# Electronic Supplementary Material (ESI) for Nanoscale.
# This journal is © The Royal Society of Chemistry 2023

####################################################################### 
# 
# 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_X4ESxT-03Jun131503_a
_database_code_depnum_ccdc_archive 'CCDC 2210204'
loop_
_audit_author_name
_audit_author_address
'Sukhendu Mandal'
;IISERTVM
India
;
_audit_update_record             
;
2023-02-07 deposited with the CCDC.	2023-04-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C129 H162 Ag20 F30 N2 O24 S10'
_chemical_formula_weight         5172.60

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0010 0.0012 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -1.4246 0.8625 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0089 0.0077 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0022 0.0024 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0047 0.0045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.0854 0.0941 '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                   15.085(3)
_cell_length_b                   19.980(4)
_cell_length_c                   27.634(6)
_cell_angle_alpha                90
_cell_angle_beta                 96.34(3)
_cell_angle_gamma                90
_cell_volume                     8278(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    120474
_cell_measurement_theta_min      1.099
_cell_measurement_theta_max      24.056

_exptl_crystal_description       Block
_exptl_crystal_colour            Colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.075
_exptl_crystal_F_000             5024
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.050
_exptl_crystal_size_min          0.020
_exptl_absorpt_coefficient_mu    1.745
_shelx_estimated_absorpt_T_min   0.845
_shelx_estimated_absorpt_T_max   0.966
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.6199
_diffrn_radiation_type           Synchrotron
_diffrn_source                   'Elettra Synchrotron - XRD2 BL'
_diffrn_measurement_device_type  'Arinax MD2s Goniometer, Pilatus 6M detector'
_diffrn_measurement_method       'Rotating crystal'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            120474
_diffrn_reflns_av_unetI/netI     0.0496
_diffrn_reflns_av_R_equivalents  0.0828
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_theta_min         1.099
_diffrn_reflns_theta_max         24.056
_diffrn_reflns_theta_full        21.835
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measured_fraction_theta_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_point_group_measured_fraction_full 0.993
_reflns_number_total             19534
_reflns_number_gt                12245
_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       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_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)+(0.2000P)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         19534
_refine_ls_number_parameters     734
_refine_ls_number_restraints     1849
_refine_ls_R_factor_all          0.1625
_refine_ls_R_factor_gt           0.1333
_refine_ls_wR_factor_ref         0.4158
_refine_ls_wR_factor_gt          0.3906
_refine_ls_goodness_of_fit_ref   1.517
_refine_ls_restrained_S_all      1.503
_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
Ag03 Ag 0.60524(7) 0.37950(6) 0.43455(4) 0.0740(3) Uani 1 1 d . . . A 1
Ag06 Ag 0.62487(8) 0.37083(7) 0.55965(4) 0.0759(3) Uani 1 1 d . . . B 1
Ag01 Ag 0.62447(7) 0.64305(7) 0.50810(4) 0.0702(3) Uani 1 1 d . . . C 1
Ag04 Ag 0.52751(7) 0.64735(7) 0.65859(4) 0.0765(4) Uani 1 1 d . . . . .
Ag05 Ag 0.53185(8) 0.49083(7) 0.68697(4) 0.0809(4) Uani 1 1 d . . . B 1
Ag02 Ag 0.51530(7) 0.33673(6) 0.65007(4) 0.0754(3) Uani 1 1 d . . . B 1
Ag07 Ag 0.63556(8) 0.53525(6) 0.60419(5) 0.0770(3) Uani 1 1 d . . . B 1
Ag08 Ag 0.60258(8) 0.54999(7) 0.40178(5) 0.0805(4) Uani 1 1 d . . . D 1
Ag09 Ag 0.52585(8) 0.74501(7) 0.56457(6) 0.0924(4) Uani 1 1 d . . . . .
Ag0A Ag 0.49915(10) 0.24949(8) 0.55108(4) 0.0888(4) Uani 1 1 d . . . . .
S00B S 0.63353(19) 0.42380(16) 0.63819(10) 0.0563(7) Uani 1 1 d . . . . .
S00C S 0.60615(19) 0.29148(19) 0.49368(10) 0.0611(8) Uani 1 1 d . . . . .
S00D S 0.63676(18) 0.65505(17) 0.59577(11) 0.0575(7) Uani 1 1 d . . . . .
S00E S 0.5939(2) 0.44357(19) 0.36129(13) 0.0685(8) Uani 1 1 d . . . . .
S00F S 0.6113(2) 0.6663(2) 0.42206(12) 0.0702(9) Uani 1 1 d . . . . .
C00G C 0.500000 0.500000 0.500000 0.049(4) Uani 1 2 d S . P . .
C00H C 0.7446(13) 0.4055(9) 0.6741(6) 0.125(3) Uani 1 1 d D . . . .
C00I C 0.7055(11) 0.2366(10) 0.4918(5) 0.118(2) Uani 1 1 d D . . . .
C00J C 0.6908(13) 0.4344(8) 0.3273(7) 0.136(3) Uani 1 1 d D . . . .
C00K C 0.7476(10) 0.6899(9) 0.6210(5) 0.108(3) Uani 1 1 d D U . . .
C00L C 0.7226(14) 0.7051(12) 0.4069(7) 0.166(5) Uani 1 1 d D . . . .
O00N O 0.6075(11) 0.5598(11) 0.7439(9) 0.162(8) Uani 1 1 d . . . . .
C00O C 0.9076(11) 0.6694(8) 0.6241(6) 0.1241(18) Uani 1 1 d D U . . .
H00O H 0.955375 0.638356 0.615457 0.149 Uiso 1 1 calc R U . . .
F00Q F 0.3890(11) 0.2909(9) 0.7981(7) 0.192(5) Uani 1 1 d D U . . .
C00S C 0.8834(14) 0.7406(13) 0.4468(6) 0.166(5) Uani 1 1 d D . . . .
H00S H 0.923651 0.747706 0.477600 0.199 Uiso 1 1 calc R U . . .
C00U C 0.7969(13) 0.1376(10) 0.4445(5) 0.118(2) Uani 1 1 d D . . . .
H00A H 0.847253 0.107461 0.439538 0.141 Uiso 1 1 calc R U . . .
H00B H 0.751067 0.132574 0.416245 0.141 Uiso 1 1 calc R U . . .
C00W C 0.769(2) 0.4869(12) 0.5053(12) 0.167(6) Uani 1 1 d D U . . .
C00X C 0.7581(10) 0.1175(9) 0.4900(5) 0.118(2) Uani 1 1 d D . . . .
H00X H 0.739197 0.069519 0.488795 0.141 Uiso 1 1 calc R U . . .
C00Y C 0.8455(10) 0.7258(9) 0.6940(6) 0.1241(18) Uani 1 1 d D U . . .
H00Y H 0.852348 0.730670 0.730247 0.149 Uiso 1 1 calc R U . . .
O00Z O 0.540(2) 0.2336(13) 0.6767(8) 0.220(5) Uani 1 1 d D U . . .
C010 C 0.8293(11) 0.2085(8) 0.4472(5) 0.118(2) Uani 1 1 d D . . . .
H010 H 0.860972 0.218389 0.418107 0.141 Uiso 1 1 calc R U . . .
C011 C 0.8484(11) 0.2037(8) 0.5376(5) 0.118(2) Uani 1 1 d D . . . .
H011 H 0.890942 0.211253 0.567502 0.141 Uiso 1 1 calc R U . . .
O012 O 0.534(2) 0.1731(12) 0.6077(8) 0.220(5) Uani 1 1 d D U . . .
C013 C 0.8990(15) 0.3295(8) 0.6830(7) 0.125(3) Uani 1 1 d D . . . .
H01A H 0.875624 0.302087 0.654606 0.150 Uiso 1 1 calc R U . . .
H01B H 0.958592 0.311739 0.695129 0.150 Uiso 1 1 calc R U . . .
C015 C 0.7538(13) 0.3768(10) 0.3484(8) 0.136(3) Uani 1 1 d D . . . .
H01C H 0.773489 0.386169 0.383097 0.163 Uiso 1 1 calc R U . . .
H01D H 0.720115 0.334239 0.346646 0.163 Uiso 1 1 calc R U . . .
C016 C 0.8579(13) 0.6794(11) 0.3646(7) 0.166(5) Uani 1 1 d D . . . .
H016 H 0.887160 0.648286 0.342909 0.199 Uiso 1 1 calc R U . . .
C017 C 0.8180(13) 0.1322(10) 0.5348(6) 0.118(2) Uani 1 1 d D . . . .
H01E H 0.870877 0.102641 0.535954 0.141 Uiso 1 1 calc R U . . .
H01F H 0.786507 0.121906 0.563457 0.141 Uiso 1 1 calc R U . . .
O018 O 0.5608(17) 0.6590(9) 0.7399(5) 0.154(8) Uani 1 1 d . . . . .
C019 C 0.7956(12) 0.7981(12) 0.3722(7) 0.166(5) Uani 1 1 d D . . . .
H019 H 0.792032 0.843043 0.356257 0.199 Uiso 1 1 calc R U . . .
C01A C 0.7687(11) 0.2501(11) 0.5370(6) 0.118(2) Uani 1 1 d D . . . .
H01G H 0.737875 0.242453 0.566383 0.141 Uiso 1 1 calc R U . . .
H01H H 0.788801 0.297274 0.537236 0.141 Uiso 1 1 calc R U . . .
C01B C 0.9138(15) 0.4524(9) 0.7046(7) 0.125(3) Uani 1 1 d D . . . .
H01I H 0.976081 0.455582 0.719942 0.150 Uiso 1 1 calc R U . . .
H01J H 0.898478 0.495872 0.688628 0.150 Uiso 1 1 calc R U . . .
C01C C 0.7852(15) 0.4750(9) 0.2470(8) 0.136(3) Uani 1 1 d D . . . .
H01K H 0.832182 0.475128 0.224675 0.163 Uiso 1 1 calc R U . . .
H01L H 0.741321 0.510081 0.235819 0.163 Uiso 1 1 calc R U . . .
C01D C 0.7463(14) 0.5012(9) 0.3288(9) 0.136(3) Uani 1 1 d D . . . .
H01M H 0.707797 0.538301 0.315228 0.163 Uiso 1 1 calc R U . . .
H01N H 0.768387 0.512337 0.362868 0.163 Uiso 1 1 calc R U . . .
C01E C 0.8526(13) 0.7921(9) 0.6701(6) 0.1241(18) Uani 1 1 d D U . . .
H01O H 0.908582 0.814159 0.683680 0.149 Uiso 1 1 calc R U . . .
H01P H 0.802186 0.820683 0.677446 0.149 Uiso 1 1 calc R U . . .
C01G C 0.7459(12) 0.3350(9) 0.6959(8) 0.125(3) Uani 1 1 d D . . . .
H01Q H 0.730994 0.301694 0.669766 0.150 Uiso 1 1 calc R U . . .
H01R H 0.700979 0.331636 0.719326 0.150 Uiso 1 1 calc R U . . .
C1 C 0.8553(12) 0.4427(8) 0.7435(7) 0.125(3) Uani 1 1 d D . . . .
H1 H 0.869480 0.474779 0.771082 0.150 Uiso 1 1 calc R U . . .
O21A O 0.4976(16) 0.479(2) 0.4629(16) 0.130(10) Uani 0.45(3) 1 d . U P E 1
C01L C 0.9178(13) 0.7366(10) 0.6014(6) 0.1241(18) Uani 1 1 d D U . . .
H01S H 0.978744 0.753619 0.611276 0.149 Uiso 1 1 calc R U . . .
H01T H 0.910316 0.731873 0.565569 0.149 Uiso 1 1 calc R U . . .
C01M C 0.8516(10) 0.7861(9) 0.6160(6) 0.127(3) Uani 1 1 d D U . . .
H01U H 0.860363 0.830822 0.600925 0.152 Uiso 1 1 calc R U . . .
C01P C 0.8163(10) 0.6393(10) 0.6094(8) 0.127(3) Uani 1 1 d D U . . .
H01V H 0.808993 0.628997 0.574159 0.152 Uiso 1 1 calc R U . . .
H01W H 0.809209 0.597355 0.627623 0.152 Uiso 1 1 calc R U . . .
F01R F 0.9047(19) 0.4711(13) 0.5412(9) 0.233(7) Uani 1 1 d D U . . .
C01S C 0.852(2) 0.4911(10) 0.5043(9) 0.173(6) Uani 1 1 d D U . . .
C01T C 0.8368(16) 0.7468(13) 0.3401(6) 0.166(5) Uani 1 1 d D . . . .
H01X H 0.795157 0.739405 0.310340 0.199 Uiso 1 1 calc R U . . .
H01Y H 0.892563 0.765646 0.330022 0.199 Uiso 1 1 calc R U . . .
F01U F 0.8848(14) 0.4563(11) 0.4719(8) 0.218(6) Uani 1 1 d D U . . .
C01V C 0.8390(10) 0.3208(8) 0.7219(7) 0.128(9) Uani 1 1 d D . . . .
H01Z H 0.843149 0.274472 0.735568 0.153 Uiso 1 1 calc R U . . .
F01W F 0.8951(16) 0.5461(11) 0.4971(9) 0.225(7) Uani 1 1 d D U . . .
C01Y C 0.8475(16) 0.3720(9) 0.7611(6) 0.125(3) Uani 1 1 d D . . . .
H01 H 0.900803 0.361431 0.784015 0.150 Uiso 1 1 calc R U . . .
H H 0.794750 0.368833 0.779328 0.150 Uiso 1 1 calc R U . . .
F01Z F 0.3960(12) 0.3917(10) 0.8300(7) 0.206(6) Uani 1 1 d D U . . .
C020 C 0.596(4) 0.614(2) 0.7587(11) 0.221(5) Uani 1 1 d D . . . .
C021 C 0.9100(12) 0.4000(8) 0.6661(6) 0.137(10) Uani 1 1 d D . . . .
H021 H 0.958824 0.404587 0.644612 0.165 Uiso 1 1 calc R U . . .
C022 C 0.7497(11) 0.2538(10) 0.4470(6) 0.118(2) Uani 1 1 d D . . . .
H02A H 0.707906 0.246461 0.417250 0.141 Uiso 1 1 calc R U . . .
H02B H 0.768602 0.301297 0.447944 0.141 Uiso 1 1 calc R U . . .
C024 C 0.7636(13) 0.4565(10) 0.7154(7) 0.125(3) Uani 1 1 d D . . . .
H02C H 0.716823 0.453347 0.737829 0.150 Uiso 1 1 calc R U . . .
H02D H 0.762324 0.502307 0.701777 0.150 Uiso 1 1 calc R U . . .
C027 C 0.7628(14) 0.6550(13) 0.3725(9) 0.166(5) Uani 1 1 d D . . . .
H02E H 0.724883 0.652787 0.340937 0.199 Uiso 1 1 calc R U . . .
H02F H 0.765778 0.609703 0.387156 0.199 Uiso 1 1 calc R U . . .
F02B F 0.6583(18) 0.1195(11) 0.7121(7) 0.232(7) Uani 1 1 d D U . . .
C02C C 0.7614(12) 0.7569(10) 0.5974(7) 0.126(3) Uani 1 1 d D U . . .
H02G H 0.713693 0.788231 0.604618 0.151 Uiso 1 1 calc R U . . .
H02H H 0.757530 0.751295 0.561612 0.151 Uiso 1 1 calc R U . . .
C02E C 0.8910(11) 0.2218(10) 0.4925(6) 0.118(2) Uani 1 1 d D . . . .
H02I H 0.907357 0.269856 0.493709 0.141 Uiso 1 1 calc R U . . .
H02J H 0.946365 0.195489 0.491529 0.141 Uiso 1 1 calc R U . . .
C02F C 0.7020(14) 0.7736(13) 0.3812(9) 0.166(5) Uani 1 1 d D . . . .
H02K H 0.663171 0.767858 0.350137 0.199 Uiso 1 1 calc R U . . .
H02L H 0.673204 0.804932 0.402347 0.199 Uiso 1 1 calc R U . . .
C02J C 0.9106(15) 0.6839(12) 0.4152(7) 0.166(5) Uani 1 1 d D . . . .
H02M H 0.903616 0.641199 0.432546 0.199 Uiso 1 1 calc R U . . .
H02N H 0.974596 0.689087 0.411190 0.199 Uiso 1 1 calc R U . . .
C02L C 0.7543(11) 0.6990(12) 0.6760(5) 0.1241(18) Uani 1 1 d D U . . .
H02O H 0.707863 0.730712 0.684407 0.149 Uiso 1 1 calc R U . . .
H02P H 0.744564 0.655622 0.691866 0.149 Uiso 1 1 calc R U . . .
C02P C 0.8165(12) 0.4109(12) 0.6385(6) 0.125(3) Uani 1 1 d D . . . .
H02Q H 0.805167 0.376874 0.612544 0.150 Uiso 1 1 calc R U . . .
H02R H 0.813565 0.455669 0.623080 0.150 Uiso 1 1 calc R U . . .
F02Q F 0.2941(12) 0.3692(10) 0.7694(7) 0.196(6) Uani 1 1 d D U . . .
C02S C 0.6573(13) 0.4180(11) 0.2726(7) 0.136(3) Uani 1 1 d D . . . .
H02S H 0.619432 0.377400 0.270939 0.163 Uiso 1 1 calc R U . . .
H02T H 0.620832 0.455607 0.258012 0.163 Uiso 1 1 calc R U . . .
O02V O 0.7297(18) 0.4273(15) 0.5030(10) 0.209(7) Uani 1 1 d D U . . .
C7 C 0.7887(13) 0.7153(15) 0.4539(7) 0.166(5) Uani 1 1 d D . . . .
H7A H 0.761581 0.747577 0.475121 0.199 Uiso 1 1 calc R U . . .
H7B H 0.794709 0.672134 0.471505 0.199 Uiso 1 1 calc R U . . .
C12 C 0.8437(16) 0.8030(12) 0.4238(7) 0.166(5) Uani 1 1 d D . . . .
H12A H 0.892085 0.836368 0.423308 0.199 Uiso 1 1 calc R U . . .
H12B H 0.800849 0.820942 0.445175 0.199 Uiso 1 1 calc R U . . .
F5 F 0.5972(18) 0.0640(11) 0.6539(7) 0.250(7) Uani 1 1 d D U . . .
O21B O 0.5048(15) 0.5507(18) 0.4836(14) 0.138(9) Uani 0.55(3) 1 d . U P E 2
C19 C 0.6790(11) 0.1637(8) 0.4896(7) 0.118(2) Uani 1 1 d D . . . .
H19A H 0.646183 0.153082 0.517718 0.141 Uiso 1 1 calc R U . . .
H19B H 0.638209 0.155699 0.459525 0.141 Uiso 1 1 calc R U . . .
C47 C 0.8371(12) 0.3688(9) 0.3206(7) 0.136(3) Uani 1 1 d D . . . .
H47 H 0.877249 0.332682 0.335383 0.163 Uiso 1 1 calc R U . . .
C6 C 0.8837(13) 0.4369(10) 0.3244(8) 0.148(10) Uani 1 1 d D . . . .
H6A H 0.941107 0.433472 0.310332 0.178 Uiso 1 1 calc R U . . .
H6B H 0.897122 0.448991 0.359219 0.178 Uiso 1 1 calc R U . . .
C5 C 0.7380(11) 0.4064(9) 0.2436(7) 0.136(3) Uani 1 1 d D . . . .
H5 H 0.717707 0.394719 0.208901 0.163 Uiso 1 1 calc R U . . .
C25 C 0.7990(14) 0.3507(8) 0.2682(8) 0.136(3) Uani 1 1 d D . . . .
H25A H 0.764384 0.308678 0.268794 0.163 Uiso 1 1 calc R U . . .
H25B H 0.848994 0.342649 0.248564 0.163 Uiso 1 1 calc R U . . .
C8 C 0.8275(13) 0.4927(8) 0.2981(8) 0.136(3) Uani 1 1 d D . . . .
H8 H 0.862472 0.535228 0.297825 0.163 Uiso 1 1 calc R U . . .
F13 F 0.6622(19) 0.5627(10) 0.8343(8) 0.258(8) Uani 1 1 d D U . . .
F1 F 0.6944(18) 0.6700(10) 0.8278(9) 0.249(8) Uani 1 1 d D U . . .
C9 C 0.9097(13) 0.6747(9) 0.6784(6) 0.1241(18) Uani 1 1 d D U . . .
H9A H 0.970884 0.686769 0.692484 0.149 Uiso 1 1 calc R U . . .
H9B H 0.895305 0.630503 0.691680 0.149 Uiso 1 1 calc R U . . .
C10 C 0.6284(17) 0.6223(10) 0.8101(11) 0.221(5) Uani 1 1 d D U . . .
F31 F 0.5553(18) 0.6397(13) 0.8364(8) 0.265(8) Uani 1 1 d D U . . .
O14 O 0.4873(7) 0.7897(6) 0.6346(4) 0.0924(4) Uani 1 1 d D U . . .
O1 O 0.4748(15) 0.4337(13) 0.7504(8) 0.175(5) Uani 1 1 d . U . . .
F34 F 0.5231(18) 0.1009(11) 0.7086(7) 0.241(7) Uani 1 1 d D U . . .
C42 C 0.444(2) 0.379(2) 0.7547(13) 0.158(5) Uani 1 1 d . U . . .
O80 O 0.4535(13) 0.7428(10) 0.6899(7) 0.152(4) Uani 1 1 d D U . . .
C13 C 0.4407(13) 0.7942(11) 0.6665(7) 0.124(4) Uani 1 1 d D U . . .
O65 O 0.4435(15) 0.3337(13) 0.7212(9) 0.173(5) Uani 1 1 d . U . . .
C32 C 0.3830(15) 0.3578(9) 0.7867(8) 0.168(5) Uani 1 1 d D U . . .
O2 O 0.6028(7) 0.8386(6) 0.5346(5) 0.0924(4) Uani 1 1 d D U . . .
C22 C 0.565(4) 0.1867(14) 0.6508(9) 0.221(5) Uani 1 1 d D U . . .
C4 C 0.5421(18) 0.8585(15) 0.4601(9) 0.143(5) Uani 1 1 d D U . . .
N12 N 0.6235(16) 0.9467(9) 0.5123(8) 0.164(5) Uani 1 1 d D U . . .
C3 C 0.5910(10) 0.8816(9) 0.5056(7) 0.153(5) Uani 1 1 d D U . . .
C21 C 0.667(2) 0.9644(14) 0.5570(9) 0.173(8) Uani 1 1 d D U . . .
H21A H 0.663175 0.927599 0.580114 0.260 Uiso 1 1 calc R U . . .
H21B H 0.639036 1.004479 0.569042 0.260 Uiso 1 1 calc R U . . .
H21C H 0.729826 0.973811 0.553643 0.260 Uiso 1 1 calc R U . . .
C44 C 0.5839(17) 0.1231(13) 0.6781(8) 0.222(6) Uani 1 1 d D U . . .
C49 C 0.596(2) 0.9948(12) 0.4784(11) 0.179(8) Uani 1 1 d D U . . .
H49A H 0.561065 1.028791 0.493253 0.269 Uiso 1 1 calc R U . . .
H49B H 0.559741 0.974099 0.450869 0.269 Uiso 1 1 calc R U . . .
H49C H 0.648668 1.015930 0.466782 0.269 Uiso 1 1 calc R U . . .
F6 F 0.3791(16) 0.9056(16) 0.6759(10) 0.140(5) Uani 0.53(2) 1 d . U P F 1
F3 F 0.3987(11) 0.8255(10) 0.7389(6) 0.174(5) Uani 1 1 d D U . . .
C2 C 0.3805(11) 0.8320(14) 0.6870(6) 0.137(4) Uani 1 1 d D U . . .
F2 F 0.4357(14) 0.8749(14) 0.6606(8) 0.132(4) Uani 0.47(2) 1 d D U P F 2
F4 F 0.2870(9) 0.8294(10) 0.6696(6) 0.161(4) Uani 1 1 d D U . . .
O19 O 0.7373(19) 0.5332(15) 0.5326(11) 0.210(7) Uani 1 1 d D 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
Ag03 S00E 2.385(4) . ?
Ag03 S00C 2.400(4) . ?
Ag03 Ag04 3.1278(19) 3_666 ?
Ag03 Ag09 3.180(2) 3_666 ?
Ag06 S00B 2.405(3) . ?
Ag06 S00C 2.409(3) . ?
Ag06 Ag0A 3.071(2) . ?
Ag06 Ag02 3.2176(19) . ?
Ag01 S00F 2.409(3) . ?
Ag01 S00D 2.421(3) . ?
Ag01 Ag09 3.0514(19) . ?
Ag01 Ag0A 3.1762(19) 3_666 ?
Ag04 O018 2.261(14) . ?
Ag04 O80 2.42(2) . ?
Ag04 S00D 2.527(3) . ?
Ag04 S00E 2.595(4) 3_666 ?
Ag04 Ag05 3.223(2) . ?
Ag04 Ag07 3.2363(19) . ?
Ag04 Ag09 3.247(2) . ?
Ag05 O00N 2.297(18) . ?
Ag05 O1 2.335(18) . ?
Ag05 S00B 2.534(3) . ?
Ag05 S00E 2.556(4) 3_666 ?
Ag05 Ag07 3.043(2) . ?
Ag05 Ag08 3.114(2) 3_666 ?
Ag05 Ag02 3.2444(19) . ?
Ag02 O00Z 2.21(2) . ?
Ag02 O65 2.35(2) . ?
Ag02 S00B 2.539(3) . ?
Ag02 S00F 2.604(3) 3_666 ?
Ag02 Ag08 3.1265(19) 3_666 ?
Ag02 Ag0A 3.2299(19) . ?
Ag07 S00D 2.405(4) . ?
Ag07 S00B 2.418(3) . ?
Ag07 O21A 2.59(3) 3_666 ?
Ag08 S00F 2.390(4) . ?
Ag08 S00E 2.400(4) . ?
Ag09 O14 2.265(13) . ?
Ag09 O2 2.397(13) . ?
Ag09 S00C 2.526(3) 3_666 ?
Ag09 S00D 2.541(3) . ?
Ag09 Ag0A 3.178(2) 3_666 ?
Ag0A O012 2.21(2) . ?
Ag0A C4 2.26(3) 3_666 ?
Ag0A S00C 2.528(3) . ?
Ag0A S00F 2.537(4) 3_666 ?
S00B C00H 1.89(2) . ?
S00C C00I 1.863(19) . ?
S00D C00K 1.872(16) . ?
S00E C00J 1.831(19) . ?
S00F C00L 1.94(2) . ?
C00G O21A 1.10(4) . ?
C00G O21A 1.10(4) 3_666 ?
C00G O21B 1.12(4) 3_666 ?
C00G O21B 1.12(4) . ?
C00H C01G 1.530(14) . ?
C00H C024 1.533(14) . ?
C00H C02P 1.546(14) . ?
C00I C022 1.510(14) . ?
C00I C01A 1.510(14) . ?
C00I C19 1.510(14) . ?
C00J C015 1.564(14) . ?
C00J C01D 1.573(14) . ?
C00J C02S 1.576(14) . ?
C00K C01P 1.507(13) . ?
C00K C02C 1.515(13) . ?
C00K C02L 1.524(13) . ?
C00L C027 1.550(15) . ?
C00L C02F 1.558(15) . ?
C00L C7 1.560(15) . ?
O00N C020 1.18(5) . ?
C00O C01L 1.497(13) . ?
C00O C9 1.501(13) . ?
C00O C01P 1.517(14) . ?
C00O H00O 1.0000 . ?
F00Q C32 1.373(18) . ?
C00S C12 1.495(14) . ?
C00S C02J 1.512(14) . ?
C00S C7 1.548(15) . ?
C00S H00S 1.0000 . ?
C00U C010 1.498(13) . ?
C00U C00X 1.499(13) . ?
C00U H00A 0.9900 . ?
C00U H00B 0.9900 . ?
C00W C01S 1.26(5) . ?
C00W O19 1.31(2) . ?
C00W O02V 1.33(2) . ?
C00X C017 1.478(13) . ?
C00X C19 1.507(14) . ?
C00X H00X 1.0000 . ?
C00Y C01E 1.489(13) . ?
C00Y C9 1.503(13) . ?
C00Y C02L 1.508(14) . ?
C00Y H00Y 1.0000 . ?
O00Z C22 1.26(3) . ?
C010 C02E 1.497(13) . ?
C010 C022 1.504(14) . ?
C010 H010 1.0000 . ?
C011 C017 1.500(14) . ?
C011 C02E 1.510(13) . ?
C011 C01A 1.517(14) . ?
C011 H011 1.0000 . ?
O012 C22 1.26(3) . ?
C013 C01V 1.489(13) . ?
C013 C021 1.497(13) . ?
C013 H01A 0.9900 . ?
C013 H01B 0.9900 . ?
C015 C47 1.551(14) . ?
C015 H01C 0.9900 . ?
C015 H01D 0.9900 . ?
C016 C01T 1.525(14) . ?
C016 C02J 1.533(14) . ?
C016 C027 1.553(15) . ?
C016 H016 1.0000 . ?
C017 H01E 0.9900 . ?
C017 H01F 0.9900 . ?
O018 C020 1.13(4) . ?
C019 C12 1.528(14) . ?
C019 C01T 1.532(14) . ?
C019 C02F 1.540(15) . ?
C019 H019 1.0000 . ?
C01A H01G 0.9900 . ?
C01A H01H 0.9900 . ?
C01B C1 1.478(13) . ?
C01B C021 1.489(13) . ?
C01B H01I 0.9900 . ?
C01B H01J 0.9900 . ?
C01C C8 1.526(14) . ?
C01C C5 1.543(14) . ?
C01C H01K 0.9900 . ?
C01C H01L 0.9900 . ?
C01D C8 1.573(15) . ?
C01D H01M 0.9900 . ?
C01D H01N 0.9900 . ?
C01E C01M 1.498(13) . ?
C01E H01O 0.9900 . ?
C01E H01P 0.9900 . ?
C01G C01V 1.531(14) . ?
C01G H01Q 0.9900 . ?
C01G H01R 0.9900 . ?
C1 C01Y 1.503(13) . ?
C1 C024 1.535(14) . ?
C1 H1 1.0000 . ?
C01L C01M 1.491(13) . ?
C01L H01S 0.9900 . ?
C01L H01T 0.9900 . ?
C01M C02C 1.517(14) . ?
C01M H01U 1.0000 . ?
C01P H01V 0.9900 . ?
C01P H01W 0.9900 . ?
F01R C01S 1.28(2) . ?
C01S F01U 1.27(2) . ?
C01S F01W 1.30(2) . ?
C01T H01X 0.9900 . ?
C01T H01Y 0.9900 . ?
C01V C01Y 1.484(13) . ?
C01V H01Z 1.0000 . ?
C01Y H01 0.9900 . ?
C01Y H 0.9900 . ?
F01Z C32 1.371(18) . ?
C020 C10 1.460(19) . ?
C021 C02P 1.543(14) . ?
C021 H021 1.0000 . ?
C022 H02A 0.9900 . ?
C022 H02B 0.9900 . ?
C024 H02C 0.9900 . ?
C024 H02D 0.9900 . ?
C027 H02E 0.9900 . ?
C027 H02F 0.9900 . ?
F02B C44 1.38(2) . ?
C02C H02G 0.9900 . ?
C02C H02H 0.9900 . ?
C02E H02I 0.9900 . ?
C02E H02J 0.9900 . ?
C02F H02K 0.9900 . ?
C02F H02L 0.9900 . ?
C02J H02M 0.9900 . ?
C02J H02N 0.9900 . ?
C02L H02O 0.9900 . ?
C02L H02P 0.9900 . ?
C02P H02Q 0.9900 . ?
C02P H02R 0.9900 . ?
F02Q C32 1.392(18) . ?
C02S C5 1.547(14) . ?
C02S H02S 0.9900 . ?
C02S H02T 0.9900 . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
F5 C44 1.38(2) . ?
C19 H19A 0.9900 . ?
C19 H19B 0.9900 . ?
C47 C6 1.531(14) . ?
C47 C25 1.541(14) . ?
C47 H47 1.0000 . ?
C6 C8 1.534(14) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C5 C25 1.553(14) . ?
C5 H5 1.0000 . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C8 H8 1.0000 . ?
F13 C10 1.43(2) . ?
F1 C10 1.43(2) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C10 F31 1.43(2) . ?
O14 C13 1.191(13) . ?
O1 C42 1.19(4) . ?
F34 C44 1.38(2) . ?
C42 O65 1.30(4) . ?
C42 C32 1.41(4) . ?
O80 C13 1.217(14) . ?
C13 C2 1.35(3) . ?
C13 F2 1.62(4) . ?
O2 C3 1.174(16) . ?
C22 C44 1.488(19) . ?
C4 C3 1.460(18) . ?
N12 C49 1.375(14) . ?
N12 C21 1.380(14) . ?
N12 C3 1.395(13) . ?
C21 H21A 0.9992 . ?
C21 H21B 0.9989 . ?
C21 H21C 0.9985 . ?
C49 H49A 0.9800 . ?
C49 H49B 0.9800 . ?
C49 H49C 0.9800 . ?
F6 C2 1.50(4) . ?
F3 C2 1.434(16) . ?
C2 F4 1.440(16) . ?
C2 F2 1.447(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
S00E Ag03 S00C 164.96(14) . . ?
S00E Ag03 Ag04 54.14(10) . 3_666 ?
S00C Ag03 Ag04 112.93(9) . 3_666 ?
S00E Ag03 Ag09 116.10(10) . 3_666 ?
S00C Ag03 Ag09 51.55(9) . 3_666 ?
Ag04 Ag03 Ag09 61.96(4) 3_666 3_666 ?
S00B Ag06 S00C 164.27(13) . . ?
S00B Ag06 Ag0A 112.85(9) . . ?
S00C Ag06 Ag0A 53.29(9) . . ?
S00B Ag06 Ag02 51.22(8) . . ?
S00C Ag06 Ag02 114.89(10) . . ?
Ag0A Ag06 Ag02 61.76(4) . . ?
S00F Ag01 S00D 163.21(14) . . ?
S00F Ag01 Ag09 112.61(11) . . ?
S00D Ag01 Ag09 53.84(8) . . ?
S00F Ag01 Ag0A 51.83(10) . 3_666 ?
S00D Ag01 Ag0A 115.08(9) . 3_666 ?
Ag09 Ag01 Ag0A 61.33(4) . 3_666 ?
O018 Ag04 O80 67.9(7) . . ?
O018 Ag04 S00D 125.9(6) . . ?
O80 Ag04 S00D 124.0(4) . . ?
O018 Ag04 S00E 110.9(5) . 3_666 ?
O80 Ag04 S00E 106.6(5) . 3_666 ?
S00D Ag04 S00E 113.31(12) . 3_666 ?
O018 Ag04 Ag03 152.6(6) . 3_666 ?
O80 Ag04 Ag03 98.7(5) . 3_666 ?
S00D Ag04 Ag03 81.49(7) . 3_666 ?
S00E Ag04 Ag03 48.17(8) 3_666 3_666 ?
O018 Ag04 Ag05 82.0(4) . . ?
O80 Ag04 Ag05 132.5(4) . . ?
S00D Ag04 Ag05 103.24(9) . . ?
S00E Ag04 Ag05 50.73(8) 3_666 . ?
Ag03 Ag04 Ag05 91.59(5) 3_666 . ?
O018 Ag04 Ag07 117.7(6) . . ?
O80 Ag04 Ag07 171.2(4) . . ?
S00D Ag04 Ag07 47.38(8) . . ?
S00E Ag04 Ag07 78.29(9) 3_666 . ?
Ag03 Ag04 Ag07 78.97(4) 3_666 . ?
Ag05 Ag04 Ag07 56.21(4) . . ?
O018 Ag04 Ag09 135.7(4) . . ?
O80 Ag04 Ag09 81.3(4) . . ?
S00D Ag04 Ag09 50.33(8) . . ?
S00E Ag04 Ag09 107.97(9) 3_666 . ?
Ag03 Ag04 Ag09 59.80(4) 3_666 . ?
Ag05 Ag04 Ag09 140.89(5) . . ?
Ag07 Ag04 Ag09 90.23(5) . . ?
O00N Ag05 O1 88.6(9) . . ?
O00N Ag05 S00B 113.4(4) . . ?
O1 Ag05 S00B 115.9(6) . . ?
O00N Ag05 S00E 109.5(6) . 3_666 ?
O1 Ag05 S00E 109.2(6) . 3_666 ?
S00B Ag05 S00E 116.82(12) . 3_666 ?
O00N Ag05 Ag07 94.7(6) . . ?
O1 Ag05 Ag07 165.9(6) . . ?
S00B Ag05 Ag07 50.39(8) . . ?
S00E Ag05 Ag07 82.62(9) 3_666 . ?
O00N Ag05 Ag08 158.1(6) . 3_666 ?
O1 Ag05 Ag08 101.6(7) . 3_666 ?
S00B Ag05 Ag08 79.76(7) . 3_666 ?
S00E Ag05 Ag08 48.87(10) 3_666 3_666 ?
Ag07 Ag05 Ag08 80.12(5) . 3_666 ?
O00N Ag05 Ag04 65.2(7) . . ?
O1 Ag05 Ag04 131.1(7) . . ?
S00B Ag05 Ag04 112.37(9) . . ?
S00E Ag05 Ag04 51.80(9) 3_666 . ?
Ag07 Ag05 Ag04 62.12(4) . . ?
Ag08 Ag05 Ag04 93.93(5) 3_666 . ?
O00N Ag05 Ag02 143.1(6) . . ?
O1 Ag05 Ag02 75.5(7) . . ?
S00B Ag05 Ag02 50.30(8) . . ?
S00E Ag05 Ag02 107.20(10) 3_666 . ?
Ag07 Ag05 Ag02 93.93(5) . . ?
Ag08 Ag05 Ag02 58.87(4) 3_666 . ?
Ag04 Ag05 Ag02 147.73(5) . . ?
O00Z Ag02 O65 76.8(10) . . ?
O00Z Ag02 S00B 126.1(10) . . ?
O65 Ag02 S00B 121.4(7) . . ?
O00Z Ag02 S00F 108.4(8) . 3_666 ?
O65 Ag02 S00F 105.9(6) . 3_666 ?
S00B Ag02 S00F 112.52(11) . 3_666 ?
O00Z Ag02 Ag08 153.5(9) . 3_666 ?
O65 Ag02 Ag08 96.4(6) . 3_666 ?
S00B Ag02 Ag08 79.44(8) . 3_666 ?
S00F Ag02 Ag08 48.24(10) 3_666 3_666 ?
O00Z Ag02 Ag06 112.1(8) . . ?
O65 Ag02 Ag06 168.5(7) . . ?
S00B Ag02 Ag06 47.62(7) . . ?
S00F Ag02 Ag06 78.86(8) 3_666 . ?
Ag08 Ag02 Ag06 78.80(4) 3_666 . ?
O00Z Ag02 Ag0A 76.9(6) . . ?
O65 Ag02 Ag0A 134.2(7) . . ?
S00B Ag02 Ag0A 104.40(8) . . ?
S00F Ag02 Ag0A 50.15(9) 3_666 . ?
Ag08 Ag02 Ag0A 90.96(5) 3_666 . ?
Ag06 Ag02 Ag0A 56.89(4) . . ?
O00Z Ag02 Ag05 141.0(6) . . ?
O65 Ag02 Ag05 77.7(7) . . ?
S00B Ag02 Ag05 50.17(8) . . ?
S00F Ag02 Ag05 106.66(11) 3_666 . ?
Ag08 Ag02 Ag05 58.48(4) 3_666 . ?
Ag06 Ag02 Ag05 90.85(5) . . ?
Ag0A Ag02 Ag05 140.74(5) . . ?
S00D Ag07 S00B 162.65(12) . . ?
S00D Ag07 O21A 93.1(9) . 3_666 ?
S00B Ag07 O21A 97.8(10) . 3_666 ?
S00D Ag07 Ag05 111.90(9) . . ?
S00B Ag07 Ag05 53.82(8) . . ?
O21A Ag07 Ag05 94.8(10) 3_666 . ?
S00D Ag07 Ag04 50.64(8) . . ?
S00B Ag07 Ag04 115.35(9) . . ?
O21A Ag07 Ag04 91.0(8) 3_666 . ?
Ag05 Ag07 Ag04 61.68(4) . . ?
S00F Ag08 S00E 165.79(13) . . ?
S00F Ag08 Ag05 116.97(9) . 3_666 ?
S00E Ag08 Ag05 53.36(9) . 3_666 ?
S00F Ag08 Ag02 54.38(9) . 3_666 ?
S00E Ag08 Ag02 115.39(10) . 3_666 ?
Ag05 Ag08 Ag02 62.66(4) 3_666 3_666 ?
O14 Ag09 O2 99.6(4) . . ?
O14 Ag09 S00C 113.6(3) . 3_666 ?
O2 Ag09 S00C 112.5(3) . 3_666 ?
O14 Ag09 S00D 102.1(3) . . ?
O2 Ag09 S00D 110.1(2) . . ?
S00C Ag09 S00D 117.09(12) 3_666 . ?
O14 Ag09 Ag01 152.4(3) . . ?
O2 Ag09 Ag01 93.6(3) . . ?
S00C Ag09 Ag01 82.88(8) 3_666 . ?
S00D Ag09 Ag01 50.30(8) . . ?
O14 Ag09 Ag0A 146.4(3) . 3_666 ?
O2 Ag09 Ag0A 68.5(3) . 3_666 ?
S00C Ag09 Ag0A 51.06(8) 3_666 3_666 ?
S00D Ag09 Ag0A 111.49(9) . 3_666 ?
Ag01 Ag09 Ag0A 61.27(5) . 3_666 ?
O14 Ag09 Ag03 94.8(3) . 3_666 ?
O2 Ag09 Ag03 159.8(3) . 3_666 ?
S00C Ag09 Ag03 48.08(9) 3_666 3_666 ?
S00D Ag09 Ag03 80.26(8) . 3_666 ?
Ag01 Ag09 Ag03 79.65(5) . 3_666 ?
Ag0A Ag09 Ag03 91.72(5) 3_666 3_666 ?
O14 Ag09 Ag04 62.2(3) . . ?
O2 Ag09 Ag04 141.6(3) . . ?
S00C Ag09 Ag04 105.80(10) 3_666 . ?
S00D Ag09 Ag04 49.97(8) . . ?
Ag01 Ag09 Ag04 92.69(5) . . ?
Ag0A Ag09 Ag04 144.58(6) 3_666 . ?
Ag03 Ag09 Ag04 58.24(4) 3_666 . ?
O012 Ag0A C4 58.5(9) . 3_666 ?
O012 Ag0A S00C 123.6(10) . . ?
C4 Ag0A S00C 114.6(7) 3_666 . ?
O012 Ag0A S00F 111.4(8) . 3_666 ?
C4 Ag0A S00F 119.6(7) 3_666 3_666 ?
S00C Ag0A S00F 116.68(13) . 3_666 ?
O012 Ag0A Ag06 113.1(9) . . ?
C4 Ag0A Ag06 157.5(7) 3_666 . ?
S00C Ag0A Ag06 49.81(9) . . ?
S00F Ag0A Ag06 82.74(9) 3_666 . ?
O012 Ag0A Ag01 156.0(10) . 3_666 ?
C4 Ag0A Ag01 116.0(6) 3_666 3_666 ?
S00C Ag0A Ag01 80.32(8) . 3_666 ?
S00F Ag0A Ag01 48.30(8) 3_666 3_666 ?
Ag06 Ag0A Ag01 80.12(5) . 3_666 ?
O012 Ag0A Ag09 136.8(7) . 3_666 ?
C4 Ag0A Ag09 83.9(7) 3_666 3_666 ?
S00C Ag0A Ag09 51.00(8) . 3_666 ?
S00F Ag0A Ag09 105.22(9) 3_666 3_666 ?
Ag06 Ag0A Ag09 93.09(5) . 3_666 ?
Ag01 Ag0A Ag09 57.40(4) 3_666 3_666 ?
O012 Ag0A Ag02 77.5(6) . . ?
C4 Ag0A Ag02 128.8(7) 3_666 . ?
S00C Ag0A Ag02 111.02(10) . . ?
S00F Ag0A Ag02 52.02(8) 3_666 . ?
Ag06 Ag0A Ag02 61.35(4) . . ?
Ag01 Ag0A Ag02 93.23(5) 3_666 . ?
Ag09 Ag0A Ag02 145.32(6) 3_666 . ?
C00H S00B Ag06 110.2(5) . . ?
C00H S00B Ag07 109.5(6) . . ?
Ag06 S00B Ag07 93.23(11) . . ?
C00H S00B Ag05 112.2(5) . . ?
Ag06 S00B Ag05 137.47(12) . . ?
Ag07 S00B Ag05 75.79(10) . . ?
C00H S00B Ag02 113.3(6) . . ?
Ag06 S00B Ag02 81.16(10) . . ?
Ag07 S00B Ag02 136.09(12) . . ?
Ag05 S00B Ag02 79.53(10) . . ?
C00I S00C Ag03 110.9(5) . . ?
C00I S00C Ag06 112.4(5) . . ?
Ag03 S00C Ag06 91.39(14) . . ?
C00I S00C Ag09 113.1(5) . 3_666 ?
Ag03 S00C Ag09 80.37(10) . 3_666 ?
Ag06 S00C Ag09 133.67(13) . 3_666 ?
C00I S00C Ag0A 113.2(6) . . ?
Ag03 S00C Ag0A 135.60(13) . . ?
Ag06 S00C Ag0A 76.90(10) . . ?
Ag09 S00C Ag0A 77.94(11) 3_666 . ?
C00K S00D Ag07 110.5(6) . . ?
C00K S00D Ag01 112.1(4) . . ?
Ag07 S00D Ag01 89.86(12) . . ?
C00K S00D Ag04 113.0(4) . . ?
Ag07 S00D Ag04 81.98(11) . . ?
Ag01 S00D Ag04 134.24(12) . . ?
C00K S00D Ag09 113.0(6) . . ?
Ag07 S00D Ag09 136.48(13) . . ?
Ag01 S00D Ag09 75.86(10) . . ?
Ag04 S00D Ag09 79.70(10) . . ?
C00J S00E Ag03 113.3(6) . . ?
C00J S00E Ag08 108.8(6) . . ?
Ag03 S00E Ag08 94.86(14) . . ?
C00J S00E Ag05 111.8(6) . 3_666 ?
Ag03 S00E Ag05 134.23(14) . 3_666 ?
Ag08 S00E Ag05 77.77(11) . 3_666 ?
C00J S00E Ag04 114.0(6) . 3_666 ?
Ag03 S00E Ag04 77.69(11) . 3_666 ?
Ag08 S00E Ag04 136.06(14) . 3_666 ?
Ag05 S00E Ag04 77.47(11) 3_666 3_666 ?
C00L S00F Ag08 111.4(7) . . ?
C00L S00F Ag01 108.1(6) . . ?
Ag08 S00F Ag01 92.33(15) . . ?
C00L S00F Ag0A 114.2(7) . 3_666 ?
Ag08 S00F Ag0A 133.84(14) . 3_666 ?
Ag01 S00F Ag0A 79.87(11) . 3_666 ?
C00L S00F Ag02 115.1(6) . 3_666 ?
Ag08 S00F Ag02 77.39(10) . 3_666 ?
Ag01 S00F Ag02 136.42(14) . 3_666 ?
Ag0A S00F Ag02 77.83(11) 3_666 3_666 ?
O21A C00G O21A 180.0(18) . 3_666 ?
O21A C00G O21B 92(3) . 3_666 ?
O21A C00G O21B 88(3) 3_666 3_666 ?
O21B C00G O21B 180(4) 3_666 . ?
C01G C00H C024 109.0(12) . . ?
C01G C00H C02P 109.6(12) . . ?
C024 C00H C02P 110.0(11) . . ?
C01G C00H S00B 110.9(12) . . ?
C024 C00H S00B 110.1(12) . . ?
C02P C00H S00B 107.2(12) . . ?
C022 C00I C01A 110.1(11) . . ?
C022 C00I C19 109.0(11) . . ?
C01A C00I C19 110.3(12) . . ?
C022 C00I S00C 108.5(11) . . ?
C01A C00I S00C 107.9(11) . . ?
C19 C00I S00C 111.0(11) . . ?
C015 C00J C01D 108.3(11) . . ?
C015 C00J C02S 108.7(11) . . ?
C01D C00J C02S 108.3(11) . . ?
C015 C00J S00E 111.7(11) . . ?
C01D C00J S00E 110.9(11) . . ?
C02S C00J S00E 108.9(12) . . ?
C01P C00K C02C 111.8(11) . . ?
C01P C00K C02L 108.7(11) . . ?
C02C C00K C02L 109.1(11) . . ?
C01P C00K S00D 106.2(11) . . ?
C02C C00K S00D 109.2(10) . . ?
C02L C00K S00D 112.0(10) . . ?
C027 C00L C02F 111.0(12) . . ?
C027 C00L C7 109.7(12) . . ?
C02F C00L C7 110.0(12) . . ?
C027 C00L S00F 106.3(13) . . ?
C02F C00L S00F 108.5(14) . . ?
C7 C00L S00F 111.3(12) . . ?
C020 O00N Ag05 135(3) . . ?
C01L C00O C9 111.3(10) . . ?
C01L C00O C01P 112.0(16) . . ?
C9 C00O C01P 102.4(14) . . ?
C01L C00O H00O 110.3 . . ?
C9 C00O H00O 110.3 . . ?
C01P C00O H00O 110.3 . . ?
C12 C00S C02J 120.0(10) . . ?
C12 C00S C7 89.6(19) . . ?
C02J C00S C7 98.2(17) . . ?
C12 C00S H00S 114.9 . . ?
C02J C00S H00S 114.8 . . ?
C7 C00S H00S 114.8 . . ?
C010 C00U C00X 111.5(10) . . ?
C010 C00U H00A 109.3 . . ?
C00X C00U H00A 109.3 . . ?
C010 C00U H00B 109.3 . . ?
C00X C00U H00B 109.3 . . ?
H00A C00U H00B 108.0 . . ?
C01S C00W O19 113(3) . . ?
C01S C00W O02V 120(3) . . ?
O19 C00W O02V 118(2) . . ?
C017 C00X C00U 112.9(10) . . ?
C017 C00X C19 107.2(14) . . ?
C00U C00X C19 102.2(14) . . ?
C017 C00X H00X 111.3 . . ?
C00U C00X H00X 111.4 . . ?
C19 C00X H00X 111.4 . . ?
C01E C00Y C9 113.4(10) . . ?
C01E C00Y C02L 106.0(16) . . ?
C9 C00Y C02L 105.0(15) . . ?
C01E C00Y H00Y 110.7 . . ?
C9 C00Y H00Y 110.7 . . ?
C02L C00Y H00Y 110.7 . . ?
C22 O00Z Ag02 124(2) . . ?
C02E C010 C00U 112.3(10) . . ?
C02E C010 C022 108.6(14) . . ?
C00U C010 C022 108.3(15) . . ?
C02E C010 H010 109.2 . . ?
C00U C010 H010 109.2 . . ?
C022 C010 H010 109.2 . . ?
C017 C011 C02E 109.9(10) . . ?
C017 C011 C01A 110.2(15) . . ?
C02E C011 C01A 104.7(14) . . ?
C017 C011 H011 110.6 . . ?
C02E C011 H011 110.6 . . ?
C01A C011 H011 110.6 . . ?
C22 O012 Ag0A 124(2) . . ?
C01V C013 C021 115.6(10) . . ?
C01V C013 H01A 108.4 . . ?
C021 C013 H01A 108.4 . . ?
C01V C013 H01B 108.4 . . ?
C021 C013 H01B 108.4 . . ?
H01A C013 H01B 107.4 . . ?
C47 C015 C00J 112.6(13) . . ?
C47 C015 H01C 109.1 . . ?
C00J C015 H01C 109.1 . . ?
C47 C015 H01D 109.1 . . ?
C00J C015 H01D 109.1 . . ?
H01C C015 H01D 107.8 . . ?
C01T C016 C02J 114.4(11) . . ?
C01T C016 C027 100.9(19) . . ?
C02J C016 C027 106.5(17) . . ?
C01T C016 H016 111.5 . . ?
C02J C016 H016 111.5 . . ?
C027 C016 H016 111.4 . . ?
C00X C017 C011 112.8(10) . . ?
C00X C017 H01E 109.0 . . ?
C011 C017 H01E 109.0 . . ?
C00X C017 H01F 109.0 . . ?
C011 C017 H01F 109.0 . . ?
H01E C017 H01F 107.8 . . ?
C020 O018 Ag04 115(2) . . ?
C12 C019 C01T 113.7(10) . . ?
C12 C019 C02F 102.7(17) . . ?
C01T C019 C02F 108.5(17) . . ?
C12 C019 H019 110.5 . . ?
C01T C019 H019 110.5 . . ?
C02F C019 H019 110.6 . . ?
C00I C01A C011 109.0(12) . . ?
C00I C01A H01G 109.9 . . ?
C011 C01A H01G 109.9 . . ?
C00I C01A H01H 109.9 . . ?
C011 C01A H01H 109.9 . . ?
H01G C01A H01H 108.3 . . ?
C1 C01B C021 116.7(10) . . ?
C1 C01B H01I 108.1 . . ?
C021 C01B H01I 108.1 . . ?
C1 C01B H01J 108.1 . . ?
C021 C01B H01J 108.1 . . ?
H01I C01B H01J 107.3 . . ?
C8 C01C C5 114.0(10) . . ?
C8 C01C H01K 108.8 . . ?
C5 C01C H01K 108.8 . . ?
C8 C01C H01L 108.7 . . ?
C5 C01C H01L 108.7 . . ?
H01K C01C H01L 107.6 . . ?
C8 C01D C00J 109.9(13) . . ?
C8 C01D H01M 109.7 . . ?
C00J C01D H01M 109.7 . . ?
C8 C01D H01N 109.7 . . ?
C00J C01D H01N 109.7 . . ?
H01M C01D H01N 108.2 . . ?
C00Y C01E C01M 112.3(10) . . ?
C00Y C01E H01O 109.1 . . ?
C01M C01E H01O 109.1 . . ?
C00Y C01E H01P 109.1 . . ?
C01M C01E H01P 109.1 . . ?
H01O C01E H01P 107.9 . . ?
C00H C01G C01V 109.0(13) . . ?
C00H C01G H01Q 109.9 . . ?
C01V C01G H01Q 109.9 . . ?
C00H C01G H01R 109.9 . . ?
C01V C01G H01R 109.9 . . ?
H01Q C01G H01R 108.3 . . ?
C01B C1 C01Y 115.6(10) . . ?
C01B C1 C024 100.7(16) . . ?
C01Y C1 C024 103.5(16) . . ?
C01B C1 H1 112.1 . . ?
C01Y C1 H1 112.0 . . ?
C024 C1 H1 112.0 . . ?
C00G O21A Ag07 130.4(17) . 3_666 ?
C01M C01L C00O 112.3(10) . . ?
C01M C01L H01S 109.1 . . ?
C00O C01L H01S 109.1 . . ?
C01M C01L H01T 109.1 . . ?
C00O C01L H01T 109.1 . . ?
H01S C01L H01T 107.9 . . ?
C01L C01M C01E 112.8(10) . . ?
C01L C01M C02C 104.8(15) . . ?
C01E C01M C02C 106.1(14) . . ?
C01L C01M H01U 110.9 . . ?
C01E C01M H01U 110.9 . . ?
C02C C01M H01U 110.9 . . ?
C00K C01P C00O 107.6(12) . . ?
C00K C01P H01V 110.2 . . ?
C00O C01P H01V 110.2 . . ?
C00K C01P H01W 110.2 . . ?
C00O C01P H01W 110.2 . . ?
H01V C01P H01W 108.5 . . ?
C00W C01S F01U 116(3) . . ?
C00W C01S F01R 119(3) . . ?
F01U C01S F01R 98(2) . . ?
C00W C01S F01W 125(3) . . ?
F01U C01S F01W 97(2) . . ?
F01R C01S F01W 96(2) . . ?
C016 C01T C019 114.3(11) . . ?
C016 C01T H01X 108.7 . . ?
C019 C01T H01X 108.7 . . ?
C016 C01T H01Y 108.7 . . ?
C019 C01T H01Y 108.7 . . ?
H01X C01T H01Y 107.6 . . ?
C01Y C01V C013 115.8(10) . . ?
C01Y C01V C01G 102.4(15) . . ?
C013 C01V C01G 103.9(16) . . ?
C01Y C01V H01Z 111.4 . . ?
C013 C01V H01Z 111.4 . . ?
C01G C01V H01Z 111.4 . . ?
C01V C01Y C1 114.5(10) . . ?
C01V C01Y H01 108.6 . . ?
C1 C01Y H01 108.6 . . ?
C01V C01Y H 108.6 . . ?
C1 C01Y H 108.6 . . ?
H01 C01Y H 107.6 . . ?
O018 C020 O00N 130(3) . . ?
O018 C020 C10 117(4) . . ?
O00N C020 C10 113(3) . . ?
C01B C021 C013 115.8(10) . . ?
C01B C021 C02P 102.3(15) . . ?
C013 C021 C02P 99.2(16) . . ?
C01B C021 H021 112.7 . . ?
C013 C021 H021 112.7 . . ?
C02P C021 H021 112.8 . . ?
C010 C022 C00I 106.5(13) . . ?
C010 C022 H02A 110.4 . . ?
C00I C022 H02A 110.4 . . ?
C010 C022 H02B 110.4 . . ?
C00I C022 H02B 110.4 . . ?
H02A C022 H02B 108.6 . . ?
C00H C024 C1 109.9(13) . . ?
C00H C024 H02C 109.7 . . ?
C1 C024 H02C 109.7 . . ?
C00H C024 H02D 109.7 . . ?
C1 C024 H02D 109.7 . . ?
H02C C024 H02D 108.2 . . ?
C00L C027 C016 108.3(14) . . ?
C00L C027 H02E 110.0 . . ?
C016 C027 H02E 110.1 . . ?
C00L C027 H02F 110.0 . . ?
C016 C027 H02F 110.1 . . ?
H02E C027 H02F 108.4 . . ?
C00K C02C C01M 110.8(13) . . ?
C00K C02C H02G 109.5 . . ?
C01M C02C H02G 109.5 . . ?
C00K C02C H02H 109.5 . . ?
C01M C02C H02H 109.5 . . ?
H02G C02C H02H 108.1 . . ?
C010 C02E C011 111.4(10) . . ?
C010 C02E H02I 109.3 . . ?
C011 C02E H02I 109.4 . . ?
C010 C02E H02J 109.4 . . ?
C011 C02E H02J 109.3 . . ?
H02I C02E H02J 108.0 . . ?
C019 C02F C00L 102.3(17) . . ?
C019 C02F H02K 111.3 . . ?
C00L C02F H02K 111.3 . . ?
C019 C02F H02L 111.3 . . ?
C00L C02F H02L 111.3 . . ?
H02K C02F H02L 109.2 . . ?
C00S C02J C016 115.1(10) . . ?
C00S C02J H02M 108.5 . . ?
C016 C02J H02M 108.5 . . ?
C00S C02J H02N 108.5 . . ?
C016 C02J H02N 108.5 . . ?
H02M C02J H02N 107.5 . . ?
C00Y C02L C00K 109.2(12) . . ?
C00Y C02L H02O 109.9 . . ?
C00K C02L H02O 109.8 . . ?
C00Y C02L H02P 109.8 . . ?
C00K C02L H02P 109.8 . . ?
H02O C02L H02P 108.3 . . ?
C021 C02P C00H 110.1(13) . . ?
C021 C02P H02Q 109.6 . . ?
C00H C02P H02Q 109.7 . . ?
C021 C02P H02R 109.7 . . ?
C00H C02P H02R 109.6 . . ?
H02Q C02P H02R 108.2 . . ?
C5 C02S C00J 110.0(14) . . ?
C5 C02S H02S 109.7 . . ?
C00J C02S H02S 109.7 . . ?
C5 C02S H02T 109.7 . . ?
C00J C02S H02T 109.6 . . ?
H02S C02S H02T 108.2 . . ?
C00S C7 C00L 116.8(14) . . ?
C00S C7 H7A 108.1 . . ?
C00L C7 H7A 108.1 . . ?
C00S C7 H7B 108.1 . . ?
C00L C7 H7B 108.1 . . ?
H7A C7 H7B 107.3 . . ?
C00S C12 C019 118.0(10) . . ?
C00S C12 H12A 107.8 . . ?
C019 C12 H12A 107.8 . . ?
C00S C12 H12B 107.8 . . ?
C019 C12 H12B 107.8 . . ?
H12A C12 H12B 107.1 . . ?
C00X C19 C00I 112.6(13) . . ?
C00X C19 H19A 109.1 . . ?
C00I C19 H19A 109.1 . . ?
C00X C19 H19B 109.1 . . ?
C00I C19 H19B 109.1 . . ?
H19A C19 H19B 107.8 . . ?
C6 C47 C25 113.2(10) . . ?
C6 C47 C015 105.4(16) . . ?
C25 C47 C015 104.6(16) . . ?
C6 C47 H47 111.1 . . ?
C25 C47 H47 111.1 . . ?
C015 C47 H47 111.1 . . ?
C47 C6 C8 112.8(10) . . ?
C47 C6 H6A 109.0 . . ?
C8 C6 H6A 109.0 . . ?
C47 C6 H6B 109.0 . . ?
C8 C6 H6B 109.1 . . ?
H6A C6 H6B 107.8 . . ?
C01C C5 C02S 102.7(15) . . ?
C01C C5 C25 111.2(10) . . ?
C02S C5 C25 110.0(15) . . ?
C01C C5 H5 110.9 . . ?
C02S C5 H5 110.9 . . ?
C25 C5 H5 110.9 . . ?
C47 C25 C5 112.7(10) . . ?
C47 C25 H25A 109.0 . . ?
C5 C25 H25A 109.0 . . ?
C47 C25 H25B 109.1 . . ?
C5 C25 H25B 109.1 . . ?
H25A C25 H25B 107.8 . . ?
C01C C8 C6 115.0(10) . . ?
C01C C8 C01D 104.6(17) . . ?
C6 C8 C01D 104.2(16) . . ?
C01C C8 H8 110.9 . . ?
C6 C8 H8 110.9 . . ?
C01D C8 H8 110.9 . . ?
C00O C9 C00Y 113.0(10) . . ?
C00O C9 H9A 109.0 . . ?
C00Y C9 H9A 109.0 . . ?
C00O C9 H9B 109.0 . . ?
C00Y C9 H9B 109.0 . . ?
H9A C9 H9B 107.8 . . ?
F1 C10 F31 102.3(18) . . ?
F1 C10 F13 101.4(17) . . ?
F31 C10 F13 102.7(18) . . ?
F1 C10 C020 124(3) . . ?
F31 C10 C020 109(3) . . ?
F13 C10 C020 115(3) . . ?
C13 O14 Ag09 153.0(14) . . ?
C42 O1 Ag05 134(3) . . ?
O1 C42 O65 123(3) . . ?
O1 C42 C32 129(4) . . ?
O65 C42 C32 106(3) . . ?
C13 O80 Ag04 121.9(14) . . ?
O14 C13 O80 104.9(16) . . ?
O14 C13 C2 146(2) . . ?
O80 C13 C2 108.9(18) . . ?
O14 C13 F2 91.4(16) . . ?
O80 C13 F2 154(2) . . ?
C2 C13 F2 57.4(12) . . ?
C42 O65 Ag02 127.8(19) . . ?
F01Z C32 F00Q 106.3(16) . . ?
F01Z C32 F02Q 105.0(16) . . ?
F00Q C32 F02Q 105.9(15) . . ?
F01Z C32 C42 111(2) . . ?
F00Q C32 C42 114(2) . . ?
F02Q C32 C42 114(2) . . ?
C3 O2 Ag09 139.8(11) . . ?
O012 C22 O00Z 126(4) . . ?
O012 C22 C44 109(2) . . ?
O00Z C22 C44 114(2) . . ?
C3 C4 Ag0A 121.7(17) . 3_666 ?
C49 N12 C21 120.5(12) . . ?
C49 N12 C3 119.2(11) . . ?
C21 N12 C3 118.9(11) . . ?
O2 C3 N12 124.5(17) . . ?
O2 C3 C4 112.4(19) . . ?
N12 C3 C4 123.0(18) . . ?
N12 C21 H21A 111.8 . . ?
N12 C21 H21B 111.6 . . ?
H21A C21 H21B 107.3 . . ?
N12 C21 H21C 111.4 . . ?
H21A C21 H21C 107.2 . . ?
H21B C21 H21C 107.4 . . ?
F5 C44 F02B 97.7(17) . . ?
F5 C44 F34 99.4(18) . . ?
F02B C44 F34 96.4(17) . . ?
F5 C44 C22 121(2) . . ?
F02B C44 C22 119(3) . . ?
F34 C44 C22 119(3) . . ?
N12 C49 H49A 109.4 . . ?
N12 C49 H49B 109.5 . . ?
H49A C49 H49B 109.5 . . ?
N12 C49 H49C 109.5 . . ?
H49A C49 H49C 109.5 . . ?
H49B C49 H49C 109.5 . . ?
C13 C2 F3 107.7(18) . . ?
C13 C2 F4 121(2) . . ?
F3 C2 F4 113.8(12) . . ?
C13 C2 F2 70.7(17) . . ?
F3 C2 F2 120.0(14) . . ?
F4 C2 F2 116.7(13) . . ?
C13 C2 F6 117.1(18) . . ?
F3 C2 F6 107(2) . . ?
F4 C2 F6 88.6(17) . . ?
C2 F2 C13 51.9(15) . . ?

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
Ag06 S00B C00H C01G -78.4(11) . . . . ?
Ag07 S00B C00H C01G -179.6(10) . . . . ?
Ag05 S00B C00H C01G 98.3(11) . . . . ?
Ag02 S00B C00H C01G 10.5(12) . . . . ?
Ag06 S00B C00H C024 160.9(9) . . . . ?
Ag07 S00B C00H C024 59.7(11) . . . . ?
Ag05 S00B C00H C024 -22.5(12) . . . . ?
Ag02 S00B C00H C024 -110.3(10) . . . . ?
Ag06 S00B C00H C02P 41.2(11) . . . . ?
Ag07 S00B C00H C02P -60.0(11) . . . . ?
Ag05 S00B C00H C02P -142.1(9) . . . . ?
Ag02 S00B C00H C02P 130.1(9) . . . . ?
Ag03 S00C C00I C022 -11.0(11) . . . . ?
Ag06 S00C C00I C022 -111.7(9) . . . . ?
Ag09 S00C C00I C022 77.2(10) 3_666 . . . ?
Ag0A S00C C00I C022 163.5(9) . . . . ?
Ag03 S00C C00I C01A 108.2(10) . . . . ?
Ag06 S00C C00I C01A 7.6(11) . . . . ?
Ag09 S00C C00I C01A -163.6(9) 3_666 . . . ?
Ag0A S00C C00I C01A -77.3(10) . . . . ?
Ag03 S00C C00I C19 -130.8(9) . . . . ?
Ag06 S00C C00I C19 128.5(9) . . . . ?
Ag09 S00C C00I C19 -42.6(11) 3_666 . . . ?
Ag0A S00C C00I C19 43.7(11) . . . . ?
Ag03 S00E C00J C015 10.1(13) . . . . ?
Ag08 S00E C00J C015 114.2(11) . . . . ?
Ag05 S00E C00J C015 -161.9(10) 3_666 . . . ?
Ag04 S00E C00J C015 -76.3(12) 3_666 . . . ?
Ag03 S00E C00J C01D -110.8(11) . . . . ?
Ag08 S00E C00J C01D -6.7(12) . . . . ?
Ag05 S00E C00J C01D 77.2(12) 3_666 . . . ?
Ag04 S00E C00J C01D 162.8(10) 3_666 . . . ?
Ag03 S00E C00J C02S 130.2(10) . . . . ?
Ag08 S00E C00J C02S -125.8(10) . . . . ?
Ag05 S00E C00J C02S -41.8(11) 3_666 . . . ?
Ag04 S00E C00J C02S 43.8(11) 3_666 . . . ?
Ag07 S00D C00K C01P 35.6(11) . . . . ?
Ag01 S00D C00K C01P -62.9(11) . . . . ?
Ag04 S00D C00K C01P 125.4(9) . . . . ?
Ag09 S00D C00K C01P -146.4(9) . . . . ?
Ag07 S00D C00K C02C 156.2(9) . . . . ?
Ag01 S00D C00K C02C 57.7(10) . . . . ?
Ag04 S00D C00K C02C -114.0(9) . . . . ?
Ag09 S00D C00K C02C -25.7(10) . . . . ?
Ag07 S00D C00K C02L -82.9(11) . . . . ?
Ag01 S00D C00K C02L 178.6(10) . . . . ?
Ag04 S00D C00K C02L 6.9(12) . . . . ?
Ag09 S00D C00K C02L 95.1(11) . . . . ?
C010 C00U C00X C017 -51(2) . . . . ?
C010 C00U C00X C19 63.7(16) . . . . ?
C00X C00U C010 C02E 52.2(19) . . . . ?
C00X C00U C010 C022 -67.6(16) . . . . ?
C01D C00J C015 C47 -56.9(19) . . . . ?
C02S C00J C015 C47 60.6(19) . . . . ?
S00E C00J C015 C47 -179.2(17) . . . . ?
C00U C00X C017 C011 53(2) . . . . ?
C19 C00X C017 C011 -58.5(17) . . . . ?
C02E C011 C017 C00X -54.9(19) . . . . ?
C01A C011 C017 C00X 60.0(17) . . . . ?
C022 C00I C01A C011 -64.3(18) . . . . ?
C19 C00I C01A C011 55.9(18) . . . . ?
S00C C00I C01A C011 177.4(14) . . . . ?
C017 C011 C01A C00I -56.6(16) . . . . ?
C02E C011 C01A C00I 61.5(15) . . . . ?
C015 C00J C01D C8 58.7(18) . . . . ?
C02S C00J C01D C8 -59.0(18) . . . . ?
S00E C00J C01D C8 -178.4(16) . . . . ?
C9 C00Y C01E C01M 49(2) . . . . ?
C02L C00Y C01E C01M -65.4(16) . . . . ?
C024 C00H C01G C01V -62.2(18) . . . . ?
C02P C00H C01G C01V 58.2(18) . . . . ?
S00B C00H C01G C01V 176.4(14) . . . . ?
C021 C01B C1 C01Y 39(3) . . . . ?
C021 C01B C1 C024 -71.5(19) . . . . ?
C9 C00O C01L C01M -53(2) . . . . ?
C01P C00O C01L C01M 60.5(17) . . . . ?
C00O C01L C01M C01E 54(2) . . . . ?
C00O C01L C01M C02C -61.3(17) . . . . ?
C00Y C01E C01M C01L -51(2) . . . . ?
C00Y C01E C01M C02C 63.1(18) . . . . ?
C02C C00K C01P C00O 54.7(18) . . . . ?
C02L C00K C01P C00O -65.8(17) . . . . ?
S00D C00K C01P C00O 173.6(14) . . . . ?
C01L C00O C01P C00K -53.8(16) . . . . ?
C9 C00O C01P C00K 65.5(15) . . . . ?
O19 C00W C01S F01U -167(3) . . . . ?
O02V C00W C01S F01U 46(4) . . . . ?
O19 C00W C01S F01R 76(4) . . . . ?
O02V C00W C01S F01R -71(4) . . . . ?
O19 C00W C01S F01W -47(4) . . . . ?
O02V C00W C01S F01W 166(3) . . . . ?
C02J C016 C01T C019 -50(2) . . . . ?
C027 C016 C01T C019 64.2(19) . . . . ?
C12 C019 C01T C016 46(2) . . . . ?
C02F C019 C01T C016 -67(2) . . . . ?
C021 C013 C01V C01Y -41(2) . . . . ?
C021 C013 C01V C01G 70(2) . . . . ?
C00H C01G C01V C01Y 63.0(16) . . . . ?
C00H C01G C01V C013 -58.0(16) . . . . ?
C013 C01V C01Y C1 43(2) . . . . ?
C01G C01V C01Y C1 -69.3(19) . . . . ?
C01B C1 C01Y C01V -42(2) . . . . ?
C024 C1 C01Y C01V 67.2(19) . . . . ?
Ag04 O018 C020 O00N -11(9) . . . . ?
Ag04 O018 C020 C10 173(3) . . . . ?
Ag05 O00N C020 O018 -30(10) . . . . ?
Ag05 O00N C020 C10 147(3) . . . . ?
C1 C01B C021 C013 -37(3) . . . . ?
C1 C01B C021 C02P 69.6(19) . . . . ?
C01V C013 C021 C01B 38(3) . . . . ?
C01V C013 C021 C02P -70.9(19) . . . . ?
C02E C010 C022 C00I -60.7(15) . . . . ?
C00U C010 C022 C00I 61.5(14) . . . . ?
C01A C00I C022 C010 61.9(17) . . . . ?
C19 C00I C022 C010 -59.1(17) . . . . ?
S00C C00I C022 C010 179.8(13) . . . . ?
C01G C00H C024 C1 59.9(18) . . . . ?
C02P C00H C024 C1 -60.3(18) . . . . ?
S00B C00H C024 C1 -178.2(14) . . . . ?
C01B C1 C024 C00H 61.5(16) . . . . ?
C01Y C1 C024 C00H -58.4(16) . . . . ?
C02F C00L C027 C016 69(2) . . . . ?
C7 C00L C027 C016 -52(2) . . . . ?
S00F C00L C027 C016 -172.8(19) . . . . ?
C01T C016 C027 C00L -62.3(17) . . . . ?
C02J C016 C027 C00L 57.5(19) . . . . ?
C01P C00K C02C C01M -61.5(17) . . . . ?
C02L C00K C02C C01M 58.7(17) . . . . ?
S00D C00K C02C C01M -178.6(12) . . . . ?
C01L C01M C02C C00K 61.3(16) . . . . ?
C01E C01M C02C C00K -58.3(16) . . . . ?
C00U C010 C02E C011 -55(2) . . . . ?
C022 C010 C02E C011 64.4(17) . . . . ?
C017 C011 C02E C010 55.5(19) . . . . ?
C01A C011 C02E C010 -62.9(16) . . . . ?
C12 C019 C02F C00L -60.7(16) . . . . ?
C01T C019 C02F C00L 60.0(17) . . . . ?
C027 C00L C02F C019 -64.2(18) . . . . ?
C7 C00L C02F C019 57.4(18) . . . . ?
S00F C00L C02F C019 179.3(14) . . . . ?
C12 C00S C02J C016 -28(3) . . . . ?
C7 C00S C02J C016 67(2) . . . . ?
C01T C016 C02J C00S 39(2) . . . . ?
C027 C016 C02J C00S -71(2) . . . . ?
C01E C00Y C02L C00K 61.9(16) . . . . ?
C9 C00Y C02L C00K -58.4(16) . . . . ?
C01P C00K C02L C00Y 61.9(17) . . . . ?
C02C C00K C02L C00Y -60.2(18) . . . . ?
S00D C00K C02L C00Y 178.8(15) . . . . ?
C01B C021 C02P C00H -56.7(16) . . . . ?
C013 C021 C02P C00H 62.4(15) . . . . ?
C01G C00H C02P C021 -62.4(18) . . . . ?
C024 C00H C02P C021 57.4(18) . . . . ?
S00B C00H C02P C021 177.2(14) . . . . ?
C015 C00J C02S C5 -55.2(18) . . . . ?
C01D C00J C02S C5 62.3(17) . . . . ?
S00E C00J C02S C5 -177.1(14) . . . . ?
C12 C00S C7 C00L 61.1(19) . . . . ?
C02J C00S C7 C00L -59(2) . . . . ?
C027 C00L C7 C00S 58(2) . . . . ?
C02F C00L C7 C00S -65(2) . . . . ?
S00F C00L C7 C00S 175(2) . . . . ?
C02J C00S C12 C019 26(3) . . . . ?
C7 C00S C12 C019 -74(2) . . . . ?
C01T C019 C12 C00S -34(3) . . . . ?
C02F C019 C12 C00S 83(2) . . . . ?
C017 C00X C19 C00I 57.5(16) . . . . ?
C00U C00X C19 C00I -61.5(15) . . . . ?
C022 C00I C19 C00X 62.8(17) . . . . ?
C01A C00I C19 C00X -58.1(17) . . . . ?
S00C C00I C19 C00X -177.7(13) . . . . ?
C00J C015 C47 C6 57.8(18) . . . . ?
C00J C015 C47 C25 -61.8(17) . . . . ?
C25 C47 C6 C8 49(2) . . . . ?
C015 C47 C6 C8 -64.7(19) . . . . ?
C8 C01C C5 C02S 68.2(18) . . . . ?
C8 C01C C5 C25 -49(2) . . . . ?
C00J C02S C5 C01C -63.0(16) . . . . ?
C00J C02S C5 C25 55.5(17) . . . . ?
C6 C47 C25 C5 -53(2) . . . . ?
C015 C47 C25 C5 61.4(16) . . . . ?
C01C C5 C25 C47 52(2) . . . . ?
C02S C5 C25 C47 -60.9(18) . . . . ?
C5 C01C C8 C6 47(2) . . . . ?
C5 C01C C8 C01D -66.3(17) . . . . ?
C47 C6 C8 C01C -46(2) . . . . ?
C47 C6 C8 C01D 67.5(18) . . . . ?
C00J C01D C8 C01C 58.7(17) . . . . ?
C00J C01D C8 C6 -62.4(17) . . . . ?
C01L C00O C9 C00Y 52(2) . . . . ?
C01P C00O C9 C00Y -68.2(17) . . . . ?
C01E C00Y C9 C00O -50(2) . . . . ?
C02L C00Y C9 C00O 65.2(17) . . . . ?
O018 C020 C10 F1 -62(6) . . . . ?
O00N C020 C10 F1 121(4) . . . . ?
O018 C020 C10 F31 58(6) . . . . ?
O00N C020 C10 F31 -119(4) . . . . ?
O018 C020 C10 F13 172(4) . . . . ?
O00N C020 C10 F13 -4(6) . . . . ?
Ag05 O1 C42 O65 7(6) . . . . ?
Ag05 O1 C42 C32 -154(2) . . . . ?
Ag09 O14 C13 O80 70(3) . . . . ?
Ag09 O14 C13 C2 -110(4) . . . . ?
Ag09 O14 C13 F2 -131(2) . . . . ?
Ag04 O80 C13 O14 -15(3) . . . . ?
Ag04 O80 C13 C2 165.4(13) . . . . ?
Ag04 O80 C13 F2 -141(3) . . . . ?
O1 C42 O65 Ag02 9(5) . . . . ?
C32 C42 O65 Ag02 173.2(16) . . . . ?
O1 C42 C32 F01Z -33(4) . . . . ?
O65 C42 C32 F01Z 163(2) . . . . ?
O1 C42 C32 F00Q -154(3) . . . . ?
O65 C42 C32 F00Q 43(3) . . . . ?
O1 C42 C32 F02Q 85(4) . . . . ?
O65 C42 C32 F02Q -79(3) . . . . ?
Ag0A O012 C22 O00Z 41(8) . . . . ?
Ag0A O012 C22 C44 -178(2) . . . . ?
Ag02 O00Z C22 O012 -45(8) . . . . ?
Ag02 O00Z C22 C44 175(2) . . . . ?
Ag09 O2 C3 N12 143.1(18) . . . . ?
Ag09 O2 C3 C4 -40.0(18) . . . . ?
C49 N12 C3 O2 -172(2) . . . . ?
C21 N12 C3 O2 -5(3) . . . . ?
C49 N12 C3 C4 11(3) . . . . ?
C21 N12 C3 C4 178(2) . . . . ?
Ag0A C4 C3 O2 -2.1(17) 3_666 . . . ?
Ag0A C4 C3 N12 174.8(18) 3_666 . . . ?
O012 C22 C44 F5 22(6) . . . . ?
O00Z C22 C44 F5 169(4) . . . . ?
O012 C22 C44 F02B 143(4) . . . . ?
O00Z C22 C44 F02B -71(5) . . . . ?
O012 C22 C44 F34 -101(4) . . . . ?
O00Z C22 C44 F34 46(5) . . . . ?
O14 C13 C2 F3 -142(4) . . . . ?
O80 C13 C2 F3 38(3) . . . . ?
F2 C13 C2 F3 -116.4(16) . . . . ?
O14 C13 C2 F4 85(4) . . . . ?
O80 C13 C2 F4 -95(2) . . . . ?
F2 C13 C2 F4 110.1(17) . . . . ?
O14 C13 C2 F2 -25(4) . . . . ?
O80 C13 C2 F2 155(2) . . . . ?
O14 C13 C2 F6 -21(5) . . . . ?
O80 C13 C2 F6 159(2) . . . . ?
F3 C2 F2 C13 100(2) . . . . ?
F4 C2 F2 C13 -116(2) . . . . ?
O14 C13 F2 C2 166.2(19) . . . . ?
O80 C13 F2 C2 -65(4) . . . . ?

_refine_diff_density_max         4.146
_refine_diff_density_min         -2.493
_refine_diff_density_rms         0.388



# start Validation Reply Form
_vrf_PLAT413_X4ESxT-03Jun131503_a 
;
PROBLEM: Short Inter XH3 .. XHn H00X ..H49C . 1.79 Ang.
 x,-1+y,z = 1_545 Check
RESPONSE: The crystals are light sensitive and hence performing single
crystal diffraction experiments on these crystals was extremely challenging
and hence this results in the collection of weak reflections of reduced accuracy.
;
_vrf_PLAT971_X4ESxT-03Jun131503_a 
;
PROBLEM: Check Calcd Resid. Dens. 0.86Ang From Ag07 3.98 eA-3
RESPONSE: Huge absorption from large number of silver atoms and highly diffuse 
electron density.
;
_vrf_PLAT084_X4ESxT-03Jun131503_a 
;
PROBLEM:  High wR2 Value (i.e. > 0.25) ................... 0.42 Report
RESPONSE: The crystals are light sensitive and hence performing single
crystal diffraction experiments on these crystals was extremely challenging
and hence this results in the collection of weak reflections of reduced accuracy.
;
_vrf_PLAT230_X4ESxT-03Jun131503_a 
;
PROBLEM: Hirshfeld Test Diff for S00B --C00H . 8.9 s.u.
RESPONSE: The crystals are light sensitive hence this results in the
collection of weak reflections of reduced accuracy.
;
_vrf_PLAT234_X4ESxT-03Jun131503_a 
;
PROBLEM: Large Hirshfeld Difference Ag01 --O21B . 0.28 Ang.
RESPONSE: The crystals are light sensitive hence this results in 
the collection of weak reflections of reduced accuracy.
;
_vrf_PLAT241_X4ESxT-03Jun131503_a 
;
PROBLEM: High 'MainMol' Ueq as Compared to Neighbors of O1 Check
RESPONSE: Huge absorption from large number of silver atoms and
highly diffuse electron density.
;
_vrf_PLAT242_X4ESxT-03Jun131503_a 
;
PROBLEM: Low 'MainMol' Ueq as Compared to Neighbors of Ag02 Check
RESPONSE: Huge absorption from large number of silver atoms and
highly diffuse electron density.
;
_vrf_PLAT342_X4ESxT-03Jun131503_a 
;
PROBLEM: Low Bond Precision on C-C Bonds ............... 0.02773 Ang.
RESPONSE: The crystals are light sensitive hence this results in the
collection of weak reflections of reduced accuracy.
;
_vrf_PLAT362_X4ESxT-03Jun131503_a 
;
PROBLEM: Short C(sp3)-C(sp2) Bond C00W - C01S . 1.26 Ang.
RESPONSE: The crystals are light sensitive hence this results in the
collection of weak reflections of reduced accuracy.
;
_vrf_PLAT410_X4ESxT-03Jun131503_a 
;
PROBLEM: Short Intra H...H Contact H7A ..H12B . 1.81 Ang.
 x,y,z = 1_555 Check
RESPONSE: The crystals are light sensitive and hence performing single
crystal diffraction experiments on these crystals was extremely challenging
and hence this results in the collection of weak reflections of reduced accuracy.
;
_vrf_PLAT434_X4ESxT-03Jun131503_a 
;
PROBLEM: Short Inter HL..HL Contact F4 ..F02Q . 2.33 Ang.
 1/2-x,1/2+y,3/2-z = 2_556 Check
RESPONSE: The crystals are light sensitive and hence performing single
crystal diffraction experiments on these crystals was extremely challenging
and hence this results in the collection of weak reflections of reduced accuracy.
;
# end Validation Reply Form


