13E C13H F13F -112.1(11) . . . . ?
C136 C13E C13H F13F 61.4(13) . . . . ?
C136 C131 B C111 28.7(4) . . . . ?
C13B C131 B C111 -158.3(6) . . . . ?
C132 C131 B C111 -159.8(4) . . . . ?
C136 C131 B C101 -91.7(4) . . . . ?
C13B C131 B C101 81.3(6) . . . . ?
C132 C131 B C101 79.8(4) . . . . ?
C136 C131 B C121 144.6(3) . . . . ?
C13B C131 B C121 -42.4(6) . . . . ?
C132 C131 B C121 -43.9(5) . . . . ?
C112 C111 B C131 -143.2(2) . . . . ?
C116 C111 B C131 43.6(3) . . . . ?
C112 C111 B C101 -27.1(3) . . . . ?
C116 C111 B C101 159.7(2) . . . . ?
C112 C111 B C121 95.4(3) . . . . ?
C116 C111 B C121 -77.8(3) . . . . ?
C102 C101 B C131 -103.4(3) . . . . ?
C106 C101 B C131 72.8(3) . . . . ?
C102 C101 B C111 135.0(3) . . . . ?
C106 C101 B C111 -48.7(3) . . . . ?
C102 C101 B C121 19.2(4) . . . . ?
C106 C101 B C121 -164.6(2) . . . . ?
C126 C121 B C131 -29.9(3) . . . . ?
C122 C121 B C131 157.0(2) . . . . ?
C126 C121 B C111 91.8(3) . . . . ?
C122 C121 B C111 -81.3(3) . . . . ?
C126 C121 B C101 -147.7(2) . . . . ?
C122 C121 B C101 39.2(3) . . . . ?
C16S C11S C12S C13S 0.0 . . . . ?
C17S C11S C12S C13S 171.7(14) . . . . ?
C11S C12S C13S C14S 0.0 . . . . ?
C11S C12S C13S C18S -175.1(15) . . . . ?
C12S C13S C14S C15S 0.0 . . . . ?
C18S C13S C14S C15S 175.8(13) . . . . ?
C13S C14S C15S C16S 0.0 . . . . ?
C13S C14S C15S C19S 179.5(14) . . . . ?
C14S C15S C16S C11S 0.0 . . . . ?
C19S C15S C16S C11S -179.6(13) . . . . ?
C12S C11S C16S C15S 0.0 . . . . ?
C17S C11S C16S C15S -171.4(14) . . . . ?
C26S C21S C22S C23S 0.0 . . . . ?
C27S C21S C22S C23S 180.0 . . . . ?
C21S C22S C23S C24S 0.0 . . . . ?
C21S C22S C23S C28S 180.0 . . . . ?
C22S C23S C24S C25S 0.0 . . . . ?
C28S C23S C24S C25S 180.0 . . . . ?
C23S C24S C25S C26S 0.0 . . . . ?
C23S C24S C25S C29S 180.0 . . . . ?
C24S C25S C26S C21S 0.0 . . . . ?
C29S C25S C26S C21S 180.0 . . . . ?
C22S C21S C26S C25S 0.0 . . . . ?
C27S C21S C26S C25S 180.0 . . . . ?
C22S C21S C27S F12F 91.6(9) . . . 2_667 ?
C26S C21S C27S F12F -88.4(9) . . . 2_667 ?
C36S C31S C32S C33S 0.0 . . . . ?
C37S C31S C32S C33S -179.2(8) . . . . ?
C31S C32S C33S C34S 0.0 . . . . ?
C31S C32S C33S C38S 178.9(8) . . . . ?
C32S C33S C34S C35S 0.0 . . . . ?
C38S C33S C34S C35S -179.0(7) . . . . ?
C33S C34S C35S C36S 0.0 . . . . ?
C33S C34S C35S C39S -177.0(7) . . . . ?
C34S C35S C36S C31S 0.0 . . . . ?
C39S C35S C36S C31S 176.7(8) . . . . ?
C32S C31S C36S C35S 0.0 . . . . ?
C37S C31S C36S C35S 179.1(9) . . . . ?

_refine_diff_density_max         0.825
_refine_diff_density_min         -0.909
_refine_diff_density_rms         0.075

####################################################################### 
# 
# 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_riv17d7
_database_code_depnum_ccdc_archive 'CCDC 1583286'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         
'C32 H12 B F24, C43.80 H35.80 Ag Cl1.40 N2, C H2 Cl2'
_chemical_formula_sum            'C76.80 H49.80 Ag B Cl3.40 F24 N2'
_chemical_formula_weight         1695.79

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'
B B 0.0090 0.0039 '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'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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. 
;

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

_cell_length_a                   15.3180(3)
_cell_length_b                   25.8009(5)
_cell_length_c                   18.7754(4)
_cell_angle_alpha                90
_cell_angle_beta                 101.5004(12)
_cell_angle_gamma                90
_cell_volume                     7271.4(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9852
_cell_measurement_theta_min      3.41
_cell_measurement_theta_max      71.77

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.549
_exptl_crystal_F_000             3402
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.276
_exptl_crystal_size_mid          0.126
_exptl_crystal_size_min          0.072
_exptl_absorpt_coefficient_mu    4.329
_shelx_estimated_absorpt_T_min   0.381
_shelx_estimated_absorpt_T_max   0.746
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.8010
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            50317
_diffrn_reflns_av_unetI/netI     0.0387
_diffrn_reflns_av_R_equivalents  0.0464
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         2.950
_diffrn_reflns_theta_max         72.553
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             14382
_reflns_number_gt                11638
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick 2015)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1126P)²+7.3244P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         14382
_refine_ls_number_parameters     1062
_refine_ls_number_restraints     55
_refine_ls_R_factor_all          0.0799
_refine_ls_R_factor_gt           0.0689
_refine_ls_wR_factor_ref         0.2056
_refine_ls_wR_factor_gt          0.1956
_refine_ls_goodness_of_fit_ref   1.081
_refine_ls_restrained_S_all      1.091
_refine_ls_shift/su_max          0.009
_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_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
Ag Ag 0.71918(2) 0.47802(2) 0.77151(2) 0.05906(13) Uani 1 1 d . . . . .
N1 N 0.86952(19) 0.55394(11) 0.74997(16) 0.0388(6) Uani 1 1 d . . . . .
N2 N 0.76482(19) 0.55349(11) 0.65424(15) 0.0367(6) Uani 1 1 d . . . . .
C1 C 0.7883(2) 0.53322(13) 0.72217(18) 0.0357(7) Uani 1 1 d . . . . .
C2 C 0.8960(3) 0.58614(16) 0.6998(2) 0.0502(9) Uani 1 1 d . . . . .
H2 H 0.950208 0.605116 0.706490 0.060 Uiso 1 1 calc R U . . .
C3 C 0.8312(3) 0.58591(16) 0.6394(2) 0.0499(9) Uani 1 1 d . . . . .
H3 H 0.831038 0.604293 0.595585 0.060 Uiso 1 1 calc R U . . .
C4 C 0.9190(2) 0.54135(14) 0.82555(19) 0.0405(7) Uani 1 1 d . . . . .
C5 C 0.6780(2) 0.54051(14) 0.60505(18) 0.0364(7) Uani 1 1 d . . . . .
C11A C 0.8508(6) 0.5446(4) 0.8775(5) 0.0401(17) Uani 0.7 1 d . . P A 1
C12A C 0.8354(4) 0.5056(4) 0.9252(3) 0.0486(14) Uani 0.7 1 d . . P A 1
H12A H 0.869062 0.474469 0.928920 0.058 Uiso 0.7 1 calc R U P A 1
C13A C 0.7711(5) 0.5121(4) 0.9674(4) 0.068(2) Uani 0.7 1 d . . P A 1
H13A H 0.760347 0.485389 0.999404 0.081 Uiso 0.7 1 calc R U P A 1
C14A C 0.7225(5) 0.5582(5) 0.9625(4) 0.076(3) Uani 0.7 1 d . . P A 1
H14A H 0.680342 0.563140 0.992739 0.091 Uiso 0.7 1 calc R U P A 1
C15A C 0.7348(5) 0.5972(5) 0.9139(4) 0.065(2) Uani 0.7 1 d . . P A 1
H15A H 0.700321 0.628089 0.909819 0.077 Uiso 0.7 1 calc R U P A 1
C16A C 0.7978(5) 0.5898(4) 0.8723(4) 0.0494(16) Uani 0.7 1 d . . P A 1
H16A H 0.806262 0.616072 0.838856 0.059 Uiso 0.7 1 calc R U P A 1
C11B C 0.8517(19) 0.5593(8) 0.8703(15) 0.044(7) Uiso 0.3 1 d . . P A 2
C12B C 0.8414(13) 0.5271(7) 0.9276(12) 0.050(5) Uiso 0.3 1 d . . P A 2
H12B H 0.872936 0.495234 0.934604 0.060 Uiso 0.3 1 calc R U P A 2
C13B C 0.7859(14) 0.5409(8) 0.9746(11) 0.068(5) Uiso 0.3 1 d . . P A 2
H13B H 0.779242 0.520562 1.015356 0.081 Uiso 0.3 1 calc R U P A 2
C14B C 0.7382(19) 0.5901(10) 0.9553(18) 0.086(7) Uiso 0.3 1 d . . P A 2
H14B H 0.697101 0.600792 0.984141 0.104 Uiso 0.3 1 calc R U P A 2
C15B C 0.748(2) 0.6198(11) 0.9021(17) 0.090(10) Uiso 0.3 1 d . . P A 2
H15B H 0.714894 0.651070 0.893155 0.108 Uiso 0.3 1 calc R U P A 2
C16B C 0.8063(15) 0.6060(8) 0.8585(12) 0.053(6) Uiso 0.3 1 d . . P A 2
H16B H 0.815408 0.628294 0.820403 0.063 Uiso 0.3 1 calc R U P A 2
C21 C 1.0001(3) 0.57810(15) 0.8457(2) 0.0473(9) Uani 1 1 d . . . . .
C22 C 1.0037(4) 0.6189(2) 0.8938(3) 0.0711(14) Uani 1 1 d . . . . .
H22 H 0.953992 0.626144 0.915426 0.085 Uiso 1 1 calc R U . . .
C23 C 1.0795(4) 0.6494(2) 0.9105(4) 0.0908(19) Uani 1 1 d . . . . .
H23 H 1.080699 0.677500 0.943434 0.109 Uiso 1 1 calc R U . . .
C24 C 1.1518(4) 0.6401(2) 0.8813(3) 0.0789(16) Uani 1 1 d . . . . .
H24 H 1.202810 0.661768 0.892968 0.095 Uiso 1 1 calc R U . . .
C25 C 1.1505(3) 0.59916(19) 0.8345(3) 0.0658(12) Uani 1 1 d . . . . .
H25 H 1.201533 0.591740 0.814632 0.079 Uiso 1 1 calc R U . . .
C26 C 1.0750(3) 0.56858(17) 0.8163(2) 0.0525(9) Uani 1 1 d . . . . .
H26 H 1.074428 0.540679 0.783170 0.063 Uiso 1 1 calc R U . . .
C31 C 0.9542(2) 0.48526(14) 0.8276(2) 0.0425(8) Uani 1 1 d . . . . .
C32 C 1.0116(3) 0.46840(17) 0.8905(3) 0.0553(10) Uani 1 1 d . . . . .
H32 H 1.028908 0.491780 0.929890 0.066 Uiso 1 1 calc R U . . .
C33 C 1.0439(4) 0.4179(2) 0.8965(3) 0.0702(14) Uani 1 1 d . . . . .
H33 H 1.082328 0.406902 0.940056 0.084 Uiso 1 1 calc R U . . .
C34 C 1.0206(4) 0.3842(2) 0.8400(4) 0.0743(15) Uani 1 1 d . . . . .
H34 H 1.041939 0.349553 0.844218 0.089 Uiso 1 1 calc R U . . .
C35 C 0.9662(4) 0.40055(18) 0.7770(3) 0.0681(13) Uani 1 1 d . . . . .
H35 H 0.951034 0.377230 0.737265 0.082 Uiso 1 1 calc R U . . .
C36 C 0.9327(3) 0.45121(16) 0.7704(2) 0.0509(9) Uani 1 1 d . . . . .
H36 H 0.895157 0.462073 0.726418 0.061 Uiso 1 1 calc R U . . .
C41 C 0.6002(2) 0.56594(13) 0.63311(19) 0.0388(7) Uani 1 1 d . . . . .
C42 C 0.5160(3) 0.56650(16) 0.5880(2) 0.0482(9) Uani 1 1 d . . . . .
H42 H 0.508186 0.552240 0.540462 0.058 Uiso 1 1 calc R U . . .
C43 C 0.4433(3) 0.58768(18) 0.6117(3) 0.0602(11) Uani 1 1 d . . . . .
H43 H 0.386387 0.587996 0.580347 0.072 Uiso 1 1 calc R U . . .
C44 C 0.4539(3) 0.60821(18) 0.6806(3) 0.0657(12) Uani 1 1 d . . . . .
H44 H 0.403675 0.621059 0.697608 0.079 Uiso 1 1 calc R U . . .
C45 C 0.5360(3) 0.61013(18) 0.7243(3) 0.0622(11) Uani 1 1 d . . . . .
H45 H 0.543332 0.625793 0.770892 0.075 Uiso 1 1 calc R U . . .
C46 C 0.6099(3) 0.58909(15) 0.7009(2) 0.0472(8) Uani 1 1 d . . . . .
H46 H 0.667114 0.590699 0.731812 0.057 Uiso 1 1 calc R U . . .
C51 C 0.6766(2) 0.56169(15) 0.52781(19) 0.0418(8) Uani 1 1 d . . . . .
C52 C 0.6777(3) 0.52973(17) 0.4689(2) 0.0501(9) Uani 1 1 d . . . . .
H52 H 0.684399 0.493368 0.475806 0.060 Uiso 1 1 calc R U . . .
C53 C 0.6690(3) 0.5507(2) 0.3989(2) 0.0629(12) Uani 1 1 d . . . . .
H53 H 0.668828 0.528396 0.358579 0.075 Uiso 1 1 calc R U . . .
C54 C 0.6607(3) 0.6031(2) 0.3883(2) 0.0627(12) Uani 1 1 d . . . . .
H54 H 0.655638 0.617133 0.340892 0.075 Uiso 1 1 calc R U . . .
C55 C 0.6598(3) 0.63520(19) 0.4459(2) 0.0572(10) Uani 1 1 d . . . . .
H55 H 0.654203 0.671561 0.438404 0.069 Uiso 1 1 calc R U . . .
C56 C 0.6670(3) 0.61503(16) 0.5156(2) 0.0496(9) Uani 1 1 d . . . . .
H56 H 0.665414 0.637700 0.555187 0.060 Uiso 1 1 calc R U . . .
C61 C 0.6714(2) 0.48068(13) 0.60471(18) 0.0374(7) Uani 1 1 d . . . . .
C62 C 0.5955(3) 0.45434(15) 0.6142(2) 0.0455(8) Uani 1 1 d . . . . .
H62 H 0.544465 0.473316 0.620706 0.055 Uiso 1 1 calc R U . . .
C63 C 0.5933(3) 0.40008(17) 0.6144(3) 0.0607(11) Uani 1 1 d . . . . .
H63 H 0.540785 0.382425 0.620175 0.073 Uiso 1 1 calc R U . . .
C64 C 0.6675(3) 0.37231(17) 0.6060(3) 0.0632(12) Uani 1 1 d . . . . .
H64 H 0.666527 0.335505 0.607011 0.076 Uiso 1 1 calc R U . . .
C65 C 0.7428(3) 0.39810(17) 0.5963(3) 0.0605(11) Uani 1 1 d . . . . .
H65 H 0.793730 0.378967 0.589975 0.073 Uiso 1 1 calc R U . . .
C66 C 0.7450(3) 0.45167(16) 0.5958(2) 0.0491(9) Uani 1 1 d . . . . .
H66 H 0.797625 0.468944 0.589156 0.059 Uiso 1 1 calc R U . . .
Cl1 Cl 0.65418(19) 0.40116(11) 0.82583(15) 0.1081(9) Uani 0.7 1 d D . P B 1
Cl2 Cl 0.5315(2) 0.48716(12) 0.8014(3) 0.1378(14) Uani 0.7 1 d D . P B 1
C7 C 0.5439(9) 0.4234(5) 0.8144(9) 0.135(5) Uani 0.7 1 d D . P B 1
H7A H 0.507503 0.405247 0.772248 0.162 Uiso 0.7 1 calc R U P B 1
H7B H 0.520279 0.413731 0.857977 0.162 Uiso 0.7 1 calc R U P B 1
C71 C 0.6459(12) 0.4394(8) 0.8722(9) 0.126(4) Uiso 0.3 1 d G U P B 2
C72 C 0.7074(13) 0.4257(8) 0.9342(8) 0.126(4) Uiso 0.3 1 d DG U P B 2
H72 H 0.703534 0.440321 0.979831 0.151 Uiso 0.3 1 calc R U P B 2
C73 C 0.7747(12) 0.3905(8) 0.9293(10) 0.126(4) Uiso 0.3 1 d G U P B 2
H73 H 0.816789 0.381075 0.971682 0.151 Uiso 0.3 1 calc R U P B 2
C74 C 0.7804(12) 0.3690(7) 0.8625(12) 0.126(4) Uiso 0.3 1 d G U P B 2
H74 H 0.826391 0.344960 0.859178 0.151 Uiso 0.3 1 calc R U P B 2
C75 C 0.7188(14) 0.3828(8) 0.8005(9) 0.126(4) Uiso 0.3 1 d G U P B 2
H75 H 0.722738 0.368090 0.754823 0.151 Uiso 0.3 1 calc R U P B 2
C76 C 0.6516(13) 0.4179(8) 0.8053(8) 0.126(4) Uiso 0.3 1 d DG U P B 2
H76 H 0.609481 0.427336 0.762971 0.151 Uiso 0.3 1 calc R U P B 2
C77 C 0.5629(15) 0.4683(12) 0.8790(14) 0.126(4) Uiso 0.3 1 d D U P B 2
H77A H 0.527057 0.474857 0.830456 0.151 Uiso 0.3 1 calc R U P B 2
H77B H 0.528242 0.447532 0.907162 0.151 Uiso 0.3 1 calc R U P B 2
H77C H 0.579153 0.501363 0.903767 0.151 Uiso 0.3 1 calc R U P B 2
F91 F 0.6530(3) 0.20390(15) -0.0668(2) 0.1128(14) Uani 1 1 d . . . . .
F92 F 0.7738(3) 0.24396(17) -0.0366(2) 0.1077(13) Uani 1 1 d . . . . .
F93 F 0.6678(5) 0.27928(17) -0.10975(18) 0.158(3) Uani 1 1 d . . . . .
F94A F 0.4871(4) 0.4023(2) 0.0968(4) 0.122(2) Uani 0.85 1 d D . P C 1
F95A F 0.6129(4) 0.43131(17) 0.0957(7) 0.188(4) Uani 0.85 1 d D . P C 1
F96A F 0.5159(6) 0.4128(2) -0.0010(3) 0.152(3) Uani 0.85 1 d D . P C 1
F94B F 0.5957(13) 0.4283(7) 0.0233(10) 0.058(4) Uiso 0.15 1 d D . P C 2
F95B F 0.4768(11) 0.4081(11) 0.0500(19) 0.092(8) Uiso 0.15 1 d D . P C 2
F96B F 0.572(2) 0.4190(11) 0.1297(10) 0.094(8) Uiso 0.15 1 d D . P C 2
F81 F 0.6344(4) 0.2819(2) 0.4862(2) 0.142(2) Uani 1 1 d . . . . .
F82 F 0.5005(4) 0.2767(2) 0.4948(2) 0.150(2) Uani 1 1 d . . . . .
F83 F 0.5767(5) 0.20968(19) 0.4906(2) 0.156(2) Uani 1 1 d . . . . .
F84A F 0.3144(3) 0.2944(3) 0.1856(4) 0.120(2) Uani 0.775 1 d . . P D 1
F85A F 0.2768(4) 0.2733(5) 0.2805(5) 0.172(4) Uani 0.775 1 d . . P D 1
F86A F 0.2986(5) 0.2171(3) 0.2022(8) 0.196(5) Uani 0.775 1 d . . P D 1
F84B F 0.2869(18) 0.2144(11) 0.2588(12) 0.108(7) Uiso 0.225 1 d . . P D 2
F85B F 0.3086(12) 0.2498(9) 0.1635(10) 0.088(4) Uiso 0.225 1 d . . P D 2
F86B F 0.2775(16) 0.2930(8) 0.2504(12) 0.095(6) Uiso 0.225 1 d . . P D 2
F111 F 1.06411(19) 0.26798(15) 0.2479(2) 0.0959(11) Uani 1 1 d . . . . .
F112 F 0.9763(2) 0.2272(2) 0.1630(3) 0.1227(17) Uani 1 1 d . . . . .
F113 F 1.0169(3) 0.19389(16) 0.2680(4) 0.148(2) Uani 1 1 d . . . . .
F114 F 0.8117(3) 0.37080(15) 0.4209(2) 0.1051(13) Uani 1 1 d . . . . .
F115 F 0.9310(3) 0.3911(2) 0.3898(3) 0.152(2) Uani 1 1 d . . . . .
F116 F 0.8083(5) 0.41423(14) 0.3283(2) 0.157(2) Uani 1 1 d . . . . .
F11A F 0.7276(4) 0.0308(3) 0.3553(3) 0.123(2) Uani 0.8 1 d D . P E 1
F12A F 0.8065(5) 0.0152(2) 0.2826(2) 0.118(2) Uani 0.8 1 d D . P E 1
F13A F 0.8338(4) 0.07980(17) 0.3517(4) 0.132(3) Uani 0.8 1 d D . P E 1
F11B F 0.8508(9) 0.0608(8) 0.2996(10) 0.079(4) Uiso 0.2 1 d D . P E 2
F12B F 0.7682(13) 0.0711(7) 0.3733(7) 0.070(4) Uiso 0.2 1 d D . P E 2
F13B F 0.7557(14) 0.0077(5) 0.3112(12) 0.084(5) Uiso 0.2 1 d D . P E 2
F14 F 0.4606(2) 0.08454(18) 0.0702(2) 0.1166(15) Uani 1 1 d . . . . .
F15 F 0.5684(3) 0.0707(3) 0.0241(2) 0.150(2) Uani 1 1 d . . . . .
F16 F 0.5311(5) 0.01690(15) 0.0931(4) 0.205(4) Uani 1 1 d . . . . .
C81 C 0.5800(3) 0.24635(14) 0.2646(2) 0.0440(8) Uani 1 1 d . . . . .
C82 C 0.5992(3) 0.24841(15) 0.3408(2) 0.0486(9) Uani 1 1 d . . . . .
H82 H 0.659410 0.245367 0.365542 0.058 Uiso 1 1 calc R U . . .
C83 C 0.5329(4) 0.25479(16) 0.3817(3) 0.0577(11) Uani 1 1 d . . . . .
C84 C 0.4452(4) 0.25751(18) 0.3486(3) 0.0650(13) Uani 1 1 d . . . . .
H84 H 0.400296 0.261325 0.376627 0.078 Uiso 1 1 calc R U . . .
C85 C 0.4228(3) 0.25463(18) 0.2740(3) 0.0617(12) Uani 1 1 d . . . . .
C86 C 0.4887(3) 0.24937(16) 0.2327(3) 0.0520(9) Uani 1 1 d . . . . .
H86 H 0.471412 0.247774 0.181298 0.062 Uiso 1 1 calc R U . . .
C87 C 0.5602(5) 0.2551(2) 0.4627(3) 0.0820(18) Uani 1 1 d . . . . .
C88 C 0.3279(4) 0.2565(3) 0.2357(4) 0.0876(19) Uani 1 1 d . . . . .
C91 C 0.6349(2) 0.26545(14) 0.1380(2) 0.0400(7) Uani 1 1 d . . . . .
C92 C 0.6625(3) 0.24619(15) 0.0762(2) 0.0435(8) Uani 1 1 d . . . . .
H92 H 0.688141 0.212576 0.078291 0.052 Uiso 1 1 calc R U . . .
C93 C 0.6538(3) 0.27423(16) 0.0126(2) 0.0520(9) Uani 1 1 d . . . . .
C94 C 0.6181(3) 0.32383(17) 0.0075(2) 0.0564(10) Uani 1 1 d . . . . .
H94 H 0.611946 0.343132 -0.036332 0.068 Uiso 1 1 calc R U . . .
C95 C 0.5918(3) 0.34443(16) 0.0678(2) 0.0524(9) Uani 1 1 d . . . . .
C96 C 0.5997(3) 0.31567(15) 0.1312(2) 0.0457(8) Uani 1 1 d . . . . .
H96 H 0.580345 0.330673 0.171569 0.055 Uiso 1 1 calc R U . . .
C97 C 0.6866(5) 0.2511(2) -0.0504(3) 0.0766(17) Uani 1 1 d . . . . .
C98 C 0.5576(4) 0.3990(2) 0.0651(3) 0.0741(15) Uani 1 1 d D . . . .
C101 C 0.6583(2) 0.17177(14) 0.20788(19) 0.0393(7) Uani 1 1 d . . . . .
C102 C 0.7114(2) 0.14063(14) 0.25948(19) 0.0409(7) Uani 1 1 d . . . . .
H102 H 0.749594 0.156734 0.299443 0.049 Uiso 1 1 calc R U . . .
C103 C 0.7108(3) 0.08664(15) 0.2549(2) 0.0435(8) Uani 1 1 d . . . . .
C104 C 0.6554(3) 0.06148(15) 0.1978(2) 0.0469(8) Uani 1 1 d . . . . .
H104 H 0.654876 0.024754 0.194244 0.056 Uiso 1 1 calc R U . . .
C105 C 0.6011(3) 0.09142(15) 0.1467(2) 0.0479(9) Uani 1 1 d . . . . .
C106 C 0.6024(3) 0.14523(15) 0.1516(2) 0.0451(8) Uani 1 1 d . . . . .
H106 H 0.563854 0.164683 0.115363 0.054 Uiso 1 1 calc R U . . .
C107 C 0.7701(3) 0.05491(16) 0.3102(2) 0.0545(10) Uani 1 1 d D . . . .
C108 C 0.5419(4) 0.06596(19) 0.0833(3) 0.0670(13) Uani 1 1 d . . . . .
C111 C 0.7536(3) 0.25869(14) 0.25352(19) 0.0410(7) Uani 1 1 d . . . . .
C112 C 0.8314(3) 0.23931(15) 0.2350(2) 0.0451(8) Uani 1 1 d . . . . .
H113 H 0.827014 0.209735 0.204368 0.054 Uiso 1 1 calc R U . . .
C113 C 0.9142(3) 0.26119(16) 0.2593(2) 0.0515(9) Uani 1 1 d . . . . .
C114 C 0.9235(3) 0.30483(17) 0.3045(3) 0.0567(10) Uani 1 1 d . . . . .
H114 H 0.980445 0.319507 0.322642 0.068 Uiso 1 1 calc R U . . .
C115 C 0.8475(3) 0.32607(16) 0.3222(2) 0.0538(10) Uani 1 1 d . . . . .
C116 C 0.7648(3) 0.30341(15) 0.2964(2) 0.0475(8) Uani 1 1 d . . . . .
H116 H 0.713533 0.319081 0.308460 0.057 Uiso 1 1 calc R U . . .
C117 C 0.9928(3) 0.2378(2) 0.2349(4) 0.0779(16) Uani 1 1 d . . . . .
C118 C 0.8517(4) 0.3745(2) 0.3668(3) 0.0730(14) Uani 1 1 d . . . . .
B B 0.6557(3) 0.23508(16) 0.2167(2) 0.0401(8) Uani 1 1 d . . . . .
Cl1S Cl 0.8424(8) 0.1895(2) 0.4446(4) 0.200(5) Uani 0.629(10) 1 d D . P F 1
Cl2S Cl 0.9231(4) 0.27913(18) 0.5187(2) 0.148(3) Uani 0.629(10) 1 d D . P F 1
C1S C 0.8282(13) 0.2418(8) 0.4943(13) 0.177(10) Uani 0.629(10) 1 d D . P F 1
H1SA H 0.808609 0.230311 0.538921 0.212 Uiso 0.629(10) 1 calc R U P F 1
H1SB H 0.780119 0.263561 0.466130 0.212 Uiso 0.629(10) 1 calc R U P F 1
Cl3S Cl 0.8462(10) 0.2621(6) 0.5379(9) 0.223(7) Uani 0.371(10) 1 d D . P F 2
Cl4S Cl 0.8807(9) 0.1877(7) 0.4313(9) 0.187(6) Uani 0.371(10) 1 d D . P F 2
C2S C 0.9199(13) 0.2406(9) 0.4860(13) 0.133(7) Uani 0.371(10) 1 d D . P F 2
H2SA H 0.976584 0.230921 0.518589 0.160 Uiso 0.371(10) 1 calc R U P F 2
H2SB H 0.932578 0.269369 0.454654 0.160 Uiso 0.371(10) 1 calc R U P F 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
Ag C76 2.03(2) . ?
Ag C1 2.098(4) . ?
Ag C75 2.52(2) . ?
Ag Cl1 2.524(2) . ?
Ag C71 2.58(2) . ?
N1 C1 1.359(4) . ?
N1 C2 1.376(5) . ?
N1 C4 1.505(4) . ?
N2 C1 1.359(4) . ?
N2 C3 1.387(5) . ?
N2 C5 1.498(4) . ?
C2 C3 1.350(6) . ?
C4 C11B 1.52(3) . ?
C4 C31 1.542(5) . ?
C4 C21 1.549(5) . ?
C4 C11A 1.567(10) . ?
C5 C41 1.542(5) . ?
C5 C51 1.546(5) . ?
C5 C61 1.547(5) . ?
C11A C12A 1.398(14) . ?
C11A C16A 1.414(12) . ?
C12A C13A 1.392(10) . ?
C13A C14A 1.396(13) . ?
C14A C15A 1.395(16) . ?
C15A C16A 1.371(11) . ?
C11B C16B 1.39(3) . ?
C11B C12B 1.39(3) . ?
C12B C13B 1.39(3) . ?
C13B C14B 1.47(3) . ?
C14B C15B 1.29(4) . ?
C15B C16B 1.37(4) . ?
C21 C22 1.382(6) . ?
C21 C26 1.391(6) . ?
C22 C23 1.386(7) . ?
C23 C24 1.352(9) . ?
C24 C25 1.372(8) . ?
C25 C26 1.385(6) . ?
C31 C36 1.376(6) . ?
C31 C32 1.394(6) . ?
C32 C33 1.390(6) . ?
C33 C34 1.364(8) . ?
C34 C35 1.370(8) . ?
C35 C36 1.401(6) . ?
C41 C46 1.387(5) . ?
C41 C42 1.396(5) . ?
C42 C43 1.390(6) . ?
C43 C44 1.377(7) . ?
C44 C45 1.358(7) . ?
C45 C46 1.403(6) . ?
C51 C52 1.383(5) . ?
C51 C56 1.398(5) . ?
C52 C53 1.402(6) . ?
C53 C54 1.369(7) . ?
C54 C55 1.364(7) . ?
C55 C56 1.392(6) . ?
C61 C62 1.389(5) . ?
C61 C66 1.392(5) . ?
C62 C63 1.400(6) . ?
C63 C64 1.377(7) . ?
C64 C65 1.376(7) . ?
C65 C66 1.383(6) . ?
Cl1 C7 1.756(11) . ?
Cl2 C7 1.669(11) . ?
C71 C72 1.3900 . ?
C71 C76 1.3900 . ?
C71 C77 1.501(9) . ?
C72 C73 1.3900 . ?
C73 C74 1.3900 . ?
C74 C75 1.3900 . ?
C75 C76 1.3900 . ?
F91 C97 1.334(7) . ?
F92 C97 1.323(8) . ?
F93 C97 1.313(6) . ?
F94A C98 1.336(7) . ?
F95A C98 1.243(7) . ?
F96A C98 1.327(7) . ?
F94B C98 1.308(13) . ?
F95B C98 1.237(15) . ?
F96B C98 1.294(15) . ?
F81 C87 1.329(7) . ?
F82 C87 1.315(7) . ?
F83 C87 1.288(8) . ?
F84A C88 1.343(9) . ?
F85A C88 1.332(9) . ?
F86A C88 1.233(9) . ?
F84B C88 1.37(3) . ?
F85B C88 1.338(19) . ?
F86B C88 1.28(2) . ?
F111 C117 1.324(6) . ?
F112 C117 1.351(8) . ?
F113 C117 1.311(7) . ?
F114 C118 1.292(6) . ?
F115 C118 1.279(7) . ?
F116 C118 1.349(7) . ?
F11A C107 1.322(6) . ?
F12A C107 1.320(5) . ?
F13A C107 1.292(6) . ?
F11B C107 1.300(12) . ?
F12B C107 1.262(12) . ?
F13B C107 1.239(13) . ?
F14 C108 1.310(7) . ?
F15 C108 1.263(7) . ?
F16 C108 1.295(6) . ?
C81 C82 1.403(6) . ?
C81 C86 1.409(6) . ?
C81 B 1.629(5) . ?
C82 C83 1.399(6) . ?
C83 C84 1.366(8) . ?
C83 C87 1.494(7) . ?
C84 C85 1.377(8) . ?
C85 C86 1.396(6) . ?
C85 C88 1.489(8) . ?
C91 C96 1.399(5) . ?
C91 C92 1.402(5) . ?
C91 B 1.646(5) . ?
C92 C93 1.381(6) . ?
C93 C94 1.387(6) . ?
C93 C97 1.498(6) . ?
C94 C95 1.381(6) . ?
C95 C96 1.387(6) . ?
C95 C98 1.500(6) . ?
C101 C102 1.390(5) . ?
C101 C106 1.400(5) . ?
C101 B 1.643(5) . ?
C102 C103 1.396(5) . ?
C103 C104 1.389(5) . ?
C103 C107 1.482(6) . ?
C104 C105 1.375(6) . ?
C105 C106 1.391(5) . ?
C105 C108 1.497(6) . ?
C111 C116 1.398(5) . ?
C111 C112 1.399(5) . ?
C111 B 1.639(5) . ?
C112 C113 1.381(6) . ?
C113 C114 1.401(6) . ?
C113 C117 1.496(7) . ?
C114 C115 1.386(7) . ?
C115 C116 1.391(6) . ?
C115 C118 1.498(6) . ?
Cl1S C1S 1.679(15) . ?
Cl2S C1S 1.728(15) . ?
Cl3S C2S 1.724(17) . ?
Cl4S C2S 1.741(18) . ?

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
C76 Ag C1 171.2(5) . . ?
C76 Ag C75 33.5(3) . . ?
C1 Ag C75 141.4(4) . . ?
C1 Ag Cl1 170.64(12) . . ?
C76 Ag C71 32.4(3) . . ?
C1 Ag C71 156.4(4) . . ?
C75 Ag C71 56.3(3) . . ?
C1 N1 C2 110.3(3) . . ?
C1 N1 C4 121.8(3) . . ?
C2 N1 C4 127.9(3) . . ?
C1 N2 C3 110.6(3) . . ?
C1 N2 C5 121.9(3) . . ?
C3 N2 C5 127.4(3) . . ?
N1 C1 N2 105.1(3) . . ?
N1 C1 Ag 127.0(2) . . ?
N2 C1 Ag 127.8(2) . . ?
C3 C2 N1 107.7(3) . . ?
C2 C3 N2 106.3(3) . . ?
N1 C4 C11B 100.7(10) . . ?
N1 C4 C31 109.5(3) . . ?
C11B C4 C31 122.8(8) . . ?
N1 C4 C21 109.0(3) . . ?
C11B C4 C21 106.1(10) . . ?
C31 C4 C21 108.0(3) . . ?
N1 C4 C11A 107.6(4) . . ?
C31 C4 C11A 107.9(5) . . ?
C21 C4 C11A 114.7(4) . . ?
N2 C5 C41 110.2(3) . . ?
N2 C5 C51 110.1(3) . . ?
C41 C5 C51 107.6(3) . . ?
N2 C5 C61 105.9(3) . . ?
C41 C5 C61 111.8(3) . . ?
C51 C5 C61 111.1(3) . . ?
C12A C11A C16A 118.0(8) . . ?
C12A C11A C4 125.4(7) . . ?
C16A C11A C4 116.5(9) . . ?
C13A C12A C11A 120.5(8) . . ?
C12A C13A C14A 119.5(8) . . ?
C15A C14A C13A 121.2(6) . . ?
C16A C15A C14A 118.3(8) . . ?
C15A C16A C11A 122.4(9) . . ?
C16B C11B C12B 121(2) . . ?
C16B C11B C4 123.3(19) . . ?
C12B C11B C4 115.9(18) . . ?
C13B C12B C11B 121(2) . . ?
C12B C13B C14B 114(2) . . ?
C15B C14B C13B 125(3) . . ?
C14B C15B C16B 120(3) . . ?
C15B C16B C11B 120(2) . . ?
C22 C21 C26 117.8(4) . . ?
C22 C21 C4 123.5(4) . . ?
C26 C21 C4 118.7(3) . . ?
C21 C22 C23 120.2(5) . . ?
C24 C23 C22 121.6(5) . . ?
C23 C24 C25 119.2(5) . . ?
C24 C25 C26 120.1(5) . . ?
C25 C26 C21 121.0(4) . . ?
C36 C31 C32 118.3(4) . . ?
C36 C31 C4 123.5(4) . . ?
C32 C31 C4 118.2(4) . . ?
C33 C32 C31 121.1(5) . . ?
C34 C33 C32 120.0(5) . . ?
C33 C34 C35 119.7(5) . . ?
C34 C35 C36 120.8(5) . . ?
C31 C36 C35 120.1(4) . . ?
C46 C41 C42 118.0(3) . . ?
C46 C41 C5 123.2(3) . . ?
C42 C41 C5 118.7(3) . . ?
C43 C42 C41 120.8(4) . . ?
C44 C43 C42 120.0(4) . . ?
C45 C44 C43 120.2(4) . . ?
C44 C45 C46 120.3(4) . . ?
C41 C46 C45 120.5(4) . . ?
C52 C51 C56 118.2(4) . . ?
C52 C51 C5 122.7(3) . . ?
C56 C51 C5 118.9(3) . . ?
C51 C52 C53 120.4(4) . . ?
C54 C53 C52 120.3(4) . . ?
C55 C54 C53 120.0(4) . . ?
C54 C55 C56 120.4(4) . . ?
C55 C56 C51 120.6(4) . . ?
C62 C61 C66 118.2(3) . . ?
C62 C61 C5 122.9(3) . . ?
C66 C61 C5 118.9(3) . . ?
C61 C62 C63 120.6(4) . . ?
C64 C63 C62 120.0(4) . . ?
C65 C64 C63 119.7(4) . . ?
C64 C65 C66 120.4(4) . . ?
C65 C66 C61 121.0(4) . . ?
C7 Cl1 Ag 98.1(4) . . ?
Cl2 C7 Cl1 114.7(9) . . ?
C72 C71 C76 120.0 . . ?
C72 C71 C77 120.0(6) . . ?
C76 C71 C77 118.8(6) . . ?
C72 C71 Ag 112.9(8) . . ?
C76 C71 Ag 51.6(8) . . ?
C77 C71 Ag 111.7(14) . . ?
C73 C72 C71 120.0 . . ?
C72 C73 C74 120.0 . . ?
C75 C74 C73 120.0 . . ?
C76 C75 C74 120.0 . . ?
C76 C75 Ag 53.8(8) . . ?
C74 C75 Ag 113.6(8) . . ?
C75 C76 C71 120.0 . . ?
C75 C76 Ag 92.7(10) . . ?
C71 C76 Ag 96.1(9) . . ?
C82 C81 C86 114.8(4) . . ?
C82 C81 B 122.9(4) . . ?
C86 C81 B 122.0(3) . . ?
C83 C82 C81 122.5(4) . . ?
C84 C83 C82 120.8(4) . . ?
C84 C83 C87 120.8(5) . . ?
C82 C83 C87 118.2(5) . . ?
C83 C84 C85 118.8(4) . . ?
C84 C85 C86 120.7(5) . . ?
C84 C85 C88 120.7(5) . . ?
C86 C85 C88 118.6(5) . . ?
C85 C86 C81 122.4(4) . . ?
F83 C87 F82 107.3(6) . . ?
F83 C87 F81 104.7(7) . . ?
F82 C87 F81 104.7(5) . . ?
F83 C87 C83 113.7(4) . . ?
F82 C87 C83 112.9(6) . . ?
F81 C87 C83 112.8(4) . . ?
F86A C88 F85A 113.0(9) . . ?
F86B C88 F85B 107.0(14) . . ?
F86A C88 F84A 104.7(9) . . ?
F85A C88 F84A 100.3(7) . . ?
F86B C88 F84B 100.3(15) . . ?
F85B C88 F84B 101.3(14) . . ?
F86A C88 C85 116.2(6) . . ?
F86B C88 C85 119.4(12) . . ?
F85A C88 C85 110.2(7) . . ?
F85B C88 C85 118.8(9) . . ?
F84A C88 C85 111.1(5) . . ?
F84B C88 C85 106.7(12) . . ?
C96 C91 C92 115.3(3) . . ?
C96 C91 B 121.7(3) . . ?
C92 C91 B 122.5(3) . . ?
C93 C92 C91 122.5(4) . . ?
C92 C93 C94 120.8(4) . . ?
C92 C93 C97 119.0(4) . . ?
C94 C93 C97 120.2(4) . . ?
C95 C94 C93 118.3(4) . . ?
C94 C95 C96 120.5(4) . . ?
C94 C95 C98 119.4(4) . . ?
C96 C95 C98 120.0(4) . . ?
C95 C96 C91 122.7(4) . . ?
F93 C97 F92 106.6(6) . . ?
F93 C97 F91 107.5(5) . . ?
F92 C97 F91 104.2(5) . . ?
F93 C97 C93 113.5(4) . . ?
F92 C97 C93 112.7(4) . . ?
F91 C97 C93 111.8(5) . . ?
F95B C98 F96B 97(2) . . ?
F95B C98 F94B 107.4(18) . . ?
F96B C98 F94B 108.5(16) . . ?
F95A C98 F96A 114.1(7) . . ?
F95A C98 F94A 106.8(7) . . ?
F96A C98 F94A 96.8(6) . . ?
F95B C98 C95 120.8(15) . . ?
F95A C98 C95 114.4(5) . . ?
F96B C98 C95 110.4(14) . . ?
F94B C98 C95 111.6(9) . . ?
F96A C98 C95 112.5(5) . . ?
F94A C98 C95 110.6(5) . . ?
C102 C101 C106 115.4(3) . . ?
C102 C101 B 121.8(3) . . ?
C106 C101 B 122.6(3) . . ?
C101 C102 C103 122.6(3) . . ?
C104 C103 C102 120.6(4) . . ?
C104 C103 C107 118.5(4) . . ?
C102 C103 C107 120.9(4) . . ?
C105 C104 C103 117.9(4) . . ?
C104 C105 C106 121.1(4) . . ?
C104 C105 C108 119.7(4) . . ?
C106 C105 C108 119.3(4) . . ?
C105 C106 C101 122.4(4) . . ?
F13B C107 F12B 105.8(14) . . ?
F13B C107 F11B 107.2(13) . . ?
F12B C107 F11B 107.8(12) . . ?
F13A C107 F12A 107.1(5) . . ?
F13A C107 F11A 104.8(6) . . ?
F12A C107 F11A 100.8(5) . . ?
F13B C107 C103 117.9(10) . . ?
F12B C107 C103 110.5(8) . . ?
F13A C107 C103 115.6(4) . . ?
F11B C107 C103 107.3(8) . . ?
F12A C107 C103 113.7(4) . . ?
F11A C107 C103 113.4(4) . . ?
F15 C108 F16 107.0(6) . . ?
F15 C108 F14 105.1(5) . . ?
F16 C108 F14 103.9(6) . . ?
F15 C108 C105 114.0(5) . . ?
F16 C108 C105 113.0(4) . . ?
F14 C108 C105 113.0(4) . . ?
C116 C111 C112 115.2(3) . . ?
C116 C111 B 123.2(3) . . ?
C112 C111 B 121.0(3) . . ?
C113 C112 C111 123.0(4) . . ?
C112 C113 C114 120.2(4) . . ?
C112 C113 C117 118.5(4) . . ?
C114 C113 C117 121.3(4) . . ?
C115 C114 C113 118.4(4) . . ?
C114 C115 C116 120.0(4) . . ?
C114 C115 C118 121.3(4) . . ?
C116 C115 C118 118.7(4) . . ?
C115 C116 C111 123.1(4) . . ?
F113 C117 F111 106.0(5) . . ?
F113 C117 F112 106.0(6) . . ?
F111 C117 F112 106.7(5) . . ?
F113 C117 C113 111.8(5) . . ?
F111 C117 C113 113.0(5) . . ?
F112 C117 C113 112.7(4) . . ?
F115 C118 F114 109.1(5) . . ?
F115 C118 F116 105.1(6) . . ?
F114 C118 F116 102.6(6) . . ?
F115 C118 C115 113.6(5) . . ?
F114 C118 C115 113.7(4) . . ?
F116 C118 C115 111.9(4) . . ?
C81 B C111 113.1(3) . . ?
C81 B C101 105.5(3) . . ?
C111 B C101 111.9(3) . . ?
C81 B C91 112.3(3) . . ?
C111 B C91 101.5(3) . . ?
C101 B C91 112.8(3) . . ?
Cl1S C1S Cl2S 113.5(12) . . ?
Cl3S C2S Cl4S 113.5(17) . . ?

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
C2 N1 C1 N2 -0.5(4) . . . . ?
C4 N1 C1 N2 179.5(3) . . . . ?
C2 N1 C1 Ag 175.8(3) . . . . ?
C4 N1 C1 Ag -4.2(5) . . . . ?
C3 N2 C1 N1 0.8(4) . . . . ?
C5 N2 C1 N1 -179.4(3) . . . . ?
C3 N2 C1 Ag -175.4(3) . . . . ?
C5 N2 C1 Ag 4.4(5) . . . . ?
C75 Ag C1 N1 -75.1(8) . . . . ?
C71 Ag C1 N1 55.2(10) . . . . ?
C75 Ag C1 N2 100.3(7) . . . . ?
C71 Ag C1 N2 -129.4(9) . . . . ?
C1 N1 C2 C3 -0.1(5) . . . . ?
C4 N1 C2 C3 179.9(4) . . . . ?
N1 C2 C3 N2 0.6(5) . . . . ?
C1 N2 C3 C2 -0.9(5) . . . . ?
C5 N2 C3 C2 179.4(3) . . . . ?
C1 N1 C4 C11B -58.7(9) . . . . ?
C2 N1 C4 C11B 121.3(9) . . . . ?
C1 N1 C4 C31 72.0(4) . . . . ?
C2 N1 C4 C31 -108.0(4) . . . . ?
C1 N1 C4 C21 -170.0(3) . . . . ?
C2 N1 C4 C21 10.0(5) . . . . ?
C1 N1 C4 C11A -45.0(6) . . . . ?
C2 N1 C4 C11A 135.0(5) . . . . ?
C1 N2 C5 C41 70.8(4) . . . . ?
C3 N2 C5 C41 -109.5(4) . . . . ?
C1 N2 C5 C51 -170.6(3) . . . . ?
C3 N2 C5 C51 9.1(5) . . . . ?
C1 N2 C5 C61 -50.3(4) . . . . ?
C3 N2 C5 C61 129.3(4) . . . . ?
N1 C4 C11A C12A 126.9(7) . . . . ?
C31 C4 C11A C12A 8.8(8) . . . . ?
C21 C4 C11A C12A -111.5(7) . . . . ?
N1 C4 C11A C16A -49.7(7) . . . . ?
C31 C4 C11A C16A -167.8(6) . . . . ?
C21 C4 C11A C16A 71.8(7) . . . . ?
C16A C11A C12A C13A -1.5(11) . . . . ?
C4 C11A C12A C13A -178.1(7) . . . . ?
C11A C12A C13A C14A -0.8(12) . . . . ?
C12A C13A C14A C15A 2.5(13) . . . . ?
C13A C14A C15A C16A -1.8(13) . . . . ?
C14A C15A C16A C11A -0.5(12) . . . . ?
C12A C11A C16A C15A 2.2(12) . . . . ?
C4 C11A C16A C15A 179.1(7) . . . . ?
N1 C4 C11B C16B -45(2) . . . . ?
C31 C4 C11B C16B -166.6(18) . . . . ?
C21 C4 C11B C16B 69(2) . . . . ?
N1 C4 C11B C12B 138.6(18) . . . . ?
C31 C4 C11B C12B 17(3) . . . . ?
C21 C4 C11B C12B -107.8(19) . . . . ?
C16B C11B C12B C13B 0(4) . . . . ?
C4 C11B C12B C13B 176.3(18) . . . . ?
C11B C12B C13B C14B 3(3) . . . . ?
C12B C13B C14B C15B -3(4) . . . . ?
C13B C14B C15B C16B 0(5) . . . . ?
C14B C15B C16B C11B 2(4) . . . . ?
C12B C11B C16B C15B -2(4) . . . . ?
C4 C11B C16B C15B -179(2) . . . . ?
N1 C4 C21 C22 106.1(5) . . . . ?
C11B C4 C21 C22 -1.6(11) . . . . ?
C31 C4 C21 C22 -134.9(4) . . . . ?
C11A C4 C21 C22 -14.7(7) . . . . ?
N1 C4 C21 C26 -76.5(4) . . . . ?
C11B C4 C21 C26 175.8(10) . . . . ?
C31 C4 C21 C26 42.4(5) . . . . ?
C11A C4 C21 C26 162.7(5) . . . . ?
C26 C21 C22 C23 1.0(8) . . . . ?
C4 C21 C22 C23 178.4(5) . . . . ?
C21 C22 C23 C24 -0.5(10) . . . . ?
C22 C23 C24 C25 -0.9(10) . . . . ?
C23 C24 C25 C26 1.7(9) . . . . ?
C24 C25 C26 C21 -1.1(7) . . . . ?
C22 C21 C26 C25 -0.2(7) . . . . ?
C4 C21 C26 C25 -177.7(4) . . . . ?
N1 C4 C31 C36 -7.3(5) . . . . ?
C11B C4 C31 C36 110.3(13) . . . . ?
C21 C4 C31 C36 -126.0(4) . . . . ?
C11A C4 C31 C36 109.6(5) . . . . ?
N1 C4 C31 C32 171.8(3) . . . . ?
C11B C4 C31 C32 -70.6(13) . . . . ?
C21 C4 C31 C32 53.2(5) . . . . ?
C11A C4 C31 C32 -71.3(5) . . . . ?
C36 C31 C32 C33 -2.4(6) . . . . ?
C4 C31 C32 C33 178.4(4) . . . . ?
C31 C32 C33 C34 1.0(7) . . . . ?
C32 C33 C34 C35 0.9(8) . . . . ?
C33 C34 C35 C36 -1.3(8) . . . . ?
C32 C31 C36 C35 1.9(6) . . . . ?
C4 C31 C36 C35 -178.9(4) . . . . ?
C34 C35 C36 C31 -0.1(7) . . . . ?
N2 C5 C41 C46 -10.8(5) . . . . ?
C51 C5 C41 C46 -130.9(4) . . . . ?
C61 C5 C41 C46 106.8(4) . . . . ?
N2 C5 C41 C42 168.3(3) . . . . ?
C51 C5 C41 C42 48.2(4) . . . . ?
C61 C5 C41 C42 -74.1(4) . . . . ?
C46 C41 C42 C43 -2.7(6) . . . . ?
C5 C41 C42 C43 178.2(4) . . . . ?
C41 C42 C43 C44 -0.3(7) . . . . ?
C42 C43 C44 C45 3.2(8) . . . . ?
C43 C44 C45 C46 -2.9(8) . . . . ?
C42 C41 C46 C45 3.0(6) . . . . ?
C5 C41 C46 C45 -177.9(4) . . . . ?
C44 C45 C46 C41 -0.2(7) . . . . ?
N2 C5 C51 C52 111.5(4) . . . . ?
C41 C5 C51 C52 -128.3(4) . . . . ?
C61 C5 C51 C52 -5.6(5) . . . . ?
N2 C5 C51 C56 -73.5(4) . . . . ?
C41 C5 C51 C56 46.7(4) . . . . ?
C61 C5 C51 C56 169.5(3) . . . . ?
C56 C51 C52 C53 -0.3(6) . . . . ?
C5 C51 C52 C53 174.8(4) . . . . ?
C51 C52 C53 C54 1.1(7) . . . . ?
C52 C53 C54 C55 -0.8(7) . . . . ?
C53 C54 C55 C56 -0.2(7) . . . . ?
C54 C55 C56 C51 0.9(7) . . . . ?
C52 C51 C56 C55 -0.7(6) . . . . ?
C5 C51 C56 C55 -175.9(4) . . . . ?
N2 C5 C61 C62 132.4(3) . . . . ?
C41 C5 C61 C62 12.3(5) . . . . ?
C51 C5 C61 C62 -108.0(4) . . . . ?
N2 C5 C61 C66 -46.5(4) . . . . ?
C41 C5 C61 C66 -166.6(3) . . . . ?
C51 C5 C61 C66 73.1(4) . . . . ?
C66 C61 C62 C63 -0.3(6) . . . . ?
C5 C61 C62 C63 -179.2(4) . . . . ?
C61 C62 C63 C64 0.9(7) . . . . ?
C62 C63 C64 C65 -1.2(7) . . . . ?
C63 C64 C65 C66 0.8(7) . . . . ?
C64 C65 C66 C61 -0.2(7) . . . . ?
C62 C61 C66 C65 0.0(6) . . . . ?
C5 C61 C66 C65 178.9(4) . . . . ?
Ag Cl1 C7 Cl2 -18.9(10) . . . . ?
C76 Ag C71 C72 110.9(6) . . . . ?
C1 Ag C71 C72 -69.0(10) . . . . ?
C75 Ag C71 C72 76.1(7) . . . . ?
C1 Ag C71 C76 -179.9(11) . . . . ?
C75 Ag C71 C76 -34.8(3) . . . . ?
C76 Ag C71 C77 -110.2(13) . . . . ?
C1 Ag C71 C77 69.9(16) . . . . ?
C75 Ag C71 C77 -145.0(14) . . . . ?
C76 C71 C72 C73 0.0 . . . . ?
C77 C71 C72 C73 167(2) . . . . ?
Ag C71 C72 C73 -57.6(8) . . . . ?
C71 C72 C73 C74 0.0 . . . . ?
C72 C73 C74 C75 0.0 . . . . ?
C73 C74 C75 C76 0.0 . . . . ?
C73 C74 C75 Ag 60.6(8) . . . . ?
C1 Ag C75 C76 -167.9(7) . . . . ?
C71 Ag C75 C76 33.6(3) . . . . ?
C76 Ag C75 C74 -110.9(6) . . . . ?
C1 Ag C75 C74 81.2(6) . . . . ?
C71 Ag C75 C74 -77.3(6) . . . . ?
C74 C75 C76 C71 0.0 . . . . ?
Ag C75 C76 C71 -98.6(10) . . . . ?
C74 C75 C76 Ag 98.6(10) . . . . ?
C72 C71 C76 C75 0.0 . . . . ?
C77 C71 C76 C75 -167(2) . . . . ?
Ag C71 C76 C75 96.7(10) . . . . ?
C72 C71 C76 Ag -96.7(10) . . . . ?
C77 C71 C76 Ag 96(2) . . . . ?
C71 Ag C76 C75 -120.56(13) . . . . ?
C75 Ag C76 C71 120.56(13) . . . . ?
C86 C81 C82 C83 -2.1(5) . . . . ?
B C81 C82 C83 -175.8(4) . . . . ?
C81 C82 C83 C84 2.3(6) . . . . ?
C81 C82 C83 C87 178.4(4) . . . . ?
C82 C83 C84 C85 -0.9(7) . . . . ?
C87 C83 C84 C85 -177.0(5) . . . . ?
C83 C84 C85 C86 -0.4(7) . . . . ?
C83 C84 C85 C88 178.9(5) . . . . ?
C84 C85 C86 C81 0.5(7) . . . . ?
C88 C85 C86 C81 -178.8(5) . . . . ?
C82 C81 C86 C85 0.7(6) . . . . ?
B C81 C86 C85 174.4(4) . . . . ?
C84 C83 C87 F83 98.9(7) . . . . ?
C82 C83 C87 F83 -77.2(7) . . . . ?
C84 C83 C87 F82 -23.6(7) . . . . ?
C82 C83 C87 F82 160.2(5) . . . . ?
C84 C83 C87 F81 -142.1(6) . . . . ?
C82 C83 C87 F81 41.7(7) . . . . ?
C84 C85 C88 F86A -115.3(11) . . . . ?
C86 C85 C88 F86A 64.0(12) . . . . ?
C84 C85 C88 F86B 50.9(14) . . . . ?
C86 C85 C88 F86B -129.8(13) . . . . ?
C84 C85 C88 F85A 14.9(10) . . . . ?
C86 C85 C88 F85A -165.8(7) . . . . ?
C84 C85 C88 F85B -175.2(13) . . . . ?
C86 C85 C88 F85B 4.1(14) . . . . ?
C84 C85 C88 F84A 125.2(6) . . . . ?
C86 C85 C88 F84A -55.5(8) . . . . ?
C84 C85 C88 F84B -61.7(13) . . . . ?
C86 C85 C88 F84B 117.6(12) . . . . ?
C96 C91 C92 C93 -1.4(6) . . . . ?
B C91 C92 C93 -172.7(4) . . . . ?
C91 C92 C93 C94 1.1(7) . . . . ?
C91 C92 C93 C97 178.9(5) . . . . ?
C92 C93 C94 C95 0.2(7) . . . . ?
C97 C93 C94 C95 -177.5(5) . . . . ?
C93 C94 C95 C96 -1.1(7) . . . . ?
C93 C94 C95 C98 176.7(5) . . . . ?
C94 C95 C96 C91 0.8(7) . . . . ?
C98 C95 C96 C91 -177.0(4) . . . . ?
C92 C91 C96 C95 0.5(6) . . . . ?
B C91 C96 C95 171.9(4) . . . . ?
C92 C93 C97 F93 174.4(6) . . . . ?
C94 C93 C97 F93 -7.9(9) . . . . ?
C92 C93 C97 F92 -64.3(7) . . . . ?
C94 C93 C97 F92 113.4(5) . . . . ?
C92 C93 C97 F91 52.6(7) . . . . ?
C94 C93 C97 F91 -129.6(5) . . . . ?
C94 C95 C98 F95B 96(2) . . . . ?
C96 C95 C98 F95B -86(2) . . . . ?
C94 C95 C98 F95A -100.9(9) . . . . ?
C96 C95 C98 F95A 76.9(9) . . . . ?
C94 C95 C98 F96B -152.6(17) . . . . ?
C96 C95 C98 F96B 25.3(17) . . . . ?
C94 C95 C98 F94B -31.8(12) . . . . ?
C96 C95 C98 F94B 146.0(11) . . . . ?
C94 C95 C98 F96A 31.4(8) . . . . ?
C96 C95 C98 F96A -150.7(6) . . . . ?
C94 C95 C98 F94A 138.4(6) . . . . ?
C96 C95 C98 F94A -43.7(7) . . . . ?
C106 C101 C102 C103 1.4(5) . . . . ?
B C101 C102 C103 176.4(3) . . . . ?
C101 C102 C103 C104 -0.7(6) . . . . ?
C101 C102 C103 C107 178.5(4) . . . . ?
C102 C103 C104 C105 -0.4(6) . . . . ?
C107 C103 C104 C105 -179.6(4) . . . . ?
C103 C104 C105 C106 0.6(6) . . . . ?
C103 C104 C105 C108 178.5(4) . . . . ?
C104 C105 C106 C101 0.2(6) . . . . ?
C108 C105 C106 C101 -177.7(4) . . . . ?
C102 C101 C106 C105 -1.2(6) . . . . ?
B C101 C106 C105 -176.1(4) . . . . ?
C104 C103 C107 F13B -13.7(14) . . . . ?
C102 C103 C107 F13B 167.1(14) . . . . ?
C104 C103 C107 F12B -135.5(11) . . . . ?
C102 C103 C107 F12B 45.3(11) . . . . ?
C104 C103 C107 F13A 164.6(6) . . . . ?
C102 C103 C107 F13A -14.6(7) . . . . ?
C104 C103 C107 F11B 107.3(11) . . . . ?
C102 C103 C107 F11B -71.9(11) . . . . ?
C104 C103 C107 F12A 40.1(7) . . . . ?
C102 C103 C107 F12A -139.1(5) . . . . ?
C104 C103 C107 F11A -74.3(6) . . . . ?
C102 C103 C107 F11A 106.5(6) . . . . ?
C104 C105 C108 F15 -105.5(6) . . . . ?
C106 C105 C108 F15 72.5(7) . . . . ?
C104 C105 C108 F16 16.9(8) . . . . ?
C106 C105 C108 F16 -165.1(6) . . . . ?
C104 C105 C108 F14 134.6(5) . . . . ?
C106 C105 C108 F14 -47.4(7) . . . . ?
C116 C111 C112 C113 2.4(6) . . . . ?
B C111 C112 C113 173.6(4) . . . . ?
C111 C112 C113 C114 0.0(7) . . . . ?
C111 C112 C113 C117 -178.8(4) . . . . ?
C112 C113 C114 C115 -1.9(7) . . . . ?
C117 C113 C114 C115 176.9(5) . . . . ?
C113 C114 C115 C116 1.3(7) . . . . ?
C113 C114 C115 C118 -176.4(4) . . . . ?
C114 C115 C116 C111 1.2(7) . . . . ?
C118 C115 C116 C111 179.0(4) . . . . ?
C112 C111 C116 C115 -3.0(6) . . . . ?
B C111 C116 C115 -174.0(4) . . . . ?
C112 C113 C117 F113 -74.3(7) . . . . ?
C114 C113 C117 F113 106.9(6) . . . . ?
C112 C113 C117 F111 166.1(5) . . . . ?
C114 C113 C117 F111 -12.7(8) . . . . ?
C112 C113 C117 F112 45.0(7) . . . . ?
C114 C113 C117 F112 -133.8(5) . . . . ?
C114 C115 C118 F115 -4.5(8) . . . . ?
C116 C115 C118 F115 177.8(5) . . . . ?
C114 C115 C118 F114 -130.1(5) . . . . ?
C116 C115 C118 F114 52.2(7) . . . . ?
C114 C115 C118 F116 114.3(6) . . . . ?
C116 C115 C118 F116 -63.5(7) . . . . ?
C82 C81 B C111 -33.3(5) . . . . ?
C86 C81 B C111 153.5(3) . . . . ?
C82 C81 B C101 89.3(4) . . . . ?
C86 C81 B C101 -83.9(4) . . . . ?
C82 C81 B C91 -147.4(3) . . . . ?
C86 C81 B C91 39.4(5) . . . . ?
C116 C111 B C81 -30.9(5) . . . . ?
C112 C111 B C81 158.7(3) . . . . ?
C116 C111 B C101 -149.9(3) . . . . ?
C112 C111 B C101 39.6(5) . . . . ?
C116 C111 B C91 89.6(4) . . . . ?
C112 C111 B C91 -80.9(4) . . . . ?
C102 C101 B C81 -87.1(4) . . . . ?
C106 C101 B C81 87.5(4) . . . . ?
C102 C101 B C111 36.3(5) . . . . ?
C106 C101 B C111 -149.1(3) . . . . ?
C102 C101 B C91 150.0(3) . . . . ?
C106 C101 B C91 -35.4(5) . . . . ?
C96 C91 B C81 38.4(5) . . . . ?
C92 C91 B C81 -150.9(3) . . . . ?
C96 C91 B C111 -82.7(4) . . . . ?
C92 C91 B C111 88.1(4) . . . . ?
C96 C91 B C101 157.5(3) . . . . ?
C92 C91 B C101 -31.8(5) . . . . ?

_refine_diff_density_max         0.916
_refine_diff_density_min         -1.406
_refine_diff_density_rms         0.081

####################################################################### 
# 
# 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_riv17b0
_database_code_depnum_ccdc_archive 'CCDC 1583285'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C32 H12 B F24, C47 H37 Ag F N2'
_chemical_formula_sum            'C79 H49 Ag B F25 N2'
_chemical_formula_weight         1619.88

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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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. 
;

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

_cell_length_a                   15.1650(7)
_cell_length_b                   26.0219(12)
_cell_length_c                   18.5838(9)
_cell_angle_alpha                90
_cell_angle_beta                 101.2305(6)
_cell_angle_gamma                90
_cell_volume                     7193.2(6)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9804
_cell_measurement_theta_min      2.23
_cell_measurement_theta_max      21.76

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.496
_exptl_crystal_F_000             3256
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.431
_exptl_crystal_size_mid          0.359
_exptl_crystal_size_min          0.250
_exptl_absorpt_coefficient_mu    0.391
_shelx_estimated_absorpt_T_min   0.850
_shelx_estimated_absorpt_T_max   0.909
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.8955
_exptl_absorpt_correction_T_max  0.9442
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            64785
_diffrn_reflns_av_unetI/netI     0.0325
_diffrn_reflns_av_R_equivalents  0.0374
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         1.364
_diffrn_reflns_theta_max         28.313
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.984
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.984
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             17602
_reflns_number_gt                12524
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick 2015)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0857P)²+5.3754P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         17602
_refine_ls_number_parameters     1006
_refine_ls_number_restraints     31
_refine_ls_R_factor_all          0.0838
_refine_ls_R_factor_gt           0.0572
_refine_ls_wR_factor_ref         0.1714
_refine_ls_wR_factor_gt          0.1528
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_restrained_S_all      1.051
_refine_ls_shift/su_max          0.005
_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_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
Ag Ag 0.72093(2) 0.48924(2) 0.26852(2) 0.04961(10) Uani 1 1 d . . . . .
F1 F 0.6277(8) 0.4836(5) 0.4965(5) 0.217(7) Uani 0.5 1 d D . P A 1
F2 F 0.7748(10) 0.4310(5) 0.5038(6) 0.258(8) Uani 0.5 1 d D . P B 2
N1 N 0.87315(14) 0.56129(8) 0.23521(12) 0.0302(4) Uani 1 1 d . . . . .
N2 N 0.76338(14) 0.55900(8) 0.14285(12) 0.0302(4) Uani 1 1 d . . . . .
C1 C 0.78993(17) 0.54162(10) 0.21227(14) 0.0303(5) Uani 1 1 d . . . . .
C2 C 0.89835(19) 0.59058(11) 0.18046(16) 0.0381(6) Uani 1 1 d . . . . .
H2 H 0.953582 0.608406 0.183261 0.046 Uiso 1 1 calc R U . . .
C3 C 0.82953(19) 0.58900(11) 0.12237(16) 0.0374(6) Uani 1 1 d . . . . .
H3 H 0.826998 0.605341 0.076301 0.045 Uiso 1 1 calc R U . . .
C4 C 0.92498(18) 0.55143(10) 0.31117(15) 0.0334(6) Uani 1 1 d . . . . .
C5 C 0.67421(17) 0.54444(10) 0.09686(14) 0.0301(5) Uani 1 1 d . . . . .
C11 C 0.95105(19) 0.49420(11) 0.31930(17) 0.0379(6) Uani 1 1 d . . . . .
C12 C 1.0029(2) 0.47758(13) 0.3847(2) 0.0548(9) Uani 1 1 d . . . . .
H12 H 1.021862 0.501461 0.423313 0.066 Uiso 1 1 calc R U . . .
C13 C 1.0276(3) 0.42578(15) 0.3946(2) 0.0705(12) Uani 1 1 d . . . . .
H13 H 1.061550 0.414572 0.440381 0.085 Uiso 1 1 calc R U . . .
C14 C 1.0030(3) 0.39129(13) 0.3389(2) 0.0612(10) Uani 1 1 d . . . . .
H14 H 1.019147 0.356113 0.345946 0.073 Uiso 1 1 calc R U . . .
C15 C 0.9551(2) 0.40772(12) 0.2728(2) 0.0505(8) Uani 1 1 d . . . . .
H15 H 0.939464 0.384023 0.233530 0.061 Uiso 1 1 calc R U . . .
C16 C 0.9291(2) 0.45884(11) 0.26283(17) 0.0407(6) Uani 1 1 d . . . . .
H16 H 0.895742 0.469712 0.216665 0.049 Uiso 1 1 calc R U . . .
C21 C 1.01338(18) 0.58312(11) 0.32442(17) 0.0382(6) Uani 1 1 d . . . . .
C22 C 1.0303(2) 0.62301(13) 0.3746(2) 0.0525(8) Uani 1 1 d . . . . .
H22 H 0.986161 0.632550 0.402037 0.063 Uiso 1 1 calc R U . . .
C23 C 1.1120(3) 0.64915(16) 0.3847(3) 0.0730(12) Uani 1 1 d . . . . .
H23 H 1.122447 0.676951 0.418418 0.088 Uiso 1 1 calc R U . . .
C24 C 1.1770(3) 0.63567(16) 0.3473(3) 0.0708(12) Uani 1 1 d . . . . .
H24 H 1.232705 0.653491 0.355560 0.085 Uiso 1 1 calc R U . . .
C25 C 1.1615(2) 0.59569(15) 0.2971(3) 0.0639(10) Uani 1 1 d . . . . .
H25 H 1.206113 0.586406 0.270053 0.077 Uiso 1 1 calc R U . . .
C26 C 1.0804(2) 0.56930(13) 0.2865(2) 0.0529(8) Uani 1 1 d . . . . .
H26 H 1.070496 0.541411 0.252949 0.063 Uiso 1 1 calc R U . . .
C31 C 0.86255(19) 0.56884(13) 0.36267(15) 0.0408(7) Uani 1 1 d . . . . .
C32 C 0.8234(2) 0.61755(16) 0.3520(2) 0.0579(9) Uani 1 1 d . . . . .
H32 H 0.834832 0.638574 0.313073 0.069 Uiso 1 1 calc R U . . .
C33 C 0.7676(3) 0.6357(2) 0.3980(2) 0.0823(15) Uani 1 1 d . . . . .
H33 H 0.741469 0.668881 0.390146 0.099 Uiso 1 1 calc R U . . .
C34 C 0.7503(3) 0.6058(3) 0.4540(2) 0.0904(17) Uani 1 1 d . . . . .
H34 H 0.713495 0.618504 0.485998 0.109 Uiso 1 1 calc R U . . .
C35 C 0.7867(3) 0.5572(2) 0.4639(2) 0.0785(14) Uani 1 1 d . . . . .
H35 H 0.773632 0.536183 0.502267 0.094 Uiso 1 1 calc R U . . .
C36 C 0.8422(2) 0.53836(16) 0.41863(18) 0.0557(9) Uani 1 1 d . . . . .
H36 H 0.866226 0.504625 0.425960 0.067 Uiso 1 1 calc R U . . .
C41 C 0.67088(18) 0.48524(10) 0.09926(14) 0.0313(5) Uani 1 1 d . . . . .
C42 C 0.59636(19) 0.45763(11) 0.11128(16) 0.0375(6) Uani 1 1 d . . . . .
H42 H 0.544174 0.475478 0.118618 0.045 Uiso 1 1 calc R U . . .
C43 C 0.5977(2) 0.40398(12) 0.11263(19) 0.0481(7) Uani 1 1 d . . . . .
H43 H 0.546293 0.385649 0.120714 0.058 Uiso 1 1 calc R U . . .
C44 C 0.6727(2) 0.37746(12) 0.10234(19) 0.0516(8) Uani 1 1 d . . . . .
H44 H 0.673467 0.340961 0.103721 0.062 Uiso 1 1 calc R U . . .
C45 C 0.7473(2) 0.40442(12) 0.08991(18) 0.0481(8) Uani 1 1 d . . . . .
H45 H 0.799157 0.386319 0.082384 0.058 Uiso 1 1 calc R U . . .
C46 C 0.7464(2) 0.45734(12) 0.08847(16) 0.0403(6) Uani 1 1 d . . . . .
H46 H 0.797922 0.475311 0.079996 0.048 Uiso 1 1 calc R U . . .
C51 C 0.66866(18) 0.56422(11) 0.01763(14) 0.0344(6) Uani 1 1 d . . . . .
C52 C 0.6583(2) 0.61704(12) 0.00402(16) 0.0414(6) Uani 1 1 d . . . . .
H52 H 0.657999 0.639995 0.043713 0.050 Uiso 1 1 calc R U . . .
C53 C 0.6485(2) 0.63625(14) -0.06690(18) 0.0487(8) Uani 1 1 d . . . . .
H53 H 0.642812 0.672217 -0.075248 0.058 Uiso 1 1 calc R U . . .
C54 C 0.6470(2) 0.60316(14) -0.12526(18) 0.0513(8) Uani 1 1 d . . . . .
H54 H 0.639300 0.616245 -0.173814 0.062 Uiso 1 1 calc R U . . .
C55 C 0.6569(2) 0.55099(15) -0.11270(17) 0.0507(8) Uani 1 1 d . . . . .
H55 H 0.656383 0.528164 -0.152668 0.061 Uiso 1 1 calc R U . . .
C56 C 0.6676(2) 0.53178(13) -0.04172(16) 0.0402(6) Uani 1 1 d . . . . .
H56 H 0.674191 0.495802 -0.033757 0.048 Uiso 1 1 calc R U . . .
C61 C 0.59756(17) 0.57053(10) 0.12706(15) 0.0319(5) Uani 1 1 d . . . . .
C62 C 0.6110(2) 0.59811(12) 0.19191(17) 0.0412(6) Uani 1 1 d . . . . .
H62 H 0.669875 0.601245 0.220555 0.049 Uiso 1 1 calc R U . . .
C63 C 0.5388(2) 0.62136(14) 0.2156(2) 0.0545(8) Uani 1 1 d . . . . .
H63 H 0.548974 0.640232 0.260253 0.065 Uiso 1 1 calc R U . . .
C64 C 0.4528(2) 0.61719(14) 0.1749(2) 0.0571(9) Uani 1 1 d . . . . .
H64 H 0.403550 0.631977 0.192101 0.069 Uiso 1 1 calc R U . . .
C65 C 0.4392(2) 0.59137(13) 0.1090(2) 0.0504(8) Uani 1 1 d . . . . .
H65 H 0.380502 0.589472 0.079690 0.060 Uiso 1 1 calc R U . . .
C66 C 0.51068(19) 0.56814(11) 0.08531(17) 0.0403(6) Uani 1 1 d . . . . .
H66 H 0.500300 0.550281 0.039855 0.048 Uiso 1 1 calc R U . . .
C71 C 0.6389(6) 0.4633(3) 0.4333(4) 0.115(2) Uani 1 1 d D . . . .
H71 H 0.626024 0.482514 0.473474 0.138 Uiso 0.5 1 calc R U P A 2
C72 C 0.7141(6) 0.4315(3) 0.4426(3) 0.123(3) Uani 1 1 d D . . . .
H72 H 0.750475 0.427902 0.490073 0.147 Uiso 0.5 1 calc R U P B 1
C73 C 0.7384(5) 0.4036(2) 0.3811(4) 0.117(2) Uani 1 1 d . . . . .
H73 H 0.791071 0.383126 0.385922 0.141 Uiso 1 1 calc R U . . .
C74 C 0.6780(4) 0.40965(18) 0.3148(3) 0.0772(13) Uani 1 1 d . . . . .
H74 H 0.688307 0.392521 0.272066 0.093 Uiso 1 1 calc R U . . .
C75 C 0.6050(4) 0.43967(19) 0.3112(3) 0.0796(13) Uani 1 1 d . . . . .
H75 H 0.564288 0.442194 0.265520 0.096 Uiso 1 1 calc R U . . .
C76 C 0.5861(4) 0.4665(3) 0.3688(4) 0.111(2) Uani 1 1 d . . . . .
H76 H 0.534183 0.487727 0.362269 0.133 Uiso 1 1 calc R U . . .
F81 F 1.07159(13) 0.26380(10) 0.75478(15) 0.0803(7) Uani 1 1 d . . . . .
F82 F 0.98203(15) 0.22738(13) 0.66827(15) 0.0959(10) Uani 1 1 d . . . . .
F83 F 1.0252(2) 0.18847(12) 0.7683(2) 0.1120(11) Uani 1 1 d . . . . .
F84 F 0.9402(3) 0.37918(16) 0.9098(2) 0.159(2) Uani 1 1 d . . . . .
F85 F 0.8695(5) 0.33218(19) 0.9702(2) 0.191(3) Uani 1 1 d . . . . .
F86 F 0.8055(3) 0.3814(2) 0.9010(4) 0.202(3) Uani 1 1 d . . . . .
F91 F 0.47349(15) 0.07492(11) 0.58097(14) 0.0839(8) Uani 1 1 d . . . . .
F92 F 0.5541(3) 0.00950(9) 0.60226(19) 0.1251(15) Uani 1 1 d . . . . .
F93 F 0.58448(19) 0.06747(13) 0.53172(13) 0.0982(10) Uani 1 1 d . . . . .
F94A F 0.8250(3) 0.08010(12) 0.88271(17) 0.0936(12) Uani 0.8 1 d D . P C 1
F95A F 0.7452(2) 0.01756(14) 0.8561(2) 0.1005(13) Uani 0.8 1 d D . P C 1
F96A F 0.8487(4) 0.0296(3) 0.79891(19) 0.139(2) Uani 0.8 1 d D . P C 1
F94B F 0.7990(10) 0.0078(3) 0.8007(8) 0.069(4) Uiso 0.2 1 d D . P C 2
F95B F 0.8663(5) 0.0732(5) 0.8251(8) 0.070(3) Uiso 0.2 1 d D . P C 2
F96B F 0.7696(13) 0.0537(9) 0.8913(5) 0.110(5) Uiso 0.2 1 d D . P C 2
F101 F 0.66483(19) 0.20657(9) 0.43792(14) 0.0811(7) Uani 1 1 d . . . . .
F102 F 0.6784(3) 0.28304(10) 0.40209(14) 0.1069(11) Uani 1 1 d . . . . .
F103 F 0.78443(18) 0.24733(12) 0.47799(14) 0.0878(8) Uani 1 1 d . . . . .
F104 F 0.4957(2) 0.40160(11) 0.50674(16) 0.0998(10) Uani 1 1 d . . . . .
F105 F 0.4571(2) 0.38341(13) 0.6060(2) 0.1216(14) Uani 1 1 d . . . . .
F106 F 0.5793(3) 0.42264(11) 0.6079(3) 0.1399(15) Uani 1 1 d . . . . .
F111 F 0.6368(2) 0.25946(17) 1.00371(15) 0.1226(13) Uani 1 1 d . . . . .
F112 F 0.5378(4) 0.20629(15) 1.00742(16) 0.1556(19) Uani 1 1 d . . . . .
F113 F 0.5051(3) 0.28339(18) 1.00205(15) 0.1398(16) Uani 1 1 d . . . . .
F14A F 0.31276(17) 0.23501(16) 0.67152(16) 0.0970(11) Uani 0.875 1 d D . P D 1
F15A F 0.28101(19) 0.19971(14) 0.7657(2) 0.0920(10) Uani 0.875 1 d D . P D 1
F16A F 0.27855(18) 0.27972(14) 0.7594(3) 0.1047(12) Uani 0.875 1 d D . P D 1
F14B F 0.277(2) 0.2498(16) 0.7949(15) 0.135(12) Uiso 0.125 1 d D . P D 2
F15B F 0.3178(11) 0.2810(4) 0.7022(8) 0.055(4) Uiso 0.125 1 d D . P D 2
F16B F 0.2989(18) 0.1917(4) 0.7251(15) 0.093(8) Uiso 0.125 1 d D . P D 2
C81 C 0.75952(19) 0.25257(11) 0.76641(16) 0.0358(6) Uani 1 1 d . . . . .
C82 C 0.83611(18) 0.23509(11) 0.74260(16) 0.0381(6) Uani 1 1 d . . . . .
H82 H 0.829463 0.208698 0.706617 0.046 Uiso 1 1 calc R U . . .
C83 C 0.9216(2) 0.25456(12) 0.76916(18) 0.0435(7) Uani 1 1 d . . . . .
C84 C 0.9352(2) 0.29202(14) 0.82353(19) 0.0530(8) Uani 1 1 d . . . . .
H84 H 0.993708 0.304454 0.843636 0.064 Uiso 1 1 calc R U . . .
C85 C 0.8606(2) 0.31035(14) 0.8471(2) 0.0548(9) Uani 1 1 d . . . . .
C86 C 0.7745(2) 0.29165(12) 0.81901(19) 0.0468(7) Uani 1 1 d . . . . .
H86 H 0.724661 0.305876 0.836133 0.056 Uiso 1 1 calc R U . . .
C87 C 1.0000(2) 0.23392(15) 0.7411(2) 0.0567(9) Uani 1 1 d . . . . .
C88 C 0.8720(3) 0.3512(2) 0.9057(3) 0.0871(16) Uani 1 1 d . . . . .
C91 C 0.66594(17) 0.16684(10) 0.71913(15) 0.0333(6) Uani 1 1 d . . . . .
C92 C 0.61277(18) 0.13941(11) 0.66175(16) 0.0357(6) Uani 1 1 d . . . . .
H92 H 0.573637 0.157946 0.624572 0.043 Uiso 1 1 calc R U . . .
C93 C 0.61502(19) 0.08611(11) 0.65708(16) 0.0375(6) Uani 1 1 d . . . . .
C94 C 0.67102(19) 0.05770(11) 0.71012(16) 0.0387(6) Uani 1 1 d . . . . .
H94 H 0.673155 0.021293 0.707094 0.046 Uiso 1 1 calc R U . . .
C95 C 0.72398(18) 0.08387(11) 0.76787(16) 0.0374(6) Uani 1 1 d . . . . .
C96 C 0.72102(18) 0.13706(11) 0.77248(15) 0.0359(6) Uani 1 1 d . . . . .
H96 H 0.757510 0.153771 0.813105 0.043 Uiso 1 1 calc R U . . .
C97 C 0.5581(2) 0.05933(13) 0.59317(19) 0.0490(8) Uani 1 1 d . . . . .
C98 C 0.7863(2) 0.05373(11) 0.82512(16) 0.0526(8) Uani 1 1 d D . . . .
C101 C 0.63561(17) 0.25956(10) 0.64951(16) 0.0346(6) Uani 1 1 d . . . . .
C102 C 0.66819(19) 0.24380(11) 0.58761(16) 0.0371(6) Uani 1 1 d . . . . .
H102 H 0.700329 0.212310 0.589916 0.045 Uiso 1 1 calc R U . . .
C103 C 0.6558(2) 0.27207(12) 0.52272(17) 0.0426(7) Uani 1 1 d . . . . .
C104 C 0.6080(2) 0.31783(13) 0.51675(19) 0.0499(8) Uani 1 1 d . . . . .
H104 H 0.597973 0.336959 0.472359 0.060 Uiso 1 1 calc R U . . .
C105 C 0.5751(2) 0.33502(13) 0.57723(19) 0.0475(8) Uani 1 1 d . . . . .
C106 C 0.58913(19) 0.30648(12) 0.64197(18) 0.0416(7) Uani 1 1 d . . . . .
H106 H 0.566328 0.319313 0.682584 0.050 Uiso 1 1 calc R U . . .
C107 C 0.6946(3) 0.25317(14) 0.46024(19) 0.0554(9) Uani 1 1 d . . . . .
C108 C 0.5271(3) 0.38583(17) 0.5750(3) 0.0693(12) Uani 1 1 d . . . . .
C111 C 0.58202(18) 0.23773(10) 0.77745(16) 0.0356(6) Uani 1 1 d . . . . .
C112 C 0.5992(2) 0.24098(11) 0.85388(17) 0.0388(6) Uani 1 1 d . . . . .
H112 H 0.659713 0.239847 0.879663 0.047 Uiso 1 1 calc R U . . .
C113 C 0.5305(2) 0.24583(11) 0.89392(18) 0.0437(7) Uani 1 1 d . . . . .
C114 C 0.4413(2) 0.24610(12) 0.8586(2) 0.0488(8) Uani 1 1 d . . . . .
H114 H 0.394490 0.249611 0.885591 0.059 Uiso 1 1 calc R U . . .
C115 C 0.4220(2) 0.24114(12) 0.7831(2) 0.0457(7) Uani 1 1 d . . . . .
C116 C 0.49059(19) 0.23745(11) 0.74355(17) 0.0394(6) Uani 1 1 d . . . . .
H116 H 0.475200 0.234623 0.691648 0.047 Uiso 1 1 calc R U . . .
C117 C 0.5523(3) 0.24869(16) 0.9755(2) 0.0610(10) Uani 1 1 d . . . . .
C118 C 0.3251(2) 0.23927(11) 0.74432(18) 0.0621(10) Uani 1 1 d D . . . .
B B 0.6601(2) 0.22965(12) 0.72858(18) 0.0348(6) 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
Ag C1 2.115(3) . ?
Ag C74 2.381(4) . ?
Ag C75 2.435(4) . ?
F1 C71 1.329(7) . ?
F2 C72 1.317(7) . ?
N1 C1 1.352(3) . ?
N1 C2 1.383(3) . ?
N1 C4 1.498(3) . ?
N2 C1 1.352(3) . ?
N2 C3 1.382(3) . ?
N2 C5 1.501(3) . ?
C2 C3 1.348(4) . ?
C4 C31 1.540(4) . ?
C4 C11 1.541(4) . ?
C4 C21 1.552(4) . ?
C5 C41 1.542(4) . ?
C5 C61 1.543(4) . ?
C5 C51 1.546(4) . ?
C11 C12 1.383(4) . ?
C11 C16 1.387(4) . ?
C12 C13 1.402(5) . ?
C13 C14 1.367(6) . ?
C14 C15 1.367(5) . ?
C15 C16 1.390(4) . ?
C21 C22 1.385(4) . ?
C21 C26 1.391(5) . ?
C22 C23 1.394(5) . ?
C23 C24 1.357(6) . ?
C24 C25 1.387(6) . ?
C25 C26 1.389(5) . ?
C31 C36 1.390(5) . ?
C31 C32 1.398(5) . ?
C32 C33 1.396(5) . ?
C33 C34 1.365(7) . ?
C34 C35 1.379(8) . ?
C35 C36 1.389(6) . ?
C41 C42 1.393(4) . ?
C41 C46 1.403(4) . ?
C42 C43 1.396(4) . ?
C43 C44 1.376(5) . ?
C44 C45 1.388(5) . ?
C45 C46 1.377(4) . ?
C51 C56 1.386(4) . ?
C51 C52 1.401(4) . ?
C52 C53 1.390(4) . ?
C53 C54 1.382(5) . ?
C54 C55 1.381(5) . ?
C55 C56 1.390(4) . ?
C61 C62 1.383(4) . ?
C61 C66 1.394(4) . ?
C62 C63 1.395(4) . ?
C63 C64 1.378(5) . ?
C64 C65 1.376(5) . ?
C65 C66 1.386(4) . ?
C71 C76 1.309(9) . ?
C71 C72 1.392(11) . ?
C72 C73 1.460(11) . ?
C73 C74 1.394(8) . ?
C74 C75 1.345(7) . ?
C75 C76 1.354(7) . ?
F81 C87 1.319(4) . ?
F82 C87 1.339(5) . ?
F83 C87 1.313(5) . ?
F84 C88 1.256(5) . ?
F85 C88 1.303(7) . ?
F86 C88 1.269(7) . ?
F91 C97 1.322(4) . ?
F92 C97 1.310(4) . ?
F93 C97 1.299(4) . ?
F94A C98 1.310(3) . ?
F95A C98 1.322(3) . ?
F96A C98 1.306(3) . ?
F94B C98 1.306(4) . ?
F95B C98 1.314(4) . ?
F96B C98 1.304(4) . ?
F101 C107 1.331(4) . ?
F102 C107 1.315(4) . ?
F103 C107 1.347(5) . ?
F104 C108 1.330(5) . ?
F105 C108 1.305(5) . ?
F106 C108 1.315(6) . ?
F111 C117 1.317(5) . ?
F112 C117 1.291(5) . ?
F113 C117 1.307(5) . ?
F14A C118 1.334(3) . ?
F15A C118 1.330(3) . ?
F16A C118 1.328(3) . ?
F14B C118 1.330(4) . ?
F15B C118 1.331(4) . ?
F16B C118 1.328(4) . ?
C81 C82 1.397(4) . ?
C81 C86 1.398(4) . ?
C81 B 1.646(4) . ?
C82 C83 1.390(4) . ?
C83 C84 1.390(4) . ?
C83 C87 1.489(4) . ?
C84 C85 1.375(5) . ?
C85 C86 1.396(5) . ?
C85 C88 1.507(5) . ?
C91 C96 1.400(4) . ?
C91 C92 1.401(4) . ?
C91 B 1.648(4) . ?
C92 C93 1.391(4) . ?
C93 C94 1.383(4) . ?
C93 C97 1.497(4) . ?
C94 C95 1.387(4) . ?
C95 C96 1.388(4) . ?
C95 C98 1.500(4) . ?
C101 C102 1.399(4) . ?
C101 C106 1.403(4) . ?
C101 B 1.640(4) . ?
C102 C103 1.394(4) . ?
C103 C104 1.387(5) . ?
C103 C107 1.484(5) . ?
C104 C105 1.390(5) . ?
C105 C106 1.394(4) . ?
C105 C108 1.505(5) . ?
C111 C112 1.396(4) . ?
C111 C116 1.407(4) . ?
C111 B 1.640(4) . ?
C112 C113 1.398(4) . ?
C113 C114 1.384(5) . ?
C113 C117 1.489(5) . ?
C114 C115 1.383(5) . ?
C115 C116 1.389(4) . ?
C115 C118 1.505(5) . ?

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 Ag C74 159.33(16) . . ?
C1 Ag C75 163.92(16) . . ?
C74 Ag C75 32.42(17) . . ?
C1 N1 C2 110.6(2) . . ?
C1 N1 C4 121.2(2) . . ?
C2 N1 C4 128.2(2) . . ?
C1 N2 C3 110.8(2) . . ?
C1 N2 C5 121.8(2) . . ?
C3 N2 C5 127.4(2) . . ?
N1 C1 N2 105.1(2) . . ?
N1 C1 Ag 127.57(18) . . ?
N2 C1 Ag 127.09(18) . . ?
C3 C2 N1 106.9(2) . . ?
C2 C3 N2 106.7(2) . . ?
N1 C4 C31 105.2(2) . . ?
N1 C4 C11 109.6(2) . . ?
C31 C4 C11 113.6(2) . . ?
N1 C4 C21 109.7(2) . . ?
C31 C4 C21 111.2(2) . . ?
C11 C4 C21 107.5(2) . . ?
N2 C5 C41 105.5(2) . . ?
N2 C5 C61 109.9(2) . . ?
C41 C5 C61 113.4(2) . . ?
N2 C5 C51 109.5(2) . . ?
C41 C5 C51 111.3(2) . . ?
C61 C5 C51 107.1(2) . . ?
C12 C11 C16 118.0(3) . . ?
C12 C11 C4 118.7(3) . . ?
C16 C11 C4 123.2(3) . . ?
C11 C12 C13 120.5(3) . . ?
C14 C13 C12 120.4(3) . . ?
C13 C14 C15 119.6(3) . . ?
C14 C15 C16 120.5(3) . . ?
C11 C16 C15 120.9(3) . . ?
C22 C21 C26 118.5(3) . . ?
C22 C21 C4 123.1(3) . . ?
C26 C21 C4 118.4(3) . . ?
C21 C22 C23 120.0(4) . . ?
C24 C23 C22 121.3(4) . . ?
C23 C24 C25 119.6(3) . . ?
C24 C25 C26 119.7(4) . . ?
C25 C26 C21 121.0(3) . . ?
C36 C31 C32 118.3(3) . . ?
C36 C31 C4 123.4(3) . . ?
C32 C31 C4 118.4(3) . . ?
C33 C32 C31 120.8(4) . . ?
C34 C33 C32 120.3(5) . . ?
C33 C34 C35 119.5(4) . . ?
C34 C35 C36 121.2(4) . . ?
C35 C36 C31 120.0(4) . . ?
C42 C41 C46 117.8(3) . . ?
C42 C41 C5 123.5(2) . . ?
C46 C41 C5 118.7(2) . . ?
C41 C42 C43 120.6(3) . . ?
C44 C43 C42 120.5(3) . . ?
C43 C44 C45 119.5(3) . . ?
C46 C45 C44 120.2(3) . . ?
C45 C46 C41 121.4(3) . . ?
C56 C51 C52 118.0(3) . . ?
C56 C51 C5 123.0(3) . . ?
C52 C51 C5 118.8(2) . . ?
C53 C52 C51 120.8(3) . . ?
C54 C53 C52 120.2(3) . . ?
C55 C54 C53 119.7(3) . . ?
C54 C55 C56 120.2(3) . . ?
C51 C56 C55 121.1(3) . . ?
C62 C61 C66 118.1(3) . . ?
C62 C61 C5 123.5(2) . . ?
C66 C61 C5 118.4(2) . . ?
C61 C62 C63 120.6(3) . . ?
C64 C63 C62 120.6(3) . . ?
C65 C64 C63 119.3(3) . . ?
C64 C65 C66 120.3(3) . . ?
C65 C66 C61 121.1(3) . . ?
C76 C71 F1 128.6(11) . . ?
C76 C71 C72 119.5(6) . . ?
F1 C71 C72 111.7(11) . . ?
F2 C72 C71 122.1(12) . . ?
F2 C72 C73 115.5(12) . . ?
C71 C72 C73 121.6(5) . . ?
C74 C73 C72 114.4(7) . . ?
C75 C74 C73 120.1(6) . . ?
C75 C74 Ag 76.0(3) . . ?
C73 C74 Ag 103.7(3) . . ?
C74 C75 C76 124.0(6) . . ?
C74 C75 Ag 71.6(2) . . ?
C76 C75 Ag 105.2(3) . . ?
C71 C76 C75 120.3(8) . . ?
C82 C81 C86 115.3(3) . . ?
C82 C81 B 119.7(2) . . ?
C86 C81 B 124.9(3) . . ?
C83 C82 C81 123.0(3) . . ?
C82 C83 C84 120.7(3) . . ?
C82 C83 C87 119.8(3) . . ?
C84 C83 C87 119.4(3) . . ?
C85 C84 C83 117.4(3) . . ?
C84 C85 C86 121.9(3) . . ?
C84 C85 C88 119.3(3) . . ?
C86 C85 C88 118.9(3) . . ?
C85 C86 C81 121.8(3) . . ?
F83 C87 F81 106.9(3) . . ?
F83 C87 F82 105.1(3) . . ?
F81 C87 F82 105.5(3) . . ?
F83 C87 C83 112.5(3) . . ?
F81 C87 C83 113.8(3) . . ?
F82 C87 C83 112.4(3) . . ?
F84 C88 F86 106.1(6) . . ?
F84 C88 F85 109.6(5) . . ?
F86 C88 F85 97.7(5) . . ?
F84 C88 C85 115.5(3) . . ?
F86 C88 C85 114.2(4) . . ?
F85 C88 C85 112.2(5) . . ?
C96 C91 C92 115.6(2) . . ?
C96 C91 B 120.7(2) . . ?
C92 C91 B 123.5(2) . . ?
C93 C92 C91 122.6(3) . . ?
C94 C93 C92 120.5(3) . . ?
C94 C93 C97 119.7(3) . . ?
C92 C93 C97 119.8(3) . . ?
C93 C94 C95 118.1(3) . . ?
C94 C95 C96 121.1(3) . . ?
C94 C95 C98 118.8(3) . . ?
C96 C95 C98 120.1(3) . . ?
C95 C96 C91 122.0(3) . . ?
F93 C97 F92 107.7(3) . . ?
F93 C97 F91 104.7(3) . . ?
F92 C97 F91 104.9(3) . . ?
F93 C97 C93 113.1(3) . . ?
F92 C97 C93 113.1(3) . . ?
F91 C97 C93 112.6(3) . . ?
F96B C98 F94B 113.3(12) . . ?
F96A C98 F94A 108.3(4) . . ?
F96B C98 F95B 110.5(11) . . ?
F94B C98 F95B 98.9(8) . . ?
F96A C98 F95A 105.0(4) . . ?
F94A C98 F95A 101.0(3) . . ?
F96B C98 C95 117.3(8) . . ?
F96A C98 C95 112.9(3) . . ?
F94B C98 C95 110.3(7) . . ?
F94A C98 C95 115.2(3) . . ?
F95B C98 C95 104.6(6) . . ?
F95A C98 C95 113.3(3) . . ?
C102 C101 C106 115.1(3) . . ?
C102 C101 B 122.9(2) . . ?
C106 C101 B 121.6(3) . . ?
C103 C102 C101 123.2(3) . . ?
C104 C103 C102 120.2(3) . . ?
C104 C103 C107 120.2(3) . . ?
C102 C103 C107 119.6(3) . . ?
C103 C104 C105 118.4(3) . . ?
C104 C105 C106 120.5(3) . . ?
C104 C105 C108 120.5(3) . . ?
C106 C105 C108 118.9(3) . . ?
C105 C106 C101 122.6(3) . . ?
F102 C107 F101 106.6(3) . . ?
F102 C107 F103 106.6(3) . . ?
F101 C107 F103 103.8(3) . . ?
F102 C107 C103 114.1(3) . . ?
F101 C107 C103 112.6(3) . . ?
F103 C107 C103 112.5(3) . . ?
F105 C108 F106 107.3(5) . . ?
F105 C108 F104 105.3(4) . . ?
F106 C108 F104 106.9(4) . . ?
F105 C108 C105 112.1(3) . . ?
F106 C108 C105 112.5(3) . . ?
F104 C108 C105 112.3(4) . . ?
C112 C111 C116 115.3(3) . . ?
C112 C111 B 124.0(3) . . ?
C116 C111 B 120.4(3) . . ?
C111 C112 C113 122.5(3) . . ?
C114 C113 C112 120.6(3) . . ?
C114 C113 C117 119.0(3) . . ?
C112 C113 C117 120.4(3) . . ?
C115 C114 C113 118.4(3) . . ?
C114 C115 C116 120.7(3) . . ?
C114 C115 C118 118.9(3) . . ?
C116 C115 C118 120.4(3) . . ?
C115 C116 C111 122.5(3) . . ?
F112 C117 F113 105.2(4) . . ?
F112 C117 F111 103.8(4) . . ?
F113 C117 F111 105.4(4) . . ?
F112 C117 C113 113.6(3) . . ?
F113 C117 C113 112.9(4) . . ?
F111 C117 C113 114.9(3) . . ?
F16B C118 F14B 102(2) . . ?
F16A C118 F15A 103.4(3) . . ?
F16B C118 F15B 128.1(14) . . ?
F14B C118 F15B 104.7(19) . . ?
F16A C118 F14A 107.8(4) . . ?
F15A C118 F14A 105.0(3) . . ?
F16A C118 C115 112.5(3) . . ?
F16B C118 C115 111.8(12) . . ?
F14B C118 C115 106.1(16) . . ?
F15A C118 C115 112.5(3) . . ?
F15B C118 C115 102.5(7) . . ?
F14A C118 C115 114.8(3) . . ?
C101 B C111 111.9(2) . . ?
C101 B C81 103.9(2) . . ?
C111 B C81 114.6(2) . . ?
C101 B C91 112.5(2) . . ?
C111 B C91 104.2(2) . . ?
C81 B C91 109.9(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
C2 N1 C1 N2 -0.2(3) . . . . ?
C4 N1 C1 N2 178.7(2) . . . . ?
C2 N1 C1 Ag 174.5(2) . . . . ?
C4 N1 C1 Ag -6.6(4) . . . . ?
C3 N2 C1 N1 0.4(3) . . . . ?
C5 N2 C1 N1 178.4(2) . . . . ?
C3 N2 C1 Ag -174.3(2) . . . . ?
C5 N2 C1 Ag 3.8(4) . . . . ?
C74 Ag C1 N1 -79.6(5) . . . . ?
C75 Ag C1 N1 156.3(5) . . . . ?
C74 Ag C1 N2 94.0(4) . . . . ?
C75 Ag C1 N2 -30.1(6) . . . . ?
C1 N1 C2 C3 -0.1(3) . . . . ?
C4 N1 C2 C3 -178.9(3) . . . . ?
N1 C2 C3 N2 0.3(3) . . . . ?
C1 N2 C3 C2 -0.4(3) . . . . ?
C5 N2 C3 C2 -178.4(2) . . . . ?
C1 N1 C4 C31 -54.6(3) . . . . ?
C2 N1 C4 C31 124.0(3) . . . . ?
C1 N1 C4 C11 67.9(3) . . . . ?
C2 N1 C4 C11 -113.5(3) . . . . ?
C1 N1 C4 C21 -174.3(2) . . . . ?
C2 N1 C4 C21 4.3(4) . . . . ?
C1 N2 C5 C41 -52.7(3) . . . . ?
C3 N2 C5 C41 125.1(3) . . . . ?
C1 N2 C5 C61 70.0(3) . . . . ?
C3 N2 C5 C61 -112.3(3) . . . . ?
C1 N2 C5 C51 -172.6(2) . . . . ?
C3 N2 C5 C51 5.2(4) . . . . ?
N1 C4 C11 C12 177.2(3) . . . . ?
C31 C4 C11 C12 -65.4(4) . . . . ?
C21 C4 C11 C12 58.0(4) . . . . ?
N1 C4 C11 C16 0.7(4) . . . . ?
C31 C4 C11 C16 118.0(3) . . . . ?
C21 C4 C11 C16 -118.5(3) . . . . ?
C16 C11 C12 C13 -3.7(5) . . . . ?
C4 C11 C12 C13 179.6(3) . . . . ?
C11 C12 C13 C14 2.0(7) . . . . ?
C12 C13 C14 C15 0.8(7) . . . . ?
C13 C14 C15 C16 -1.9(6) . . . . ?
C12 C11 C16 C15 2.7(5) . . . . ?
C4 C11 C16 C15 179.3(3) . . . . ?
C14 C15 C16 C11 0.0(5) . . . . ?
N1 C4 C21 C22 113.6(3) . . . . ?
C31 C4 C21 C22 -2.3(4) . . . . ?
C11 C4 C21 C22 -127.3(3) . . . . ?
N1 C4 C21 C26 -69.4(3) . . . . ?
C31 C4 C21 C26 174.7(3) . . . . ?
C11 C4 C21 C26 49.8(4) . . . . ?
C26 C21 C22 C23 1.7(5) . . . . ?
C4 C21 C22 C23 178.7(3) . . . . ?
C21 C22 C23 C24 -1.4(6) . . . . ?
C22 C23 C24 C25 1.1(7) . . . . ?
C23 C24 C25 C26 -1.2(6) . . . . ?
C24 C25 C26 C21 1.5(6) . . . . ?
C22 C21 C26 C25 -1.7(5) . . . . ?
C4 C21 C26 C25 -178.9(3) . . . . ?
N1 C4 C31 C36 128.9(3) . . . . ?
C11 C4 C31 C36 9.1(4) . . . . ?
C21 C4 C31 C36 -112.4(3) . . . . ?
N1 C4 C31 C32 -50.2(3) . . . . ?
C11 C4 C31 C32 -170.1(3) . . . . ?
C21 C4 C31 C32 68.5(3) . . . . ?
C36 C31 C32 C33 2.0(5) . . . . ?
C4 C31 C32 C33 -178.8(3) . . . . ?
C31 C32 C33 C34 -0.1(6) . . . . ?
C32 C33 C34 C35 -1.5(7) . . . . ?
C33 C34 C35 C36 1.3(7) . . . . ?
C34 C35 C36 C31 0.6(6) . . . . ?
C32 C31 C36 C35 -2.2(5) . . . . ?
C4 C31 C36 C35 178.7(3) . . . . ?
N2 C5 C41 C42 134.2(3) . . . . ?
C61 C5 C41 C42 13.9(3) . . . . ?
C51 C5 C41 C42 -107.1(3) . . . . ?
N2 C5 C41 C46 -46.1(3) . . . . ?
C61 C5 C41 C46 -166.4(2) . . . . ?
C51 C5 C41 C46 72.6(3) . . . . ?
C46 C41 C42 C43 0.2(4) . . . . ?
C5 C41 C42 C43 179.8(3) . . . . ?
C41 C42 C43 C44 0.2(5) . . . . ?
C42 C43 C44 C45 -0.5(5) . . . . ?
C43 C44 C45 C46 0.5(5) . . . . ?
C44 C45 C46 C41 -0.1(5) . . . . ?
C42 C41 C46 C45 -0.2(4) . . . . ?
C5 C41 C46 C45 -179.9(3) . . . . ?
N2 C5 C51 C56 111.9(3) . . . . ?
C41 C5 C51 C56 -4.4(3) . . . . ?
C61 C5 C51 C56 -128.9(3) . . . . ?
N2 C5 C51 C52 -72.4(3) . . . . ?
C41 C5 C51 C52 171.3(2) . . . . ?
C61 C5 C51 C52 46.7(3) . . . . ?
C56 C51 C52 C53 -0.9(4) . . . . ?
C5 C51 C52 C53 -176.8(3) . . . . ?
C51 C52 C53 C54 1.3(5) . . . . ?
C52 C53 C54 C55 -1.1(5) . . . . ?
C53 C54 C55 C56 0.5(5) . . . . ?
C52 C51 C56 C55 0.3(4) . . . . ?
C5 C51 C56 C55 176.0(3) . . . . ?
C54 C55 C56 C51 -0.1(5) . . . . ?
N2 C5 C61 C62 -6.8(4) . . . . ?
C41 C5 C61 C62 110.9(3) . . . . ?
C51 C5 C61 C62 -125.8(3) . . . . ?
N2 C5 C61 C66 170.3(2) . . . . ?
C41 C5 C61 C66 -72.0(3) . . . . ?
C51 C5 C61 C66 51.3(3) . . . . ?
C66 C61 C62 C63 2.0(4) . . . . ?
C5 C61 C62 C63 179.1(3) . . . . ?
C61 C62 C63 C64 0.1(5) . . . . ?
C62 C63 C64 C65 -2.4(6) . . . . ?
C63 C64 C65 C66 2.5(6) . . . . ?
C64 C65 C66 C61 -0.3(5) . . . . ?
C62 C61 C66 C65 -1.9(4) . . . . ?
C5 C61 C66 C65 -179.2(3) . . . . ?
C76 C71 C72 F2 172.5(8) . . . . ?
C76 C71 C72 C73 3.3(9) . . . . ?
F1 C71 C72 C73 178.1(6) . . . . ?
F2 C72 C73 C74 -173.0(7) . . . . ?
C71 C72 C73 C74 -3.2(8) . . . . ?
C72 C73 C74 C75 0.7(6) . . . . ?
C72 C73 C74 Ag 82.3(5) . . . . ?
C1 Ag C74 C75 -154.7(3) . . . . ?
C1 Ag C74 C73 87.2(6) . . . . ?
C75 Ag C74 C73 -118.1(6) . . . . ?
C73 C74 C75 C76 1.7(7) . . . . ?
Ag C74 C75 C76 -96.3(5) . . . . ?
C73 C74 C75 Ag 97.9(4) . . . . ?
C1 Ag C75 C74 147.0(5) . . . . ?
C1 Ag C75 C76 -91.7(7) . . . . ?
C74 Ag C75 C76 121.3(6) . . . . ?
F1 C71 C76 C75 -174.7(7) . . . . ?
C72 C71 C76 C75 -0.9(9) . . . . ?
C74 C75 C76 C71 -1.7(8) . . . . ?
Ag C75 C76 C71 -79.5(6) . . . . ?
C86 C81 C82 C83 0.4(5) . . . . ?
B C81 C82 C83 176.5(3) . . . . ?
C81 C82 C83 C84 2.1(5) . . . . ?
C81 C82 C83 C87 180.0(3) . . . . ?
C82 C83 C84 C85 -2.9(5) . . . . ?
C87 C83 C84 C85 179.2(4) . . . . ?
C83 C84 C85 C86 1.3(6) . . . . ?
C83 C84 C85 C88 -179.7(4) . . . . ?
C84 C85 C86 C81 1.2(6) . . . . ?
C88 C85 C86 C81 -177.8(4) . . . . ?
C82 C81 C86 C85 -2.0(5) . . . . ?
B C81 C86 C85 -177.9(3) . . . . ?
C82 C83 C87 F83 -75.5(4) . . . . ?
C84 C83 C87 F83 102.4(4) . . . . ?
C82 C83 C87 F81 162.8(3) . . . . ?
C84 C83 C87 F81 -19.3(5) . . . . ?
C82 C83 C87 F82 42.9(5) . . . . ?
C84 C83 C87 F82 -139.2(4) . . . . ?
C84 C85 C88 F84 25.9(8) . . . . ?
C86 C85 C88 F84 -155.1(5) . . . . ?
C84 C85 C88 F86 149.4(5) . . . . ?
C86 C85 C88 F86 -31.6(7) . . . . ?
C84 C85 C88 F85 -100.6(6) . . . . ?
C86 C85 C88 F85 78.4(7) . . . . ?
C96 C91 C92 C93 -0.9(4) . . . . ?
B C91 C92 C93 -176.2(3) . . . . ?
C91 C92 C93 C94 0.1(4) . . . . ?
C91 C92 C93 C97 -178.4(3) . . . . ?
C92 C93 C94 C95 0.4(4) . . . . ?
C97 C93 C94 C95 178.9(3) . . . . ?
C93 C94 C95 C96 0.0(4) . . . . ?
C93 C94 C95 C98 -178.9(3) . . . . ?
C94 C95 C96 C91 -0.9(4) . . . . ?
C98 C95 C96 C91 178.0(2) . . . . ?
C92 C91 C96 C95 1.3(4) . . . . ?
B C91 C96 C95 176.8(2) . . . . ?
C94 C93 C97 F93 -109.6(4) . . . . ?
C92 C93 C97 F93 68.9(4) . . . . ?
C94 C93 C97 F92 13.3(5) . . . . ?
C92 C93 C97 F92 -168.2(3) . . . . ?
C94 C93 C97 F91 132.0(3) . . . . ?
C92 C93 C97 F91 -49.5(4) . . . . ?
C94 C95 C98 F96B -114.1(12) . . . . ?
C96 C95 C98 F96B 67.0(12) . . . . ?
C94 C95 C98 F96A 63.5(5) . . . . ?
C96 C95 C98 F96A -115.4(5) . . . . ?
C94 C95 C98 F94B 17.6(8) . . . . ?
C96 C95 C98 F94B -161.3(7) . . . . ?
C94 C95 C98 F94A -171.3(3) . . . . ?
C96 C95 C98 F94A 9.8(4) . . . . ?
C94 C95 C98 F95B 123.0(7) . . . . ?
C96 C95 C98 F95B -55.9(7) . . . . ?
C94 C95 C98 F95A -55.6(4) . . . . ?
C96 C95 C98 F95A 125.5(4) . . . . ?
C106 C101 C102 C103 -0.2(4) . . . . ?
B C101 C102 C103 -172.8(3) . . . . ?
C101 C102 C103 C104 -1.0(5) . . . . ?
C101 C102 C103 C107 178.5(3) . . . . ?
C102 C103 C104 C105 1.5(5) . . . . ?
C107 C103 C104 C105 -178.0(3) . . . . ?
C103 C104 C105 C106 -0.7(5) . . . . ?
C103 C104 C105 C108 176.7(3) . . . . ?
C104 C105 C106 C101 -0.5(5) . . . . ?
C108 C105 C106 C101 -178.0(3) . . . . ?
C102 C101 C106 C105 1.0(4) . . . . ?
B C101 C106 C105 173.7(3) . . . . ?
C104 C103 C107 F102 -0.5(5) . . . . ?
C102 C103 C107 F102 180.0(3) . . . . ?
C104 C103 C107 F101 -122.1(4) . . . . ?
C102 C103 C107 F101 58.4(4) . . . . ?
C104 C103 C107 F103 121.1(4) . . . . ?
C102 C103 C107 F103 -58.4(4) . . . . ?
C104 C105 C108 F105 138.9(4) . . . . ?
C106 C105 C108 F105 -43.6(6) . . . . ?
C104 C105 C108 F106 -100.0(5) . . . . ?
C106 C105 C108 F106 77.5(5) . . . . ?
C104 C105 C108 F104 20.6(5) . . . . ?
C106 C105 C108 F104 -161.9(3) . . . . ?
C116 C111 C112 C113 -2.6(4) . . . . ?
B C111 C112 C113 -177.4(3) . . . . ?
C111 C112 C113 C114 1.9(4) . . . . ?
C111 C112 C113 C117 179.5(3) . . . . ?
C112 C113 C114 C115 0.4(5) . . . . ?
C117 C113 C114 C115 -177.2(3) . . . . ?
C113 C114 C115 C116 -1.8(5) . . . . ?
C113 C114 C115 C118 177.6(3) . . . . ?
C114 C115 C116 C111 1.0(5) . . . . ?
C118 C115 C116 C111 -178.4(3) . . . . ?
C112 C111 C116 C115 1.2(4) . . . . ?
B C111 C116 C115 176.2(3) . . . . ?
C114 C113 C117 F112 74.8(5) . . . . ?
C112 C113 C117 F112 -102.8(4) . . . . ?
C114 C113 C117 F113 -44.9(5) . . . . ?
C112 C113 C117 F113 137.5(4) . . . . ?
C114 C113 C117 F111 -165.8(4) . . . . ?
C112 C113 C117 F111 16.6(5) . . . . ?
C114 C115 C118 F16A 55.6(4) . . . . ?
C116 C115 C118 F16A -125.0(4) . . . . ?
C114 C115 C118 F16B -102.3(14) . . . . ?
C116 C115 C118 F16B 77.1(14) . . . . ?
C114 C115 C118 F14B 8(2) . . . . ?
C116 C115 C118 F14B -173(2) . . . . ?
C114 C115 C118 F15A -60.7(4) . . . . ?
C116 C115 C118 F15A 118.7(4) . . . . ?
C114 C115 C118 F15B 117.4(8) . . . . ?
C116 C115 C118 F15B -63.2(9) . . . . ?
C114 C115 C118 F14A 179.3(3) . . . . ?
C116 C115 C118 F14A -1.3(4) . . . . ?
C102 C101 B C111 -153.8(3) . . . . ?
C106 C101 B C111 34.0(4) . . . . ?
C102 C101 B C81 82.0(3) . . . . ?
C106 C101 B C81 -90.2(3) . . . . ?
C102 C101 B C91 -36.8(3) . . . . ?
C106 C101 B C91 151.0(3) . . . . ?
C112 C111 B C101 -146.2(3) . . . . ?
C116 C111 B C101 39.3(4) . . . . ?
C112 C111 B C81 -28.3(4) . . . . ?
C116 C111 B C81 157.2(3) . . . . ?
C112 C111 B C91 92.0(3) . . . . ?
C116 C111 B C91 -82.5(3) . . . . ?
C82 C81 B C101 -76.9(3) . . . . ?
C86 C81 B C101 98.8(3) . . . . ?
C82 C81 B C111 160.6(3) . . . . ?
C86 C81 B C111 -23.6(4) . . . . ?
C82 C81 B C91 43.6(3) . . . . ?
C86 C81 B C91 -140.6(3) . . . . ?
C96 C91 B C101 152.1(2) . . . . ?
C92 C91 B C101 -32.8(3) . . . . ?
C96 C91 B C111 -86.5(3) . . . . ?
C92 C91 B C111 88.6(3) . . . . ?
C96 C91 B C81 36.9(3) . . . . ?
C92 C91 B C81 -148.0(3) . . . . ?

_refine_diff_density_max         0.889
_refine_diff_density_min         -0.531
_refine_diff_density_rms         0.073

####################################################################### 
# 
# 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_riv17d0
_database_code_depnum_ccdc_archive 'CCDC 1583288'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C42 H32 Ag N2 O P, 2(C4 H8 O)'
_chemical_formula_sum            'C50 H48 Ag N2 O3 P'
_chemical_formula_weight         863.74

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'
P P 0.2955 0.4335 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.15213(16)
_cell_length_b                   11.75148(17)
_cell_length_c                   16.7352(3)
_cell_angle_alpha                83.7416(11)
_cell_angle_beta                 85.9962(8)
_cell_angle_gamma                71.1237(9)
_cell_volume                     2061.50(5)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9368
_cell_measurement_theta_min      4.19
_cell_measurement_theta_max      73.51

_exptl_crystal_description       fragment
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.391
_exptl_crystal_F_000             896
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.218
_exptl_crystal_size_mid          0.161
_exptl_crystal_size_min          0.040
_exptl_absorpt_coefficient_mu    4.644
_shelx_estimated_absorpt_T_min   0.431
_shelx_estimated_absorpt_T_max   0.836
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.4758
_exptl_absorpt_correction_T_max  0.8910
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            14722
_diffrn_reflns_av_unetI/netI     0.0403
_diffrn_reflns_av_R_equivalents  0.0287
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         2.658
_diffrn_reflns_theta_max         73.933
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.960
_diffrn_measured_fraction_theta_full 0.968
_diffrn_reflns_Laue_measured_fraction_max 0.960
_diffrn_reflns_Laue_measured_fraction_full 0.968
_diffrn_reflns_point_group_measured_fraction_max 0.960
_diffrn_reflns_point_group_measured_fraction_full 0.968
_reflns_number_total             8024
_reflns_number_gt                7411
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014 (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0469P)²+0.5798P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         8024
_refine_ls_number_parameters     514
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0334
_refine_ls_R_factor_gt           0.0308
_refine_ls_wR_factor_ref         0.0844
_refine_ls_wR_factor_gt          0.0828
_refine_ls_goodness_of_fit_ref   1.058
_refine_ls_restrained_S_all      1.058
_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_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
Ag Ag -0.08126(2) 0.23312(2) 0.26231(2) 0.02923(6) Uani 1 1 d . . . . .
P P -0.28716(7) 0.21212(8) 0.29258(5) 0.04945(18) Uani 1 1 d . . . . .
O1 O -0.2535(2) 0.2349(2) 0.45343(13) 0.0596(6) Uani 1 1 d . . . . .
N1 N 0.17181(15) 0.20618(14) 0.15873(10) 0.0203(3) Uani 1 1 d . . . . .
N2 N 0.17356(15) 0.29571(14) 0.26377(10) 0.0208(3) Uani 1 1 d . . . . .
C1 C 0.10244(18) 0.24525(17) 0.22620(12) 0.0215(3) Uani 1 1 d . . . . .
C2 C 0.28366(18) 0.23454(18) 0.15365(12) 0.0242(4) Uani 1 1 d . . . . .
H2 H 0.347190 0.217729 0.111768 0.029 Uiso 1 1 calc R U . . .
C3 C 0.28494(18) 0.29059(18) 0.21962(12) 0.0246(4) Uani 1 1 d . . . . .
H3 H 0.349582 0.320715 0.233226 0.030 Uiso 1 1 calc R U . . .
C4 C 0.12238(18) 0.14890(17) 0.09786(11) 0.0208(4) Uani 1 1 d . . . . .
C5 C 0.12729(18) 0.35497(17) 0.34025(11) 0.0213(4) Uani 1 1 d . . . . .
C6 C -0.2620(2) 0.2246(2) 0.38299(19) 0.0424(6) Uani 1 1 d . . . . .
C11 C 0.0774(2) 0.04969(18) 0.14651(12) 0.0249(4) Uani 1 1 d . . . . .
C12 C 0.1604(2) -0.0325(2) 0.20052(13) 0.0328(5) Uani 1 1 d . . . . .
H12 H 0.241743 -0.025814 0.206944 0.039 Uiso 1 1 calc R U . . .
C13 C 0.1242(3) -0.1238(2) 0.24481(15) 0.0458(6) Uani 1 1 d . . . . .
H13 H 0.181138 -0.179509 0.281321 0.055 Uiso 1 1 calc R U . . .
C14 C 0.0057(3) -0.1342(3) 0.23605(16) 0.0505(7) Uani 1 1 d . . . . .
H14 H -0.018093 -0.197503 0.265990 0.061 Uiso 1 1 calc R U . . .
C15 C -0.0773(3) -0.0529(3) 0.18400(16) 0.0444(6) Uani 1 1 d . . . . .
H15 H -0.159045 -0.059375 0.178606 0.053 Uiso 1 1 calc R U . . .
C16 C -0.0421(2) 0.0391(2) 0.13905(14) 0.0323(5) Uani 1 1 d . . . . .
H16 H -0.099905 0.094904 0.103102 0.039 Uiso 1 1 calc R U . . .
C21 C 0.22844(18) 0.09409(17) 0.03497(11) 0.0221(4) Uani 1 1 d . . . . .
C22 C 0.2756(2) -0.02899(19) 0.02628(13) 0.0286(4) Uani 1 1 d . . . . .
H22 H 0.247427 -0.083781 0.062646 0.034 Uiso 1 1 calc R U . . .
C23 C 0.3640(2) -0.0727(2) -0.03544(15) 0.0370(5) Uani 1 1 d . . . . .
H23 H 0.395381 -0.157072 -0.040661 0.044 Uiso 1 1 calc R U . . .
C24 C 0.4064(2) 0.0049(2) -0.08881(14) 0.0363(5) Uani 1 1 d . . . . .
H24 H 0.467228 -0.025559 -0.130326 0.044 Uiso 1 1 calc R U . . .
C25 C 0.3593(2) 0.1277(2) -0.08133(13) 0.0334(5) Uani 1 1 d . . . . .
H25 H 0.387863 0.182007 -0.117955 0.040 Uiso 1 1 calc R U . . .
C26 C 0.2707(2) 0.17189(19) -0.02062(13) 0.0272(4) Uani 1 1 d . . . . .
H26 H 0.238142 0.256523 -0.016691 0.033 Uiso 1 1 calc R U . . .
C31 C 0.01606(18) 0.24583(18) 0.05188(12) 0.0234(4) Uani 1 1 d . . . . .
C32 C -0.0327(2) 0.36481(18) 0.07120(14) 0.0290(4) Uani 1 1 d . . . . .
H32 H -0.002303 0.388792 0.116076 0.035 Uiso 1 1 calc R U . . .
C33 C -0.1257(2) 0.4484(2) 0.02512(16) 0.0377(5) Uani 1 1 d . . . . .
H33 H -0.158183 0.529186 0.039148 0.045 Uiso 1 1 calc R U . . .
C34 C -0.1721(2) 0.4171(2) -0.04060(16) 0.0405(5) Uani 1 1 d . . . . .
H34 H -0.236340 0.475097 -0.071405 0.049 Uiso 1 1 calc R U . . .
C35 C -0.1228(2) 0.2995(3) -0.06047(15) 0.0407(5) Uani 1 1 d . . . . .
H35 H -0.153088 0.276273 -0.105720 0.049 Uiso 1 1 calc R U . . .
C36 C -0.0300(2) 0.2153(2) -0.01536(14) 0.0332(5) Uani 1 1 d . . . . .
H36 H 0.003091 0.135004 -0.030340 0.040 Uiso 1 1 calc R U . . .
C41 C 0.12641(18) 0.25885(18) 0.41067(12) 0.0242(4) Uani 1 1 d . . . . .
C42 C 0.1423(2) 0.13850(19) 0.40165(13) 0.0299(4) Uani 1 1 d . . . . .
H42 H 0.155000 0.111407 0.349325 0.036 Uiso 1 1 calc R U . . .
C43 C 0.1398(3) 0.0572(2) 0.46842(16) 0.0390(5) Uani 1 1 d . . . . .
H43 H 0.148996 -0.024256 0.461000 0.047 Uiso 1 1 calc R U . . .
C44 C 0.1242(3) 0.0937(2) 0.54539(16) 0.0425(6) Uani 1 1 d . . . . .
H44 H 0.122069 0.038268 0.590810 0.051 Uiso 1 1 calc R U . . .
C45 C 0.1117(3) 0.2132(2) 0.55503(14) 0.0413(5) Uani 1 1 d . . . . .
H45 H 0.102852 0.239033 0.607581 0.050 Uiso 1 1 calc R U . . .
C46 C 0.1121(2) 0.2943(2) 0.48914(13) 0.0338(5) Uani 1 1 d . . . . .
H46 H 0.102543 0.375660 0.496948 0.041 Uiso 1 1 calc R U . . .
C51 C -0.00570(18) 0.44497(17) 0.32294(12) 0.0232(4) Uani 1 1 d . . . . .
C52 C -0.0188(2) 0.52544(18) 0.25354(13) 0.0270(4) Uani 1 1 d . . . . .
H52 H 0.052521 0.520936 0.218001 0.032 Uiso 1 1 calc R U . . .
C53 C -0.1352(2) 0.6121(2) 0.23597(15) 0.0352(5) Uani 1 1 d . . . . .
H53 H -0.143118 0.666455 0.188808 0.042 Uiso 1 1 calc R U . . .
C54 C -0.2396(2) 0.6186(2) 0.28760(17) 0.0423(6) Uani 1 1 d . . . . .
H54 H -0.319152 0.677524 0.275924 0.051 Uiso 1 1 calc R U . . .
C55 C -0.2275(2) 0.5393(2) 0.35600(17) 0.0408(5) Uani 1 1 d . . . . .
H55 H -0.299208 0.543807 0.391156 0.049 Uiso 1 1 calc R U . . .
C56 C -0.1112(2) 0.4525(2) 0.37412(14) 0.0301(4) Uani 1 1 d . . . . .
H56 H -0.104092 0.398583 0.421456 0.036 Uiso 1 1 calc R U . . .
C61 C 0.21705(18) 0.42156(17) 0.36325(11) 0.0223(4) Uani 1 1 d . . . . .
C62 C 0.3415(2) 0.35585(19) 0.38343(13) 0.0282(4) Uani 1 1 d . . . . .
H62 H 0.373006 0.271818 0.377169 0.034 Uiso 1 1 calc R U . . .
C63 C 0.4197(2) 0.4115(2) 0.41248(13) 0.0326(5) Uani 1 1 d . . . . .
H63 H 0.504815 0.366084 0.424664 0.039 Uiso 1 1 calc R U . . .
C64 C 0.3736(2) 0.5340(2) 0.42377(14) 0.0341(5) Uani 1 1 d . . . . .
H64 H 0.426731 0.572178 0.444137 0.041 Uiso 1 1 calc R U . . .
C65 C 0.2505(2) 0.5996(2) 0.40528(14) 0.0325(5) Uani 1 1 d . . . . .
H65 H 0.218398 0.682955 0.413469 0.039 Uiso 1 1 calc R U . . .
C66 C 0.1730(2) 0.54415(18) 0.37470(13) 0.0269(4) Uani 1 1 d . . . . .
H66 H 0.088646 0.590556 0.361379 0.032 Uiso 1 1 calc R U . . .
O1S O 0.4541(2) 0.4499(2) 0.14283(18) 0.0685(7) Uani 1 1 d . . . . .
C1S C 0.4182(4) 0.5445(4) 0.1949(2) 0.0757(11) Uani 1 1 d . . . . .
H1SA H 0.464103 0.518132 0.245632 0.091 Uiso 1 1 calc R U . . .
H1SB H 0.325941 0.568815 0.207808 0.091 Uiso 1 1 calc R U . . .
C3S C 0.5746(3) 0.5815(3) 0.1046(2) 0.0630(9) Uani 1 1 d . . . . .
H3SA H 0.649939 0.583555 0.131622 0.076 Uiso 1 1 calc R U . . .
H3SB H 0.575896 0.618554 0.048622 0.076 Uiso 1 1 calc R U . . .
C2S C 0.4531(3) 0.6467(3) 0.1499(3) 0.0661(9) Uani 1 1 d . . . . .
H2SA H 0.468174 0.700341 0.187086 0.079 Uiso 1 1 calc R U . . .
H2SB H 0.386486 0.694861 0.112526 0.079 Uiso 1 1 calc R U . . .
C4S C 0.5717(3) 0.4511(3) 0.1062(3) 0.0646(9) Uani 1 1 d . . . . .
H4SA H 0.579539 0.426495 0.050797 0.078 Uiso 1 1 calc R U . . .
H4SB H 0.642498 0.394621 0.137366 0.078 Uiso 1 1 calc R U . . .
O2S O 0.5168(2) 0.1109(2) 0.71846(13) 0.0579(5) Uani 1 1 d . . . . .
C5S C 0.4560(4) 0.0322(3) 0.69361(19) 0.0628(9) Uani 1 1 d . . . . .
H5SA H 0.364009 0.062208 0.707259 0.075 Uiso 1 1 calc R U . . .
H5SB H 0.491695 -0.049770 0.721224 0.075 Uiso 1 1 calc R U . . .
C6S C 0.4779(3) 0.0284(3) 0.60397(18) 0.0509(7) Uani 1 1 d . . . . .
H6SA H 0.403641 0.021197 0.578364 0.061 Uiso 1 1 calc R U . . .
H6SB H 0.554150 -0.039179 0.590473 0.061 Uiso 1 1 calc R U . . .
C7S C 0.4967(3) 0.1493(3) 0.57914(19) 0.0553(7) Uani 1 1 d . . . . .
H7SA H 0.549059 0.147133 0.528732 0.066 Uiso 1 1 calc R U . . .
H7SB H 0.414486 0.214266 0.572017 0.066 Uiso 1 1 calc R U . . .
C8S C 0.5644(3) 0.1656(3) 0.6493(2) 0.0553(7) Uani 1 1 d . . . . .
H8SA H 0.657001 0.126544 0.642122 0.066 Uiso 1 1 calc R U . . .
H8SB H 0.547682 0.252564 0.654575 0.066 Uiso 1 1 calc R U . . .


_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
Ag C1 2.1400(19) . ?
Ag P 2.4015(6) . ?
P C6 1.588(3) . ?
O1 C6 1.211(4) . ?
N1 C1 1.358(2) . ?
N1 C2 1.387(2) . ?
N1 C4 1.504(2) . ?
N2 C1 1.353(2) . ?
N2 C3 1.388(2) . ?
N2 C5 1.503(2) . ?
C2 C3 1.349(3) . ?
C4 C31 1.536(3) . ?
C4 C11 1.546(3) . ?
C4 C21 1.550(2) . ?
C5 C41 1.543(3) . ?
C5 C51 1.543(3) . ?
C5 C61 1.546(2) . ?
C11 C16 1.392(3) . ?
C11 C12 1.398(3) . ?
C12 C13 1.389(3) . ?
C13 C14 1.385(4) . ?
C14 C15 1.374(5) . ?
C15 C16 1.395(3) . ?
C21 C22 1.390(3) . ?
C21 C26 1.399(3) . ?
C22 C23 1.396(3) . ?
C23 C24 1.376(4) . ?
C24 C25 1.384(3) . ?
C25 C26 1.386(3) . ?
C31 C32 1.392(3) . ?
C31 C36 1.395(3) . ?
C32 C33 1.386(3) . ?
C33 C34 1.379(4) . ?
C34 C35 1.381(4) . ?
C35 C36 1.379(3) . ?
C41 C42 1.391(3) . ?
C41 C46 1.404(3) . ?
C42 C43 1.394(3) . ?
C43 C44 1.384(4) . ?
C44 C45 1.391(4) . ?
C45 C46 1.377(3) . ?
C51 C56 1.391(3) . ?
C51 C52 1.400(3) . ?
C52 C53 1.394(3) . ?
C53 C54 1.386(4) . ?
C54 C55 1.380(4) . ?
C55 C56 1.394(3) . ?
C61 C66 1.394(3) . ?
C61 C62 1.397(3) . ?
C62 C63 1.387(3) . ?
C63 C64 1.393(3) . ?
C64 C65 1.377(3) . ?
C65 C66 1.390(3) . ?
O1S C4S 1.412(4) . ?
O1S C1S 1.424(5) . ?
C1S C2S 1.492(5) . ?
C3S C2S 1.520(5) . ?
C3S C4S 1.541(5) . ?
O2S C8S 1.417(4) . ?
O2S C5S 1.420(4) . ?
C5S C6S 1.506(4) . ?
C6S C7S 1.511(4) . ?
C7S C8S 1.502(5) . ?

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 Ag P 175.22(5) . . ?
C6 P Ag 85.35(9) . . ?
C1 N1 C2 110.72(15) . . ?
C1 N1 C4 121.53(15) . . ?
C2 N1 C4 127.61(15) . . ?
C1 N2 C3 110.88(15) . . ?
C1 N2 C5 121.64(15) . . ?
C3 N2 C5 127.36(15) . . ?
N2 C1 N1 104.85(16) . . ?
N2 C1 Ag 128.08(14) . . ?
N1 C1 Ag 127.06(13) . . ?
C3 C2 N1 106.81(16) . . ?
C2 C3 N2 106.72(16) . . ?
N1 C4 C31 109.46(14) . . ?
N1 C4 C11 105.55(15) . . ?
C31 C4 C11 113.30(16) . . ?
N1 C4 C21 110.49(15) . . ?
C31 C4 C21 107.01(15) . . ?
C11 C4 C21 111.06(15) . . ?
N2 C5 C41 110.23(15) . . ?
N2 C5 C51 105.61(15) . . ?
C41 C5 C51 113.07(16) . . ?
N2 C5 C61 110.94(15) . . ?
C41 C5 C61 106.40(15) . . ?
C51 C5 C61 110.67(15) . . ?
O1 C6 P 174.5(2) . . ?
C16 C11 C12 118.8(2) . . ?
C16 C11 C4 122.9(2) . . ?
C12 C11 C4 118.31(18) . . ?
C13 C12 C11 120.2(2) . . ?
C14 C13 C12 120.4(3) . . ?
C15 C14 C13 119.9(2) . . ?
C14 C15 C16 120.2(2) . . ?
C11 C16 C15 120.4(2) . . ?
C22 C21 C26 117.94(18) . . ?
C22 C21 C4 122.86(18) . . ?
C26 C21 C4 118.93(17) . . ?
C21 C22 C23 120.5(2) . . ?
C24 C23 C22 120.8(2) . . ?
C23 C24 C25 119.3(2) . . ?
C24 C25 C26 120.2(2) . . ?
C25 C26 C21 121.18(19) . . ?
C32 C31 C36 117.9(2) . . ?
C32 C31 C4 123.44(18) . . ?
C36 C31 C4 118.60(17) . . ?
C33 C32 C31 120.2(2) . . ?
C34 C33 C32 121.7(2) . . ?
C33 C34 C35 118.3(2) . . ?
C36 C35 C34 120.7(2) . . ?
C35 C36 C31 121.2(2) . . ?
C42 C41 C46 117.8(2) . . ?
C42 C41 C5 124.30(17) . . ?
C46 C41 C5 117.91(18) . . ?
C41 C42 C43 120.8(2) . . ?
C44 C43 C42 120.7(2) . . ?
C43 C44 C45 118.8(2) . . ?
C46 C45 C44 120.7(2) . . ?
C45 C46 C41 121.2(2) . . ?
C56 C51 C52 118.85(19) . . ?
C56 C51 C5 123.27(19) . . ?
C52 C51 C5 117.84(17) . . ?
C53 C52 C51 120.8(2) . . ?
C54 C53 C52 119.7(2) . . ?
C55 C54 C53 119.8(2) . . ?
C54 C55 C56 120.8(2) . . ?
C51 C56 C55 120.0(2) . . ?
C66 C61 C62 118.07(18) . . ?
C66 C61 C5 121.58(17) . . ?
C62 C61 C5 119.82(17) . . ?
C63 C62 C61 120.96(19) . . ?
C62 C63 C64 120.0(2) . . ?
C65 C64 C63 119.7(2) . . ?
C64 C65 C66 120.2(2) . . ?
C65 C66 C61 121.0(2) . . ?
C4S O1S C1S 105.9(3) . . ?
O1S C1S C2S 105.7(3) . . ?
C2S C3S C4S 104.2(3) . . ?
C1S C2S C3S 102.2(3) . . ?
O1S C4S C3S 106.7(3) . . ?
C8S O2S C5S 108.8(2) . . ?
O2S C5S C6S 107.8(3) . . ?
C5S C6S C7S 101.7(2) . . ?
C8S C7S C6S 102.0(3) . . ?
O2S C8S C7S 106.5(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
C1 Ag P C6 160.6(7) . . . . ?
C3 N2 C1 N1 1.2(2) . . . . ?
C5 N2 C1 N1 177.49(16) . . . . ?
C3 N2 C1 Ag -177.25(15) . . . . ?
C5 N2 C1 Ag -1.0(3) . . . . ?
C2 N1 C1 N2 -1.3(2) . . . . ?
C4 N1 C1 N2 -177.21(16) . . . . ?
C2 N1 C1 Ag 177.18(14) . . . . ?
C4 N1 C1 Ag 1.3(3) . . . . ?
P Ag C1 N2 175.9(5) . . . . ?
P Ag C1 N1 -2.2(8) . . . . ?
C1 N1 C2 C3 0.9(2) . . . . ?
C4 N1 C2 C3 176.52(18) . . . . ?
N1 C2 C3 N2 -0.1(2) . . . . ?
C1 N2 C3 C2 -0.7(2) . . . . ?
C5 N2 C3 C2 -176.70(18) . . . . ?
C1 N1 C4 C31 71.8(2) . . . . ?
C2 N1 C4 C31 -103.4(2) . . . . ?
C1 N1 C4 C11 -50.4(2) . . . . ?
C2 N1 C4 C11 134.37(19) . . . . ?
C1 N1 C4 C21 -170.59(17) . . . . ?
C2 N1 C4 C21 14.2(3) . . . . ?
C1 N2 C5 C41 71.0(2) . . . . ?
C3 N2 C5 C41 -113.4(2) . . . . ?
C1 N2 C5 C51 -51.5(2) . . . . ?
C3 N2 C5 C51 124.2(2) . . . . ?
C1 N2 C5 C61 -171.43(17) . . . . ?
C3 N2 C5 C61 4.2(3) . . . . ?
Ag P C6 O1 170(2) . . . . ?
N1 C4 C11 C16 129.38(18) . . . . ?
C31 C4 C11 C16 9.6(2) . . . . ?
C21 C4 C11 C16 -110.9(2) . . . . ?
N1 C4 C11 C12 -50.4(2) . . . . ?
C31 C4 C11 C12 -170.13(17) . . . . ?
C21 C4 C11 C12 69.4(2) . . . . ?
C16 C11 C12 C13 0.9(3) . . . . ?
C4 C11 C12 C13 -179.31(19) . . . . ?
C11 C12 C13 C14 -0.1(4) . . . . ?
C12 C13 C14 C15 -0.8(4) . . . . ?
C13 C14 C15 C16 0.9(4) . . . . ?
C12 C11 C16 C15 -0.8(3) . . . . ?
C4 C11 C16 C15 179.45(18) . . . . ?
C14 C15 C16 C11 -0.1(3) . . . . ?
N1 C4 C21 C22 115.9(2) . . . . ?
C31 C4 C21 C22 -125.1(2) . . . . ?
C11 C4 C21 C22 -0.9(3) . . . . ?
N1 C4 C21 C26 -70.3(2) . . . . ?
C31 C4 C21 C26 48.8(2) . . . . ?
C11 C4 C21 C26 172.89(17) . . . . ?
C26 C21 C22 C23 1.1(3) . . . . ?
C4 C21 C22 C23 174.9(2) . . . . ?
C21 C22 C23 C24 0.1(4) . . . . ?
C22 C23 C24 C25 -0.7(4) . . . . ?
C23 C24 C25 C26 0.1(4) . . . . ?
C24 C25 C26 C21 1.0(3) . . . . ?
C22 C21 C26 C25 -1.6(3) . . . . ?
C4 C21 C26 C25 -175.73(19) . . . . ?
N1 C4 C31 C32 -6.0(3) . . . . ?
C11 C4 C31 C32 111.5(2) . . . . ?
C21 C4 C31 C32 -125.7(2) . . . . ?
N1 C4 C31 C36 170.66(18) . . . . ?
C11 C4 C31 C36 -71.8(2) . . . . ?
C21 C4 C31 C36 50.9(2) . . . . ?
C36 C31 C32 C33 1.1(3) . . . . ?
C4 C31 C32 C33 177.7(2) . . . . ?
C31 C32 C33 C34 -0.2(4) . . . . ?
C32 C33 C34 C35 -0.6(4) . . . . ?
C33 C34 C35 C36 0.4(4) . . . . ?
C34 C35 C36 C31 0.5(4) . . . . ?
C32 C31 C36 C35 -1.2(3) . . . . ?
C4 C31 C36 C35 -178.0(2) . . . . ?
N2 C5 C41 C42 -11.5(3) . . . . ?
C51 C5 C41 C42 106.5(2) . . . . ?
C61 C5 C41 C42 -131.8(2) . . . . ?
N2 C5 C41 C46 166.69(18) . . . . ?
C51 C5 C41 C46 -75.4(2) . . . . ?
C61 C5 C41 C46 46.3(2) . . . . ?
C46 C41 C42 C43 2.1(3) . . . . ?
C5 C41 C42 C43 -179.8(2) . . . . ?
C41 C42 C43 C44 -1.4(4) . . . . ?
C42 C43 C44 C45 -0.4(4) . . . . ?
C43 C44 C45 C46 1.4(4) . . . . ?
C44 C45 C46 C41 -0.7(4) . . . . ?
C42 C41 C46 C45 -1.0(3) . . . . ?
C5 C41 C46 C45 -179.3(2) . . . . ?
N2 C5 C51 C56 131.63(18) . . . . ?
C41 C5 C51 C56 11.0(2) . . . . ?
C61 C5 C51 C56 -108.2(2) . . . . ?
N2 C5 C51 C52 -50.7(2) . . . . ?
C41 C5 C51 C52 -171.29(16) . . . . ?
C61 C5 C51 C52 69.5(2) . . . . ?
C56 C51 C52 C53 0.3(3) . . . . ?
C5 C51 C52 C53 -177.54(17) . . . . ?
C51 C52 C53 C54 -0.2(3) . . . . ?
C52 C53 C54 C55 0.0(3) . . . . ?
C53 C54 C55 C56 0.2(4) . . . . ?
C52 C51 C56 C55 -0.1(3) . . . . ?
C5 C51 C56 C55 177.59(19) . . . . ?
C54 C55 C56 C51 -0.2(4) . . . . ?
N2 C5 C61 C66 123.65(19) . . . . ?
C41 C5 C61 C66 -116.5(2) . . . . ?
C51 C5 C61 C66 6.8(3) . . . . ?
N2 C5 C61 C62 -64.8(2) . . . . ?
C41 C5 C61 C62 55.1(2) . . . . ?
C51 C5 C61 C62 178.27(18) . . . . ?
C66 C61 C62 C63 -1.3(3) . . . . ?
C5 C61 C62 C63 -173.1(2) . . . . ?
C61 C62 C63 C64 1.6(3) . . . . ?
C62 C63 C64 C65 -0.6(3) . . . . ?
C63 C64 C65 C66 -0.7(3) . . . . ?
C64 C65 C66 C61 1.0(3) . . . . ?
C62 C61 C66 C65 0.0(3) . . . . ?
C5 C61 C66 C65 171.66(19) . . . . ?
C4S O1S C1S C2S 40.2(4) . . . . ?
O1S C1S C2S C3S -35.7(4) . . . . ?
C4S C3S C2S C1S 18.3(4) . . . . ?
C1S O1S C4S C3S -27.2(4) . . . . ?
C2S C3S C4S O1S 4.6(4) . . . . ?
C8S O2S C5S C6S 5.7(4) . . . . ?
O2S C5S C6S C7S -26.1(4) . . . . ?
C5S C6S C7S C8S 35.1(3) . . . . ?
C5S O2S C8S C7S 17.5(4) . . . . ?
C6S C7S C8S O2S -33.3(3) . . . . ?

_refine_diff_density_max         0.774
_refine_diff_density_min         -0.720
_refine_diff_density_rms         0.061

####################################################################### 
# 
# 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_riv17e6
_database_code_depnum_ccdc_archive 'CCDC 1583287'
_audit_update_record             
;
2017-10-31 deposited with the CCDC.
2017-12-14 downloaded from the CCDC.
;

# start Validation Reply Form
_vrf_CHEMW03_riv17e6             
;
PROBLEM: WARNING: The ratio of given/expected molecular weight as
RESPONSE: The reported molecular weight and formula, and therefore
Mu and F000, all contain the contributions of the unresolvable solvent
hexane molecules that were removed by use of the SQUEEZE routine of the
program PLATON.  A total solvent-accessible void volume of 417 cubic
angstroms with a total electron count of 110 (consistent with two molecules
of solvent hexane) was found in the unit cell.  This comment also applies to
alerts FORMU01, CELLZ01, PLAT041, PLAT051, PLAT068, PLAT606 and PLAT869.
;

_vrf_PLAT002_riv17e6             
;
PROBLEM: Number of Distance or Angle Restraints on AtSite
RESPONSE: The anion in this structure is prone to disorder, particularly
with respect to the CF3 groups.  All but one of the CF3 groups was 
rotationally disordered.  Additionally, one of the bis(trifluoromethyl)phenyl
groups also disorderd.  Many restraints/constraints were required to correctly
model the anion.  This comment also applies to alerts PLAT174, PLAT176, 
PLAT230, PLAT242, PLAT300, and PLAT302.
;

# end Validation Reply Form

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C82 H64 Ag2 N4, 2(C32 H12 B F24), 2(C6 H14)'
_chemical_formula_sum            'C158 H116 Ag2 B2 F48 N4'
_chemical_formula_weight         3219.90

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'
B B 0.0090 0.0039 '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'
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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   15.6902(3)
_cell_length_b                   16.2845(4)
_cell_length_c                   16.4921(4)
_cell_angle_alpha                117.7485(13)
_cell_angle_beta                 92.4871(15)
_cell_angle_gamma                105.9078(15)
_cell_volume                     3513.30(15)
_cell_formula_units_Z            1
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    7544
_cell_measurement_theta_min      2.99
_cell_measurement_theta_max      69.91

_exptl_crystal_description       rod
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.522
_exptl_crystal_F_000             1628
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.251
_exptl_crystal_size_mid          0.045
_exptl_crystal_size_min          0.043
_exptl_absorpt_coefficient_mu    3.284
_shelx_estimated_absorpt_T_min   0.493
_shelx_estimated_absorpt_T_max   0.872
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.6236
_exptl_absorpt_correction_T_max  0.9787
_exptl_absorpt_process_details   'SADABS 2016/2 (Krause et al., 2015)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            21964
_diffrn_reflns_av_unetI/netI     0.0868
_diffrn_reflns_av_R_equivalents  0.0514
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         2.989
_diffrn_reflns_theta_max         72.619
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.951
_diffrn_measured_fraction_theta_full 0.964
_diffrn_reflns_Laue_measured_fraction_max 0.951
_diffrn_reflns_Laue_measured_fraction_full 0.964
_diffrn_reflns_point_group_measured_fraction_max 0.951
_diffrn_reflns_point_group_measured_fraction_full 0.964
_reflns_number_total             13276
_reflns_number_gt                9284
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick 2015)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0845P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         13276
_refine_ls_number_parameters     1072
_refine_ls_number_restraints     118
_refine_ls_R_factor_all          0.0852
_refine_ls_R_factor_gt           0.0605
_refine_ls_wR_factor_ref         0.1720
_refine_ls_wR_factor_gt          0.1555
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_restrained_S_all      1.029
_refine_ls_shift/su_max          0.009
_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_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
Ag Ag -0.04201(2) -0.10136(2) 0.08031(2) 0.05133(12) Uani 1 1 d . . . . .
N1 N 0.0924(2) 0.0972(2) 0.2458(2) 0.0410(8) Uani 1 1 d . . . . .
N2 N 0.1309(2) -0.0261(2) 0.2304(2) 0.0474(8) Uani 1 1 d . . . . .
C1 C 0.0682(3) -0.0026(3) 0.1933(3) 0.0415(9) Uani 1 1 d . . . . .
C2 C 0.1721(3) 0.1353(3) 0.3092(3) 0.0563(12) Uani 1 1 d . . . . .
H2 H 0.203469 0.202868 0.352119 0.068 Uiso 1 1 calc R U . . .
C3 C 0.1971(3) 0.0592(3) 0.2991(3) 0.0598(13) Uani 1 1 d . . . . .
H3 H 0.250085 0.062795 0.332514 0.072 Uiso 1 1 calc R U . . .
C4 C 0.0405(3) 0.1573(3) 0.2334(3) 0.0391(9) Uani 1 1 d . . . . .
C5 C 0.1346(3) -0.1275(3) 0.1974(3) 0.0478(10) Uani 1 1 d . . . . .
C11 C 0.0561(3) 0.2530(3) 0.3293(3) 0.0404(9) Uani 1 1 d . . . . .
C12 C -0.0118(3) 0.2691(3) 0.3807(3) 0.0448(10) Uani 1 1 d . . . . .
H12 H -0.069179 0.219037 0.359619 0.054 Uiso 1 1 calc R U . . .
C13 C 0.0040(3) 0.3580(3) 0.4626(3) 0.0542(11) Uani 1 1 d . . . . .
H13 H -0.042767 0.367986 0.497003 0.065 Uiso 1 1 calc R U . . .
C14 C 0.0864(3) 0.4315(3) 0.4942(3) 0.0545(12) Uani 1 1 d . . . . .
H14 H 0.096795 0.492003 0.550249 0.065 Uiso 1 1 calc R U . . .
C15 C 0.1539(3) 0.4165(3) 0.4439(3) 0.0505(10) Uani 1 1 d . . . . .
H15 H 0.211348 0.466500 0.465926 0.061 Uiso 1 1 calc R U . . .
C16 C 0.1386(3) 0.3298(3) 0.3623(3) 0.0460(10) Uani 1 1 d . . . . .
H16 H 0.185190 0.321815 0.327412 0.055 Uiso 1 1 calc R U . . .
C21 C 0.0761(3) 0.1889(3) 0.1640(3) 0.0416(9) Uani 1 1 d . . . . .
C22 C 0.0567(3) 0.2671(3) 0.1624(3) 0.0467(10) Uani 1 1 d . . . . .
H22 H 0.019702 0.297357 0.202323 0.056 Uiso 1 1 calc R U . . .
C23 C 0.0906(3) 0.3011(3) 0.1036(3) 0.0511(11) Uani 1 1 d . . . . .
H23 H 0.076226 0.354110 0.103648 0.061 Uiso 1 1 calc R U . . .
C24 C 0.1449(3) 0.2593(3) 0.0449(3) 0.0500(10) Uani 1 1 d . . . . .
H24 H 0.167827 0.282940 0.004572 0.060 Uiso 1 1 calc R U . . .
C25 C 0.1654(3) 0.1816(3) 0.0458(3) 0.0512(11) Uani 1 1 d . . . . .
H25 H 0.203087 0.152303 0.006205 0.061 Uiso 1 1 calc R U . . .
C26 C 0.1306(3) 0.1464(3) 0.1048(3) 0.0454(10) Uani 1 1 d . . . . .
H26 H 0.144486 0.092963 0.104305 0.054 Uiso 1 1 calc R U . . .
C31 C -0.0607(3) 0.0943(3) 0.2014(3) 0.0423(9) Uani 1 1 d . . . . .
C32 C -0.0998(3) 0.0476(3) 0.2499(3) 0.0471(10) Uani 1 1 d . . . . .
H32 H -0.062984 0.051704 0.299856 0.057 Uiso 1 1 calc R U . . .
C33 C -0.1920(3) -0.0049(3) 0.2260(3) 0.0528(11) Uani 1 1 d . . . . .
H33 H -0.217675 -0.036979 0.259038 0.063 Uiso 1 1 calc R U . . .
C34 C -0.2460(3) -0.0103(3) 0.1542(3) 0.0580(12) Uani 1 1 d . . . . .
H34 H -0.309003 -0.045525 0.137948 0.070 Uiso 1 1 calc R U . . .
C35 C -0.2079(3) 0.0358(3) 0.1063(3) 0.0560(12) Uani 1 1 d . . . . .
H35 H -0.245192 0.032694 0.057269 0.067 Uiso 1 1 calc R U . . .
C36 C -0.1164(3) 0.0864(3) 0.1283(3) 0.0473(10) Uani 1 1 d . . . . .
H36 H -0.091082 0.116132 0.093213 0.057 Uiso 1 1 calc R U . . .
C41 C 0.1882(3) -0.1481(3) 0.1188(3) 0.0526(11) Uani 1 1 d . . . . .
C42 C 0.2825(4) -0.1078(4) 0.1410(5) 0.0780(16) Uani 1 1 d . . . . .
H42 H 0.312943 -0.068219 0.204610 0.094 Uiso 1 1 calc R U . . .
C43 C 0.3324(5) -0.1256(5) 0.0694(6) 0.091(2) Uani 1 1 d . . . . .
H43 H 0.396589 -0.099012 0.084860 0.109 Uiso 1 1 calc R U . . .
C44 C 0.2894(5) -0.1804(5) -0.0215(5) 0.090(2) Uani 1 1 d . . . . .
H44 H 0.323620 -0.193301 -0.069470 0.108 Uiso 1 1 calc R U . . .
C45 C 0.1975(5) -0.2172(5) -0.0445(4) 0.0820(19) Uani 1 1 d . . . . .
H45 H 0.167796 -0.254676 -0.108377 0.098 Uiso 1 1 calc R U . . .
C46 C 0.1472(4) -0.2000(4) 0.0251(4) 0.0641(13) Uani 1 1 d . . . . .
H46 H 0.083058 -0.224541 0.008114 0.077 Uiso 1 1 calc R U . . .
C51 C 0.0386(3) -0.2037(3) 0.1676(3) 0.0492(10) Uani 1 1 d . . . . .
C52 C 0.0254(4) -0.3023(3) 0.1075(4) 0.0649(13) Uani 1 1 d . . . . .
H52 H 0.073472 -0.321475 0.079753 0.078 Uiso 1 1 calc R U . . .
C53 C -0.0579(4) -0.3730(4) 0.0877(5) 0.0799(17) Uani 1 1 d . . . . .
H53 H -0.065977 -0.440333 0.046311 0.096 Uiso 1 1 calc R U . . .
C54 C -0.1281(4) -0.3479(4) 0.1264(4) 0.0751(16) Uani 1 1 d . . . . .
H54 H -0.185313 -0.396678 0.110765 0.090 Uiso 1 1 calc R U . . .
C55 C -0.1147(3) -0.2506(4) 0.1885(4) 0.0639(13) Uani 1 1 d . . . . .
H55 H -0.162510 -0.232220 0.217641 0.077 Uiso 1 1 calc R U . . .
C56 C -0.0321(3) -0.1792(4) 0.2088(3) 0.0522(11) Uani 1 1 d . . . . .
H56 H -0.023968 -0.112305 0.251678 0.063 Uiso 1 1 calc R U . . .
C61 C 0.1778(3) -0.1313(3) 0.2814(3) 0.0514(10) Uani 1 1 d . . . . .
C62 C 0.2258(4) -0.1950(4) 0.2667(4) 0.0745(16) Uani 1 1 d . . . . .
H62 H 0.237884 -0.230235 0.206217 0.089 Uiso 1 1 calc R U . . .
C63 C 0.2563(5) -0.2084(5) 0.3367(5) 0.092(2) Uani 1 1 d . . . . .
H63 H 0.288413 -0.253310 0.324361 0.110 Uiso 1 1 calc R U . . .
C64 C 0.2408(5) -0.1577(5) 0.4248(5) 0.090(2) Uani 1 1 d . . . . .
H64 H 0.264036 -0.165101 0.474186 0.108 Uiso 1 1 calc R U . . .
C65 C 0.1908(4) -0.0952(4) 0.4409(4) 0.0754(15) Uani 1 1 d . . . . .
H65 H 0.178338 -0.060700 0.501290 0.090 Uiso 1 1 calc R U . . .
C66 C 0.1591(3) -0.0833(4) 0.3685(3) 0.0603(12) Uani 1 1 d . . . . .
H66 H 0.123959 -0.041410 0.379528 0.072 Uiso 1 1 calc R U . . .
F71A F 0.6798(4) 0.1650(3) 0.3236(3) 0.1080(17) Uani 0.85 1 d D . P A 1
F72A F 0.7087(5) 0.3107(5) 0.4325(2) 0.126(2) Uani 0.85 1 d D . P A 1
F73A F 0.7906(3) 0.2739(6) 0.3341(5) 0.141(2) Uani 0.85 1 d D . P A 1
F71B F 0.7702(12) 0.3304(11) 0.4104(12) 0.054(5) Uiso 0.15 1 d D . P A 2
F72B F 0.7455(17) 0.1921(16) 0.3099(14) 0.070(6) Uiso 0.15 1 d D . P A 2
F73B F 0.6540(13) 0.227(2) 0.3925(16) 0.078(6) Uiso 0.15 1 d D . P A 2
F74A F 0.3847(4) 0.1157(6) 0.1364(4) 0.139(3) Uani 0.7 1 d D . P B 1
F75A F 0.3983(6) 0.1814(5) 0.0549(8) 0.177(5) Uani 0.7 1 d D . P B 1
F76A F 0.4556(4) 0.0726(5) 0.0338(6) 0.148(3) Uani 0.7 1 d D . P B 1
F74B F 0.4559(9) 0.1375(10) 0.0118(6) 0.076(3) Uiso 0.3 1 d D . P B 2
F75B F 0.4211(11) 0.0667(8) 0.0895(12) 0.093(4) Uiso 0.3 1 d D . P B 2
F76B F 0.3752(8) 0.1821(11) 0.1049(9) 0.079(4) Uiso 0.3 1 d D . P B 2
F81A F 0.6347(6) 0.2884(5) -0.1008(4) 0.083(2) Uani 0.55 1 d D . P C 1
F82A F 0.7317(9) 0.3978(10) -0.1132(10) 0.129(5) Uani 0.55 1 d D . P C 1
F83A F 0.5933(5) 0.3587(4) -0.1709(3) 0.0840(18) Uani 0.55 1 d D . P C 1
F84A F 0.5521(8) 0.6857(9) 0.0304(12) 0.152(6) Uani 0.55 1 d D . P C 1
F85A F 0.6054(16) 0.7602(10) 0.1693(9) 0.177(7) Uani 0.55 1 d D . P C 1
F86A F 0.6913(10) 0.7498(11) 0.0771(12) 0.103(5) Uani 0.55 1 d D . P C 1
F81B F 0.6478(7) 0.3112(11) -0.1458(8) 0.174(9) Uani 0.45 1 d D . P C 2
F82B F 0.7600(8) 0.4322(11) -0.1150(10) 0.090(4) Uani 0.45 1 d D . P C 2
F83B F 0.7673(6) 0.3547(7) -0.0503(5) 0.103(3) Uani 0.45 1 d D . P C 2
F84B F 0.6757(10) 0.7618(10) 0.1208(18) 0.136(9) Uani 0.45 1 d D . P C 2
F85B F 0.5862(11) 0.6623(10) -0.0123(6) 0.114(6) Uani 0.45 1 d D . P C 2
F86B F 0.5429(7) 0.7019(7) 0.1139(8) 0.083(3) Uani 0.45 1 d D . P C 2
F91A F 0.9970(4) 0.4751(4) 0.2923(4) 0.1069(15) Uani 0.9 1 d D . P D 1
F92A F 0.9710(3) 0.4721(3) 0.1659(3) 0.0973(13) Uani 0.9 1 d D . P D 1
F93A F 1.0752(3) 0.5931(3) 0.2757(6) 0.143(2) Uani 0.9 1 d D . P D 1
F91B F 1.035(2) 0.559(3) 0.202(2) 0.074(9) Uiso 0.1 1 d D . P D 2
F92B F 1.0621(16) 0.565(3) 0.3253(16) 0.065(8) Uiso 0.1 1 d D . P D 2
F93B F 0.967(3) 0.4365(7) 0.218(3) 0.095(11) Uiso 0.1 1 d D . P D 2
F94A F 0.9460(6) 0.8897(3) 0.4148(3) 0.132(3) Uani 0.8 1 d D . P E 1
F95A F 0.9826(5) 0.8702(3) 0.5233(4) 0.133(2) Uani 0.8 1 d D . P E 1
F96A F 0.8525(3) 0.8669(3) 0.4896(6) 0.152(3) Uani 0.8 1 d D . P E 1
F94B F 0.9050(11) 0.8564(10) 0.5363(7) 0.051(3) Uiso 0.2 1 d D . P E 2
F95B F 0.8747(11) 0.8796(10) 0.4283(11) 0.055(3) Uiso 0.2 1 d D . P E 2
F96B F 1.0030(6) 0.8828(9) 0.4627(12) 0.059(3) Uiso 0.2 1 d D . P E 2
F101 F 0.6480(2) 0.6416(2) 0.60987(18) 0.0755(9) Uani 1 1 d . . . . .
F102 F 0.6078(2) 0.7615(2) 0.6243(2) 0.0868(10) Uani 1 1 d . . . . .
F103 F 0.5134(2) 0.6385(2) 0.62368(18) 0.0750(8) Uani 1 1 d . . . . .
F14A F 0.3255(4) 0.6080(4) 0.3158(6) 0.144(3) Uani 0.8 1 d D . P F 1
F15A F 0.3209(3) 0.4718(4) 0.2117(3) 0.1001(16) Uani 0.8 1 d D . P F 1
F16A F 0.2832(3) 0.4888(6) 0.3377(5) 0.128(2) Uani 0.8 1 d D . P F 1
F14B F 0.3054(11) 0.4317(7) 0.2548(13) 0.080(5) Uiso 0.2 1 d D . P F 2
F15B F 0.2972(10) 0.5679(12) 0.3645(9) 0.061(4) Uiso 0.2 1 d D . P F 2
F16B F 0.3423(12) 0.5646(14) 0.2465(12) 0.078(5) Uiso 0.2 1 d D . P F 2
C71 C 0.6346(3) 0.3953(3) 0.2374(2) 0.0378(8) Uani 1 1 d . . . . .
C72 C 0.6805(3) 0.3700(3) 0.2916(3) 0.0415(9) Uani 1 1 d . . . . .
H72 H 0.733224 0.418544 0.336603 0.050 Uiso 1 1 calc R U . . .
C73 C 0.6529(3) 0.2770(3) 0.2830(3) 0.0453(10) Uani 1 1 d . . . . .
C74 C 0.5755(3) 0.2045(3) 0.2194(3) 0.0491(10) Uani 1 1 d . . . . .
H74 H 0.555555 0.141043 0.213483 0.059 Uiso 1 1 calc R U . . .
C75 C 0.5278(3) 0.2276(3) 0.1643(3) 0.0476(10) Uani 1 1 d . . . . .
C76 C 0.5567(3) 0.3197(3) 0.1725(3) 0.0439(9) Uani 1 1 d . . . . .
H76 H 0.523058 0.332566 0.133163 0.053 Uiso 1 1 calc R U . . .
C77 C 0.7056(3) 0.2566(3) 0.3442(3) 0.0616(13) Uani 1 1 d D . . . .
C78 C 0.4431(4) 0.1515(3) 0.0959(4) 0.0707(15) Uani 1 1 d D . . . .
C81A C 0.6423(8) 0.5081(6) 0.1554(4) 0.043(5) Uani 0.55 1 d DG . P C 1
C82A C 0.6459(6) 0.4361(5) 0.0678(5) 0.033(2) Uani 0.55 1 d G . P C 1
H82A H 0.652020 0.376488 0.059929 0.039 Uiso 0.55 1 calc R U P C 1
C83A C 0.6406(6) 0.4512(6) -0.0083(4) 0.044(3) Uani 0.55 1 d DG . P C 1
C84A C 0.6317(8) 0.5384(8) 0.0032(5) 0.046(3) Uani 0.55 1 d G . P C 1
H84A H 0.628086 0.548704 -0.048835 0.056 Uiso 0.55 1 calc R U P C 1
C85A C 0.6281(10) 0.6104(6) 0.0907(7) 0.046(4) Uani 0.55 1 d DG . P C 1
C86A C 0.6334(10) 0.5953(6) 0.1668(4) 0.037(3) Uani 0.55 1 d G . P C 1
H86A H 0.630880 0.644588 0.226695 0.044 Uiso 0.55 1 calc R U P C 1
C87A C 0.6485(6) 0.3720(6) -0.1006(6) 0.063(3) Uani 0.55 1 d D . P C 1
C88A C 0.6189(7) 0.6994(8) 0.0896(7) 0.076(7) Uani 0.55 1 d D . P C 1
C81B C 0.6439(9) 0.5166(8) 0.1601(4) 0.042(7) Uani 0.45 1 d DG . P C 2
C82B C 0.6729(8) 0.4499(6) 0.0873(6) 0.041(3) Uani 0.45 1 d G . P C 2
H82B H 0.690966 0.401895 0.094024 0.049 Uiso 0.45 1 calc R U P C 2
C83B C 0.6755(7) 0.4534(9) 0.0048(5) 0.055(4) Uani 0.45 1 d DG . P C 2
C84B C 0.6491(9) 0.5236(11) -0.0049(7) 0.051(4) Uani 0.45 1 d G . P C 2
H84B H 0.650838 0.526021 -0.061329 0.062 Uiso 0.45 1 calc R U P C 2
C85B C 0.6200(11) 0.5904(9) 0.0678(8) 0.030(3) Uani 0.45 1 d DG . P C 2
C86B C 0.6175(11) 0.5869(8) 0.1503(6) 0.030(3) Uani 0.45 1 d G . P C 2
H86B H 0.597620 0.632495 0.200007 0.036 Uiso 0.45 1 calc R U P C 2
C87B C 0.7098(7) 0.3873(7) -0.0763(6) 0.068(4) Uani 0.45 1 d D . P C 2
C88B C 0.6084(8) 0.6806(9) 0.0724(7) 0.067(6) Uani 0.45 1 d D . P C 2
C91 C 0.7670(3) 0.5713(3) 0.2997(2) 0.0383(8) Uani 1 1 d . . . . .
C92 C 0.8339(3) 0.5296(3) 0.2673(3) 0.0433(9) Uani 1 1 d . . . . .
H92 H 0.816202 0.460923 0.224835 0.052 Uiso 1 1 calc R U . . .
C93 C 0.9251(3) 0.5848(3) 0.2948(3) 0.0497(10) Uani 1 1 d . . . . .
C94 C 0.9551(3) 0.6857(3) 0.3555(3) 0.0481(10) Uani 1 1 d . . . . .
H94 H 1.017559 0.723577 0.373845 0.058 Uiso 1 1 calc R U . . .
C95 C 0.8894(3) 0.7289(3) 0.3883(3) 0.0437(9) Uani 1 1 d . . . . .
C96 C 0.7985(3) 0.6734(3) 0.3612(3) 0.0400(9) Uani 1 1 d . . . . .
H96 H 0.755727 0.705556 0.385131 0.048 Uiso 1 1 calc R U . . .
C97 C 0.9924(3) 0.5330(3) 0.2579(3) 0.0634(13) Uani 1 1 d D . . . .
C98 C 0.9184(3) 0.8370(3) 0.4536(3) 0.0559(11) Uani 1 1 d D . . . .
C101 C 0.5916(3) 0.5497(3) 0.3256(3) 0.0384(8) Uani 1 1 d . . . . .
C102 C 0.6138(3) 0.5919(3) 0.4225(3) 0.0403(9) Uani 1 1 d . . . . .
H102 H 0.673766 0.605433 0.450627 0.048 Uiso 1 1 calc R U . . .
C103 C 0.5516(3) 0.6149(3) 0.4797(3) 0.0443(9) Uani 1 1 d . . . . .
C104 C 0.4636(3) 0.5956(3) 0.4413(3) 0.0502(10) Uani 1 1 d . . . . .
H104 H 0.420816 0.611475 0.479925 0.060 Uiso 1 1 calc R U . . .
C105 C 0.4392(3) 0.5527(3) 0.3454(3) 0.0484(10) Uani 1 1 d . . . . .
C106 C 0.5017(3) 0.5311(3) 0.2893(3) 0.0435(9) Uani 1 1 d . . . . .
H106 H 0.483045 0.502554 0.223663 0.052 Uiso 1 1 calc R U . . .
C107 C 0.5796(3) 0.6628(4) 0.5833(3) 0.0531(11) Uani 1 1 d . . . . .
C108 C 0.3428(3) 0.5282(4) 0.3020(3) 0.0673(14) Uani 1 1 d D . . . .
B B 0.6599(3) 0.5082(3) 0.2565(3) 0.0394(10) Uani 1 1 d 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
Ag C1 2.110(4) . ?
Ag C25 2.348(4) 2 ?
Ag C24 2.444(4) 2 ?
N1 C1 1.363(5) . ?
N1 C2 1.378(5) . ?
N1 C4 1.508(4) . ?
N2 C1 1.364(5) . ?
N2 C3 1.389(5) . ?
N2 C5 1.498(5) . ?
C2 C3 1.340(6) . ?
C4 C21 1.527(6) . ?
C4 C31 1.544(5) . ?
C4 C11 1.566(5) . ?
C5 C41 1.532(6) . ?
C5 C51 1.548(6) . ?
C5 C61 1.550(6) . ?
C11 C12 1.396(6) . ?
C11 C16 1.397(6) . ?
C12 C13 1.391(5) . ?
C13 C14 1.375(7) . ?
C14 C15 1.377(6) . ?
C15 C16 1.370(5) . ?
C21 C26 1.389(5) . ?
C21 C22 1.400(5) . ?
C22 C23 1.382(6) . ?
C23 C24 1.379(6) . ?
C24 C25 1.395(6) . ?
C25 C26 1.402(6) . ?
C31 C36 1.391(5) . ?
C31 C32 1.396(6) . ?
C32 C33 1.392(6) . ?
C33 C34 1.380(6) . ?
C34 C35 1.375(7) . ?
C35 C36 1.378(6) . ?
C41 C46 1.384(7) . ?
C41 C42 1.396(7) . ?
C42 C43 1.406(8) . ?
C43 C44 1.355(9) . ?
C44 C45 1.359(9) . ?
C45 C46 1.386(7) . ?
C51 C56 1.381(6) . ?
C51 C52 1.385(6) . ?
C52 C53 1.389(7) . ?
C53 C54 1.362(8) . ?
C54 C55 1.375(8) . ?
C55 C56 1.385(6) . ?
C61 C66 1.371(6) . ?
C61 C62 1.383(6) . ?
C62 C63 1.362(7) . ?
C63 C64 1.369(9) . ?
C64 C65 1.387(8) . ?
C65 C66 1.388(7) . ?
F71A C77 1.300(5) . ?
F72A C77 1.293(5) . ?
F73A C77 1.321(5) . ?
F71B C77 1.295(8) . ?
F72B C77 1.287(8) . ?
F73B C77 1.310(8) . ?
F74A C78 1.322(6) . ?
F75A C78 1.282(5) . ?
F76A C78 1.291(5) . ?
F74B C78 1.332(7) . ?
F75B C78 1.279(7) . ?
F76B C78 1.280(7) . ?
F81A C87A 1.317(7) . ?
F82A C87A 1.314(8) . ?
F83A C87A 1.311(7) . ?
F84A C88A 1.298(7) . ?
F85A C88A 1.296(7) . ?
F86A C88A 1.292(8) . ?
F81B C87B 1.310(7) . ?
F82B C87B 1.312(8) . ?
F83B C87B 1.311(8) . ?
F84B C88B 1.296(7) . ?
F85B C88B 1.293(7) . ?
F86B C88B 1.296(7) . ?
F91A C97 1.322(5) . ?
F92A C97 1.331(5) . ?
F93A C97 1.316(5) . ?
F91B C97 1.316(9) . ?
F92B C97 1.320(8) . ?
F93B C97 1.318(9) . ?
F94A C98 1.291(5) . ?
F95A C98 1.285(5) . ?
F96A C98 1.311(5) . ?
F94B C98 1.290(7) . ?
F95B C98 1.278(8) . ?
F96B C98 1.296(8) . ?
F101 C107 1.329(5) . ?
F102 C107 1.344(5) . ?
F103 C107 1.327(5) . ?
F14A C108 1.318(5) . ?
F15A C108 1.298(5) . ?
F16A C108 1.305(5) . ?
F14B C108 1.318(8) . ?
F15B C108 1.299(8) . ?
F16B C108 1.302(8) . ?
C71 C72 1.392(5) . ?
C71 C76 1.410(5) . ?
C71 B 1.639(6) . ?
C72 C73 1.392(5) . ?
C73 C74 1.385(6) . ?
C73 C77 1.484(6) . ?
C74 C75 1.394(6) . ?
C75 C76 1.379(5) . ?
C75 C78 1.496(6) . ?
C81A C82A 1.3900 . ?
C81A C86A 1.3900 . ?
C81A B 1.679(6) . ?
C82A C83A 1.3900 . ?
C83A C84A 1.3900 . ?
C83A C87A 1.507(9) . ?
C84A C85A 1.3900 . ?
C85A C86A 1.3900 . ?
C85A C88A 1.503(8) . ?
C81B C82B 1.3900 . ?
C81B C86B 1.3900 . ?
C81B B 1.673(7) . ?
C82B C83B 1.3900 . ?
C83B C84B 1.3900 . ?
C83B C87B 1.510(10) . ?
C84B C85B 1.3900 . ?
C85B C86B 1.3900 . ?
C85B C88B 1.498(9) . ?
C91 C92 1.396(5) . ?
C91 C96 1.405(5) . ?
C91 B 1.629(6) . ?
C92 C93 1.386(6) . ?
C93 C94 1.388(6) . ?
C93 C97 1.505(6) . ?
C94 C95 1.392(6) . ?
C95 C96 1.384(6) . ?
C95 C98 1.490(5) . ?
C101 C102 1.396(5) . ?
C101 C106 1.402(5) . ?
C101 B 1.640(6) . ?
C102 C103 1.390(5) . ?
C103 C104 1.381(6) . ?
C103 C107 1.493(6) . ?
C104 C105 1.381(6) . ?
C105 C106 1.381(6) . ?
C105 C108 1.506(6) . ?

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 Ag C25 168.04(15) . 2 ?
C1 Ag C24 157.96(15) . 2 ?
C25 Ag C24 33.77(14) 2 2 ?
C1 N1 C2 110.6(3) . . ?
C1 N1 C4 124.3(3) . . ?
C2 N1 C4 125.0(3) . . ?
C1 N2 C3 110.0(3) . . ?
C1 N2 C5 126.0(3) . . ?
C3 N2 C5 123.7(3) . . ?
N1 C1 N2 104.7(3) . . ?
N1 C1 Ag 128.5(3) . . ?
N2 C1 Ag 126.8(3) . . ?
C3 C2 N1 107.3(4) . . ?
C2 C3 N2 107.1(4) . . ?
N1 C4 C21 109.9(3) . . ?
N1 C4 C31 107.6(3) . . ?
C21 C4 C31 112.9(3) . . ?
N1 C4 C11 109.0(3) . . ?
C21 C4 C11 107.5(3) . . ?
C31 C4 C11 109.9(3) . . ?
N2 C5 C41 106.1(3) . . ?
N2 C5 C51 111.3(3) . . ?
C41 C5 C51 113.9(4) . . ?
N2 C5 C61 109.0(3) . . ?
C41 C5 C61 113.9(4) . . ?
C51 C5 C61 102.7(3) . . ?
C12 C11 C16 117.4(4) . . ?
C12 C11 C4 122.7(4) . . ?
C16 C11 C4 119.6(4) . . ?
C13 C12 C11 120.4(4) . . ?
C14 C13 C12 120.8(4) . . ?
C13 C14 C15 119.3(4) . . ?
C16 C15 C14 120.4(4) . . ?
C15 C16 C11 121.6(4) . . ?
C26 C21 C22 118.0(4) . . ?
C26 C21 C4 123.0(3) . . ?
C22 C21 C4 118.9(3) . . ?
C23 C22 C21 121.1(4) . . ?
C24 C23 C22 121.1(4) . . ?
C23 C24 C25 118.7(4) . . ?
C23 C24 Ag 104.9(3) . 2 ?
C25 C24 Ag 69.3(2) . 2 ?
C24 C25 C26 120.4(4) . . ?
C24 C25 Ag 76.9(3) . 2 ?
C26 C25 Ag 101.4(3) . 2 ?
C21 C26 C25 120.7(4) . . ?
C36 C31 C32 118.1(4) . . ?
C36 C31 C4 122.2(4) . . ?
C32 C31 C4 119.6(3) . . ?
C33 C32 C31 120.8(4) . . ?
C34 C33 C32 119.9(5) . . ?
C35 C34 C33 119.5(4) . . ?
C34 C35 C36 120.9(4) . . ?
C35 C36 C31 120.7(4) . . ?
C46 C41 C42 117.4(5) . . ?
C46 C41 C5 122.9(4) . . ?
C42 C41 C5 119.6(5) . . ?
C41 C42 C43 120.1(6) . . ?
C44 C43 C42 120.3(6) . . ?
C43 C44 C45 120.4(6) . . ?
C44 C45 C46 120.1(6) . . ?
C41 C46 C45 121.5(6) . . ?
C56 C51 C52 118.0(5) . . ?
C56 C51 C5 122.1(4) . . ?
C52 C51 C5 119.3(4) . . ?
C51 C52 C53 120.2(5) . . ?
C54 C53 C52 121.3(5) . . ?
C53 C54 C55 118.9(6) . . ?
C54 C55 C56 120.4(5) . . ?
C51 C56 C55 121.1(5) . . ?
C66 C61 C62 118.1(4) . . ?
C66 C61 C5 121.4(4) . . ?
C62 C61 C5 119.9(4) . . ?
C63 C62 C61 121.6(5) . . ?
C62 C63 C64 120.4(5) . . ?
C63 C64 C65 119.2(5) . . ?
C64 C65 C66 119.8(6) . . ?
C61 C66 C65 120.9(5) . . ?
C72 C71 C76 115.2(4) . . ?
C72 C71 B 122.8(3) . . ?
C76 C71 B 121.5(3) . . ?
C73 C72 C71 123.2(4) . . ?
C74 C73 C72 120.3(4) . . ?
C74 C73 C77 120.1(4) . . ?
C72 C73 C77 119.5(4) . . ?
C73 C74 C75 117.9(4) . . ?
C76 C75 C74 121.1(4) . . ?
C76 C75 C78 119.6(4) . . ?
C74 C75 C78 119.2(4) . . ?
C75 C76 C71 122.3(4) . . ?
F72B C77 F71B 100.8(14) . . ?
F72A C77 F71A 108.5(5) . . ?
F72B C77 F73B 103.2(15) . . ?
F71B C77 F73B 101.0(14) . . ?
F72A C77 F73A 105.7(6) . . ?
F71A C77 F73A 102.7(5) . . ?
F72B C77 C73 121.2(11) . . ?
F72A C77 C73 113.9(4) . . ?
F71B C77 C73 117.3(9) . . ?
F71A C77 C73 114.4(4) . . ?
F73B C77 C73 110.6(11) . . ?
F73A C77 C73 110.6(4) . . ?
F75B C78 F76B 110.5(10) . . ?
F75A C78 F76A 109.1(7) . . ?
F75A C78 F74A 104.5(8) . . ?
F76A C78 F74A 101.2(6) . . ?
F75B C78 F74B 106.2(9) . . ?
F76B C78 F74B 102.0(8) . . ?
F75B C78 C75 116.8(7) . . ?
F76B C78 C75 113.2(8) . . ?
F75A C78 C75 115.4(4) . . ?
F76A C78 C75 113.5(5) . . ?
F74A C78 C75 111.9(4) . . ?
F74B C78 C75 106.8(7) . . ?
C82A C81A C86A 120.0 . . ?
C82A C81A B 126.3(6) . . ?
C86A C81A B 113.3(6) . . ?
C81A C82A C83A 120.0 . . ?
C84A C83A C82A 120.0 . . ?
C84A C83A C87A 122.5(7) . . ?
C82A C83A C87A 117.5(7) . . ?
C85A C84A C83A 120.0 . . ?
C84A C85A C86A 120.0 . . ?
C84A C85A C88A 112.4(7) . . ?
C86A C85A C88A 127.6(7) . . ?
C85A C86A C81A 120.0 . . ?
F83A C87A F82A 108.2(10) . . ?
F83A C87A F81A 110.3(8) . . ?
F82A C87A F81A 105.9(10) . . ?
F83A C87A C83A 111.9(7) . . ?
F82A C87A C83A 108.9(9) . . ?
F81A C87A C83A 111.4(7) . . ?
F86A C88A F85A 105.0(12) . . ?
F86A C88A F84A 106.5(12) . . ?
F85A C88A F84A 102.8(11) . . ?
F86A C88A C85A 112.9(11) . . ?
F85A C88A C85A 110.8(8) . . ?
F84A C88A C85A 117.6(9) . . ?
C82B C81B C86B 120.0 . . ?
C82B C81B B 111.2(7) . . ?
C86B C81B B 128.2(7) . . ?
C81B C82B C83B 120.0 . . ?
C82B C83B C84B 120.0 . . ?
C82B C83B C87B 124.0(8) . . ?
C84B C83B C87B 115.9(8) . . ?
C85B C84B C83B 120.0 . . ?
C84B C85B C86B 120.0 . . ?
C84B C85B C88B 123.9(9) . . ?
C86B C85B C88B 114.9(9) . . ?
C85B C86B C81B 120.0 . . ?
F81B C87B F83B 107.6(11) . . ?
F81B C87B F82B 105.0(13) . . ?
F83B C87B F82B 100.4(9) . . ?
F81B C87B C83B 115.9(9) . . ?
F83B C87B C83B 112.4(7) . . ?
F82B C87B C83B 114.2(11) . . ?
F85B C88B F84B 111.6(17) . . ?
F85B C88B F86B 106.8(10) . . ?
F84B C88B F86B 102.1(14) . . ?
F85B C88B C85B 108.1(9) . . ?
F84B C88B C85B 116.3(13) . . ?
F86B C88B C85B 111.4(10) . . ?
C92 C91 C96 115.3(4) . . ?
C92 C91 B 121.5(3) . . ?
C96 C91 B 122.5(3) . . ?
C93 C92 C91 122.4(4) . . ?
C92 C93 C94 121.5(4) . . ?
C92 C93 C97 118.6(4) . . ?
C94 C93 C97 119.8(4) . . ?
C93 C94 C95 117.0(4) . . ?
C96 C95 C94 121.3(4) . . ?
C96 C95 C98 119.8(4) . . ?
C94 C95 C98 118.9(4) . . ?
C95 C96 C91 122.4(4) . . ?
F91B C97 F93B 108(3) . . ?
F91B C97 F92B 99(2) . . ?
F93B C97 F92B 105(2) . . ?
F93A C97 F91A 107.1(5) . . ?
F93A C97 F92A 106.3(5) . . ?
F91A C97 F92A 103.4(4) . . ?
F93A C97 C93 113.8(4) . . ?
F91B C97 C93 112.9(15) . . ?
F93B C97 C93 119.6(18) . . ?
F92B C97 C93 110.6(14) . . ?
F91A C97 C93 112.0(4) . . ?
F92A C97 C93 113.5(4) . . ?
F95B C98 F94B 105.8(10) . . ?
F95A C98 F94A 105.0(5) . . ?
F95B C98 F96B 105.5(10) . . ?
F94B C98 F96B 106.8(10) . . ?
F95A C98 F96A 105.9(5) . . ?
F94A C98 F96A 102.1(5) . . ?
F95B C98 C95 112.9(8) . . ?
F95A C98 C95 115.1(4) . . ?
F94B C98 C95 111.3(7) . . ?
F94A C98 C95 114.2(4) . . ?
F96B C98 C95 113.9(7) . . ?
F96A C98 C95 113.3(4) . . ?
C102 C101 C106 115.3(4) . . ?
C102 C101 B 122.8(3) . . ?
C106 C101 B 121.2(3) . . ?
C103 C102 C101 122.6(4) . . ?
C104 C103 C102 120.3(4) . . ?
C104 C103 C107 119.2(4) . . ?
C102 C103 C107 120.4(4) . . ?
C103 C104 C105 118.5(4) . . ?
C106 C105 C104 120.8(4) . . ?
C106 C105 C108 120.0(4) . . ?
C104 C105 C108 119.3(4) . . ?
C105 C106 C101 122.4(4) . . ?
F103 C107 F101 106.1(4) . . ?
F103 C107 F102 106.2(4) . . ?
F101 C107 F102 105.4(4) . . ?
F103 C107 C103 113.2(4) . . ?
F101 C107 C103 113.5(3) . . ?
F102 C107 C103 111.9(4) . . ?
F15B C108 F16B 106.3(11) . . ?
F15A C108 F16A 107.4(5) . . ?
F15B C108 F14B 110.9(12) . . ?
F16B C108 F14B 110.5(12) . . ?
F15A C108 F14A 103.6(5) . . ?
F16A C108 F14A 104.6(6) . . ?
F15A C108 C105 115.5(4) . . ?
F15B C108 C105 111.8(8) . . ?
F16B C108 C105 109.2(9) . . ?
F16A C108 C105 113.5(4) . . ?
F14B C108 C105 108.1(8) . . ?
F14A C108 C105 111.2(5) . . ?
C91 B C71 112.6(3) . . ?
C91 B C101 114.9(3) . . ?
C71 B C101 102.1(3) . . ?
C91 B C81B 102.0(6) . . ?
C71 B C81B 114.4(5) . . ?
C101 B C81B 111.3(5) . . ?
C91 B C81A 103.7(5) . . ?
C71 B C81A 110.5(4) . . ?
C101 B C81A 113.4(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
C2 N1 C1 N2 4.5(5) . . . . ?
C4 N1 C1 N2 -177.5(3) . . . . ?
C2 N1 C1 Ag -176.1(3) . . . . ?
C4 N1 C1 Ag 1.9(6) . . . . ?
C3 N2 C1 N1 -5.3(5) . . . . ?
C5 N2 C1 N1 -179.9(4) . . . . ?
C3 N2 C1 Ag 175.3(3) . . . . ?
C5 N2 C1 Ag 0.7(6) . . . . ?
C1 N1 C2 C3 -2.0(6) . . . . ?
C4 N1 C2 C3 -179.9(4) . . . . ?
N1 C2 C3 N2 -1.4(6) . . . . ?
C1 N2 C3 C2 4.3(6) . . . . ?
C5 N2 C3 C2 179.0(4) . . . . ?
C1 N1 C4 C21 -90.4(4) . . . . ?
C2 N1 C4 C21 87.3(5) . . . . ?
C1 N1 C4 C31 32.8(5) . . . . ?
C2 N1 C4 C31 -149.4(4) . . . . ?
C1 N1 C4 C11 152.0(4) . . . . ?
C2 N1 C4 C11 -30.3(6) . . . . ?
C1 N2 C5 C41 86.4(5) . . . . ?
C3 N2 C5 C41 -87.5(5) . . . . ?
C1 N2 C5 C51 -38.0(6) . . . . ?
C3 N2 C5 C51 148.2(4) . . . . ?
C1 N2 C5 C61 -150.5(4) . . . . ?
C3 N2 C5 C61 35.6(6) . . . . ?
N1 C4 C11 C12 -110.4(4) . . . . ?
C21 C4 C11 C12 130.5(4) . . . . ?
C31 C4 C11 C12 7.3(5) . . . . ?
N1 C4 C11 C16 75.1(4) . . . . ?
C21 C4 C11 C16 -44.0(4) . . . . ?
C31 C4 C11 C16 -167.2(3) . . . . ?
C16 C11 C12 C13 -1.3(6) . . . . ?
C4 C11 C12 C13 -176.0(4) . . . . ?
C11 C12 C13 C14 0.1(6) . . . . ?
C12 C13 C14 C15 0.0(7) . . . . ?
C13 C14 C15 C16 1.1(6) . . . . ?
C14 C15 C16 C11 -2.4(6) . . . . ?
C12 C11 C16 C15 2.4(6) . . . . ?
C4 C11 C16 C15 177.2(4) . . . . ?
N1 C4 C21 C26 15.3(5) . . . . ?
C31 C4 C21 C26 -104.8(4) . . . . ?
C11 C4 C21 C26 133.9(4) . . . . ?
N1 C4 C21 C22 -161.7(3) . . . . ?
C31 C4 C21 C22 78.2(4) . . . . ?
C11 C4 C21 C22 -43.2(5) . . . . ?
C26 C21 C22 C23 0.1(6) . . . . ?
C4 C21 C22 C23 177.3(4) . . . . ?
C21 C22 C23 C24 -0.2(6) . . . . ?
C22 C23 C24 C25 -0.1(6) . . . . ?
C22 C23 C24 Ag 74.2(4) . . . 2 ?
C23 C24 C25 C26 0.6(6) . . . . ?
Ag C24 C25 C26 -95.6(4) 2 . . . ?
C23 C24 C25 Ag 96.2(4) . . . 2 ?
C22 C21 C26 C25 0.4(6) . . . . ?
C4 C21 C26 C25 -176.7(4) . . . . ?
C24 C25 C26 C21 -0.7(6) . . . . ?
Ag C25 C26 C21 -82.1(4) 2 . . . ?
N1 C4 C31 C36 -134.5(4) . . . . ?
C21 C4 C31 C36 -13.1(5) . . . . ?
C11 C4 C31 C36 106.9(4) . . . . ?
N1 C4 C31 C32 49.0(4) . . . . ?
C21 C4 C31 C32 170.4(3) . . . . ?
C11 C4 C31 C32 -69.6(4) . . . . ?
C36 C31 C32 C33 -0.4(6) . . . . ?
C4 C31 C32 C33 176.2(3) . . . . ?
C31 C32 C33 C34 -0.7(6) . . . . ?
C32 C33 C34 C35 0.5(6) . . . . ?
C33 C34 C35 C36 0.7(6) . . . . ?
C34 C35 C36 C31 -1.8(6) . . . . ?
C32 C31 C36 C35 1.6(6) . . . . ?
C4 C31 C36 C35 -174.9(4) . . . . ?
N2 C5 C41 C46 -96.8(5) . . . . ?
C51 C5 C41 C46 25.9(5) . . . . ?
C61 C5 C41 C46 143.3(4) . . . . ?
N2 C5 C41 C42 78.7(5) . . . . ?
C51 C5 C41 C42 -158.6(4) . . . . ?
C61 C5 C41 C42 -41.3(6) . . . . ?
C46 C41 C42 C43 -3.8(8) . . . . ?
C5 C41 C42 C43 -179.5(5) . . . . ?
C41 C42 C43 C44 1.2(9) . . . . ?
C42 C43 C44 C45 1.3(9) . . . . ?
C43 C44 C45 C46 -1.0(9) . . . . ?
C42 C41 C46 C45 4.2(7) . . . . ?
C5 C41 C46 C45 179.7(4) . . . . ?
C44 C45 C46 C41 -1.8(8) . . . . ?
N2 C5 C51 C56 -30.7(5) . . . . ?
C41 C5 C51 C56 -150.5(4) . . . . ?
C61 C5 C51 C56 85.9(4) . . . . ?
N2 C5 C51 C52 158.5(4) . . . . ?
C41 C5 C51 C52 38.6(5) . . . . ?
C61 C5 C51 C52 -85.0(5) . . . . ?
C56 C51 C52 C53 2.0(7) . . . . ?
C5 C51 C52 C53 173.2(5) . . . . ?
C51 C52 C53 C54 0.0(8) . . . . ?
C52 C53 C54 C55 -2.0(8) . . . . ?
C53 C54 C55 C56 2.1(8) . . . . ?
C52 C51 C56 C55 -1.9(6) . . . . ?
C5 C51 C56 C55 -172.9(4) . . . . ?
C54 C55 C56 C51 -0.2(7) . . . . ?
N2 C5 C61 C66 38.9(6) . . . . ?
C41 C5 C61 C66 157.1(4) . . . . ?
C51 C5 C61 C66 -79.3(5) . . . . ?
N2 C5 C61 C62 -150.5(5) . . . . ?
C41 C5 C61 C62 -32.3(6) . . . . ?
C51 C5 C61 C62 91.3(5) . . . . ?
C66 C61 C62 C63 -1.8(9) . . . . ?
C5 C61 C62 C63 -172.7(6) . . . . ?
C61 C62 C63 C64 -0.8(11) . . . . ?
C62 C63 C64 C65 2.4(11) . . . . ?
C63 C64 C65 C66 -1.5(10) . . . . ?
C62 C61 C66 C65 2.7(8) . . . . ?
C5 C61 C66 C65 173.5(5) . . . . ?
C64 C65 C66 C61 -1.1(9) . . . . ?
C76 C71 C72 C73 0.4(6) . . . . ?
B C71 C72 C73 172.2(4) . . . . ?
C71 C72 C73 C74 -1.1(6) . . . . ?
C71 C72 C73 C77 -179.6(4) . . . . ?
C72 C73 C74 C75 0.8(6) . . . . ?
C77 C73 C74 C75 179.3(4) . . . . ?
C73 C74 C75 C76 0.2(7) . . . . ?
C73 C74 C75 C78 -179.0(4) . . . . ?
C74 C75 C76 C71 -0.9(7) . . . . ?
C78 C75 C76 C71 178.3(4) . . . . ?
C72 C71 C76 C75 0.7(6) . . . . ?
B C71 C76 C75 -171.3(4) . . . . ?
C74 C73 C77 F72B 64.7(16) . . . . ?
C72 C73 C77 F72B -116.9(16) . . . . ?
C74 C73 C77 F72A -117.0(6) . . . . ?
C72 C73 C77 F72A 61.5(7) . . . . ?
C74 C73 C77 F71B -171.2(12) . . . . ?
C72 C73 C77 F71B 7.2(13) . . . . ?
C74 C73 C77 F71A 8.7(7) . . . . ?
C72 C73 C77 F71A -172.9(5) . . . . ?
C74 C73 C77 F73B -56.1(14) . . . . ?
C72 C73 C77 F73B 122.3(14) . . . . ?
C74 C73 C77 F73A 124.1(6) . . . . ?
C72 C73 C77 F73A -57.4(6) . . . . ?
C76 C75 C78 F75B 178.0(11) . . . . ?
C74 C75 C78 F75B -2.7(12) . . . . ?
C76 C75 C78 F76B -52.0(9) . . . . ?
C74 C75 C78 F76B 127.2(8) . . . . ?
C76 C75 C78 F75A -6.1(10) . . . . ?
C74 C75 C78 F75A 173.1(9) . . . . ?
C76 C75 C78 F76A 120.9(7) . . . . ?
C74 C75 C78 F76A -59.9(8) . . . . ?
C76 C75 C78 F74A -125.3(7) . . . . ?
C74 C75 C78 F74A 53.9(8) . . . . ?
C76 C75 C78 F74B 59.5(9) . . . . ?
C74 C75 C78 F74B -121.3(8) . . . . ?
C86A C81A C82A C83A 0.0 . . . . ?
B C81A C82A C83A -172.2(9) . . . . ?
C81A C82A C83A C84A 0.0 . . . . ?
C81A C82A C83A C87A 177.8(8) . . . . ?
C82A C83A C84A C85A 0.0 . . . . ?
C87A C83A C84A C85A -177.6(9) . . . . ?
C83A C84A C85A C86A 0.0 . . . . ?
C83A C84A C85A C88A 179.7(10) . . . . ?
C84A C85A C86A C81A 0.0 . . . . ?
C88A C85A C86A C81A -179.6(12) . . . . ?
C82A C81A C86A C85A 0.0 . . . . ?
B C81A C86A C85A 173.2(8) . . . . ?
C84A C83A C87A F83A -41.1(10) . . . . ?
C82A C83A C87A F83A 141.2(7) . . . . ?
C84A C83A C87A F82A 78.5(10) . . . . ?
C82A C83A C87A F82A -99.2(10) . . . . ?
C84A C83A C87A F81A -165.0(7) . . . . ?
C82A C83A C87A F81A 17.3(10) . . . . ?
C84A C85A C88A F86A -69.8(13) . . . . ?
C86A C85A C88A F86A 109.9(12) . . . . ?
C84A C85A C88A F85A 172.7(13) . . . . ?
C86A C85A C88A F85A -7.6(16) . . . . ?
C84A C85A C88A F84A 54.9(15) . . . . ?
C86A C85A C88A F84A -125.5(13) . . . . ?
C86B C81B C82B C83B 0.0 . . . . ?
B C81B C82B C83B -172.2(9) . . . . ?
C81B C82B C83B C84B 0.0 . . . . ?
C81B C82B C83B C87B 177.1(11) . . . . ?
C82B C83B C84B C85B 0.0 . . . . ?
C87B C83B C84B C85B -177.4(10) . . . . ?
C83B C84B C85B C86B 0.0 . . . . ?
C83B C84B C85B C88B 167.0(12) . . . . ?
C84B C85B C86B C81B 0.0 . . . . ?
C88B C85B C86B C81B -168.1(12) . . . . ?
C82B C81B C86B C85B 0.0 . . . . ?
B C81B C86B C85B 170.8(11) . . . . ?
C82B C83B C87B F81B 99.5(14) . . . . ?
C84B C83B C87B F81B -83.2(14) . . . . ?
C82B C83B C87B F83B -24.8(14) . . . . ?
C84B C83B C87B F83B 152.4(8) . . . . ?
C82B C83B C87B F82B -138.3(10) . . . . ?
C84B C83B C87B F82B 38.9(11) . . . . ?
C84B C85B C88B F85B 30.5(15) . . . . ?
C86B C85B C88B F85B -161.8(11) . . . . ?
C84B C85B C88B F84B -95.9(18) . . . . ?
C86B C85B C88B F84B 71.7(19) . . . . ?
C84B C85B C88B F86B 147.6(10) . . . . ?
C86B C85B C88B F86B -44.7(12) . . . . ?
C96 C91 C92 C93 0.8(6) . . . . ?
B C91 C92 C93 172.0(4) . . . . ?
C91 C92 C93 C94 -1.0(7) . . . . ?
C91 C92 C93 C97 178.6(4) . . . . ?
C92 C93 C94 C95 0.6(6) . . . . ?
C97 C93 C94 C95 -179.0(4) . . . . ?
C93 C94 C95 C96 -0.1(6) . . . . ?
C93 C94 C95 C98 180.0(4) . . . . ?
C94 C95 C96 C91 0.0(6) . . . . ?
C98 C95 C96 C91 179.9(4) . . . . ?
C92 C91 C96 C95 -0.3(6) . . . . ?
B C91 C96 C95 -171.4(4) . . . . ?
C92 C93 C97 F93A 169.6(6) . . . . ?
C94 C93 C97 F93A -10.8(8) . . . . ?
C92 C93 C97 F91B 114(2) . . . . ?
C94 C93 C97 F91B -67(2) . . . . ?
C92 C93 C97 F93B -15(3) . . . . ?
C94 C93 C97 F93B 165(2) . . . . ?
C92 C93 C97 F92B -136.5(18) . . . . ?
C94 C93 C97 F92B 43.1(19) . . . . ?
C92 C93 C97 F91A -68.8(6) . . . . ?
C94 C93 C97 F91A 110.8(5) . . . . ?
C92 C93 C97 F92A 47.9(6) . . . . ?
C94 C93 C97 F92A -132.5(5) . . . . ?
C96 C95 C98 F95B -49.9(11) . . . . ?
C94 C95 C98 F95B 130.0(10) . . . . ?
C96 C95 C98 F95A 131.0(6) . . . . ?
C94 C95 C98 F95A -49.1(7) . . . . ?
C96 C95 C98 F94B 68.9(9) . . . . ?
C94 C95 C98 F94B -111.2(9) . . . . ?
C96 C95 C98 F94A -107.4(6) . . . . ?
C94 C95 C98 F94A 72.5(7) . . . . ?
C96 C95 C98 F96B -170.2(10) . . . . ?
C94 C95 C98 F96B 9.7(10) . . . . ?
C96 C95 C98 F96A 9.0(7) . . . . ?
C94 C95 C98 F96A -171.1(6) . . . . ?
C106 C101 C102 C103 -0.5(6) . . . . ?
B C101 C102 C103 -171.2(4) . . . . ?
C101 C102 C103 C104 0.4(6) . . . . ?
C101 C102 C103 C107 -178.1(4) . . . . ?
C102 C103 C104 C105 0.4(6) . . . . ?
C107 C103 C104 C105 178.9(4) . . . . ?
C103 C104 C105 C106 -1.1(7) . . . . ?
C103 C104 C105 C108 178.1(4) . . . . ?
C104 C105 C106 C101 1.0(7) . . . . ?
C108 C105 C106 C101 -178.2(4) . . . . ?
C102 C101 C106 C105 -0.2(6) . . . . ?
B C101 C106 C105 170.6(4) . . . . ?
C104 C103 C107 F103 32.4(6) . . . . ?
C102 C103 C107 F103 -149.1(4) . . . . ?
C104 C103 C107 F101 153.4(4) . . . . ?
C102 C103 C107 F101 -28.0(6) . . . . ?
C104 C103 C107 F102 -87.5(5) . . . . ?
C102 C103 C107 F102 91.0(5) . . . . ?
C106 C105 C108 F15A 11.8(7) . . . . ?
C104 C105 C108 F15A -167.4(5) . . . . ?
C106 C105 C108 F15B -169.2(10) . . . . ?
C104 C105 C108 F15B 11.6(11) . . . . ?
C106 C105 C108 F16B -51.9(11) . . . . ?
C104 C105 C108 F16B 128.9(11) . . . . ?
C106 C105 C108 F16A 136.4(6) . . . . ?
C104 C105 C108 F16A -42.8(7) . . . . ?
C106 C105 C108 F14B 68.4(11) . . . . ?
C104 C105 C108 F14B -110.8(11) . . . . ?
C106 C105 C108 F14A -106.0(6) . . . . ?
C104 C105 C108 F14A 74.8(7) . . . . ?
C92 C91 B C71 40.8(5) . . . . ?
C96 C91 B C71 -148.7(4) . . . . ?
C92 C91 B C101 157.1(3) . . . . ?
C96 C91 B C101 -32.4(5) . . . . ?
C92 C91 B C81B -82.3(5) . . . . ?
C96 C91 B C81B 88.2(5) . . . . ?
C92 C91 B C81A -78.6(5) . . . . ?
C96 C91 B C81A 91.9(5) . . . . ?
C72 C71 B C91 31.1(5) . . . . ?
C76 C71 B C91 -157.5(4) . . . . ?
C72 C71 B C101 -92.6(4) . . . . ?
C76 C71 B C101 78.7(4) . . . . ?
C72 C71 B C81B 147.1(6) . . . . ?
C76 C71 B C81B -41.6(7) . . . . ?
C72 C71 B C81A 146.6(5) . . . . ?
C76 C71 B C81A -42.1(6) . . . . ?
C102 C101 B C91 -35.4(5) . . . . ?
C106 C101 B C91 154.5(4) . . . . ?
C102 C101 B C71 86.8(4) . . . . ?
C106 C101 B C71 -83.3(4) . . . . ?
C102 C101 B C81B -150.7(6) . . . . ?
C106 C101 B C81B 39.2(6) . . . . ?
C102 C101 B C81A -154.4(5) . . . . ?
C106 C101 B C81A 35.5(6) . . . . ?
C82B C81B B C91 80.4(7) . . . . ?
C86B C81B B C91 -91.0(8) . . . . ?
C82B C81B B C71 -41.6(8) . . . . ?
C86B C81B B C71 147.0(6) . . . . ?
C82B C81B B C101 -156.6(5) . . . . ?
C86B C81B B C101 32.0(9) . . . . ?
C82A C81A B C91 93.7(7) . . . . ?
C86A C81A B C91 -79.0(6) . . . . ?
C82A C81A B C71 -27.2(9) . . . . ?
C86A C81A B C71 160.1(5) . . . . ?
C82A C81A B C101 -141.1(6) . . . . ?
C86A C81A B C101 46.2(6) . . . . ?

_refine_diff_density_max         0.592
_refine_diff_density_min         -1.316
_refine_diff_density_rms         0.072



