# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2022

####################################################################### 
# 
# 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_xyh20210622_80_2_0m_a_a
_database_code_depnum_ccdc_archive 'CCDC 2180649'
loop_
_audit_author_name
_audit_author_address
'Yuhan Xia'
;Huazhong University of Scienceand Technology
China
;
_audit_update_record             
;
2022-06-21 deposited with the CCDC.	2022-08-26 downloaded from the CCDC.
;
_audit_creation_date             2022-06-20
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        xyh01
_chemical_formula_moiety         'C114 H210 Ag46 F36 N2 O54 S28 V10'
_chemical_formula_sum            'C114 H210 Ag46 F36 N2 O54 S28 V10'
_chemical_formula_weight         9525.93
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
V V 0.3005 0.5294 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

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

_cell_length_a                   18.1391(7)
_cell_length_b                   39.1409(16)
_cell_length_c                   18.9060(9)
_cell_angle_alpha                90
_cell_angle_beta                 114.1710(10)
_cell_angle_gamma                90
_cell_volume                     12246.1(9)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9894
_cell_measurement_temperature    305.3
_cell_measurement_theta_max      25.34
_cell_measurement_theta_min      2.59
_shelx_estimated_absorpt_T_max   0.700
_shelx_estimated_absorpt_T_min   0.587
_exptl_absorpt_coefficient_mu    4.262
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5923
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.0775 before and 0.0586 after correction.
The Ratio of minimum to maximum transmission is 0.7948.
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.0775 before and 0.0586 after correction.
The Ratio of minimum to maximum transmission is 0.7948.
The λ/2 correction factor is 0.00150.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear orangish orange'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   orangish
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.583
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             9008
_exptl_crystal_preparation       'stir for 2h'
_exptl_crystal_recrystallization_method 'at room temperature'
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.09
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0695
_diffrn_reflns_av_unetI/netI     0.0810
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.990
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       47
_diffrn_reflns_limit_k_min       -45
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            89557
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.990
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.461
_diffrn_reflns_theta_min         2.460
_diffrn_ambient_temperature      305.3
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  XYH20210622_80_2_0m_a_a
_diffrn_measurement_method       ?
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_special_details          nothing
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                11747
_reflns_number_total             22472
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.3 (Bourhis et al., 2015)'
_refine_diff_density_max         2.190
_refine_diff_density_min         -1.203
_refine_diff_density_rms         0.163
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.022
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1919
_refine_ls_number_reflns         22472
_refine_ls_number_restraints     1796
_refine_ls_R_factor_all          0.1568
_refine_ls_R_factor_gt           0.0896
_refine_ls_restrained_S_all      0.992
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0914P)²+204.8295P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2222
_refine_ls_wR_factor_ref         0.2577
_refine_special_details          nothing
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C33-C32 = C66A-C32 = C31-C32 = C41A-C32
 1.54 with sigma of 0.01
 F10-C34 = C34-F11
 1.38 with sigma of 0.02
 F12-C34 = C34-F10
 1.38 with sigma of 0.02
 F11A-C34 = C34-F10A
 1.38 with sigma of 0.02
 F10A-C34 = C34-F12A
 1.38 with sigma of 0.02
 C29A-C27 = C26-C27 = C28-C27 = C74A-C27
 1.54 with sigma of 0.01
 F12-C34 = C34-F11
 1.38 with sigma of 0.02
 C4A-C48 = C47-C48 = C30A-C48 = C49-C48
 1.54 with sigma of 0.01
 O24-C43 = O25-C43
 1.2 with sigma of 0.01
 C64A-C54 = C55-C54 = C54A-C54 = C53-C54
 1.54 with sigma of 0.01
 C49-C48 = C48-C47
 1.54 with sigma of 0.02
 C19-N1 = N1-C18
 1.43 with sigma of 0.02
 C2A-C16 = C16-C1A
 1.54 with sigma of 0.02
 C25-C24 = C40A-C24 = C23-C24 = C9A-C24
 1.54 with sigma of 0.01
 C4A-C48 = C48-C30A
 1.54 with sigma of 0.02
 C53-C54
 1.54 with sigma of 0.01
 C45-C16A = C45-C46 = C45-C44 = C45-C33A
 1.54 with sigma of 0.01
 C21-C22 = C42-C43
 1.54 with sigma of 0.01
 F13-C42 = C42-F15
 1.38 with sigma of 0.02
 F7A-C42 = C42-F1A
 1.38 with sigma of 0.02
 C38A-N18A = N18A-C35A
 1.43 with sigma of 0.02
 C35A-N18A
 1.43 with sigma of 0.01
 C38A-N18A
 1.43 with sigma of 0.01
 C28A-C37 = C37-C17A
 1.54 with sigma of 0.01
 F4-C21 = C21-F5
 1.38 with sigma of 0.02
 F8-C29 = C29-F7
 1.38 with sigma of 0.02
 F9-C29 = C29-F7
 1.38 with sigma of 0.02
 F3-C7 = C7-F1
 1.38 with sigma of 0.02
 F3-C7 = C7-F2
 1.38 with sigma of 0.02
 F6A-C7 = C7-F3A
 1.38 with sigma of 0.02
 F6A-C7 = C7-F4A
 1.38 with sigma of 0.02
 F17A-C21 = C21-F28A
 1.38 with sigma of 0.02
 F8A-C21 = C21-F17A
 1.38 with sigma of 0.02
 F9A-C29 = C29-F19A
 1.38 with sigma of 0.02
 F8A-C21 = C21-F28A
 1.38 with sigma of 0.02
 C30-C29
 1.54 with sigma of 0.01
 F16A-C29 = C29-F9A
 1.38 with sigma of 0.02
 O20-C30 = O21-C30
 1.2 with sigma of 0.01
 F3A-C7 = C7-F4A
 1.38 with sigma of 0.02
 C15-C16 = C16-C17
 1.54 with sigma of 0.02
 F2-C7 = C7-F1
 1.38 with sigma of 0.02
 C8-C7
 1.54 with sigma of 0.01
 C52-C51 = C51-C50
 1.54 with sigma of 0.01
 F11A-C34 = C34-F12A
 1.38 with sigma of 0.02
 O9A-C30 = C30-O66A
 1.2 with sigma of 0.02
 O15A-C8 = C8-O16A
 1.2 with sigma of 0.02
 O18-C22 = C22-O19
 1.2 with sigma of 0.02
 O24A-C43 = C43-O25A
 1.2 with sigma of 0.02
 O23A-C35 = C35-O22A
 1.2 with sigma of 0.02
 O22-C35 = C35-O23
 1.2 with sigma of 0.02
 F10-F11
 2.254 with sigma of 0.04
 F12-F10
 2.254 with sigma of 0.04
 F11A-F10A
 2.254 with sigma of 0.04
 F10A-F12A
 2.254 with sigma of 0.04
 F12-F11
 2.254 with sigma of 0.04
 C49-C47
 2.515 with sigma of 0.04
 C19-C18
 2.336 with sigma of 0.04
 C2A-C1A
 2.515 with sigma of 0.04
 C4A-C30A
 2.515 with sigma of 0.04
 F13-F15
 2.254 with sigma of 0.04
 F7A-F1A
 2.254 with sigma of 0.04
 C38A-C35A
 2.336 with sigma of 0.04
 F4-F5
 2.254 with sigma of 0.04
 F8-F7
 2.254 with sigma of 0.04
 F9-F7
 2.254 with sigma of 0.04
 F3-F2
 2.254 with sigma of 0.04
 F3-F1
 2.254 with sigma of 0.04
 F6A-F4A
 2.254 with sigma of 0.04
 F6A-F3A
 2.254 with sigma of 0.04
 F17A-F28A
 2.254 with sigma of 0.04
 F9A-F19A
 2.254 with sigma of 0.04
 F8A-F17A
 2.254 with sigma of 0.04
 F8A-F28A
 2.254 with sigma of 0.04
 F16A-F9A
 2.254 with sigma of 0.04
 F3A-F4A
 2.254 with sigma of 0.04
 C15-C17
 2.515 with sigma of 0.04
 F2-F1
 2.254 with sigma of 0.04
 F11A-F12A
 2.254 with sigma of 0.04
 O9A-O66A
 2.078 with sigma of 0.04
 O18-O19
 2.078 with sigma of 0.04
 O24A-O25A
 2.078 with sigma of 0.04
 O15A-O16A
 2.078 with sigma of 0.04
 O23A-O22A
 2.078 with sigma of 0.04
 O22-O23
 2.078 with sigma of 0.04
 O2A-C22 \\sim O18-C22 \\sim O19-C22 \\sim O64A-C22
 with sigma of 0.02
 S4-O18 \\sim S5-O18
 with sigma of 0.02
 O9A-C30 \\sim O20-C30 \\sim O66A-C30 \\sim O21-C30
 with sigma of 0.02
 O9A-C29 \\sim O66A-C29
 with sigma of 0.02
 F12-C34 \\sim F11-C34 \\sim F10-C34
 with sigma of 0.02
 O2A-C21 \\sim O64A-C21
 with sigma of 0.02
 N1-C19 \\sim N1-C18
 with sigma of 0.02
 C18-C20 \\sim C20-C19
 with sigma of 0.02
 S10-C64A \\sim S10-C54A
 with sigma of 0.02
 F15-C42 \\sim F13-C42 \\sim F14-C42 \\sim F1A-C42 \\sim F7A-C42 \\sim F29A-C42
 with sigma of 0.02
 C46A-C10 \\sim C9-C10 \\sim C32A-C10 \\sim C11-C10
 with sigma of 0.02
 S3-C32A \\sim S3-C46A
 with sigma of 0.02
 C40-C27A \\sim C40-C39 \\sim C40-C31A \\sim C40-C41
 with sigma of 0.02
 C4-C5 \\sim C6-C5 \\sim C67A-C5 \\sim C44A-C5
 with sigma of 0.02
 C38A-C36A \\sim C36A-C35A
 with sigma of 0.02
 C28A-C37 \\sim C36-C37 \\sim C37-C17A \\sim C37-C38
 with sigma of 0.02
 S14-C38 \\sim S14-C36
 with sigma of 0.02
 F5-C21 \\sim F6-C21 \\sim F4-C21 \\sim F8A-C21 \\sim F17A-C21 \\sim F28A-C21
 with sigma of 0.02
 F16-C56 \\sim F18-C56 \\sim F01{-C56 \\sim F0-C56 \\sim F19-C56 \\sim F17-C56
 with sigma of 0.02
 F1-C7 \\sim F3-C7 \\sim F6A-C7 \\sim F3A-C7 \\sim F4A-C7 \\sim F2-C7
 with sigma of 0.02
 F7-C29 \\sim F9-C29 \\sim F8-C29 \\sim F16A-C29 \\sim F19A-C29 \\sim F9A-C29
 with sigma of 0.02
 F9-C30 \\sim F7-C30 \\sim F8-C30
 with sigma of 0.02
 O21-C29 \\sim O20-C29
 with sigma of 0.02
 F6A-C8 \\sim F4A-C8 \\sim F3A-C8
 with sigma of 0.02
 O17-C20 \\sim O17-C36A
 with sigma of 0.02
 N1-C20 \\sim N18A-C36A
 with sigma of 0.02
 O24A-C42 \\sim O25A-C42
 with sigma of 0.02
 F3A-C8 \\sim F2-C8 \\sim F3-C8 \\sim F4A-C8 \\sim F6A-C8 \\sim F1-C8
 with sigma of 0.02
 O15A-C7 \\sim O16-C7 \\sim O16A-C7 \\sim O15-C7
 with sigma of 0.02
 F11-C35 \\sim F10A-C35 \\sim F10-C35 \\sim F11A-C35 \\sim F12-C35 \\sim
F12A-C35
 with sigma of 0.02
 O23A-C34 \\sim O23-C34 \\sim O22-C34 \\sim O22A-C34
 with sigma of 0.02
 S8-O23A \\sim S13-O22A
 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
O5 \\sim O3 \\sim O8 \\sim O6 \\sim O7 \\sim O2 \\sim O12 \\sim O11 \\sim O10
\\sim O1 \\sim O4 \\sim O13 \\sim O9 \\sim O14 \\sim O27 \\sim O26 \\sim O18
\\sim O25 \\sim O24 \\sim O17 \\sim O19 \\sim O16 \\sim O15 \\sim O64A \\sim
O2A \\sim O21 \\sim O20 \\sim O66A \\sim O9A \\sim O15A \\sim O16A \\sim O24A
\\sim O25A \\sim O22 \\sim O23 \\sim O23A \\sim O22A: within 2A with sigma of
0.001 and sigma for terminal atoms of 0.002 within 2A
O19 \\sim O2A \\sim O18 \\sim O64A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
C22 \\sim O19 \\sim O64A \\sim O18 \\sim O2A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
O21 \\sim O9A \\sim O20 \\sim O66A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
F7 \\sim F9 \\sim F8 \\sim C29 \\sim F16A \\sim F19A \\sim F9A \\sim O21 \\sim
C30 \\sim O20 \\sim O66A \\sim O9A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
C27 \\sim C26 \\sim C28 \\sim C29A \\sim C74A \\sim C46 \\sim C44 \\sim C33A
\\sim C45 \\sim C16A: within 2A with sigma of 0.01 and sigma for terminal atoms
of 0.02 within 2A
C48 \\sim C49 \\sim C47 \\sim C4A \\sim C30A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
O17 \\sim C19 \\sim N1 \\sim C18 \\sim C20 \\sim C36A \\sim C35A \\sim N18A
\\sim C38A: within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02
within 2A
C16 \\sim C17 \\sim C15 \\sim C1A \\sim C2A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C55 \\sim C64A \\sim C53 \\sim C54A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
C25 \\sim C40A \\sim C24 \\sim C9A \\sim C23: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
F2 \\sim F1 \\sim F3 \\sim C7 \\sim F6A \\sim F3A \\sim F4A \\sim F5 \\sim F6
\\sim C21 \\sim F4 \\sim F8A \\sim F17A \\sim F28A \\sim F9 \\sim F8 \\sim C29
\\sim F16A \\sim F19A \\sim F9A \\sim F7 \\sim F15 \\sim F13 \\sim F14 \\sim
C42 \\sim F1A \\sim F7A \\sim F29A \\sim F16 \\sim F17 \\sim F18 \\sim C56
\\sim F01{ \\sim F0 \\sim F19: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
C32 \\sim C31 \\sim C33 \\sim C41A \\sim C66A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C10 \\sim C11 \\sim C9 \\sim C32A \\sim C46A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C40 \\sim C39 \\sim C41 \\sim C31A \\sim C27A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C5 \\sim C4 \\sim C6 \\sim C67A \\sim C44A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C36 \\sim C17A \\sim C38 \\sim C37 \\sim C28A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
Ag24 \\sim Ag13: within 2A with sigma of 0.01 and sigma for terminal atoms of
0.02 within 2A
Ag4 \\sim Ag27: within 2A with sigma of 0.01 and sigma for terminal atoms of
0.02 within 2A
O16 \\sim O15A \\sim O15 \\sim O16A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
O25 \\sim O24A \\sim O24 \\sim C43 \\sim O25A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C57 \\sim C56 \\sim C2 \\sim C51 \\sim C1 \\sim C27 \\sim C3 \\sim C52 \\sim C5
\\sim C13 \\sim C50 \\sim C26 \\sim C12 \\sim C14 \\sim C54 \\sim C4 \\sim C53
\\sim C55 \\sim C6 \\sim C28 \\sim C16 \\sim C10 \\sim C40 \\sim C17 \\sim C39
\\sim C41 \\sim C11 \\sim C9 \\sim C48 \\sim C24 \\sim C32 \\sim C49 \\sim C23
\\sim C47 \\sim C31 \\sim C36 \\sim C38 \\sim C33 \\sim C25 \\sim C21 \\sim C22
\\sim C42 \\sim C19 \\sim C29 \\sim C18 \\sim C7 \\sim C43 \\sim C8 \\sim C41A
\\sim C66A \\sim C37 \\sim C32A \\sim C46A \\sim C28A \\sim C17A \\sim C27A
\\sim C31A \\sim C67A \\sim C44A \\sim C30 \\sim C34 \\sim C20 \\sim C36A \\sim
C35A \\sim C38A \\sim C15 \\sim C1A \\sim C2A \\sim C45 \\sim C46 \\sim C44
\\sim C16A \\sim C33A \\sim C29A \\sim C74A \\sim C4A \\sim C30A \\sim C9A
\\sim C40A \\sim C54A \\sim C64A \\sim C35: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
S2 \\sim C44A \\sim C5 \\sim C4 \\sim C67A \\sim C6: within 2A with sigma of
0.01 and sigma for terminal atoms of 0.02 within 2A
Ag2 \\sim O9: within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02
within 2A
C34 \\sim F12 \\sim F11 \\sim F10 \\sim F12A \\sim F11A \\sim F10A \\sim O22A
\\sim O22 \\sim C35 \\sim O23 \\sim O23A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
O9 \\sim V3: within 2A with sigma of 0.004 and sigma for terminal atoms of
0.008 within 2A
Uanis(O17) \\sim Ueq, Uanis(N1) \\sim Ueq, Uanis(C19) \\sim Ueq: with sigma of
0.1 and sigma for terminal atoms of 0.2
Uanis(F15) \\sim Ueq, Uanis(F13) \\sim Ueq, Uanis(F14) \\sim Ueq, Uanis(C42)
\\sim Ueq, Uanis(F1A) \\sim Ueq, Uanis(F7A) \\sim Ueq, Uanis(F29A) \\sim Ueq:
with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C43) \\sim Ueq: with sigma of 0.1 and sigma for terminal atoms of 0.2
Uanis(F5) \\sim Ueq, Uanis(F6) \\sim Ueq, Uanis(C21) \\sim Ueq, Uanis(F4) \\sim
Ueq, Uanis(F8A) \\sim Ueq, Uanis(F17A) \\sim Ueq, Uanis(F28A) \\sim Ueq: with
sigma of 0.1 and sigma for terminal atoms of 0.2
Uanis(C28A) \\sim Ueq, Uanis(C36) \\sim Ueq, Uanis(C17A) \\sim Ueq, Uanis(C38)
\\sim Ueq, Uanis(C37) \\sim Ueq, Uanis(C4) \\sim Ueq, Uanis(C44A) \\sim Ueq,
Uanis(C5) \\sim Ueq, Uanis(C6) \\sim Ueq, Uanis(C67A) \\sim Ueq: with sigma of
0.1 and sigma for terminal atoms of 0.2
Uanis(O22A) \\sim Ueq, Uanis(O22) \\sim Ueq, Uanis(C35) \\sim Ueq, Uanis(O23A)
\\sim Ueq, Uanis(O23) \\sim Ueq, Uanis(C34) \\sim Ueq, Uanis(F12) \\sim Ueq,
Uanis(F11) \\sim Ueq, Uanis(F10) \\sim Ueq, Uanis(F12A) \\sim Ueq, Uanis(F11A)
\\sim Ueq, Uanis(F10A) \\sim Ueq: with sigma of 0.1 and sigma for terminal
atoms of 0.2
4. Others
 Sof(Ag8A)=1-FVAR(1)
 Sof(Ag22)=FVAR(1)
 Sof(Ag7A)=1-FVAR(2)
 Sof(Ag12)=FVAR(2)
 Sof(Ag6A)=1-FVAR(3)
 Sof(Ag9)=FVAR(3)
 Sof(Ag4A)=1-FVAR(4)
 Sof(Ag11)=FVAR(4)
 Sof(Ag)=1-FVAR(5)
 Sof(Ag17)=FVAR(5)
 Sof(F1A)=Sof(F7A)=Sof(F29A)=1-FVAR(6)
 Sof(F15)=Sof(F13)=Sof(F14)=FVAR(6)
 Sof(F8A)=Sof(F17A)=Sof(F28A)=1-FVAR(7)
 Sof(F5)=Sof(F6)=Sof(F4)=FVAR(7)
 Sof(F01{)=Sof(F0)=Sof(F19)=1-FVAR(8)
 Sof(F16)=Sof(F17)=Sof(F18)=FVAR(8)
 Sof(F6A)=Sof(F3A)=Sof(F4A)=1-FVAR(9)
 Sof(F2)=Sof(F1)=Sof(F3)=FVAR(9)
 Sof(F16A)=Sof(F19A)=Sof(F9A)=1-FVAR(10)
 Sof(F7)=Sof(F9)=Sof(F8)=FVAR(10)
 Sof(O64A)=Sof(O2A)=1-FVAR(11)
 Sof(O18)=Sof(O19)=FVAR(11)
 Sof(H32A)=Sof(C41A)=Sof(H41D)=Sof(H41E)=Sof(H41F)=Sof(C66A)=Sof(H66A)=
 Sof(H66B)=Sof(H66C)=1-FVAR(12)
 Sof(H32)=Sof(C31)=Sof(H31A)=Sof(H31B)=Sof(H31C)=Sof(C33)=Sof(H33A)=Sof(H33B)=
 Sof(H33C)=FVAR(12)
 Sof(H10A)=Sof(C32A)=Sof(H32B)=Sof(H32C)=Sof(H32D)=Sof(C46A)=Sof(H46A)=
 Sof(H46B)=Sof(H46C)=1-FVAR(13)
 Sof(H10)=Sof(C11)=Sof(H11A)=Sof(H11B)=Sof(H11C)=Sof(C9)=Sof(H9A)=Sof(H9B)=
 Sof(H9C)=FVAR(13)
 Sof(H37A)=Sof(C28A)=Sof(H28D)=Sof(H28E)=Sof(H28F)=Sof(C17A)=Sof(H17D)=
 Sof(H17E)=Sof(H17F)=1-FVAR(14)
 Sof(C36)=Sof(H36A)=Sof(H36B)=Sof(H36C)=Sof(C38)=Sof(H38A)=Sof(H38B)=Sof(H38C)=
 Sof(H37)=FVAR(14)
 Sof(H40A)=Sof(C27A)=Sof(H27B)=Sof(H27C)=Sof(H27D)=Sof(C31A)=Sof(H31D)=
 Sof(H31E)=Sof(H31F)=1-FVAR(15)
 Sof(H40)=Sof(C39)=Sof(H39A)=Sof(H39B)=Sof(H39C)=Sof(C41)=Sof(H41A)=Sof(H41B)=
 Sof(H41C)=FVAR(15)
 Sof(Ag24)=1-FVAR(16)
 Sof(Ag13)=FVAR(16)
 Sof(H5B)=Sof(C67A)=Sof(H67A)=Sof(H67B)=Sof(H67C)=Sof(C44A)=Sof(H44A)=
 Sof(H44B)=Sof(H44C)=1-FVAR(17)
 Sof(H5A)=Sof(C4)=Sof(H4A)=Sof(H4B)=Sof(H4C)=Sof(C6)=Sof(H6A)=Sof(H6B)=
 Sof(H6C)=FVAR(17)
 Sof(O66A)=Sof(O9A)=1-FVAR(18)
 Sof(O21)=Sof(O20)=FVAR(18)
 Sof(C36A)=Sof(H36D)=Sof(C35A)=Sof(H35A)=Sof(H35B)=Sof(H35C)=Sof(N18A)=
 Sof(C38A)=Sof(H38D)=Sof(H38E)=Sof(H38F)=1-FVAR(19)
 Sof(C19)=Sof(H19A)=Sof(H19B)=Sof(H19C)=Sof(N1)=Sof(C18)=Sof(H18A)=Sof(H18B)=
 Sof(H18C)=Sof(C20)=Sof(H20)=FVAR(19)
 Sof(Ag25)=1-FVAR(20)
 Sof(Ag18)=FVAR(20)
 Sof(Ag26)=1-FVAR(21)
 Sof(Ag14)=FVAR(21)
 Sof(H16A)=Sof(C1A)=Sof(H1AA)=Sof(H1AB)=Sof(H1AC)=Sof(C2A)=Sof(H2AA)=Sof(H2AB)=
 Sof(H2AC)=1-FVAR(22)
 Sof(H16)=Sof(C17)=Sof(H17A)=Sof(H17B)=Sof(H17C)=Sof(C15)=Sof(H15A)=Sof(H15B)=
 Sof(H15C)=FVAR(22)
 Sof(H45A)=Sof(C16A)=Sof(H16B)=Sof(H16C)=Sof(H16D)=Sof(C33A)=Sof(H33D)=
 Sof(H33E)=Sof(H33F)=1-FVAR(23)
 Sof(H45)=Sof(C46)=Sof(H46D)=Sof(H46E)=Sof(H46F)=Sof(C44)=Sof(H44D)=Sof(H44E)=
 Sof(H44F)=FVAR(23)
 Sof(H27A)=Sof(C29A)=Sof(H29A)=Sof(H29B)=Sof(H29C)=Sof(C74A)=Sof(H74A)=
 Sof(H74B)=Sof(H74C)=1-FVAR(24)
 Sof(H27)=Sof(C26)=Sof(H26A)=Sof(H26B)=Sof(H26C)=Sof(C28)=Sof(H28A)=Sof(H28B)=
 Sof(H28C)=FVAR(24)
 Sof(H48A)=Sof(C4A)=Sof(H4AA)=Sof(H4AB)=Sof(H4AC)=Sof(C30A)=Sof(H30A)=
 Sof(H30B)=Sof(H30C)=1-FVAR(25)
 Sof(H48)=Sof(C49)=Sof(H49A)=Sof(H49B)=Sof(H49C)=Sof(C47)=Sof(H47A)=Sof(H47B)=
 Sof(H47C)=FVAR(25)
 Sof(Ag27)=1-FVAR(26)
 Sof(Ag4)=FVAR(26)
 Sof(H24A)=Sof(C9A)=Sof(H9AA)=Sof(H9AB)=Sof(H9AC)=Sof(C40A)=Sof(H40B)=
 Sof(H40C)=Sof(H40D)=1-FVAR(27)
 Sof(H24)=Sof(C23)=Sof(H23A)=Sof(H23B)=Sof(H23C)=Sof(C25)=Sof(H25A)=Sof(H25B)=
 Sof(H25C)=FVAR(27)
 Sof(H54A)=Sof(C54A)=Sof(H54B)=Sof(H54C)=Sof(H54D)=Sof(C64A)=Sof(H64A)=
 Sof(H64B)=Sof(H64C)=1-FVAR(28)
 Sof(H54)=Sof(C53)=Sof(H53A)=Sof(H53B)=Sof(H53C)=Sof(C55)=Sof(H55A)=Sof(H55B)=
 Sof(H55C)=FVAR(28)
 Sof(O15A)=Sof(O16A)=1-FVAR(29)
 Sof(O16)=Sof(O15)=FVAR(29)
 Sof(O24A)=Sof(O25A)=1-FVAR(30)
 Sof(O25)=Sof(O24)=FVAR(30)
 Sof(F12A)=Sof(F11A)=Sof(F10A)=1-FVAR(31)
 Sof(F12)=Sof(F11)=Sof(F10)=FVAR(31)
 Fixed Sof: O22(0.5) O23(0.5) O23A(0.5) O22A(0.5)
5.a Riding coordinates:
 C50(H50A,H50B,H50C), C26(H26A,H26B,H26C), C53(H53A,H53B,H53C), C55(H55A,H55B,
 H55C), C28(H28A,H28B,H28C), C39(H39A,H39B,H39C), C41(H41A,H41B,H41C), C9(H9A,
 H9B,H9C), C49(H49A,H49B,H49C), C23(H23A,H23B,H23C), C47(H47A,H47B,H47C),
 C31(H31A,H31B,H31C), C36(H36A,H36B,H36C), C38(H38A,H38B,H38C), C33(H33A,H33B,
 H33C), C25(H25A,H25B,H25C), C19(H19A,H19B,H19C), C18(H18A,H18B,H18C),
 C41A(H41D,H41E,H41F), C66A(H66A,H66B,H66C), C32A(H32B,H32C,H32D), C46A(H46A,
 H46B,H46C), C28A(H28D,H28E,H28F), C17A(H17D,H17E,H17F), C27A(H27B,H27C,H27D),
 C31A(H31D,H31E,H31F), C67A(H67A,H67B,H67C), C44A(H44A,H44B,H44C), C35A(H35A,
 H35B,H35C), C38A(H38D,H38E,H38F), C15(H15A,H15B,H15C), C1A(H1AA,H1AB,H1AC),
 C2A(H2AA,H2AB,H2AC), C33A(H33D,H33E,H33F), C74A(H74A,H74B,H74C), C4A(H4AA,H4AB,
 H4AC), C30A(H30A,H30B,H30C), C9A(H9AA,H9AB,H9AC), C64A(H64A,H64B,H64C)
5.b Ternary CH refined with riding coordinates:
 C2(H2), C51(H51), C27(H27), C27(H27A), C5(H5A), C5(H5B), C13(H13), C54(H54),
 C54(H54A), C16(H16), C16(H16A), C10(H10), C10(H10A), C40(H40), C40(H40A),
 C48(H48), C48(H48A), C24(H24), C24(H24A), C32(H32), C32(H32A), C37(H37),
 C37(H37A), C45(H45), C45(H45A)
5.c Aromatic/amide H refined with riding coordinates:
 C20(H20), C36A(H36D)
5.d Idealised Me refined as rotating group:
 C1(H1A,H1B,H1C), C3(H3A,H3B,H3C), C52(H52A,H52B,H52C), C12(H12A,H12B,H12C),
 C14(H14A,H14B,H14C), C4(H4A,H4B,H4C), C6(H6A,H6B,H6C), C17(H17A,H17B,H17C),
 C11(H11A,H11B,H11C), C46(H46D,H46E,H46F), C44(H44D,H44E,H44F), C16A(H16B,H16C,
 H16D), C29A(H29A,H29B,H29C), C40A(H40B,H40C,H40D), C54A(H54B,H54C,H54D)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag5 Ag 0.77203(8) 0.51424(4) 0.64980(9) 0.0720(4) Uani 1 1 d . . . . .
Ag6 Ag 0.76766(8) 0.54843(4) 0.50594(10) 0.0741(4) Uani 1 1 d . . . . .
Ag19 Ag 0.40888(9) 0.54248(4) 0.69238(9) 0.0754(4) Uani 1 1 d . . . . .
Ag16 Ag 0.76146(9) 0.59489(5) 0.64762(10) 0.0892(5) Uani 1 1 d . . . . .
Ag1 Ag 0.42265(12) 0.43619(4) 0.69601(11) 0.0936(5) Uani 1 1 d . . . . .
Ag7 Ag 0.73304(11) 0.62230(5) 0.39653(11) 0.0963(6) Uani 1 1 d . . . . .
Ag21 Ag 0.20211(11) 0.61819(5) 0.55803(11) 0.1025(6) Uani 1 1 d . . . . .
Ag20 Ag 0.23684(10) 0.53298(5) 0.57875(12) 0.0999(6) Uani 1 1 d . . . . .
Ag10 Ag 0.21649(11) 0.50835(6) 0.18605(12) 0.1076(6) Uani 1 1 d . . . . .
Ag23 Ag 0.54073(13) 0.65477(6) 0.59925(15) 0.1277(8) Uani 1 1 d . . . . .
Ag18 Ag 0.4159(15) 0.6243(3) 0.6835(5) 0.092(3) Uani 0.63(6) 1 d . . P A 1
Ag17 Ag 0.5903(4) 0.61685(11) 0.7459(6) 0.106(2) Uani 0.84(3) 1 d . . P A 1
V2 V 0.57889(12) 0.50380(5) 0.47872(12) 0.0311(5) Uani 1 1 d . . . . .
Ag11 Ag 0.19690(15) 0.56411(7) 0.3672(3) 0.0982(12) Uani 0.775(11) 1 d . . P A
1
V3 V 0.41271(13) 0.53768(6) 0.37375(13) 0.0381(5) Uani 1 1 d . U . . .
Ag3 Ag 0.60817(15) 0.55716(7) 0.84794(15) 0.1395(9) Uani 1 1 d . . . . .
Ag8 Ag 0.44949(14) 0.62093(7) 0.28214(15) 0.1403(9) Uani 1 1 d . . . . .
V4 V 0.41006(14) 0.57448(6) 0.51720(14) 0.0401(6) Uani 1 1 d . . . . .
V5 V 0.55877(14) 0.58143(6) 0.48190(14) 0.0407(6) Uani 1 1 d . . . . .
Ag2 Ag 0.60139(14) 0.48179(9) 0.82711(14) 0.1533(11) Uani 1 1 d . . . . .
Ag15 Ag 0.72978(15) 0.66595(6) 0.54323(17) 0.1510(10) Uani 1 1 d . . . . .
Ag4 Ag 0.7541(6) 0.5875(4) 0.8303(10) 0.137(4) Uani 0.74(4) 1 d . U P A 1
Ag14 Ag 0.5906(15) 0.6673(3) 0.3880(7) 0.120(5) Uani 0.64(5) 1 d . . P A 1
Ag22 Ag 0.26772(18) 0.67398(7) 0.4996(2) 0.1149(14) Uani 0.697(6) 1 d . . P A 1
S12 S 0.1817(2) 0.51137(12) 0.4457(3) 0.0634(11) Uani 1 1 d . . . . .
S4 S 0.7994(3) 0.61032(12) 0.5396(3) 0.0677(12) Uani 1 1 d D . . . .
S11 S 0.2899(3) 0.58188(12) 0.6646(3) 0.0679(12) Uani 1 1 d . . . . .
S3 S 0.8196(3) 0.55352(14) 0.7613(3) 0.0761(14) Uani 1 1 d D . . . .
S1 S 0.4568(3) 0.49044(13) 0.7632(3) 0.0720(13) Uani 1 1 d . . . . .
S13 S 0.1754(3) 0.62421(14) 0.4204(3) 0.0809(14) Uani 1 1 d D . . . .
S5 S 0.5919(4) 0.62614(14) 0.2912(3) 0.0855(16) Uani 1 1 d D . . . .
S9 S 0.6798(3) 0.63915(14) 0.6951(4) 0.0917(18) Uani 1 1 d . . . . .
S14 S 0.4080(4) 0.67235(13) 0.5912(4) 0.0936(18) Uani 1 1 d D . . . .
S10 S 0.5065(3) 0.60104(16) 0.8110(3) 0.0910(17) Uani 1 1 d D . . . .
S2 S 0.7207(3) 0.5177(2) 0.8949(3) 0.1012(19) Uani 1 1 d . U . . .
O5 O 0.4933(4) 0.5350(2) 0.4998(5) 0.0303(18) Uani 1 1 d . . . . .
O3 O 0.6277(5) 0.5040(2) 0.5898(5) 0.037(2) Uani 1 1 d . . . . .
O8 O 0.4910(5) 0.5018(2) 0.3797(5) 0.0346(19) Uani 1 1 d . . . . .
O6 O 0.6341(5) 0.4716(2) 0.4659(5) 0.035(2) Uani 1 1 d . . . . .
O7 O 0.3542(5) 0.5644(2) 0.4122(5) 0.041(2) Uani 1 1 d . . . . .
O2 O 0.4881(5) 0.5662(2) 0.6219(6) 0.042(2) Uani 1 1 d . . . . .
O12 O 0.6204(5) 0.5408(2) 0.4643(5) 0.038(2) Uani 1 1 d . . . . .
O11 O 0.4792(5) 0.6044(2) 0.4994(5) 0.043(2) Uani 1 1 d . . . . .
O10 O 0.6183(5) 0.5725(2) 0.5874(5) 0.044(2) Uani 1 1 d . . . . .
O1 O 0.6310(6) 0.5404(3) 0.7182(5) 0.050(2) Uani 1 1 d . . . . .
O4 O 0.3470(6) 0.5991(2) 0.5307(6) 0.057(3) Uani 1 1 d . . . . .
O13 O 0.4853(5) 0.5710(2) 0.3788(5) 0.043(2) Uani 1 1 d . . . . .
O9 O 0.3548(5) 0.5356(2) 0.2817(5) 0.0462(18) Uani 1 1 d . U . . .
O14 O 0.6105(6) 0.6115(3) 0.4656(7) 0.059(3) Uani 1 1 d . . . . .
O27 O 0.2439(9) 0.4445(4) 0.6285(8) 0.098(4) Uani 1 1 d . . . . .
O26 O 0.1839(12) 0.4905(4) 0.6420(12) 0.129(7) Uani 1 1 d . . . . .
C57 C 0.2056(14) 0.4621(8) 0.6549(13) 0.094(5) Uani 1 1 d . U . . .
F16 F 0.2473(15) 0.4448(8) 0.7882(12) 0.130(7) Uani 0.634(18) 1 d D U P B 1
F17 F 0.1291(16) 0.4594(7) 0.7316(16) 0.126(6) Uani 0.634(18) 1 d D U P B 1
F18 F 0.1605(16) 0.4122(6) 0.6975(13) 0.122(6) Uani 0.634(18) 1 d D U P B 1
C56 C 0.1867(11) 0.4441(6) 0.7175(13) 0.111(5) Uani 1 1 d D U . . .
V1 V 0.57176(13) 0.54064(6) 0.62636(13) 0.0375(5) Uani 1 1 d . . . . .
S6 S 0.1670(3) 0.55886(16) 0.2277(3) 0.0882(16) Uani 1 1 d . . . . .
Ag9 Ag 0.2754(2) 0.59727(12) 0.2403(4) 0.119(3) Uani 0.571(12) 1 d . . P A 1
Ag12 Ag 0.27708(19) 0.63239(10) 0.3766(2) 0.1201(19) Uani 0.682(7) 1 d . . P A
1
Ag13 Ag 0.4543(4) 0.67792(18) 0.4186(7) 0.161(3) Uani 0.500(13) 1 d . U P A 1
S8 S 0.5931(4) 0.69445(13) 0.4963(5) 0.103(2) Uani 1 1 d D . . . .
S7 S 0.3549(5) 0.65081(17) 0.3199(5) 0.121(2) Uani 1 1 d . . . . .
C2 C 0.4198(14) 0.4881(6) 0.8417(11) 0.088(5) Uani 1 1 d . U . . .
H2 H 0.360651 0.487647 0.816037 0.105 Uiso 1 1 calc R U . . .
C51 C 0.0767(12) 0.5065(6) 0.4231(15) 0.122(7) Uani 1 1 d D U . . .
H51 H 0.075348 0.487643 0.456634 0.146 Uiso 1 1 calc R U . . .
C1 C 0.4453(16) 0.4549(6) 0.8849(13) 0.108(7) Uani 1 1 d . U . . .
H1A H 0.503222 0.453201 0.906975 0.162 Uiso 1 1 calc R U . . .
H1B H 0.422578 0.436171 0.849804 0.162 Uiso 1 1 calc R U . . .
H1C H 0.426555 0.454004 0.925531 0.162 Uiso 1 1 calc R U . . .
C27 C 0.5824(14) 0.6423(6) 0.1966(14) 0.120(7) Uani 1 1 d D U . . .
H27 H 0.551778 0.622859 0.165976 0.144 Uiso 0.33(4) 1 calc R U P C 1
H27A H 0.537500 0.631992 0.152787 0.144 Uiso 0.67(4) 1 calc R U P C 2
C3 C 0.4422(15) 0.5204(6) 0.8863(12) 0.105(6) Uani 1 1 d . U . . .
H3A H 0.417443 0.521161 0.922518 0.158 Uiso 1 1 calc R U . . .
H3B H 0.423675 0.539428 0.851376 0.158 Uiso 1 1 calc R U . . .
H3C H 0.499818 0.521568 0.913942 0.158 Uiso 1 1 calc R U . . .
C52 C 0.0385(14) 0.5362(6) 0.4488(17) 0.128(8) Uani 1 1 d D U . . .
H52A H 0.041775 0.556646 0.422102 0.192 Uiso 1 1 calc R U . . .
H52B H 0.066930 0.539546 0.503660 0.192 Uiso 1 1 calc R U . . .
H52C H -0.017108 0.531082 0.436624 0.192 Uiso 1 1 calc R U . . .
C5 C 0.7629(14) 0.5090(9) 0.9997(13) 0.126(5) Uani 1 1 d D U . . .
H5A H 0.755274 0.484158 0.996323 0.151 Uiso 0.55(3) 1 calc R U P D 1
H5B H 0.716003 0.498415 1.004247 0.151 Uiso 0.45(3) 1 calc R U P D 2
C13 C 0.7258(19) 0.6786(7) 0.744(2) 0.144(9) Uani 1 1 d . U . . .
H13 H 0.722971 0.695384 0.705018 0.173 Uiso 1 1 calc R U . . .
C50 C 0.0263(15) 0.4933(8) 0.3416(16) 0.156(10) Uani 1 1 d D U . . .
H50A H -0.029340 0.500028 0.323734 0.234 Uiso 1 1 d R U . . .
H50B H 0.030160 0.468868 0.346614 0.234 Uiso 1 1 d R U . . .
H50C H 0.047320 0.500507 0.304984 0.234 Uiso 1 1 d R U . . .
C26 C 0.641(5) 0.646(3) 0.156(5) 0.122(11) Uani 0.33(4) 1 d D U P C 1
H26A H 0.640511 0.668891 0.138923 0.183 Uiso 0.33(4) 1 d R U P C 1
H26B H 0.622411 0.630641 0.112573 0.183 Uiso 0.33(4) 1 d R U P C 1
H26C H 0.694351 0.639621 0.191513 0.183 Uiso 0.33(4) 1 d R U P C 1
C12 C 0.691(2) 0.6935(7) 0.792(2) 0.165(11) Uani 1 1 d . U . . .
H12A H 0.662466 0.676210 0.807504 0.248 Uiso 1 1 calc R U . . .
H12B H 0.653256 0.711029 0.763707 0.248 Uiso 1 1 calc R U . . .
H12C H 0.732306 0.703241 0.837515 0.248 Uiso 1 1 calc R U . . .
C14 C 0.814(2) 0.6718(8) 0.795(2) 0.170(11) Uani 1 1 d . U . . .
H14A H 0.834248 0.689013 0.834158 0.255 Uiso 1 1 calc R U . . .
H14B H 0.844302 0.672279 0.763288 0.255 Uiso 1 1 calc R U . . .
H14C H 0.819586 0.649727 0.818599 0.255 Uiso 1 1 calc R U . . .
C54 C 0.533(2) 0.6297(8) 0.8936(15) 0.181(12) Uani 1 1 d D U . . .
H54 H 0.588671 0.638447 0.912323 0.217 Uiso 0.46(10) 1 calc R U P E 1
H54A H 0.580097 0.641676 0.892092 0.217 Uiso 0.54(10) 1 calc R U P E 2
C4 C 0.709(2) 0.5164(14) 1.035(2) 0.111(8) Uani 0.55(3) 1 d D U P D 1
H4A H 0.687974 0.539066 1.020700 0.167 Uiso 0.55(3) 1 calc R U P D 1
H4B H 0.737127 0.514760 1.089933 0.167 Uiso 0.55(3) 1 calc R U P D 1
H4C H 0.665187 0.500268 1.016837 0.167 Uiso 0.55(3) 1 calc R U P D 1
C53 C 0.468(5) 0.657(2) 0.858(5) 0.178(15) Uani 0.46(10) 1 d D U P E 1
H53A H 0.477587 0.669914 0.904580 0.267 Uiso 0.46(10) 1 d R U P E 1
H53B H 0.414417 0.648574 0.836590 0.267 Uiso 0.46(10) 1 d R U P E 1
H53C H 0.475697 0.672424 0.821100 0.267 Uiso 0.46(10) 1 d R U P E 1
C55 C 0.515(8) 0.6105(19) 0.956(5) 0.181(15) Uani 0.46(10) 1 d D U P E 1
H55A H 0.473176 0.593871 0.944208 0.272 Uiso 0.46(10) 1 d R U P E 1
H55B H 0.512396 0.626631 0.992828 0.272 Uiso 0.46(10) 1 d R U P E 1
H55C H 0.566966 0.599211 0.977058 0.272 Uiso 0.46(10) 1 d R U P E 1
C6 C 0.848(2) 0.5090(18) 1.035(3) 0.140(10) Uani 0.55(3) 1 d D U P D 1
H6A H 0.865913 0.498396 1.085364 0.210 Uiso 0.55(3) 1 calc R U P D 1
H6B H 0.867408 0.532062 1.041052 0.210 Uiso 0.55(3) 1 calc R U P D 1
H6C H 0.868590 0.496438 1.003629 0.210 Uiso 0.55(3) 1 calc R U P D 1
C28 C 0.517(5) 0.669(2) 0.157(5) 0.130(12) Uani 0.33(4) 1 d D U P C 1
H28A H 0.496565 0.666004 0.102298 0.195 Uiso 0.33(4) 1 d R U P C 1
H28B H 0.538155 0.692224 0.169698 0.195 Uiso 0.33(4) 1 d R U P C 1
H28C H 0.474195 0.666344 0.174038 0.195 Uiso 0.33(4) 1 d R U P C 1
Ag8A Ag 0.3001(5) 0.66680(19) 0.4430(5) 0.121(3) Uani 0.303(6) 1 d . . P A 2
Ag7A Ag 0.2541(5) 0.6038(2) 0.3159(6) 0.143(4) Uani 0.318(7) 1 d . . P A 2
Ag6A Ag 0.2597(5) 0.5829(2) 0.1770(7) 0.154(4) Uani 0.429(12) 1 d . . P A 2
C16 C 0.9085(12) 0.6176(6) 0.5735(14) 0.111(7) Uani 1 1 d D U . . .
H16 H 0.908931 0.639888 0.549997 0.133 Uiso 0.47(3) 1 calc R U P F 1
H16A H 0.935240 0.601383 0.615766 0.133 Uiso 0.53(3) 1 calc R U P F 2
C10 C 0.9310(12) 0.5571(6) 0.8062(14) 0.121(8) Uani 1 1 d D U . . .
H10 H 0.959566 0.546787 0.777265 0.145 Uiso 0.72(2) 1 calc R U P G 1
H10A H 0.944197 0.566095 0.858304 0.145 Uiso 0.28(2) 1 calc R U P G 2
C40 C 0.2542(18) 0.5820(8) 0.7444(17) 0.136(9) Uani 1 1 d D U . . .
H40 H 0.284216 0.563913 0.780402 0.163 Uiso 0.71(3) 1 calc R U P H 1
H40A H 0.308662 0.583438 0.785886 0.163 Uiso 0.29(3) 1 calc R U P H 2
C17 C 0.949(4) 0.5954(17) 0.533(3) 0.112(11) Uani 0.47(3) 1 d D U P F 1
H17A H 0.953717 0.572465 0.552599 0.168 Uiso 0.47(3) 1 calc R U P F 1
H17B H 1.001810 0.604324 0.544049 0.168 Uiso 0.47(3) 1 calc R U P F 1
H17C H 0.917001 0.595565 0.478545 0.168 Uiso 0.47(3) 1 calc R U P F 1
C39 C 0.273(3) 0.6142(11) 0.790(3) 0.158(12) Uani 0.71(3) 1 d D U P H 1
H39A H 0.230605 0.630680 0.765462 0.237 Uiso 0.71(3) 1 d R U P H 1
H39B H 0.322075 0.622290 0.788342 0.237 Uiso 0.71(3) 1 d R U P H 1
H39C H 0.280685 0.611410 0.843212 0.237 Uiso 0.71(3) 1 d R U P H 1
C41 C 0.168(2) 0.5710(11) 0.710(2) 0.133(11) Uani 0.71(3) 1 d D U P H 1
H41A H 0.137954 0.584077 0.731444 0.200 Uiso 0.71(3) 1 d R U P H 1
H41B H 0.163074 0.547088 0.718294 0.200 Uiso 0.71(3) 1 d R U P H 1
H41C H 0.147724 0.575287 0.654864 0.200 Uiso 0.71(3) 1 d R U P H 1
C11 C 0.9555(18) 0.5930(8) 0.835(2) 0.137(11) Uani 0.72(2) 1 d D U P G 1
H11A H 0.967220 0.594119 0.889415 0.205 Uiso 0.72(2) 1 calc R U P G 1
H11B H 0.912206 0.608439 0.807158 0.205 Uiso 0.72(2) 1 calc R U P G 1
H11C H 1.002757 0.599343 0.827277 0.205 Uiso 0.72(2) 1 calc R U P G 1
C9 C 0.955(2) 0.5443(11) 0.8876(18) 0.148(11) Uani 0.72(2) 1 d D U P G 1
H9A H 1.010711 0.549171 0.917056 0.222 Uiso 0.72(2) 1 d R U P G 1
H9B H 0.946311 0.519991 0.885686 0.222 Uiso 0.72(2) 1 d R U P G 1
H9C H 0.923061 0.554951 0.911836 0.222 Uiso 0.72(2) 1 d R U P G 1
Ag4A Ag 0.1942(6) 0.5682(2) 0.4213(12) 0.107(7) Uani 0.225(11) 1 d . . P A 2
C48 C 0.0721(14) 0.5757(8) 0.1637(14) 0.134(8) Uani 1 1 d D U . . .
H48 H 0.054063 0.592223 0.192229 0.160 Uiso 0.36(3) 1 calc R U P I 1
H48A H 0.076133 0.600604 0.168708 0.160 Uiso 0.64(3) 1 calc R U P I 2
C24 C 0.596(2) 0.7416(6) 0.4940(19) 0.154(11) Uani 1 1 d D U . . .
H24 H 0.549130 0.746513 0.445963 0.184 Uiso 0.25(3) 1 calc R U P J 1
H24A H 0.541625 0.749228 0.484045 0.184 Uiso 0.75(3) 1 calc R U P J 2
C32 C 0.299(2) 0.6828(10) 0.248(2) 0.193(15) Uani 1 1 d D U . . .
H32 H 0.321980 0.703835 0.277321 0.232 Uiso 0.59(4) 1 calc R U P K 1
H32A H 0.274269 0.693932 0.279761 0.232 Uiso 0.41(4) 1 calc R U P K 2
C49 C 0.001(3) 0.5521(16) 0.117(4) 0.137(11) Uani 0.36(3) 1 d D U P I 1
H49A H -0.026163 0.559804 0.064560 0.205 Uiso 0.36(3) 1 d R U P I 1
H49B H -0.036193 0.552924 0.141820 0.205 Uiso 0.36(3) 1 d R U P I 1
H49C H 0.019117 0.529064 0.117820 0.205 Uiso 0.36(3) 1 d R U P I 1
C23 C 0.664(6) 0.759(3) 0.477(9) 0.163(13) Uani 0.25(3) 1 d D U P J 1
H23A H 0.699302 0.775294 0.512735 0.244 Uiso 0.25(3) 1 d R U P J 1
H23B H 0.633202 0.769684 0.428565 0.244 Uiso 0.25(3) 1 d R U P J 1
H23C H 0.695382 0.740654 0.469865 0.244 Uiso 0.25(3) 1 d R U P J 1
C47 C 0.093(4) 0.595(2) 0.103(4) 0.146(13) Uani 0.36(3) 1 d D U P I 1
H47A H 0.133578 0.612038 0.128729 0.219 Uiso 0.36(3) 1 d R U P I 1
H47B H 0.045268 0.606078 0.066639 0.219 Uiso 0.36(3) 1 d R U P I 1
H47C H 0.112968 0.579178 0.076739 0.219 Uiso 0.36(3) 1 d R U P I 1
C31 C 0.324(4) 0.6867(18) 0.180(3) 0.202(17) Uani 0.59(4) 1 d D U P K 1
H31A H 0.371094 0.672950 0.190978 0.303 Uiso 0.59(4) 1 d R U P K 1
H31B H 0.336844 0.710320 0.177718 0.303 Uiso 0.59(4) 1 d R U P K 1
H31C H 0.282284 0.679900 0.131108 0.303 Uiso 0.59(4) 1 d R U P K 1
C36 C 0.408(4) 0.7411(10) 0.605(3) 0.212(16) Uani 0.58(4) 1 d D U P L 1
H36A H 0.418776 0.735023 0.560674 0.319 Uiso 0.58(4) 1 d R U P L 1
H36B H 0.441696 0.759883 0.631494 0.319 Uiso 0.58(4) 1 d R U P L 1
H36C H 0.352056 0.747613 0.587214 0.319 Uiso 0.58(4) 1 d R U P L 1
C38 C 0.371(4) 0.7065(16) 0.697(4) 0.218(17) Uani 0.58(4) 1 d D U P L 1
H38A H 0.384476 0.686534 0.729751 0.327 Uiso 0.58(4) 1 d R U P L 1
H38B H 0.319416 0.703254 0.654881 0.327 Uiso 0.58(4) 1 d R U P L 1
H38C H 0.368666 0.725964 0.727211 0.327 Uiso 0.58(4) 1 d R U P L 1
C33 C 0.210(2) 0.6872(17) 0.233(4) 0.197(17) Uani 0.59(4) 1 d D U P K 1
H33A H 0.174821 0.680351 0.181593 0.296 Uiso 0.59(4) 1 d R U P K 1
H33B H 0.201211 0.710981 0.240053 0.296 Uiso 0.59(4) 1 d R U P K 1
H33C H 0.197601 0.673911 0.269923 0.296 Uiso 0.59(4) 1 d R U P K 1
O18 O 0.808(3) 0.6643(11) 0.3716(17) 0.195(7) Uani 0.52(3) 1 d D U P A 1
O25 O 0.1364(19) 0.6573(7) 0.5997(19) 0.180(7) Uani 0.89(3) 1 d D U P A 1
O24 O 0.1878(19) 0.6979(8) 0.5574(18) 0.197(8) Uani 0.89(3) 1 d D U P A 1
C25 C 0.597(9) 0.773(2) 0.544(7) 0.162(15) Uani 0.25(3) 1 d D U P J 1
H25A H 0.570748 0.762935 0.574160 0.242 Uiso 0.25(3) 1 d R U P J 1
H25B H 0.577208 0.795645 0.529010 0.242 Uiso 0.25(3) 1 d R U P J 1
H25C H 0.654058 0.773275 0.573650 0.242 Uiso 0.25(3) 1 d R U P J 1
O17 O 0.8261(18) 0.7056(9) 0.626(2) 0.262(13) Uani 1 1 d D U . . .
F5 F 0.7995(19) 0.7328(10) 0.290(2) 0.227(10) Uani 0.63(2) 1 d D U P M 1
F6 F 0.864(3) 0.7467(8) 0.415(2) 0.240(10) Uani 0.63(2) 1 d D U P M 1
Ag Ag 0.620(3) 0.6279(13) 0.792(4) 0.133(14) Uani 0.16(3) 1 d . . P A 2
C21 C 0.8476(17) 0.7195(7) 0.3624(19) 0.227(8) Uani 1 1 d D U . . .
C22 C 0.795(3) 0.6938(7) 0.383(3) 0.203(7) Uani 1 1 d D U . . .
O19 O 0.774(3) 0.6992(10) 0.436(3) 0.204(8) Uani 0.52(3) 1 d D U P A 1
F15 F 0.127(4) 0.6982(13) 0.705(3) 0.220(10) Uani 0.45(2) 1 d D U P N 1
F13 F 0.145(4) 0.7472(10) 0.653(4) 0.238(10) Uani 0.45(2) 1 d D U P N 1
F14 F 0.038(2) 0.7115(17) 0.588(4) 0.229(10) Uani 0.45(2) 1 d D U P N 1
C42 C 0.122(2) 0.7132(9) 0.6353(19) 0.225(8) Uani 1 1 d D U . . .
F7 F 0.402(2) 0.6125(19) 0.030(3) 0.254(10) Uani 0.40(2) 1 d D U P O 1
C19 C 0.960(3) 0.7783(11) 0.643(4) 0.267(16) Uani 0.78(3) 1 d D U P P 1
H19A H 0.925421 0.796804 0.615406 0.400 Uiso 0.78(3) 1 d R U P P 1
H19B H 0.991531 0.770774 0.616286 0.400 Uiso 0.78(3) 1 d R U P P 1
H19C H 0.994581 0.785704 0.694416 0.400 Uiso 0.78(3) 1 d R U P P 1
F9 F 0.287(4) 0.5838(18) -0.040(2) 0.269(10) Uani 0.40(2) 1 d D U P O 1
N1 N 0.913(3) 0.7507(11) 0.652(3) 0.263(13) Uani 0.78(3) 1 d D U P P 1
F8 F 0.280(4) 0.6318(16) -0.002(4) 0.268(11) Uani 0.40(2) 1 d D U P O 1
C29 C 0.3273(17) 0.6028(7) 0.0267(17) 0.251(7) Uani 1 1 d D U . . .
C18 C 0.963(3) 0.7345(14) 0.724(3) 0.263(15) Uani 0.78(3) 1 d D U P P 1
H18A H 0.995841 0.750446 0.761996 0.395 Uiso 0.78(3) 1 d R U P P 1
H18B H 0.996341 0.718586 0.711866 0.395 Uiso 0.78(3) 1 d R U P P 1
H18C H 0.929121 0.722196 0.743456 0.395 Uiso 0.78(3) 1 d R U P P 1
F4 F 0.9253(18) 0.7139(10) 0.371(3) 0.236(10) Uani 0.63(2) 1 d D U P M 1
O16 O 0.731(2) 0.6198(11) 0.9256(18) 0.210(10) Uani 0.77(4) 1 d D U P A 1
O15 O 0.852(2) 0.6080(10) 0.973(2) 0.210(10) Uani 0.77(4) 1 d D U P A 1
F2 F 0.821(4) 0.6755(8) 1.029(2) 0.247(14) Uani 0.43(2) 1 d D U P Q 1
F1 F 0.872(3) 0.6317(13) 1.1122(17) 0.230(14) Uani 0.43(2) 1 d D U P Q 1
F3 F 0.739(2) 0.6471(16) 1.061(3) 0.236(14) Uani 0.43(2) 1 d D U P Q 1
C7 C 0.8072(13) 0.6426(7) 1.0472(14) 0.237(12) Uani 1 1 d D U . . .
F1A F 0.176(2) 0.7281(14) 0.705(3) 0.231(10) Uani 0.55(2) 1 d D U P N 2
F7A F 0.064(3) 0.7000(12) 0.659(3) 0.218(10) Uani 0.55(2) 1 d D U P N 2
F29A F 0.085(3) 0.7390(12) 0.578(3) 0.235(10) Uani 0.55(2) 1 d D U P N 2
F8A F 0.855(4) 0.7067(13) 0.297(3) 0.224(10) Uani 0.37(2) 1 d D U P M 2
F17A F 0.848(4) 0.7547(7) 0.360(4) 0.233(11) Uani 0.37(2) 1 d D U P M 2
F28A F 0.920(3) 0.7115(15) 0.425(3) 0.236(11) Uani 0.37(2) 1 d D U P M 2
F01{ F 0.182(3) 0.4682(10) 0.765(2) 0.127(7) Uani 0.366(18) 1 d D U P B 2
F0 F 0.1090(16) 0.4355(14) 0.690(2) 0.123(7) Uani 0.366(18) 1 d D U P B 2
F19 F 0.247(2) 0.4252(12) 0.766(2) 0.128(8) Uani 0.366(18) 1 d D U P B 2
F6A F 0.758(3) 0.6707(9) 1.0285(18) 0.230(13) Uani 0.57(2) 1 d D U P Q 2
F3A F 0.8877(15) 0.6517(13) 1.081(2) 0.246(14) Uani 0.57(2) 1 d D U P Q 2
F4A F 0.798(3) 0.6244(9) 1.1059(18) 0.237(13) Uani 0.57(2) 1 d D U P Q 2
F16A F 0.2443(18) 0.6033(15) -0.016(3) 0.270(10) Uani 0.60(2) 1 d D U P O 2
F19A F 0.337(3) 0.6332(9) -0.005(3) 0.263(10) Uani 0.60(2) 1 d D U P O 2
F9A F 0.356(3) 0.5763(9) -0.004(3) 0.256(9) Uani 0.60(2) 1 d D U P O 2
C43 C 0.160(3) 0.6861(7) 0.601(3) 0.198(7) Uani 1 1 d D U . . .
C8 C 0.790(2) 0.6189(10) 0.9772(17) 0.237(13) Uani 1 1 d D U . . .
O64A O 0.726(3) 0.7061(13) 0.356(4) 0.204(8) Uani 0.48(3) 1 d D U P A 2
O2A O 0.819(4) 0.6652(7) 0.376(4) 0.195(7) Uani 0.48(3) 1 d D U P A 2
C41A C 0.355(4) 0.7128(16) 0.250(6) 0.200(18) Uani 0.41(4) 1 d D U P K 2
H41D H 0.396408 0.715821 0.301395 0.300 Uiso 0.41(4) 1 d R U P K 2
H41E H 0.323858 0.733381 0.234035 0.300 Uiso 0.41(4) 1 d R U P K 2
H41F H 0.379158 0.707571 0.214885 0.300 Uiso 0.41(4) 1 d R U P K 2
C66A C 0.219(4) 0.6725(19) 0.181(4) 0.196(17) Uani 0.41(4) 1 d D U P K 2
H66A H 0.228791 0.657536 0.145221 0.294 Uiso 0.41(4) 1 d R U P K 2
H66B H 0.190601 0.692396 0.153681 0.294 Uiso 0.41(4) 1 d R U P K 2
H66C H 0.187741 0.660806 0.203501 0.294 Uiso 0.41(4) 1 d R U P K 2
C37 C 0.435(2) 0.7126(8) 0.665(2) 0.206(15) Uani 1 1 d D U . . .
H37 H 0.490958 0.713859 0.703987 0.247 Uiso 0.58(4) 1 calc R U P L 1
H37A H 0.460366 0.708335 0.721410 0.247 Uiso 0.42(4) 1 calc R U P L 2
C32A C 0.964(4) 0.583(2) 0.768(4) 0.130(13) Uani 0.28(2) 1 d D U P G 2
H32B H 0.944519 0.605277 0.771917 0.194 Uiso 0.28(2) 1 d R U P G 2
H32C H 0.945759 0.576517 0.714637 0.194 Uiso 0.28(2) 1 d R U P G 2
H32D H 1.022229 0.582877 0.791847 0.194 Uiso 0.28(2) 1 d R U P G 2
C46A C 0.974(3) 0.5236(14) 0.819(5) 0.131(13) Uani 0.28(2) 1 d D U P G 2
H46A H 1.012289 0.522646 0.795329 0.197 Uiso 0.28(2) 1 d R U P G 2
H46B H 0.934910 0.505827 0.797769 0.197 Uiso 0.28(2) 1 d R U P G 2
H46C H 1.002509 0.520527 0.873809 0.197 Uiso 0.28(2) 1 d R U P G 2
C28A C 0.473(6) 0.7386(16) 0.630(6) 0.209(17) Uani 0.42(4) 1 d D U P L 2
H28D H 0.511699 0.727128 0.615430 0.313 Uiso 0.42(4) 1 d R U P L 2
H28E H 0.497079 0.758888 0.658390 0.313 Uiso 0.42(4) 1 d R U P L 2
H28F H 0.426639 0.744668 0.583740 0.313 Uiso 0.42(4) 1 d R U P L 2
C17A C 0.351(3) 0.729(2) 0.630(6) 0.210(16) Uani 0.42(4) 1 d D U P L 2
H17D H 0.309041 0.713868 0.627804 0.316 Uiso 0.42(4) 1 d R U P L 2
H17E H 0.339401 0.737588 0.578464 0.316 Uiso 0.42(4) 1 d R U P L 2
H17F H 0.353221 0.748218 0.662944 0.316 Uiso 0.42(4) 1 d R U P L 2
C27A C 0.235(8) 0.6187(13) 0.750(7) 0.147(13) Uani 0.29(3) 1 d D U P H 2
H27B H 0.281333 0.629463 0.789141 0.221 Uiso 0.29(3) 1 d R U P H 2
H27C H 0.191104 0.619073 0.766621 0.221 Uiso 0.29(3) 1 d R U P H 2
H27D H 0.219114 0.630783 0.702241 0.221 Uiso 0.29(3) 1 d R U P H 2
C31A C 0.237(7) 0.5482(14) 0.769(6) 0.138(13) Uani 0.29(3) 1 d D U P H 2
H31D H 0.285028 0.546331 0.815203 0.208 Uiso 0.29(3) 1 d R U P H 2
H31E H 0.233878 0.529381 0.734803 0.208 Uiso 0.29(3) 1 d R U P H 2
H31F H 0.190408 0.547601 0.781132 0.208 Uiso 0.29(3) 1 d R U P H 2
Ag24 Ag 0.4325(5) 0.67749(16) 0.4609(5) 0.150(3) Uani 0.500(13) 1 d . U P A 2
C67A C 0.818(4) 0.4813(13) 1.022(3) 0.127(10) Uani 0.45(3) 1 d D U P D 2
H67A H 0.793062 0.462270 0.988831 0.190 Uiso 0.45(3) 1 d R U P D 2
H67B H 0.833383 0.474550 1.075291 0.190 Uiso 0.45(3) 1 d R U P D 2
H67C H 0.864923 0.488360 1.014861 0.190 Uiso 0.45(3) 1 d R U P D 2
C44A C 0.760(4) 0.5420(11) 1.029(3) 0.132(10) Uani 0.45(3) 1 d D U P D 2
H44A H 0.780030 0.558293 1.003174 0.198 Uiso 0.45(3) 1 d R U P D 2
H44B H 0.797910 0.539823 1.082114 0.198 Uiso 0.45(3) 1 d R U P D 2
H44C H 0.709040 0.549803 1.027344 0.198 Uiso 0.45(3) 1 d R U P D 2
O21 O 0.278(2) 0.6046(11) 0.116(2) 0.226(5) Uani 0.73(3) 1 d D U P A 1
C30 C 0.3261(16) 0.5877(9) 0.1016(17) 0.230(6) Uani 1 1 d D U . . .
O20 O 0.3887(18) 0.5934(12) 0.1541(18) 0.226(5) Uani 0.73(3) 1 d D U P A 1
O66A O 0.362(5) 0.5618(13) 0.100(5) 0.226(5) Uani 0.27(3) 1 d D U P A 2
O9A O 0.372(5) 0.6078(17) 0.145(4) 0.226(5) Uani 0.27(3) 1 d D U P A 2
C34 C 0.2868(18) 0.7822(9) 0.3953(18) 0.357(12) Uani 1 1 d D U . . .
F12 F 0.205(2) 0.7860(9) 0.376(6) 0.363(14) Uani 0.70(6) 1 d D U P R 1
F11 F 0.308(6) 0.7934(10) 0.336(4) 0.358(14) Uani 0.70(6) 1 d D U P R 1
F10 F 0.334(5) 0.7964(9) 0.466(3) 0.359(14) Uani 0.70(6) 1 d D U P R 1
C20 C 0.862(4) 0.7343(15) 0.594(4) 0.262(14) Uani 0.78(3) 1 d D U P P 1
H20 H 0.849993 0.738731 0.542158 0.315 Uiso 0.78(3) 1 calc R U P P 1
C36A C 0.883(10) 0.716(4) 0.709(6) 0.264(14) Uani 0.22(3) 1 d D U P P 2
H36D H 0.876658 0.699078 0.740248 0.316 Uiso 0.22(3) 1 calc R U P P 2
C35A C 0.952(10) 0.770(3) 0.736(12) 0.263(15) Uani 0.22(3) 1 d D U P P 2
H35A H 0.910659 0.785611 0.731746 0.395 Uiso 0.22(3) 1 d R U P P 2
H35B H 0.962719 0.770781 0.690066 0.395 Uiso 0.22(3) 1 d R U P P 2
H35C H 1.000838 0.775121 0.780426 0.395 Uiso 0.22(3) 1 d R U P P 2
N18A N 0.934(7) 0.737(3) 0.758(7) 0.264(14) Uani 0.22(3) 1 d D U P P 2
C38A C 1.003(7) 0.725(4) 0.824(8) 0.264(17) Uani 0.22(3) 1 d D U P P 2
H38D H 0.996879 0.700382 0.820331 0.395 Uiso 0.22(3) 1 d R U P P 2
H38E H 1.006249 0.732532 0.872901 0.395 Uiso 0.22(3) 1 d R U P P 2
H38F H 1.051699 0.731022 0.818101 0.395 Uiso 0.22(3) 1 d R U P P 2
Ag25 Ag 0.382(3) 0.6333(12) 0.6751(13) 0.113(7) Uani 0.37(6) 1 d . . P A 2
Ag26 Ag 0.6162(10) 0.6769(7) 0.3773(8) 0.096(4) Uani 0.36(5) 1 d . . P A 2
C15 C 0.955(3) 0.6257(16) 0.6577(19) 0.121(11) Uani 0.47(3) 1 d D U P F 1
H15A H 0.935996 0.612704 0.690066 0.181 Uiso 0.47(3) 1 d R U P F 1
H15B H 0.943756 0.649444 0.660746 0.181 Uiso 0.47(3) 1 d R U P F 1
H15C H 1.012166 0.622484 0.674966 0.181 Uiso 0.47(3) 1 d R U P F 1
C1A C 0.935(4) 0.6082(14) 0.508(3) 0.110(11) Uani 0.53(3) 1 d D U P F 2
H1AA H 0.887662 0.608634 0.460380 0.165 Uiso 0.53(3) 1 d R U P F 2
H1AB H 0.958412 0.585804 0.516739 0.165 Uiso 0.53(3) 1 d R U P F 2
H1AC H 0.973512 0.624564 0.506020 0.165 Uiso 0.53(3) 1 d R U P F 2
C2A C 0.934(3) 0.6526(9) 0.607(3) 0.127(11) Uani 0.53(3) 1 d D U P F 2
H2AA H 0.914988 0.668958 0.564996 0.190 Uiso 0.53(3) 1 d R U P F 2
H2AB H 0.991928 0.653788 0.632037 0.190 Uiso 0.53(3) 1 d R U P F 2
H2AC H 0.911278 0.657738 0.643087 0.190 Uiso 0.53(3) 1 d R U P F 2
C45 C 0.0811(18) 0.6452(8) 0.357(2) 0.160(11) Uani 1 1 d D U . . .
H45 H 0.061322 0.625103 0.323851 0.192 Uiso 0.49(3) 1 calc R U P S 1
H45A H 0.082368 0.642715 0.306216 0.192 Uiso 0.51(3) 1 calc R U P S 2
C46 C 0.018(3) 0.6416(18) 0.392(4) 0.156(14) Uani 0.49(3) 1 d D U P S 1
H46D H 0.003227 0.663810 0.402805 0.235 Uiso 0.49(3) 1 calc R U P S 1
H46E H 0.040400 0.628412 0.438534 0.235 Uiso 0.49(3) 1 calc R U P S 1
H46F H -0.029007 0.630201 0.354956 0.235 Uiso 0.49(3) 1 calc R U P S 1
C44 C 0.093(4) 0.6662(17) 0.294(3) 0.168(15) Uani 0.49(3) 1 d D U P S 1
H44D H 0.148580 0.673059 0.312273 0.252 Uiso 0.49(3) 1 calc R U P S 1
H44E H 0.059227 0.686111 0.282481 0.252 Uiso 0.49(3) 1 calc R U P S 1
H44F H 0.078774 0.652560 0.248230 0.252 Uiso 0.49(3) 1 calc R U P S 1
C16A C 0.006(3) 0.6239(14) 0.348(5) 0.165(15) Uani 0.51(3) 1 d D U P S 2
H16B H 0.007206 0.602711 0.322648 0.248 Uiso 0.51(3) 1 calc R U P S 2
H16C H -0.041693 0.636403 0.316785 0.248 Uiso 0.51(3) 1 calc R U P S 2
H16D H 0.006719 0.619426 0.397808 0.248 Uiso 0.51(3) 1 calc R U P S 2
C33A C 0.088(3) 0.6842(9) 0.369(4) 0.171(14) Uani 0.51(3) 1 d D U P S 2
H33D H 0.037362 0.694723 0.338121 0.257 Uiso 0.51(3) 1 d R U P S 2
H33E H 0.129162 0.692852 0.353901 0.257 Uiso 0.51(3) 1 d R U P S 2
H33F H 0.102682 0.689292 0.422771 0.257 Uiso 0.51(3) 1 d R U P S 2
C29A C 0.6647(18) 0.6373(12) 0.193(2) 0.116(9) Uani 0.67(4) 1 d D U P C 2
H29A H 0.705005 0.650272 0.233752 0.174 Uiso 0.67(4) 1 calc R U P C 2
H29B H 0.661704 0.645078 0.143779 0.174 Uiso 0.67(4) 1 calc R U P C 2
H29C H 0.678911 0.613564 0.199449 0.174 Uiso 0.67(4) 1 calc R U P C 2
C74A C 0.572(3) 0.6810(6) 0.204(2) 0.132(10) Uani 0.67(4) 1 d D U P C 2
H74A H 0.612615 0.688886 0.252913 0.198 Uiso 0.67(4) 1 d R U P C 2
H74B H 0.519545 0.685646 0.202463 0.198 Uiso 0.67(4) 1 d R U P C 2
H74C H 0.578675 0.692756 0.162603 0.198 Uiso 0.67(4) 1 d R U P C 2
C4A C 0.053(3) 0.5673(14) 0.0785(16) 0.145(11) Uani 0.64(3) 1 d D U P I 2
H4AA H 0.096393 0.554421 0.075996 0.218 Uiso 0.64(3) 1 d R U P I 2
H4AB H 0.045543 0.588051 0.049436 0.218 Uiso 0.64(3) 1 d R U P I 2
H4AC H 0.003783 0.554041 0.057086 0.218 Uiso 0.64(3) 1 d R U P I 2
C30A C 0.004(2) 0.5647(12) 0.187(2) 0.139(11) Uani 0.64(3) 1 d D U P I 2
H30A H 0.023988 0.561644 0.241799 0.209 Uiso 0.64(3) 1 d R U P I 2
H30B H -0.041612 0.549664 0.161589 0.209 Uiso 0.64(3) 1 d R U P I 2
H30C H -0.013792 0.587894 0.173799 0.209 Uiso 0.64(3) 1 d R U P I 2
Ag27 Ag 0.7740(19) 0.5739(10) 0.8565(18) 0.138(5) Uani 0.26(4) 1 d . U P A 2
C9A C 0.608(3) 0.7500(9) 0.420(2) 0.163(13) Uani 0.75(3) 1 d D U P J 2
H9AA H 0.647818 0.734975 0.415264 0.244 Uiso 0.75(3) 1 d R U P J 2
H9AB H 0.625578 0.773235 0.421374 0.244 Uiso 0.75(3) 1 d R U P J 2
H9AC H 0.557468 0.746865 0.376194 0.244 Uiso 0.75(3) 1 d R U P J 2
C40A C 0.650(3) 0.7544(10) 0.576(2) 0.166(12) Uani 0.75(3) 1 d D U P J 2
H40B H 0.700714 0.742346 0.595289 0.249 Uiso 0.75(3) 1 calc R U P J 2
H40C H 0.623385 0.750288 0.609896 0.249 Uiso 0.75(3) 1 calc R U P J 2
H40D H 0.659815 0.778401 0.574495 0.249 Uiso 0.75(3) 1 calc R U P J 2
C54A C 0.476(5) 0.6596(17) 0.888(4) 0.177(15) Uani 0.54(10) 1 d D U P E 2
H54B H 0.479750 0.676291 0.852068 0.265 Uiso 0.54(10) 1 calc R U P E 2
H54C H 0.491726 0.669847 0.937937 0.265 Uiso 0.54(10) 1 calc R U P E 2
H54D H 0.421844 0.651312 0.869722 0.265 Uiso 0.54(10) 1 calc R U P E 2
C64A C 0.570(8) 0.614(2) 0.9753(19) 0.184(15) Uani 0.54(10) 1 d D U P E 2
H64A H 0.586507 0.632758 1.011125 0.276 Uiso 0.54(10) 1 d R U P E 2
H64B H 0.613097 0.607338 0.961835 0.276 Uiso 0.54(10) 1 d R U P E 2
H64C H 0.554658 0.595018 0.998945 0.276 Uiso 0.54(10) 1 d R U P E 2
O15A O 0.813(8) 0.628(3) 0.930(5) 0.210(10) Uani 0.23(4) 1 d D U P A 2
O16A O 0.732(7) 0.600(3) 0.962(5) 0.210(10) Uani 0.23(4) 1 d D U P A 2
O24A O 0.105(6) 0.667(3) 0.566(11) 0.180(7) Uani 0.11(3) 1 d D U P A 2
O25A O 0.213(8) 0.674(4) 0.659(6) 0.180(7) Uani 0.11(3) 1 d D U P A 2
F12A F 0.243(12) 0.7893(14) 0.438(11) 0.359(15) Uani 0.30(6) 1 d D U P R 2
F11A F 0.244(13) 0.7887(14) 0.317(2) 0.361(15) Uani 0.30(6) 1 d D U P R 2
F10A F 0.361(2) 0.7984(9) 0.426(13) 0.358(15) Uani 0.30(6) 1 d D U P R 2
O22 O 0.261(5) 0.7256(11) 0.425(10) 0.345(11) Uani 0.5 1 d D U P A 1
O23 O 0.378(3) 0.7354(11) 0.428(6) 0.347(13) Uani 0.5 1 d D U P A 1
C35 C 0.306(2) 0.7410(13) 0.404(3) 0.350(11) Uani 1 1 d D U . . .
O23A O 0.359(2) 0.7332(10) 0.385(4) 0.347(13) Uani 0.5 1 d D U P A 2
O22A O 0.252(6) 0.7241(8) 0.406(10) 0.345(11) Uani 0.5 1 d D U P A 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
Ag5 Ag6 3.003(2) . ?
Ag5 Ag16 3.162(3) . ?
Ag5 Ag10 3.151(3) 3_666 ?
Ag5 Ag11 3.158(3) 3_666 ?
Ag5 S12 2.493(4) 3_666 ?
Ag5 S3 2.462(5) . ?
Ag5 O3 2.423(8) . ?
Ag6 Ag16 3.277(2) . ?
Ag6 S12 2.544(5) 3_666 ?
Ag6 S4 2.511(5) . ?
Ag6 O12 2.474(8) . ?
Ag6 O27 2.479(14) 3_666 ?
Ag19 Ag20 3.000(2) . ?
Ag19 Ag18 3.214(9) . ?
Ag19 S11 2.526(5) . ?
Ag19 S1 2.397(5) . ?
Ag19 O2 2.504(8) . ?
Ag16 Ag15 3.322(4) . ?
Ag16 S4 2.483(5) . ?
Ag16 S3 2.549(6) . ?
Ag16 S9 2.663(5) . ?
Ag16 O10 2.528(9) . ?
Ag1 Ag8 3.125(3) 3_666 ?
Ag1 S1 2.421(5) . ?
Ag1 S5 2.476(6) 3_666 ?
Ag7 Ag15 3.279(3) . ?
Ag7 Ag14 3.075(19) . ?
Ag7 S4 2.513(5) . ?
Ag7 S5 2.523(6) . ?
Ag7 O18 2.30(8) . ?
Ag7 O2A 2.42(7) . ?
Ag7 Ag26 2.924(14) . ?
Ag21 Ag22 2.913(4) . ?
Ag21 S11 2.447(5) . ?
Ag21 S13 2.455(6) . ?
Ag21 Ag4A 3.20(2) . ?
Ag21 O25 2.27(3) . ?
Ag21 Ag25 3.16(4) . ?
Ag20 S12 2.446(5) . ?
Ag20 S11 2.438(5) . ?
Ag20 O26 2.462(16) . ?
Ag20 Ag4A 3.078(19) . ?
Ag10 S3 2.796(6) 3_666 ?
Ag10 S2 2.472(6) 3_666 ?
Ag10 S6 2.431(6) . ?
Ag10 Ag6A 3.044(9) . ?
Ag10 Ag27 3.34(4) 3_666 ?
Ag23 Ag17 2.943(8) . ?
Ag23 S9 2.505(7) . ?
Ag23 S14 2.448(6) . ?
Ag23 Ag13 3.249(12) . ?
Ag23 S8 2.936(7) . ?
Ag23 Ag24 2.698(8) . ?
Ag18 Ag17 2.90(3) . ?
Ag18 S11 2.728(19) . ?
Ag18 S14 2.528(10) . ?
Ag18 S10 2.470(16) . ?
Ag17 Ag3 2.962(5) . ?
Ag17 Ag4 2.969(17) . ?
Ag17 S9 2.366(6) . ?
Ag17 S10 2.395(7) . ?
V2 V4 3.069(3) 3_666 ?
V2 V5 3.064(3) . ?
V2 O5 2.148(8) 3_666 ?
V2 O5 2.137(8) . ?
V2 O3 1.915(9) . ?
V2 O8 1.899(9) . ?
V2 O6 1.689(8) . ?
V2 O12 1.704(9) . ?
Ag11 S12 2.622(6) . ?
Ag11 S13 2.649(6) . ?
Ag11 S6 2.475(7) . ?
Ag11 Ag12 3.013(5) . ?
V3 V4 3.089(3) . ?
V3 V5 3.114(3) . ?
V3 O5 2.231(8) . ?
V3 O3 2.022(9) 3_666 ?
V3 O8 1.967(9) . ?
V3 O7 1.838(8) . ?
V3 O13 1.826(9) . ?
V3 O9 1.626(9) . ?
V3 V1 3.078(3) 3_666 ?
Ag3 Ag2 2.972(4) . ?
Ag3 Ag4 3.041(12) . ?
Ag3 S10 2.405(7) . ?
Ag3 S2 2.420(7) . ?
Ag3 Ag 3.00(3) . ?
Ag3 Ag27 3.02(3) . ?
Ag8 Ag14 3.11(2) . ?
Ag8 S5 2.526(6) . ?
Ag8 O13 2.572(9) . ?
Ag8 Ag9 3.068(5) . ?
Ag8 S7 2.413(8) . ?
Ag8 O20 2.46(3) . ?
Ag8 O9A 2.44(5) . ?
V4 V5 3.045(3) . ?
V4 O5 2.277(8) . ?
V4 O6 2.050(9) 3_666 ?
V4 O7 1.865(10) . ?
V4 O2 1.932(10) . ?
V4 O11 1.843(9) . ?
V4 O4 1.596(9) . ?
V4 V1 3.108(3) . ?
V5 O5 2.272(8) . ?
V5 O12 2.049(9) . ?
V5 O11 1.842(9) . ?
V5 O10 1.871(10) . ?
V5 O13 1.902(10) . ?
V5 O14 1.613(9) . ?
V5 V1 3.088(3) . ?
Ag2 S1 2.420(6) . ?
Ag2 S2 2.456(7) . ?
Ag2 O9 2.581(9) 3_666 ?
Ag2 O66A 2.13(6) 3_666 ?
Ag15 Ag14 2.987(9) . ?
Ag15 S4 2.533(5) . ?
Ag15 S8 2.525(6) . ?
Ag15 O17 2.38(3) . ?
Ag15 Ag26 2.996(14) . ?
Ag4 S3 2.480(9) . ?
Ag4 O16 2.38(3) . ?
Ag14 S5 2.444(13) . ?
Ag14 O14 2.57(2) . ?
Ag14 Ag13 2.79(3) . ?
Ag14 S8 2.291(17) . ?
Ag22 S13 2.605(7) . ?
Ag22 S14 2.422(7) . ?
Ag22 Ag12 2.900(6) . ?
Ag22 O24 2.34(3) . ?
Ag22 O22 2.44(6) . ?
S12 C51 1.78(2) . ?
S12 Ag4A 2.301(9) . ?
S4 C16 1.84(2) . ?
S11 C40 1.87(2) . ?
S11 Ag25 2.572(17) . ?
S3 C10 1.85(2) . ?
S3 Ag27 2.40(3) . ?
S1 C2 1.865(16) . ?
S13 Ag12 2.333(6) . ?
S13 Ag8A 2.700(10) . ?
S13 Ag4A 2.219(12) . ?
S13 C45 1.83(3) . ?
S5 C27 1.836(19) . ?
S5 Ag26 2.49(2) . ?
S9 C13 1.82(2) . ?
S9 Ag 2.53(2) . ?
S14 Ag8A 2.691(11) . ?
S14 C37 2.03(4) . ?
S14 Ag24 2.684(13) . ?
S14 Ag25 2.38(2) . ?
S10 C54 1.82(3) . ?
S10 Ag 2.46(4) . ?
S10 Ag25 2.92(5) . ?
S2 C5 1.84(2) . ?
S2 Ag27 2.62(3) . ?
O5 V1 2.238(8) . ?
O3 V1 2.035(8) . ?
O8 V1 1.991(8) 3_666 ?
O7 Ag7A 2.507(11) . ?
O2 V1 1.790(8) . ?
O10 V1 1.822(9) . ?
O1 V1 1.626(10) . ?
O27 C57 1.22(3) . ?
O26 C57 1.17(3) . ?
C57 C56 1.53(3) . ?
F16 C56 1.339(17) . ?
F17 C56 1.325(17) . ?
F18 C56 1.336(17) . ?
C56 F01{ 1.333(19) . ?
C56 F0 1.332(18) . ?
C56 F19 1.328(19) . ?
S6 Ag9 2.407(8) . ?
S6 Ag7A 2.493(12) . ?
S6 Ag6A 2.438(8) . ?
S6 C48 1.78(2) . ?
Ag9 Ag12 2.909(9) . ?
Ag9 S7 2.638(10) . ?
Ag9 O21 2.39(3) . ?
Ag12 S7 2.213(8) . ?
Ag13 S8 2.427(9) . ?
Ag13 S7 2.259(12) . ?
S8 C24 1.85(2) . ?
S8 Ag24 2.789(11) . ?
S8 Ag26 2.547(13) . ?
S7 Ag8A 2.948(12) . ?
S7 Ag7A 2.573(12) . ?
S7 C32 1.82(3) . ?
S7 Ag24 2.665(12) . ?
C2 H2 0.9800 . ?
C2 C1 1.50(3) . ?
C2 C3 1.48(3) . ?
C51 H51 0.9800 . ?
C51 C52 1.530(10) . ?
C51 C50 1.526(10) . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C27 H27 0.9800 . ?
C27 H27A 0.9800 . ?
C27 C26 1.540(10) . ?
C27 C28 1.537(10) . ?
C27 C29A 1.535(10) . ?
C27 C74A 1.541(10) . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C52 H52A 0.9600 . ?
C52 H52B 0.9600 . ?
C52 H52C 0.9600 . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 C4 1.41(2) . ?
C5 C6 1.41(3) . ?
C5 C67A 1.42(3) . ?
C5 C44A 1.42(3) . ?
C13 H13 0.9800 . ?
C13 C12 1.43(3) . ?
C13 C14 1.51(4) . ?
C50 H50A 0.9609 . ?
C50 H50B 0.9591 . ?
C50 H50C 0.9600 . ?
C26 H26A 0.9610 . ?
C26 H26B 0.9608 . ?
C26 H26C 0.9601 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C54 H54 0.9800 . ?
C54 H54A 0.9800 . ?
C54 C53 1.538(7) . ?
C54 C55 1.539(10) . ?
C54 C54A 1.534(10) . ?
C54 C64A 1.539(10) . ?
C4 H4A 0.9600 . ?
C4 H4B 0.9600 . ?
C4 H4C 0.9600 . ?
C53 H53A 0.9597 . ?
C53 H53B 0.9593 . ?
C53 H53C 0.9606 . ?
C55 H55A 0.9590 . ?
C55 H55B 0.9612 . ?
C55 H55C 0.9609 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C28 H28A 0.9601 . ?
C28 H28B 0.9608 . ?
C28 H28C 0.9590 . ?
Ag8A Ag7A 3.303(14) . ?
Ag8A Ag24 2.322(13) . ?
Ag8A O22A 2.40(5) . ?
Ag7A Ag6A 2.791(18) . ?
Ag7A Ag4A 2.98(2) . ?
Ag6A C30 2.22(3) . ?
Ag6A O9A 2.55(9) . ?
C16 H16 0.9800 . ?
C16 H16A 0.9800 . ?
C16 C17 1.523(19) . ?
C16 C15 1.499(19) . ?
C16 C1A 1.538(19) . ?
C16 C2A 1.500(19) . ?
C10 H10 0.9800 . ?
C10 H10A 0.9800 . ?
C10 C11 1.51(3) . ?
C10 C9 1.51(3) . ?
C10 C32A 1.50(3) . ?
C10 C46A 1.50(3) . ?
C40 H40 0.9800 . ?
C40 H40A 0.9800 . ?
C40 C39 1.49(3) . ?
C40 C41 1.49(3) . ?
C40 C27A 1.49(3) . ?
C40 C31A 1.48(3) . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C39 H39A 0.9624 . ?
C39 H39B 0.9595 . ?
C39 H39C 0.9620 . ?
C41 H41A 0.9596 . ?
C41 H41B 0.9606 . ?
C41 H41C 0.9602 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C9 H9A 0.9592 . ?
C9 H9B 0.9611 . ?
C9 H9C 0.9608 . ?
C48 H48 0.9800 . ?
C48 H48A 0.9800 . ?
C48 C49 1.538(9) . ?
C48 C47 1.542(9) . ?
C48 C4A 1.536(9) . ?
C48 C30A 1.536(9) . ?
C24 H24 0.9800 . ?
C24 H24A 0.9800 . ?
C24 C23 1.539(11) . ?
C24 C25 1.539(10) . ?
C24 C9A 1.536(10) . ?
C24 C40A 1.540(10) . ?
C32 H32 0.9800 . ?
C32 H32A 0.9800 . ?
C32 C31 1.540(10) . ?
C32 C33 1.537(10) . ?
C32 C41A 1.540(10) . ?
C32 C66A 1.542(10) . ?
C49 H49A 0.9604 . ?
C49 H49B 0.9598 . ?
C49 H49C 0.9602 . ?
C23 H23A 0.9603 . ?
C23 H23B 0.9594 . ?
C23 H23C 0.9584 . ?
C47 H47A 0.9601 . ?
C47 H47B 0.9606 . ?
C47 H47C 0.9612 . ?
C31 H31A 0.9597 . ?
C31 H31B 0.9611 . ?
C31 H31C 0.9598 . ?
C36 H36A 0.9605 . ?
C36 H36B 0.9597 . ?
C36 H36C 0.9594 . ?
C36 C37 1.534(19) . ?
C38 H38A 0.9592 . ?
C38 H38B 0.9601 . ?
C38 H38C 0.9594 . ?
C38 C37 1.530(19) . ?
C33 H33A 0.9597 . ?
C33 H33B 0.9592 . ?
C33 H33C 0.9610 . ?
O18 C22 1.218(14) . ?
O25 C43 1.203(10) . ?
O24 C43 1.213(10) . ?
C25 H25A 0.9603 . ?
C25 H25B 0.9609 . ?
C25 H25C 0.9604 . ?
O17 C20 1.54(5) . ?
O17 C36A 1.55(6) . ?
F5 C21 1.388(13) . ?
F6 C21 1.399(16) . ?
Ag Ag27 3.32(5) . ?
C21 C22 1.545(10) . ?
C21 F4 1.370(13) . ?
C21 F8A 1.389(11) . ?
C21 F17A 1.378(11) . ?
C21 F28A 1.392(11) . ?
C22 O19 1.225(14) . ?
C22 O64A 1.232(19) . ?
C22 O2A 1.23(2) . ?
F15 C42 1.404(14) . ?
F13 C42 1.394(14) . ?
F14 C42 1.416(18) . ?
C42 F1A 1.412(14) . ?
C42 F7A 1.391(14) . ?
C42 F29A 1.428(18) . ?
C42 C43 1.554(10) . ?
F7 C29 1.385(11) . ?
C19 H19A 0.9592 . ?
C19 H19B 0.9620 . ?
C19 H19C 0.9595 . ?
C19 N1 1.427(16) . ?
F9 C29 1.389(13) . ?
N1 C18 1.432(16) . ?
N1 C20 1.28(6) . ?
F8 C29 1.391(13) . ?
C29 F16A 1.388(13) . ?
C29 F19A 1.380(13) . ?
C29 F9A 1.391(11) . ?
C29 C30 1.542(10) . ?
C18 H18A 0.9595 . ?
C18 H18B 0.9614 . ?
C18 H18C 0.9619 . ?
O16 C8 1.12(4) . ?
O15 C8 1.23(4) . ?
F2 C7 1.384(11) . ?
F1 C7 1.371(11) . ?
F3 C7 1.377(11) . ?
C7 F6A 1.367(11) . ?
C7 F3A 1.379(11) . ?
C7 F4A 1.386(11) . ?
C7 C8 1.540(10) . ?
C43 O24A 1.20(2) . ?
C43 O25A 1.22(2) . ?
C8 O15A 1.19(2) . ?
C8 O16A 1.20(2) . ?
O64A Ag26 2.46(5) . ?
C41A H41D 0.9597 . ?
C41A H41E 0.9592 . ?
C41A H41F 0.9603 . ?
C66A H66A 0.9587 . ?
C66A H66B 0.9616 . ?
C66A H66C 0.9598 . ?
C37 H37 0.9800 . ?
C37 H37A 0.9800 . ?
C37 C28A 1.536(9) . ?
C37 C17A 1.539(9) . ?
C32A H32B 0.9618 . ?
C32A H32C 0.9598 . ?
C32A H32D 0.9605 . ?
C46A H46A 0.9603 . ?
C46A H46B 0.9599 . ?
C46A H46C 0.9595 . ?
C28A H28D 0.9596 . ?
C28A H28E 0.9591 . ?
C28A H28F 0.9597 . ?
C17A H17D 0.9578 . ?
C17A H17E 0.9612 . ?
C17A H17F 0.9605 . ?
C27A H27B 0.9593 . ?
C27A H27C 0.9595 . ?
C27A H27D 0.9608 . ?
C31A H31D 0.9596 . ?
C31A H31E 0.9630 . ?
C31A H31F 0.9597 . ?
C67A H67A 0.9603 . ?
C67A H67B 0.9601 . ?
C67A H67C 0.9613 . ?
C44A H44A 0.9599 . ?
C44A H44B 0.9611 . ?
C44A H44C 0.9604 . ?
O21 C30 1.208(9) . ?
C30 O20 1.185(9) . ?
C30 O66A 1.212(14) . ?
C30 O9A 1.197(14) . ?
C34 F12 1.377(11) . ?
C34 F11 1.384(11) . ?
C34 F10 1.380(11) . ?
C34 F12A 1.376(14) . ?
C34 F11A 1.375(14) . ?
C34 F10A 1.378(15) . ?
C34 C35 1.65(6) . ?
C20 H20 0.9300 . ?
C36A H36D 0.9300 . ?
C36A N18A 1.29(6) . ?
C35A H35A 0.9607 . ?
C35A H35B 0.9597 . ?
C35A H35C 0.9599 . ?
C35A N18A 1.431(9) . ?
N18A C38A 1.431(9) . ?
C38A H38D 0.9619 . ?
C38A H38E 0.9601 . ?
C38A H38F 0.9595 . ?
C15 H15A 0.9615 . ?
C15 H15B 0.9580 . ?
C15 H15C 0.9598 . ?
C1A H1AA 0.9599 . ?
C1A H1AB 0.9601 . ?
C1A H1AC 0.9607 . ?
C2A H2AA 0.9606 . ?
C2A H2AB 0.9605 . ?
C2A H2AC 0.9594 . ?
C45 H45 0.9800 . ?
C45 H45A 0.9800 . ?
C45 C46 1.536(10) . ?
C45 C44 1.536(10) . ?
C45 C16A 1.538(10) . ?
C45 C33A 1.541(10) . ?
C46 H46D 0.9600 . ?
C46 H46E 0.9600 . ?
C46 H46F 0.9600 . ?
C44 H44D 0.9600 . ?
C44 H44E 0.9600 . ?
C44 H44F 0.9600 . ?
C16A H16B 0.9600 . ?
C16A H16C 0.9600 . ?
C16A H16D 0.9600 . ?
C33A H33D 0.9597 . ?
C33A H33E 0.9615 . ?
C33A H33F 0.9591 . ?
C29A H29A 0.9600 . ?
C29A H29B 0.9600 . ?
C29A H29C 0.9600 . ?
C74A H74A 0.9600 . ?
C74A H74B 0.9601 . ?
C74A H74C 0.9602 . ?
C4A H4AA 0.9598 . ?
C4A H4AB 0.9599 . ?
C4A H4AC 0.9601 . ?
C30A H30A 0.9603 . ?
C30A H30B 0.9606 . ?
C30A H30C 0.9590 . ?
Ag27 O15A 2.49(7) . ?
C9A H9AA 0.9606 . ?
C9A H9AB 0.9592 . ?
C9A H9AC 0.9602 . ?
C40A H40B 0.9600 . ?
C40A H40C 0.9600 . ?
C40A H40D 0.9600 . ?
C54A H54B 0.9600 . ?
C54A H54C 0.9600 . ?
C54A H54D 0.9600 . ?
C64A H64A 0.9599 . ?
C64A H64B 0.9604 . ?
C64A H64C 0.9607 . ?
O22 C35 1.20(2) . ?
O23 C35 1.21(2) . ?
C35 O23A 1.19(2) . ?
C35 O22A 1.19(2) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Ag6 Ag5 Ag16 64.17(5) . . ?
Ag6 Ag5 Ag10 169.65(7) . 3_666 ?
Ag6 Ag5 Ag11 106.26(10) . 3_666 ?
Ag10 Ag5 Ag16 105.79(6) 3_666 . ?
Ag10 Ag5 Ag11 83.42(11) 3_666 3_666 ?
Ag11 Ag5 Ag16 168.68(10) 3_666 . ?
S12 Ag5 Ag6 54.20(12) 3_666 . ?
S12 Ag5 Ag16 115.39(13) 3_666 . ?
S12 Ag5 Ag10 134.00(13) 3_666 3_666 ?
S12 Ag5 Ag11 53.73(14) 3_666 3_666 ?
S3 Ag5 Ag6 111.54(15) . . ?
S3 Ag5 Ag16 52.12(14) . . ?
S3 Ag5 Ag10 58.21(14) . 3_666 ?
S3 Ag5 Ag11 132.76(16) . 3_666 ?
S3 Ag5 S12 140.12(16) . 3_666 ?
O3 Ag5 Ag6 91.5(2) . . ?
O3 Ag5 Ag16 96.4(2) . . ?
O3 Ag5 Ag10 92.2(2) . 3_666 ?
O3 Ag5 Ag11 89.7(2) . 3_666 ?
O3 Ag5 S12 102.4(2) . 3_666 ?
O3 Ag5 S3 115.9(2) . . ?
Ag5 Ag6 Ag16 60.27(5) . . ?
S12 Ag6 Ag5 52.62(10) 3_666 . ?
S12 Ag6 Ag16 110.19(12) 3_666 . ?
S4 Ag6 Ag5 106.40(13) . . ?
S4 Ag6 Ag16 48.61(11) . . ?
S4 Ag6 S12 141.73(17) . 3_666 ?
O12 Ag6 Ag5 81.9(2) . . ?
O12 Ag6 Ag16 86.2(2) . . ?
O12 Ag6 S12 100.8(2) . 3_666 ?
O12 Ag6 S4 107.7(2) . . ?
O12 Ag6 O27 93.5(4) . 3_666 ?
O27 Ag6 Ag5 159.7(4) 3_666 . ?
O27 Ag6 Ag16 139.4(4) 3_666 . ?
O27 Ag6 S12 109.7(4) 3_666 3_666 ?
O27 Ag6 S4 93.8(4) 3_666 . ?
Ag20 Ag19 Ag18 97.9(4) . . ?
S11 Ag19 Ag20 51.49(12) . . ?
S11 Ag19 Ag18 55.2(5) . . ?
S1 Ag19 Ag20 109.14(15) . . ?
S1 Ag19 Ag18 149.7(3) . . ?
S1 Ag19 S11 135.95(16) . . ?
S1 Ag19 O2 117.1(2) . . ?
O2 Ag19 Ag20 108.7(2) . . ?
O2 Ag19 Ag18 63.8(4) . . ?
O2 Ag19 S11 106.9(2) . . ?
Ag5 Ag16 Ag6 55.56(5) . . ?
Ag5 Ag16 Ag15 146.99(7) . . ?
Ag6 Ag16 Ag15 91.98(6) . . ?
S4 Ag16 Ag5 102.58(13) . . ?
S4 Ag16 Ag6 49.35(12) . . ?
S4 Ag16 Ag15 49.17(13) . . ?
S4 Ag16 S3 133.62(17) . . ?
S4 Ag16 S9 119.9(2) . . ?
S4 Ag16 O10 107.1(2) . . ?
S3 Ag16 Ag5 49.67(12) . . ?
S3 Ag16 Ag6 101.29(13) . . ?
S3 Ag16 Ag15 160.75(14) . . ?
S3 Ag16 S9 102.97(19) . . ?
S9 Ag16 Ag5 133.18(14) . . ?
S9 Ag16 Ag6 147.82(16) . . ?
S9 Ag16 Ag15 70.78(16) . . ?
O10 Ag16 Ag5 72.9(2) . . ?
O10 Ag16 Ag6 79.2(2) . . ?
O10 Ag16 Ag15 97.3(2) . . ?
O10 Ag16 S3 98.8(2) . . ?
O10 Ag16 S9 76.5(2) . . ?
S1 Ag1 Ag8 122.78(16) . 3_666 ?
S1 Ag1 S5 145.84(19) . 3_666 ?
S5 Ag1 Ag8 52.07(14) 3_666 3_666 ?
Ag14 Ag7 Ag15 55.98(16) . . ?
S4 Ag7 Ag15 49.73(12) . . ?
S4 Ag7 Ag14 100.7(3) . . ?
S4 Ag7 S5 138.12(16) . . ?
S4 Ag7 Ag26 105.9(3) . . ?
S5 Ag7 Ag15 105.83(14) . . ?
S5 Ag7 Ag14 50.61(19) . . ?
S5 Ag7 Ag26 53.8(4) . . ?
O18 Ag7 Ag15 91.0(8) . . ?
O18 Ag7 Ag14 97.8(10) . . ?
O18 Ag7 S4 106.9(5) . . ?
O18 Ag7 S5 106.9(5) . . ?
O2A Ag7 Ag15 90.4(16) . . ?
O2A Ag7 S4 104.1(17) . . ?
O2A Ag7 S5 110.1(15) . . ?
O2A Ag7 Ag26 87.3(13) . . ?
Ag26 Ag7 Ag15 57.4(2) . . ?
S11 Ag21 Ag22 121.23(15) . . ?
S11 Ag21 S13 135.05(17) . . ?
S11 Ag21 Ag4A 96.2(2) . . ?
S11 Ag21 Ag25 52.7(8) . . ?
S13 Ag21 Ag22 57.31(16) . . ?
S13 Ag21 Ag4A 43.8(3) . . ?
S13 Ag21 Ag25 115.0(3) . . ?
O25 Ag21 Ag22 88.9(7) . . ?
O25 Ag21 S11 111.3(9) . . ?
O25 Ag21 S13 113.5(9) . . ?
Ag25 Ag21 Ag4A 111.8(9) . . ?
Ag19 Ag20 Ag4A 114.40(18) . . ?
S12 Ag20 Ag19 130.31(11) . . ?
S12 Ag20 O26 100.9(5) . . ?
S12 Ag20 Ag4A 47.6(3) . . ?
S11 Ag20 Ag19 54.16(12) . . ?
S11 Ag20 S12 147.13(19) . . ?
S11 Ag20 O26 109.5(5) . . ?
S11 Ag20 Ag4A 99.6(3) . . ?
O26 Ag20 Ag19 103.5(5) . . ?
O26 Ag20 Ag4A 141.1(6) . . ?
Ag5 Ag10 Ag27 88.7(5) 3_666 3_666 ?
S3 Ag10 Ag5 48.47(11) 3_666 3_666 ?
S3 Ag10 Ag6A 162.4(3) 3_666 . ?
S3 Ag10 Ag27 45.0(5) 3_666 3_666 ?
S2 Ag10 Ag5 129.28(18) 3_666 3_666 ?
S2 Ag10 S3 95.6(2) 3_666 3_666 ?
S2 Ag10 Ag6A 99.6(3) 3_666 . ?
S2 Ag10 Ag27 51.0(5) 3_666 3_666 ?
S6 Ag10 Ag5 78.09(15) . 3_666 ?
S6 Ag10 S3 114.70(19) . 3_666 ?
S6 Ag10 S2 149.4(3) . 3_666 ?
S6 Ag10 Ag6A 51.4(2) . . ?
S6 Ag10 Ag27 157.5(5) . 3_666 ?
Ag6A Ag10 Ag27 150.5(5) . 3_666 ?
Ag17 Ag23 Ag13 163.9(2) . . ?
S9 Ag23 Ag17 50.71(16) . . ?
S9 Ag23 Ag13 137.6(2) . . ?
S9 Ag23 S8 96.0(2) . . ?
S9 Ag23 Ag24 154.0(3) . . ?
S14 Ag23 Ag17 96.52(19) . . ?
S14 Ag23 S9 141.9(2) . . ?
S14 Ag23 Ag13 79.5(3) . . ?
S14 Ag23 S8 112.8(2) . . ?
S14 Ag23 Ag24 62.6(3) . . ?
S8 Ag23 Ag17 146.59(19) . . ?
S8 Ag23 Ag13 45.9(2) . . ?
Ag24 Ag23 S8 59.2(3) . . ?
Ag17 Ag18 Ag19 86.4(6) . . ?
S11 Ag18 Ag19 49.49(17) . . ?
S11 Ag18 Ag17 134.9(6) . . ?
S14 Ag18 Ag19 141.7(4) . . ?
S14 Ag18 Ag17 95.7(7) . . ?
S14 Ag18 S11 123.7(8) . . ?
S10 Ag18 Ag19 66.8(3) . . ?
S10 Ag18 Ag17 52.2(5) . . ?
S10 Ag18 S11 95.2(3) . . ?
S10 Ag18 S14 140.8(8) . . ?
Ag23 Ag17 Ag3 157.1(4) . . ?
Ag23 Ag17 Ag4 123.7(4) . . ?
Ag18 Ag17 Ag23 72.8(3) . . ?
Ag18 Ag17 Ag3 98.92(19) . . ?
Ag18 Ag17 Ag4 160.3(4) . . ?
Ag3 Ag17 Ag4 61.7(4) . . ?
S9 Ag17 Ag23 55.0(2) . . ?
S9 Ag17 Ag18 127.7(4) . . ?
S9 Ag17 Ag3 130.2(2) . . ?
S9 Ag17 Ag4 70.1(4) . . ?
S9 Ag17 S10 171.5(5) . . ?
S10 Ag17 Ag23 127.0(3) . . ?
S10 Ag17 Ag18 54.6(2) . . ?
S10 Ag17 Ag3 52.04(19) . . ?
S10 Ag17 Ag4 109.2(5) . . ?
V5 V2 V4 175.24(9) . 3_666 ?
O5 V2 V4 47.9(2) 3_666 3_666 ?
O5 V2 V4 127.6(2) . 3_666 ?
O5 V2 V5 47.8(2) . . ?
O5 V2 V5 127.6(2) 3_666 . ?
O5 V2 O5 79.8(3) . 3_666 ?
O3 V2 V4 88.9(3) . 3_666 ?
O3 V2 V5 88.9(3) . . ?
O3 V2 O5 80.8(3) . 3_666 ?
O3 V2 O5 80.7(3) . . ?
O8 V2 V4 90.2(3) . 3_666 ?
O8 V2 V5 90.1(3) . . ?
O8 V2 O5 80.0(3) . 3_666 ?
O8 V2 O5 80.0(3) . . ?
O8 V2 O3 154.8(3) . . ?
O6 V2 V4 38.9(3) . 3_666 ?
O6 V2 V5 145.7(3) . . ?
O6 V2 O5 166.5(4) . . ?
O6 V2 O5 86.7(4) . 3_666 ?
O6 V2 O3 97.2(4) . . ?
O6 V2 O8 97.8(4) . . ?
O6 V2 O12 106.5(4) . . ?
O12 V2 V4 145.4(3) . 3_666 ?
O12 V2 V5 39.2(3) . . ?
O12 V2 O5 87.0(4) . . ?
O12 V2 O5 166.7(4) . 3_666 ?
O12 V2 O3 97.8(4) . . ?
O12 V2 O8 97.2(4) . . ?
S12 Ag11 Ag5 50.04(11) . 3_666 ?
S12 Ag11 S13 114.7(2) . . ?
S12 Ag11 Ag12 145.6(2) . . ?
S13 Ag11 Ag5 164.0(2) . 3_666 ?
S13 Ag11 Ag12 48.14(15) . . ?
S6 Ag11 Ag5 77.35(18) . 3_666 ?
S6 Ag11 S12 120.7(2) . . ?
S6 Ag11 S13 118.4(2) . . ?
S6 Ag11 Ag12 91.5(2) . . ?
Ag12 Ag11 Ag5 139.93(13) . 3_666 ?
V4 V3 V5 58.80(7) . . ?
O5 V3 V4 47.4(2) . . ?
O5 V3 V5 46.8(2) . . ?
O5 V3 V1 86.2(2) . 3_666 ?
O3 V3 V4 86.5(3) 3_666 . ?
O3 V3 V5 123.3(3) 3_666 . ?
O3 V3 O5 76.5(3) 3_666 . ?
O3 V3 V1 40.8(2) 3_666 3_666 ?
O8 V3 V4 123.6(3) . . ?
O8 V3 V5 87.4(3) . . ?
O8 V3 O5 76.3(3) . . ?
O8 V3 O3 76.1(3) . 3_666 ?
O8 V3 V1 39.2(2) . 3_666 ?
O7 V3 V4 33.7(3) . . ?
O7 V3 V5 84.3(3) . . ?
O7 V3 O5 80.6(4) . . ?
O7 V3 O3 88.6(4) . 3_666 ?
O7 V3 O8 154.6(4) . . ?
O7 V3 V1 129.4(3) . 3_666 ?
O13 V3 V4 83.8(3) . . ?
O13 V3 V5 34.1(3) . . ?
O13 V3 O5 80.5(4) . . ?
O13 V3 O3 155.7(4) . 3_666 ?
O13 V3 O8 91.0(4) . . ?
O13 V3 O7 95.4(4) . . ?
O13 V3 V1 130.3(3) . 3_666 ?
O9 V3 V4 136.7(3) . . ?
O9 V3 V5 137.2(4) . . ?
O9 V3 O5 174.4(4) . . ?
O9 V3 O3 99.2(4) . 3_666 ?
O9 V3 O8 99.2(4) . . ?
O9 V3 O7 103.1(4) . . ?
O9 V3 O13 103.2(5) . . ?
O9 V3 V1 88.2(3) . 3_666 ?
V1 V3 V4 119.95(9) 3_666 . ?
V1 V3 V5 119.64(9) 3_666 . ?
Ag17 Ag3 Ag2 135.2(2) . . ?
Ag17 Ag3 Ag4 59.3(4) . . ?
Ag2 Ag3 Ag4 111.3(3) . . ?
Ag2 Ag3 Ag 151.1(12) . . ?
Ag2 Ag3 Ag27 102.1(7) . . ?
S10 Ag3 Ag17 51.76(16) . . ?
S10 Ag3 Ag2 133.26(18) . . ?
S10 Ag3 Ag4 106.7(4) . . ?
S10 Ag3 S2 173.5(3) . . ?
S10 Ag3 Ag 52.7(5) . . ?
S10 Ag3 Ag27 119.3(9) . . ?
S2 Ag3 Ag17 126.42(18) . . ?
S2 Ag3 Ag2 52.99(18) . . ?
S2 Ag3 Ag4 69.4(4) . . ?
S2 Ag3 Ag 123.3(6) . . ?
S2 Ag3 Ag27 56.4(9) . . ?
Ag Ag3 Ag27 66.9(10) . . ?
Ag14 Ag8 Ag1 87.8(2) . 3_666 ?
S5 Ag8 Ag1 50.64(13) . 3_666 ?
S5 Ag8 Ag14 50.2(5) . . ?
S5 Ag8 O13 93.4(2) . . ?
S5 Ag8 Ag9 163.3(2) . . ?
O13 Ag8 Ag1 53.4(2) . 3_666 ?
O13 Ag8 Ag14 94.8(4) . . ?
O13 Ag8 Ag9 83.5(2) . . ?
Ag9 Ag8 Ag1 116.62(13) . 3_666 ?
Ag9 Ag8 Ag14 146.3(5) . . ?
S7 Ag8 Ag1 152.45(17) . 3_666 ?
S7 Ag8 Ag14 91.4(5) . . ?
S7 Ag8 S5 140.5(3) . . ?
S7 Ag8 O13 99.3(2) . . ?
S7 Ag8 Ag9 56.0(2) . . ?
S7 Ag8 O20 114.7(8) . . ?
S7 Ag8 O9A 104(2) . . ?
O20 Ag8 Ag1 80.0(9) . 3_666 ?
O20 Ag8 Ag14 144.0(10) . . ?
O20 Ag8 S5 97.8(8) . . ?
O20 Ag8 O13 104.3(11) . . ?
O20 Ag8 Ag9 67.4(8) . . ?
O9A Ag8 S5 102(2) . . ?
O9A Ag8 O13 117.6(17) . . ?
V2 V4 V3 62.11(7) 3_666 . ?
V2 V4 V1 61.56(7) 3_666 . ?
V3 V4 V1 91.98(8) . . ?
V5 V4 V2 92.30(8) . 3_666 ?
V5 V4 V3 61.02(7) . . ?
V5 V4 V1 60.24(7) . . ?
O5 V4 V2 44.4(2) . 3_666 ?
O5 V4 V3 46.1(2) . . ?
O5 V4 V5 47.9(2) . . ?
O5 V4 V1 46.0(2) . . ?
O6 V4 V2 31.1(2) 3_666 3_666 ?
O6 V4 V3 82.8(2) 3_666 . ?
O6 V4 V5 123.4(2) 3_666 . ?
O6 V4 O5 75.5(3) 3_666 . ?
O6 V4 V1 81.0(2) 3_666 . ?
O7 V4 V2 79.4(3) . 3_666 ?
O7 V4 V3 33.2(2) . . ?
O7 V4 V5 85.9(3) . . ?
O7 V4 O5 78.8(3) . . ?
O7 V4 O6 84.5(4) . 3_666 ?
O7 V4 O2 155.0(4) . . ?
O7 V4 V1 124.8(3) . . ?
O2 V4 V2 78.1(3) . 3_666 ?
O2 V4 V3 123.6(3) . . ?
O2 V4 V5 84.0(2) . . ?
O2 V4 O5 77.5(3) . . ?
O2 V4 O6 82.1(4) . 3_666 ?
O2 V4 V1 32.0(2) . . ?
O11 V4 V2 126.6(3) . 3_666 ?
O11 V4 V3 83.1(3) . . ?
O11 V4 V5 34.3(3) . . ?
O11 V4 O5 82.2(3) . . ?
O11 V4 O6 157.6(4) . 3_666 ?
O11 V4 O7 93.1(4) . . ?
O11 V4 O2 91.5(4) . . ?
O11 V4 V1 82.2(3) . . ?
O4 V4 V2 130.1(4) . 3_666 ?
O4 V4 V3 133.9(4) . . ?
O4 V4 V5 137.6(4) . . ?
O4 V4 O5 174.4(4) . . ?
O4 V4 O6 98.9(4) . 3_666 ?
O4 V4 O7 100.7(5) . . ?
O4 V4 O2 102.1(5) . . ?
O4 V4 O11 103.4(5) . . ?
O4 V4 V1 134.0(4) . . ?
V2 V5 V3 61.18(7) . . ?
V2 V5 V1 62.49(7) . . ?
V4 V5 V2 92.23(8) . . ?
V4 V5 V3 60.19(7) . . ?
V4 V5 V1 60.89(7) . . ?
O5 V5 V2 44.2(2) . . ?
O5 V5 V3 45.7(2) . . ?
O5 V5 V4 48.1(2) . . ?
O5 V5 V1 46.3(2) . . ?
O12 V5 V2 31.7(2) . . ?
O12 V5 V3 80.8(2) . . ?
O12 V5 V4 123.9(2) . . ?
O12 V5 O5 75.9(3) . . ?
O12 V5 V1 83.8(3) . . ?
O11 V5 V2 126.5(3) . . ?
O11 V5 V3 82.4(3) . . ?
O11 V5 V4 34.3(3) . . ?
O11 V5 O5 82.3(3) . . ?
O11 V5 O12 158.1(4) . . ?
O11 V5 O10 93.0(4) . . ?
O11 V5 O13 91.0(4) . . ?
O11 V5 V1 82.8(3) . . ?
O10 V5 V2 79.3(3) . . ?
O10 V5 V3 124.2(3) . . ?
O10 V5 V4 85.7(3) . . ?
O10 V5 O5 78.5(3) . . ?
O10 V5 O12 85.0(4) . . ?
O10 V5 O13 155.3(4) . . ?
O10 V5 V1 32.8(3) . . ?
O13 V5 V2 78.8(3) . . ?
O13 V5 V3 32.6(3) . . ?
O13 V5 V4 83.9(3) . . ?
O13 V5 O5 77.9(3) . . ?
O13 V5 O12 82.3(4) . . ?
O13 V5 V1 124.2(3) . . ?
O14 V5 V2 129.6(4) . . ?
O14 V5 V3 133.0(4) . . ?
O14 V5 V4 138.1(4) . . ?
O14 V5 O5 173.7(4) . . ?
O14 V5 O12 97.9(4) . . ?
O14 V5 O11 103.8(5) . . ?
O14 V5 O10 102.3(5) . . ?
O14 V5 O13 100.4(5) . . ?
O14 V5 V1 135.0(4) . . ?
V1 V5 V3 91.87(8) . . ?
S1 Ag2 Ag3 84.54(16) . . ?
S1 Ag2 S2 136.4(2) . . ?
S1 Ag2 O9 105.3(2) . 3_666 ?
S2 Ag2 Ag3 51.90(18) . . ?
S2 Ag2 O9 94.2(3) . 3_666 ?
O9 Ag2 Ag3 111.0(2) 3_666 . ?
O66A Ag2 Ag3 137(2) 3_666 . ?
O66A Ag2 S1 115(2) 3_666 . ?
O66A Ag2 S2 98(3) 3_666 . ?
Ag7 Ag15 Ag16 90.43(7) . . ?
Ag14 Ag15 Ag16 118.0(5) . . ?
Ag14 Ag15 Ag7 58.6(4) . . ?
S4 Ag15 Ag16 47.88(12) . . ?
S4 Ag15 Ag7 49.22(12) . . ?
S4 Ag15 Ag14 102.6(2) . . ?
S4 Ag15 Ag26 103.3(4) . . ?
S8 Ag15 Ag16 119.00(17) . . ?
S8 Ag15 Ag7 106.74(19) . . ?
S8 Ag15 Ag14 48.2(4) . . ?
S8 Ag15 S4 143.0(2) . . ?
S8 Ag15 Ag26 54.1(3) . . ?
O17 Ag15 Ag16 104.7(11) . . ?
O17 Ag15 Ag7 129.3(8) . . ?
O17 Ag15 Ag14 137.0(11) . . ?
O17 Ag15 S4 109.8(8) . . ?
O17 Ag15 S8 107.1(8) . . ?
O17 Ag15 Ag26 126.8(12) . . ?
Ag26 Ag15 Ag16 128.3(6) . . ?
Ag26 Ag15 Ag7 55.3(2) . . ?
Ag17 Ag4 Ag3 59.04(18) . . ?
S3 Ag4 Ag17 121.0(6) . . ?
S3 Ag4 Ag3 118.3(4) . . ?
O16 Ag4 Ag17 75.7(10) . . ?
O16 Ag4 Ag3 72.1(11) . . ?
O16 Ag4 S3 162.9(11) . . ?
Ag7 Ag14 Ag8 98.78(18) . . ?
Ag15 Ag14 Ag7 65.5(3) . . ?
Ag15 Ag14 Ag8 139.9(8) . . ?
S5 Ag14 Ag7 52.9(4) . . ?
S5 Ag14 Ag8 52.5(3) . . ?
S5 Ag14 Ag15 117.4(5) . . ?
S5 Ag14 O14 80.0(4) . . ?
S5 Ag14 Ag13 122.3(9) . . ?
O14 Ag14 Ag7 64.3(3) . . ?
O14 Ag14 Ag8 76.0(7) . . ?
O14 Ag14 Ag15 63.9(3) . . ?
O14 Ag14 Ag13 86.4(10) . . ?
Ag13 Ag14 Ag7 150.6(9) . . ?
Ag13 Ag14 Ag8 69.8(7) . . ?
Ag13 Ag14 Ag15 105.2(7) . . ?
S8 Ag14 Ag7 120.6(4) . . ?
S8 Ag14 Ag8 123.8(13) . . ?
S8 Ag14 Ag15 55.3(2) . . ?
S8 Ag14 S5 166.4(10) . . ?
S8 Ag14 O14 86.4(8) . . ?
S8 Ag14 Ag13 56.0(7) . . ?
S13 Ag22 Ag21 52.48(14) . . ?
S13 Ag22 Ag12 49.80(15) . . ?
S14 Ag22 Ag21 100.45(18) . . ?
S14 Ag22 S13 129.1(2) . . ?
S14 Ag22 Ag12 99.76(17) . . ?
S14 Ag22 O22 103(3) . . ?
Ag12 Ag22 Ag21 92.90(11) . . ?
O24 Ag22 Ag21 72.2(8) . . ?
O24 Ag22 S13 101.1(8) . . ?
O24 Ag22 S14 110.3(8) . . ?
O24 Ag22 Ag12 148.2(8) . . ?
O24 Ag22 O22 93(2) . . ?
O22 Ag22 Ag21 155.4(18) . . ?
O22 Ag22 S13 115(4) . . ?
O22 Ag22 Ag12 90(3) . . ?
Ag5 S12 Ag6 73.19(12) 3_666 3_666 ?
Ag5 S12 Ag11 76.22(16) 3_666 . ?
Ag6 S12 Ag11 145.23(18) 3_666 . ?
Ag20 S12 Ag5 140.05(19) . 3_666 ?
Ag20 S12 Ag6 90.75(17) . 3_666 ?
Ag20 S12 Ag11 102.48(19) . . ?
C51 S12 Ag5 115.3(7) . 3_666 ?
C51 S12 Ag6 100.4(9) . 3_666 ?
C51 S12 Ag20 103.3(7) . . ?
C51 S12 Ag11 107.4(10) . . ?
C51 S12 Ag4A 103.8(9) . . ?
Ag4A S12 Ag20 80.8(6) . . ?
Ag6 S4 Ag7 87.04(16) . . ?
Ag6 S4 Ag15 140.5(2) . . ?
Ag16 S4 Ag6 82.04(15) . . ?
Ag16 S4 Ag7 139.34(19) . . ?
Ag16 S4 Ag15 82.94(16) . . ?
Ag7 S4 Ag15 81.05(17) . . ?
C16 S4 Ag6 109.9(8) . . ?
C16 S4 Ag16 111.9(8) . . ?
C16 S4 Ag7 108.6(8) . . ?
C16 S4 Ag15 109.6(8) . . ?
Ag19 S11 Ag18 75.3(5) . . ?
Ag19 S11 Ag25 89.3(15) . . ?
Ag21 S11 Ag19 137.60(19) . . ?
Ag21 S11 Ag18 89.0(4) . . ?
Ag21 S11 Ag25 78.1(13) . . ?
Ag20 S11 Ag19 74.35(14) . . ?
Ag20 S11 Ag21 87.78(18) . . ?
Ag20 S11 Ag18 130.3(4) . . ?
Ag20 S11 Ag25 137.1(6) . . ?
C40 S11 Ag19 112.5(11) . . ?
C40 S11 Ag21 109.8(11) . . ?
C40 S11 Ag20 111.5(9) . . ?
C40 S11 Ag18 116.1(9) . . ?
C40 S11 Ag25 111.4(11) . . ?
Ag5 S3 Ag16 78.21(15) . . ?
Ag5 S3 Ag10 73.32(15) . 3_666 ?
Ag5 S3 Ag4 135.2(3) . . ?
Ag16 S3 Ag10 140.70(19) . 3_666 ?
Ag4 S3 Ag16 88.9(6) . . ?
Ag4 S3 Ag10 92.5(5) . 3_666 ?
C10 S3 Ag5 111.9(8) . . ?
C10 S3 Ag16 109.6(8) . . ?
C10 S3 Ag10 105.9(8) . 3_666 ?
C10 S3 Ag4 112.8(9) . . ?
C10 S3 Ag27 106.2(11) . . ?
Ag27 S3 Ag5 137.8(6) . . ?
Ag27 S3 Ag16 105.7(11) . . ?
Ag19 S1 Ag1 119.7(2) . . ?
Ag19 S1 Ag2 118.0(2) . . ?
Ag2 S1 Ag1 97.57(19) . . ?
C2 S1 Ag19 108.7(7) . . ?
C2 S1 Ag1 106.0(7) . . ?
C2 S1 Ag2 105.4(8) . . ?
Ag21 S13 Ag11 108.7(2) . . ?
Ag21 S13 Ag22 70.21(17) . . ?
Ag21 S13 Ag8A 95.9(3) . . ?
Ag22 S13 Ag11 136.2(2) . . ?
Ag12 S13 Ag21 123.2(2) . . ?
Ag12 S13 Ag11 74.11(19) . . ?
Ag12 S13 Ag22 71.7(2) . . ?
Ag4A S13 Ag21 86.2(6) . . ?
Ag4A S13 Ag8A 119.5(4) . . ?
C45 S13 Ag21 117.4(11) . . ?
C45 S13 Ag11 113.2(12) . . ?
C45 S13 Ag22 104.4(12) . . ?
C45 S13 Ag12 111.7(11) . . ?
C45 S13 Ag8A 109.0(11) . . ?
C45 S13 Ag4A 123.2(12) . . ?
Ag1 S5 Ag7 88.77(18) 3_666 . ?
Ag1 S5 Ag8 77.30(17) 3_666 . ?
Ag1 S5 Ag26 136.0(7) 3_666 . ?
Ag7 S5 Ag8 136.7(2) . . ?
Ag14 S5 Ag1 122.8(7) . 3_666 ?
Ag14 S5 Ag7 76.5(4) . . ?
Ag14 S5 Ag8 77.3(7) . . ?
C27 S5 Ag1 117.6(9) . 3_666 ?
C27 S5 Ag7 116.7(8) . . ?
C27 S5 Ag8 106.0(7) . . ?
C27 S5 Ag14 118.4(10) . . ?
C27 S5 Ag26 106.4(11) . . ?
Ag26 S5 Ag7 71.4(3) . . ?
Ag26 S5 Ag8 90.7(5) . . ?
Ag23 S9 Ag16 116.7(2) . . ?
Ag23 S9 Ag 87.9(11) . . ?
Ag17 S9 Ag16 117.8(3) . . ?
Ag17 S9 Ag23 74.3(3) . . ?
C13 S9 Ag16 121.5(9) . . ?
C13 S9 Ag23 106.2(12) . . ?
C13 S9 Ag17 110.6(10) . . ?
C13 S9 Ag 91(2) . . ?
Ag S9 Ag16 126.6(8) . . ?
Ag23 S14 Ag18 88.4(6) . . ?
Ag23 S14 Ag8A 108.6(3) . . ?
Ag23 S14 Ag24 63.2(2) . . ?
Ag22 S14 Ag23 140.4(3) . . ?
Ag22 S14 Ag18 105.0(6) . . ?
C37 S14 Ag23 102.9(10) . . ?
C37 S14 Ag18 99.7(11) . . ?
C37 S14 Ag22 111.0(11) . . ?
C37 S14 Ag8A 130.5(12) . . ?
C37 S14 Ag24 119.5(10) . . ?
C37 S14 Ag25 95.5(13) . . ?
Ag24 S14 Ag8A 51.2(3) . . ?
Ag25 S14 Ag23 103.5(16) . . ?
Ag25 S14 Ag8A 112.6(7) . . ?
Ag25 S14 Ag24 144.1(10) . . ?
Ag17 S10 Ag18 73.2(6) . . ?
Ag17 S10 Ag3 76.19(19) . . ?
Ag3 S10 Ag18 132.2(5) . . ?
Ag3 S10 Ag 76.2(6) . . ?
Ag3 S10 Ag25 141.9(9) . . ?
C54 S10 Ag18 116.5(9) . . ?
C54 S10 Ag17 106.2(13) . . ?
C54 S10 Ag3 106.8(9) . . ?
C54 S10 Ag 85(2) . . ?
C54 S10 Ag25 109.1(12) . . ?
Ag S10 Ag25 94.5(11) . . ?
Ag10 S2 Ag27 81.8(7) 3_666 . ?
Ag3 S2 Ag10 124.7(2) . 3_666 ?
Ag3 S2 Ag2 75.1(2) . . ?
Ag3 S2 Ag27 73.4(9) . . ?
Ag2 S2 Ag10 88.4(2) . 3_666 ?
Ag2 S2 Ag27 132.9(8) . . ?
C5 S2 Ag10 119.8(8) . 3_666 ?
C5 S2 Ag3 115.5(8) . . ?
C5 S2 Ag2 110.2(10) . . ?
C5 S2 Ag27 114.6(12) . . ?
V2 O5 V2 100.2(3) . 3_666 ?
V2 O5 V3 92.1(3) . . ?
V2 O5 V3 93.0(3) 3_666 . ?
V2 O5 V4 87.8(3) 3_666 . ?
V2 O5 V4 171.9(4) . . ?
V2 O5 V5 171.7(4) 3_666 . ?
V2 O5 V5 88.0(3) . . ?
V2 O5 V1 93.6(3) . . ?
V2 O5 V1 92.2(3) 3_666 . ?
V3 O5 V4 86.5(3) . . ?
V3 O5 V5 87.5(3) . . ?
V3 O5 V1 171.5(4) . . ?
V5 O5 V4 84.0(3) . . ?
V1 O5 V4 87.0(3) . . ?
V1 O5 V5 86.4(3) . . ?
V2 O3 Ag5 116.1(4) . . ?
V2 O3 V3 107.5(4) . 3_666 ?
V2 O3 V1 107.7(4) . . ?
V3 O3 Ag5 116.6(4) 3_666 . ?
V3 O3 V1 98.7(3) 3_666 . ?
V1 O3 Ag5 108.5(4) . . ?
V2 O8 V3 108.8(4) . . ?
V2 O8 V1 108.7(4) . 3_666 ?
V3 O8 V1 102.1(4) . 3_666 ?
V2 O6 V4 110.0(4) . 3_666 ?
V3 O7 V4 113.1(4) . . ?
V3 O7 Ag7A 115.2(5) . . ?
V4 O7 Ag7A 124.0(5) . . ?
V4 O2 Ag19 105.5(4) . . ?
V1 O2 Ag19 115.3(4) . . ?
V1 O2 V4 113.2(5) . . ?
V2 O12 Ag6 122.9(4) . . ?
V2 O12 V5 109.1(4) . . ?
V5 O12 Ag6 116.4(4) . . ?
V5 O11 V4 111.4(5) . . ?
V5 O10 Ag16 116.9(4) . . ?
V1 O10 Ag16 128.0(5) . . ?
V1 O10 V5 113.5(5) . . ?
V3 O13 Ag8 122.6(5) . . ?
V3 O13 V5 113.3(5) . . ?
V5 O13 Ag8 115.6(4) . . ?
V3 O9 Ag2 126.2(5) . 3_666 ?
V5 O14 Ag14 140.6(9) . . ?
C57 O27 Ag6 122.3(16) . 3_666 ?
C57 O26 Ag20 125.3(16) . . ?
O27 C57 C56 114(2) . . ?
O26 C57 O27 130(2) . . ?
O26 C57 C56 116(2) . . ?
F16 C56 C57 114(2) . . ?
F17 C56 C57 113(2) . . ?
F17 C56 F16 100(2) . . ?
F17 C56 F18 105(2) . . ?
F18 C56 C57 112(2) . . ?
F18 C56 F16 111(2) . . ?
F01{ C56 C57 107(3) . . ?
F0 C56 C57 111(2) . . ?
F0 C56 F01{ 95(3) . . ?
F19 C56 C57 114(3) . . ?
F19 C56 F01{ 101(3) . . ?
F19 C56 F0 125(4) . . ?
V3 V1 V4 119.06(9) 3_666 . ?
V3 V1 V5 119.22(9) 3_666 . ?
V5 V1 V4 58.86(7) . . ?
O5 V1 V3 85.3(2) . 3_666 ?
O5 V1 V4 47.0(2) . . ?
O5 V1 V5 47.3(2) . . ?
O3 V1 V3 40.5(2) . 3_666 ?
O3 V1 V4 122.8(3) . . ?
O3 V1 V5 86.1(3) . . ?
O3 V1 O5 75.8(3) . . ?
O8 V1 V3 38.7(2) 3_666 3_666 ?
O8 V1 V4 87.5(3) 3_666 . ?
O8 V1 V5 123.1(3) 3_666 . ?
O8 V1 O5 76.0(3) 3_666 . ?
O8 V1 O3 75.2(3) 3_666 . ?
O2 V1 V3 129.2(3) . 3_666 ?
O2 V1 V4 34.9(3) . . ?
O2 V1 V5 85.0(3) . . ?
O2 V1 O5 81.3(4) . . ?
O2 V1 O3 155.4(4) . . ?
O2 V1 O8 90.6(4) . 3_666 ?
O2 V1 O10 97.0(4) . . ?
O10 V1 V3 128.6(3) . 3_666 ?
O10 V1 V4 84.7(3) . . ?
O10 V1 V5 33.8(3) . . ?
O10 V1 O5 80.4(4) . . ?
O10 V1 O3 88.1(4) . . ?
O10 V1 O8 153.7(4) . 3_666 ?
O1 V1 V3 88.5(4) . 3_666 ?
O1 V1 V4 138.0(3) . . ?
O1 V1 V5 136.5(4) . . ?
O1 V1 O5 173.8(4) . . ?
O1 V1 O3 98.9(4) . . ?
O1 V1 O8 99.7(4) . 3_666 ?
O1 V1 O2 103.3(5) . . ?
O1 V1 O10 102.9(5) . . ?
Ag10 S6 Ag11 117.6(2) . . ?
Ag10 S6 Ag7A 125.0(3) . . ?
Ag10 S6 Ag6A 77.4(3) . . ?
Ag9 S6 Ag10 98.4(3) . . ?
Ag9 S6 Ag11 91.6(3) . . ?
Ag6A S6 Ag7A 68.9(5) . . ?
C48 S6 Ag10 117.7(10) . . ?
C48 S6 Ag11 115.0(9) . . ?
C48 S6 Ag9 111.2(10) . . ?
C48 S6 Ag7A 111.5(10) . . ?
C48 S6 Ag6A 102.8(9) . . ?
S6 Ag9 Ag8 157.9(2) . . ?
S6 Ag9 Ag12 95.5(3) . . ?
S6 Ag9 S7 141.9(4) . . ?
Ag12 Ag9 Ag8 89.58(18) . . ?
S7 Ag9 Ag8 49.34(18) . . ?
S7 Ag9 Ag12 46.7(2) . . ?
O21 Ag9 Ag8 77.4(10) . . ?
O21 Ag9 S6 108.9(11) . . ?
O21 Ag9 Ag12 144.9(10) . . ?
O21 Ag9 S7 103.8(11) . . ?
Ag22 Ag12 Ag11 111.08(14) . . ?
Ag22 Ag12 Ag9 172.99(16) . . ?
S13 Ag12 Ag11 57.74(18) . . ?
S13 Ag12 Ag22 58.53(17) . . ?
S13 Ag12 Ag9 121.8(2) . . ?
Ag9 Ag12 Ag11 72.48(16) . . ?
S7 Ag12 Ag11 130.5(3) . . ?
S7 Ag12 Ag22 117.6(3) . . ?
S7 Ag12 S13 166.0(3) . . ?
S7 Ag12 Ag9 60.2(3) . . ?
Ag14 Ag13 Ag23 95.1(3) . . ?
S8 Ag13 Ag23 60.2(3) . . ?
S8 Ag13 Ag14 51.5(3) . . ?
S7 Ag13 Ag23 128.0(4) . . ?
S7 Ag13 Ag14 103.5(5) . . ?
S7 Ag13 S8 154.7(6) . . ?
Ag15 S8 Ag23 94.1(2) . . ?
Ag15 S8 Ag24 139.3(3) . . ?
Ag15 S8 Ag26 72.4(3) . . ?
Ag14 S8 Ag23 117.0(7) . . ?
Ag14 S8 Ag15 76.5(4) . . ?
Ag14 S8 Ag13 72.5(8) . . ?
Ag13 S8 Ag23 73.9(3) . . ?
Ag13 S8 Ag15 136.2(3) . . ?
C24 S8 Ag23 124.5(10) . . ?
C24 S8 Ag15 114.4(12) . . ?
C24 S8 Ag14 115.6(12) . . ?
C24 S8 Ag13 106.7(12) . . ?
C24 S8 Ag24 105.8(12) . . ?
C24 S8 Ag26 103.3(12) . . ?
Ag24 S8 Ag23 56.2(2) . . ?
Ag26 S8 Ag23 131.2(8) . . ?
Ag26 S8 Ag24 104.9(6) . . ?
Ag8 S7 Ag9 74.6(3) . . ?
Ag8 S7 Ag8A 147.9(3) . . ?
Ag8 S7 Ag7A 103.1(4) . . ?
Ag8 S7 Ag24 109.7(4) . . ?
Ag12 S7 Ag8 131.1(3) . . ?
Ag12 S7 Ag9 73.1(3) . . ?
Ag12 S7 Ag13 101.8(5) . . ?
Ag13 S7 Ag8 92.8(4) . . ?
Ag13 S7 Ag9 155.4(3) . . ?
Ag7A S7 Ag8A 73.1(4) . . ?
Ag7A S7 Ag24 112.8(4) . . ?
C32 S7 Ag8 111.2(12) . . ?
C32 S7 Ag9 96.6(15) . . ?
C32 S7 Ag12 108.2(11) . . ?
C32 S7 Ag13 107.7(15) . . ?
C32 S7 Ag8A 100.1(12) . . ?
C32 S7 Ag7A 107.3(13) . . ?
C32 S7 Ag24 112.3(16) . . ?
Ag24 S7 Ag8A 48.6(3) . . ?
S1 C2 H2 106.6 . . ?
C1 C2 S1 110.1(14) . . ?
C1 C2 H2 106.6 . . ?
C3 C2 S1 107.9(14) . . ?
C3 C2 H2 106.6 . . ?
C3 C2 C1 118(2) . . ?
S12 C51 H51 103.5 . . ?
C52 C51 S12 114.9(16) . . ?
C52 C51 H51 103.5 . . ?
C50 C51 S12 114.7(16) . . ?
C50 C51 H51 103.5 . . ?
C50 C51 C52 115(2) . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
S5 C27 H27 96.5 . . ?
S5 C27 H27A 113.3 . . ?
C26 C27 S5 135(4) . . ?
C26 C27 H27 96.5 . . ?
C28 C27 S5 117(3) . . ?
C28 C27 H27 96.5 . . ?
C28 C27 C26 104(4) . . ?
C29A C27 S5 107.1(17) . . ?
C29A C27 H27A 113.3 . . ?
C29A C27 C74A 106(3) . . ?
C74A C27 S5 102.4(18) . . ?
C74A C27 H27A 113.3 . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C51 C52 H52A 109.5 . . ?
C51 C52 H52B 109.5 . . ?
C51 C52 H52C 109.5 . . ?
H52A C52 H52B 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
S2 C5 H5A 97.3 . . ?
S2 C5 H5B 100.3 . . ?
C4 C5 S2 114(2) . . ?
C4 C5 H5A 97.3 . . ?
C6 C5 S2 114(3) . . ?
C6 C5 H5A 97.3 . . ?
C6 C5 C4 128(3) . . ?
C67A C5 S2 113(3) . . ?
C67A C5 H5B 100.3 . . ?
C67A C5 C44A 136(4) . . ?
C44A C5 S2 101(3) . . ?
C44A C5 H5B 100.3 . . ?
S9 C13 H13 108.0 . . ?
C12 C13 S9 116(2) . . ?
C12 C13 H13 108.0 . . ?
C12 C13 C14 108(3) . . ?
C14 C13 S9 109(2) . . ?
C14 C13 H13 108.0 . . ?
C51 C50 H50A 111.7 . . ?
C51 C50 H50B 104.4 . . ?
C51 C50 H50C 112.2 . . ?
H50A C50 H50B 109.5 . . ?
H50A C50 H50C 109.6 . . ?
H50B C50 H50C 109.3 . . ?
C27 C26 H26A 110.4 . . ?
C27 C26 H26B 108.0 . . ?
C27 C26 H26C 110.1 . . ?
H26A C26 H26B 109.5 . . ?
H26A C26 H26C 109.4 . . ?
H26B C26 H26C 109.4 . . ?
C13 C12 H12A 109.5 . . ?
C13 C12 H12B 109.5 . . ?
C13 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14B 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
S10 C54 H54 113.5 . . ?
S10 C54 H54A 101.6 . . ?
C53 C54 S10 100(4) . . ?
C53 C54 H54 113.5 . . ?
C53 C54 C55 108(6) . . ?
C55 C54 S10 107(4) . . ?
C55 C54 H54 113.5 . . ?
C54A C54 S10 118(3) . . ?
C54A C54 H54A 101.6 . . ?
C54A C54 C64A 112(4) . . ?
C64A C54 S10 118(3) . . ?
C64A C54 H54A 101.6 . . ?
C5 C4 H4A 109.5 . . ?
C5 C4 H4B 109.5 . . ?
C5 C4 H4C 109.5 . . ?
H4A C4 H4B 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C54 C53 H53A 98.3 . . ?
C54 C53 H53B 113.3 . . ?
C54 C53 H53C 116.1 . . ?
H53A C53 H53B 109.5 . . ?
H53A C53 H53C 109.4 . . ?
H53B C53 H53C 109.5 . . ?
C54 C55 H55A 123.7 . . ?
C54 C55 H55B 109.1 . . ?
C54 C55 H55C 94.1 . . ?
H55A C55 H55B 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6B 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C27 C28 H28A 107.9 . . ?
C27 C28 H28B 111.8 . . ?
C27 C28 H28C 108.7 . . ?
H28A C28 H28B 109.4 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
S13 Ag8A S7 106.0(3) . . ?
S13 Ag8A Ag7A 58.6(3) . . ?
S14 Ag8A S13 114.8(3) . . ?
S14 Ag8A S7 120.2(3) . . ?
S14 Ag8A Ag7A 132.6(3) . . ?
S7 Ag8A Ag7A 48.2(3) . . ?
Ag24 Ag8A S13 152.1(4) . . ?
Ag24 Ag8A S14 64.3(3) . . ?
Ag24 Ag8A S7 59.3(3) . . ?
Ag24 Ag8A Ag7A 100.3(4) . . ?
Ag24 Ag8A O22A 96.0(14) . . ?
O22A Ag8A S13 110.5(18) . . ?
O22A Ag8A S14 104(4) . . ?
O22A Ag8A S7 100(3) . . ?
O22A Ag8A Ag7A 122(4) . . ?
O7 Ag7A S7 97.1(4) . . ?
O7 Ag7A Ag8A 92.2(4) . . ?
O7 Ag7A Ag6A 102.0(4) . . ?
O7 Ag7A Ag4A 65.2(3) . . ?
S6 Ag7A O7 97.1(4) . . ?
S6 Ag7A S7 140.6(5) . . ?
S6 Ag7A Ag8A 156.3(4) . . ?
S6 Ag7A Ag6A 54.6(3) . . ?
S6 Ag7A Ag4A 79.2(4) . . ?
S7 Ag7A Ag8A 58.7(3) . . ?
S7 Ag7A Ag6A 86.5(4) . . ?
S7 Ag7A Ag4A 139.9(6) . . ?
Ag6A Ag7A Ag8A 143.9(4) . . ?
Ag6A Ag7A Ag4A 131.0(5) . . ?
Ag4A Ag7A Ag8A 85.1(5) . . ?
S6 Ag6A Ag10 51.2(2) . . ?
S6 Ag6A Ag7A 56.5(3) . . ?
S6 Ag6A O9A 171.4(15) . . ?
Ag7A Ag6A Ag10 96.9(3) . . ?
C30 Ag6A Ag10 109.7(10) . . ?
C30 Ag6A S6 158.1(11) . . ?
C30 Ag6A Ag7A 144.8(10) . . ?
C30 Ag6A O9A 28.0(11) . . ?
O9A Ag6A Ag10 129.1(18) . . ?
O9A Ag6A Ag7A 116.8(12) . . ?
S4 C16 H16 100.8 . . ?
S4 C16 H16A 106.7 . . ?
C17 C16 S4 114(3) . . ?
C17 C16 H16 100.8 . . ?
C15 C16 S4 117(2) . . ?
C15 C16 H16 100.8 . . ?
C15 C16 C17 118(3) . . ?
C1A C16 S4 109(3) . . ?
C1A C16 H16A 106.7 . . ?
C2A C16 S4 113(2) . . ?
C2A C16 H16A 106.7 . . ?
C2A C16 C1A 114(2) . . ?
S3 C10 H10 116.2 . . ?
S3 C10 H10A 105.0 . . ?
C11 C10 S3 109.9(19) . . ?
C11 C10 H10 116.2 . . ?
C9 C10 S3 104.0(19) . . ?
C9 C10 H10 116.2 . . ?
C9 C10 C11 91(3) . . ?
C32A C10 S3 114(3) . . ?
C32A C10 H10A 105.0 . . ?
C46A C10 S3 114(3) . . ?
C46A C10 H10A 105.0 . . ?
C46A C10 C32A 112(6) . . ?
S11 C40 H40 106.3 . . ?
S11 C40 H40A 94.4 . . ?
C39 C40 S11 114(3) . . ?
C39 C40 H40 106.3 . . ?
C39 C40 C41 117(3) . . ?
C41 C40 S11 106.8(19) . . ?
C41 C40 H40 106.3 . . ?
C27A C40 S11 104(5) . . ?
C27A C40 H40A 94.4 . . ?
C31A C40 S11 116(4) . . ?
C31A C40 H40A 94.4 . . ?
C31A C40 C27A 139(6) . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C40 C39 H39A 109.8 . . ?
C40 C39 H39B 104.6 . . ?
C40 C39 H39C 114.2 . . ?
H39A C39 H39B 109.4 . . ?
H39A C39 H39C 109.2 . . ?
H39B C39 H39C 109.4 . . ?
C40 C41 H41A 109.6 . . ?
C40 C41 H41B 111.4 . . ?
C40 C41 H41C 107.4 . . ?
H41A C41 H41B 109.5 . . ?
H41A C41 H41C 109.4 . . ?
H41B C41 H41C 109.5 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C9 H9A 108.4 . . ?
C10 C9 H9B 108.4 . . ?
C10 C9 H9C 111.6 . . ?
H9A C9 H9B 109.3 . . ?
H9A C9 H9C 109.6 . . ?
H9B C9 H9C 109.6 . . ?
Ag20 Ag4A Ag21 65.3(5) . . ?
S12 Ag4A Ag21 113.9(8) . . ?
S12 Ag4A Ag20 51.7(3) . . ?
S12 Ag4A Ag7A 132.8(9) . . ?
S13 Ag4A Ag21 50.0(4) . . ?
S13 Ag4A Ag20 115.3(9) . . ?
S13 Ag4A S12 158.3(10) . . ?
S13 Ag4A Ag7A 68.2(4) . . ?
Ag7A Ag4A Ag21 110.3(4) . . ?
Ag7A Ag4A Ag20 147.2(4) . . ?
S6 C48 H48 108.6 . . ?
S6 C48 H48A 106.8 . . ?
C49 C48 S6 121(3) . . ?
C49 C48 H48 108.6 . . ?
C49 C48 C47 106(2) . . ?
C47 C48 S6 103(3) . . ?
C47 C48 H48 108.6 . . ?
C4A C48 S6 112(2) . . ?
C4A C48 H48A 106.8 . . ?
C4A C48 C30A 112(2) . . ?
C30A C48 S6 112(2) . . ?
C30A C48 H48A 106.8 . . ?
S8 C24 H24 101.1 . . ?
S8 C24 H24A 105.6 . . ?
C23 C24 S8 119(5) . . ?
C23 C24 H24 101.1 . . ?
C23 C24 C25 89(7) . . ?
C25 C24 S8 140(5) . . ?
C25 C24 H24 101.1 . . ?
C9A C24 S8 105(2) . . ?
C9A C24 H24A 105.6 . . ?
C9A C24 C40A 126(4) . . ?
C40A C24 S8 108(2) . . ?
C40A C24 H24A 105.6 . . ?
S7 C32 H32 100.6 . . ?
S7 C32 H32A 96.3 . . ?
C31 C32 S7 115(3) . . ?
C31 C32 H32 100.6 . . ?
C33 C32 S7 116(3) . . ?
C33 C32 H32 100.6 . . ?
C33 C32 C31 119(4) . . ?
C41A C32 S7 110(4) . . ?
C41A C32 H32A 96.3 . . ?
C41A C32 C66A 127(5) . . ?
C66A C32 S7 119(4) . . ?
C66A C32 H32A 96.3 . . ?
C48 C49 H49A 110.9 . . ?
C48 C49 H49B 107.1 . . ?
C48 C49 H49C 110.5 . . ?
H49A C49 H49B 109.4 . . ?
H49A C49 H49C 109.5 . . ?
H49B C49 H49C 109.5 . . ?
C24 C23 H23A 120.8 . . ?
C24 C23 H23B 101.1 . . ?
C24 C23 H23C 106.0 . . ?
H23A C23 H23B 109.4 . . ?
H23A C23 H23C 109.4 . . ?
H23B C23 H23C 109.5 . . ?
C48 C47 H47A 110.0 . . ?
C48 C47 H47B 109.5 . . ?
C48 C47 H47C 109.1 . . ?
H47A C47 H47B 109.4 . . ?
H47A C47 H47C 109.4 . . ?
H47B C47 H47C 109.4 . . ?
C32 C31 H31A 107.8 . . ?
C32 C31 H31B 107.0 . . ?
C32 C31 H31C 113.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
H36A C36 H36B 109.4 . . ?
H36A C36 H36C 109.4 . . ?
H36B C36 H36C 109.6 . . ?
C37 C36 H36A 110.5 . . ?
C37 C36 H36B 102.7 . . ?
C37 C36 H36C 114.8 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C37 C38 H38A 110.0 . . ?
C37 C38 H38B 109.0 . . ?
C37 C38 H38C 109.3 . . ?
C32 C33 H33A 111.3 . . ?
C32 C33 H33B 107.3 . . ?
C32 C33 H33C 109.8 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.4 . . ?
H33B C33 H33C 109.5 . . ?
C22 O18 Ag7 118(5) . . ?
C43 O25 Ag21 114(3) . . ?
C43 O24 Ag22 132(3) . . ?
C24 C25 H25A 99.7 . . ?
C24 C25 H25B 130.8 . . ?
C24 C25 H25C 96.2 . . ?
H25A C25 H25B 109.6 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.4 . . ?
C20 O17 Ag15 122(3) . . ?
C36A O17 Ag15 148(7) . . ?
Ag3 Ag Ag27 56.8(6) . . ?
S9 Ag Ag3 121.8(18) . . ?
S9 Ag Ag27 80.0(7) . . ?
S10 Ag Ag3 51.1(7) . . ?
S10 Ag S9 144(3) . . ?
S10 Ag Ag27 107.7(10) . . ?
F5 C21 F6 106(3) . . ?
F5 C21 C22 106(3) . . ?
F6 C21 C22 107(3) . . ?
F4 C21 F5 112(2) . . ?
F4 C21 F6 97(3) . . ?
F4 C21 C22 126(3) . . ?
F8A C21 C22 106(3) . . ?
F8A C21 F28A 106(3) . . ?
F17A C21 C22 132(3) . . ?
F17A C21 F8A 109(3) . . ?
F17A C21 F28A 104(3) . . ?
F28A C21 C22 96(3) . . ?
O18 C22 C21 113(5) . . ?
O18 C22 O19 117(3) . . ?
O19 C22 C21 121(3) . . ?
O64A C22 C21 106(3) . . ?
O2A C22 C21 107(3) . . ?
O2A C22 O64A 131(6) . . ?
F15 C42 F14 103(4) . . ?
F15 C42 C43 104(3) . . ?
F13 C42 F15 106(3) . . ?
F13 C42 F14 110(5) . . ?
F13 C42 C43 127(4) . . ?
F14 C42 C43 104(4) . . ?
F1A C42 F29A 110(4) . . ?
F1A C42 C43 115(4) . . ?
F7A C42 F1A 100(2) . . ?
F7A C42 F29A 109(4) . . ?
F7A C42 C43 114(3) . . ?
F29A C42 C43 108(3) . . ?
H19A C19 H19B 109.4 . . ?
H19A C19 H19C 109.6 . . ?
H19B C19 H19C 109.4 . . ?
N1 C19 H19A 110.8 . . ?
N1 C19 H19B 110.5 . . ?
N1 C19 H19C 107.0 . . ?
C19 N1 C18 106(3) . . ?
C20 N1 C19 122(3) . . ?
C20 N1 C18 123(3) . . ?
F7 C29 F9 109(3) . . ?
F7 C29 F8 103(3) . . ?
F7 C29 C30 117(2) . . ?
F9 C29 F8 94(6) . . ?
F9 C29 C30 115(2) . . ?
F8 C29 C30 115(2) . . ?
F16A C29 F9A 106(2) . . ?
F16A C29 C30 97(3) . . ?
F19A C29 F16A 92(3) . . ?
F19A C29 F9A 109(2) . . ?
F19A C29 C30 142(3) . . ?
F9A C29 C30 104(3) . . ?
N1 C18 H18A 112.6 . . ?
N1 C18 H18B 106.5 . . ?
N1 C18 H18C 109.4 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.3 . . ?
C8 O16 Ag4 104(3) . . ?
F2 C7 C8 109.9(15) . . ?
F1 C7 F2 110(2) . . ?
F1 C7 F3 112(2) . . ?
F1 C7 C8 112.5(15) . . ?
F3 C7 F2 101(2) . . ?
F3 C7 C8 111.0(15) . . ?
F6A C7 F3A 111(2) . . ?
F6A C7 F4A 110(2) . . ?
F6A C7 C8 112.4(15) . . ?
F3A C7 F4A 102(2) . . ?
F3A C7 C8 111.2(14) . . ?
F4A C7 C8 109.3(14) . . ?
O25 C43 O24 126(4) . . ?
O25 C43 C42 115(3) . . ?
O24 C43 C42 114(3) . . ?
O24A C43 C42 104(7) . . ?
O24A C43 O25A 114(4) . . ?
O25A C43 C42 102(7) . . ?
O16 C8 O15 122(3) . . ?
O16 C8 C7 121(3) . . ?
O15 C8 C7 113(2) . . ?
O15A C8 C7 116(3) . . ?
O15A C8 O16A 123(4) . . ?
O16A C8 C7 115(3) . . ?
C22 O64A Ag26 120(3) . . ?
C22 O2A Ag7 110(5) . . ?
C32 C41A H41D 110.7 . . ?
C32 C41A H41E 109.8 . . ?
C32 C41A H41F 107.9 . . ?
H41D C41A H41E 109.4 . . ?
H41D C41A H41F 109.5 . . ?
H41E C41A H41F 109.4 . . ?
C32 C66A H66A 111.4 . . ?
C32 C66A H66B 110.4 . . ?
C32 C66A H66C 106.5 . . ?
H66A C66A H66B 109.5 . . ?
H66A C66A H66C 109.6 . . ?
H66B C66A H66C 109.4 . . ?
S14 C37 H37 115.9 . . ?
S14 C37 H37A 119.3 . . ?
C36 C37 S14 98(3) . . ?
C36 C37 H37 115.9 . . ?
C38 C37 S14 98(3) . . ?
C38 C37 C36 110(4) . . ?
C38 C37 H37 115.9 . . ?
C28A C37 S14 104(4) . . ?
C28A C37 H37A 119.3 . . ?
C28A C37 C17A 94(5) . . ?
C17A C37 S14 96(4) . . ?
C17A C37 H37A 119.3 . . ?
C10 C32A H32B 110.2 . . ?
C10 C32A H32C 107.3 . . ?
C10 C32A H32D 110.9 . . ?
H32B C32A H32C 109.4 . . ?
H32B C32A H32D 109.5 . . ?
H32C C32A H32D 109.5 . . ?
C10 C46A H46A 112.9 . . ?
C10 C46A H46B 108.3 . . ?
C10 C46A H46C 107.1 . . ?
H46A C46A H46B 109.5 . . ?
H46A C46A H46C 109.4 . . ?
H46B C46A H46C 109.5 . . ?
C37 C28A H28D 109.0 . . ?
C37 C28A H28E 118.9 . . ?
C37 C28A H28F 100.1 . . ?
H28D C28A H28E 109.4 . . ?
H28D C28A H28F 109.4 . . ?
H28E C28A H28F 109.6 . . ?
C37 C17A H17D 112.1 . . ?
C37 C17A H17E 110.6 . . ?
C37 C17A H17F 105.7 . . ?
H17D C17A H17E 109.5 . . ?
H17D C17A H17F 109.5 . . ?
H17E C17A H17F 109.4 . . ?
C40 C27A H27B 108.7 . . ?
C40 C27A H27C 106.9 . . ?
C40 C27A H27D 112.9 . . ?
H27B C27A H27C 109.5 . . ?
H27B C27A H27D 109.4 . . ?
H27C C27A H27D 109.4 . . ?
C40 C31A H31D 96.9 . . ?
C40 C31A H31E 116.1 . . ?
C40 C31A H31F 114.8 . . ?
H31D C31A H31E 109.2 . . ?
H31D C31A H31F 109.5 . . ?
H31E C31A H31F 109.4 . . ?
Ag23 Ag24 S8 64.7(2) . . ?
S14 Ag24 Ag23 54.1(2) . . ?
S14 Ag24 S8 110.3(3) . . ?
S7 Ag24 Ag23 135.8(3) . . ?
S7 Ag24 S14 132.1(4) . . ?
S7 Ag24 S8 113.9(5) . . ?
Ag8A Ag24 Ag23 112.4(4) . . ?
Ag8A Ag24 S14 64.5(4) . . ?
Ag8A Ag24 S8 173.8(5) . . ?
Ag8A Ag24 S7 72.1(3) . . ?
C5 C67A H67A 108.2 . . ?
C5 C67A H67B 113.2 . . ?
C5 C67A H67C 107.0 . . ?
H67A C67A H67B 109.5 . . ?
H67A C67A H67C 109.4 . . ?
H67B C67A H67C 109.4 . . ?
C5 C44A H44A 108.9 . . ?
C5 C44A H44B 101.6 . . ?
C5 C44A H44C 117.7 . . ?
H44A C44A H44B 109.4 . . ?
H44A C44A H44C 109.5 . . ?
H44B C44A H44C 109.3 . . ?
C30 O21 Ag9 118(3) . . ?
C29 C30 Ag6A 146.9(17) . . ?
O21 C30 C29 106(2) . . ?
O20 C30 C29 109(3) . . ?
O20 C30 O21 104(4) . . ?
O66A C30 Ag6A 113(4) . . ?
O66A C30 C29 95(4) . . ?
O9A C30 Ag6A 92(5) . . ?
O9A C30 C29 96(4) . . ?
O9A C30 O66A 110(4) . . ?
C30 O20 Ag8 143(3) . . ?
C30 O66A Ag2 133(6) . 3_666 ?
Ag8 O9A Ag6A 90(3) . . ?
C30 O9A Ag8 143(6) . . ?
C30 O9A Ag6A 60(4) . . ?
F12 C34 F11 111(3) . . ?
F12 C34 F10 113(3) . . ?
F12 C34 C35 106.8(18) . . ?
F11 C34 C35 106.2(18) . . ?
F10 C34 F11 113(3) . . ?
F10 C34 C35 105.9(18) . . ?
F12A C34 F10A 111(3) . . ?
F12A C34 C35 106.6(19) . . ?
F11A C34 F12A 113(3) . . ?
F11A C34 F10A 113(3) . . ?
F11A C34 C35 107.0(19) . . ?
F10A C34 C35 106.3(19) . . ?
O17 C20 H20 126.3 . . ?
N1 C20 O17 107(4) . . ?
N1 C20 H20 126.3 . . ?
O17 C36A H36D 103.9 . . ?
N18A C36A O17 152(10) . . ?
N18A C36A H36D 103.9 . . ?
H35A C35A H35B 109.5 . . ?
H35A C35A H35C 109.5 . . ?
H35B C35A H35C 109.5 . . ?
N18A C35A H35A 109.6 . . ?
N18A C35A H35B 117.8 . . ?
N18A C35A H35C 100.5 . . ?
C36A N18A C35A 122(7) . . ?
C36A N18A C38A 122(7) . . ?
C35A N18A C38A 109(3) . . ?
N18A C38A H38D 103.6 . . ?
N18A C38A H38E 114.5 . . ?
N18A C38A H38F 110.1 . . ?
H38D C38A H38E 109.4 . . ?
H38D C38A H38F 109.5 . . ?
H38E C38A H38F 109.4 . . ?
S11 Ag25 Ag21 49.2(5) . . ?
S11 Ag25 S10 88.5(13) . . ?
S14 Ag25 Ag21 94.7(14) . . ?
S14 Ag25 S11 138.5(10) . . ?
S14 Ag25 S10 124.9(16) . . ?
S10 Ag25 Ag21 137.7(9) . . ?
Ag7 Ag26 Ag15 67.2(3) . . ?
S5 Ag26 Ag7 54.9(4) . . ?
S5 Ag26 Ag15 115.6(8) . . ?
S5 Ag26 S8 138.1(14) . . ?
S8 Ag26 Ag7 117.4(7) . . ?
S8 Ag26 Ag15 53.5(3) . . ?
O64A Ag26 Ag7 76.5(12) . . ?
O64A Ag26 Ag15 88.8(15) . . ?
O64A Ag26 S5 101.8(16) . . ?
O64A Ag26 S8 116.9(19) . . ?
C16 C15 H15A 111.8 . . ?
C16 C15 H15B 103.2 . . ?
C16 C15 H15C 113.1 . . ?
H15A C15 H15B 109.6 . . ?
H15A C15 H15C 109.4 . . ?
H15B C15 H15C 109.5 . . ?
C16 C1A H1AA 107.5 . . ?
C16 C1A H1AB 110.3 . . ?
C16 C1A H1AC 110.4 . . ?
H1AA C1A H1AB 109.6 . . ?
H1AA C1A H1AC 109.4 . . ?
H1AB C1A H1AC 109.6 . . ?
C16 C2A H2AA 108.7 . . ?
C16 C2A H2AB 109.8 . . ?
C16 C2A H2AC 109.9 . . ?
H2AA C2A H2AB 109.4 . . ?
H2AA C2A H2AC 109.5 . . ?
H2AB C2A H2AC 109.5 . . ?
S13 C45 H45 93.4 . . ?
S13 C45 H45A 101.9 . . ?
C46 C45 S13 110(3) . . ?
C46 C45 H45 93.4 . . ?
C46 C45 C44 138(4) . . ?
C44 C45 S13 111(3) . . ?
C44 C45 H45 93.4 . . ?
C16A C45 S13 112(3) . . ?
C16A C45 H45A 101.9 . . ?
C16A C45 C33A 125(4) . . ?
C33A C45 S13 110(3) . . ?
C33A C45 H45A 101.9 . . ?
C45 C46 H46D 109.5 . . ?
C45 C46 H46E 109.5 . . ?
C45 C46 H46F 109.5 . . ?
H46D C46 H46E 109.5 . . ?
H46D C46 H46F 109.5 . . ?
H46E C46 H46F 109.5 . . ?
C45 C44 H44D 109.5 . . ?
C45 C44 H44E 109.5 . . ?
C45 C44 H44F 109.5 . . ?
H44D C44 H44E 109.5 . . ?
H44D C44 H44F 109.5 . . ?
H44E C44 H44F 109.5 . . ?
C45 C16A H16B 109.5 . . ?
C45 C16A H16C 109.5 . . ?
C45 C16A H16D 109.5 . . ?
H16B C16A H16C 109.5 . . ?
H16B C16A H16D 109.5 . . ?
H16C C16A H16D 109.5 . . ?
C45 C33A H33D 109.6 . . ?
C45 C33A H33E 109.6 . . ?
C45 C33A H33F 109.3 . . ?
H33D C33A H33E 109.5 . . ?
H33D C33A H33F 109.6 . . ?
H33E C33A H33F 109.4 . . ?
C27 C29A H29A 109.5 . . ?
C27 C29A H29B 109.5 . . ?
C27 C29A H29C 109.5 . . ?
H29A C29A H29B 109.5 . . ?
H29A C29A H29C 109.5 . . ?
H29B C29A H29C 109.5 . . ?
C27 C74A H74A 109.4 . . ?
C27 C74A H74B 109.6 . . ?
C27 C74A H74C 109.5 . . ?
H74A C74A H74B 109.5 . . ?
H74A C74A H74C 109.4 . . ?
H74B C74A H74C 109.4 . . ?
C48 C4A H4AA 109.0 . . ?
C48 C4A H4AB 109.9 . . ?
C48 C4A H4AC 109.6 . . ?
H4AA C4A H4AB 109.5 . . ?
H4AA C4A H4AC 109.5 . . ?
H4AB C4A H4AC 109.4 . . ?
C48 C30A H30A 110.1 . . ?
C48 C30A H30B 131.1 . . ?
C48 C30A H30C 83.2 . . ?
H30A C30A H30B 109.4 . . ?
H30A C30A H30C 109.5 . . ?
H30B C30A H30C 109.3 . . ?
Ag3 Ag27 Ag10 85.8(7) . 3_666 ?
Ag3 Ag27 Ag 56.3(9) . . ?
S3 Ag27 Ag10 55.4(7) . 3_666 ?
S3 Ag27 Ag3 121.9(9) . . ?
S3 Ag27 S2 102.0(12) . . ?
S3 Ag27 Ag 115.8(16) . . ?
S3 Ag27 O15A 126.7(17) . . ?
S2 Ag27 Ag10 47.1(6) . 3_666 ?
S2 Ag27 Ag3 50.2(5) . . ?
S2 Ag27 Ag 106.5(11) . . ?
O15A Ag27 Ag3 105(3) . . ?
O15A Ag27 S2 128.1(15) . . ?
O15A Ag27 Ag 70(4) . . ?
C24 C9A H9AA 109.9 . . ?
C24 C9A H9AB 110.1 . . ?
C24 C9A H9AC 108.4 . . ?
H9AA C9A H9AB 109.5 . . ?
H9AA C9A H9AC 109.4 . . ?
H9AB C9A H9AC 109.5 . . ?
C24 C40A H40B 109.5 . . ?
C24 C40A H40C 109.5 . . ?
C24 C40A H40D 109.5 . . ?
H40B C40A H40C 109.5 . . ?
H40B C40A H40D 109.5 . . ?
H40C C40A H40D 109.5 . . ?
C54 C54A H54B 109.5 . . ?
C54 C54A H54C 109.5 . . ?
C54 C54A H54D 109.5 . . ?
H54B C54A H54C 109.5 . . ?
H54B C54A H54D 109.5 . . ?
H54C C54A H54D 109.5 . . ?
C54 C64A H64A 106.5 . . ?
C54 C64A H64B 84.3 . . ?
C54 C64A H64C 133.7 . . ?
H64A C64A H64B 109.5 . . ?
H64A C64A H64C 109.5 . . ?
H64B C64A H64C 109.4 . . ?
C8 O15A Ag27 92(4) . . ?
C35 O22 Ag22 136(4) . . ?
O22 C35 C34 113(3) . . ?
O22 C35 O23 124(4) . . ?
O23 C35 C34 111(3) . . ?
O23A C35 C34 112(3) . . ?
O22A C35 C34 114(3) . . ?
O22A C35 O23A 130(5) . . ?
C35 O22A Ag8A 109(5) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Ag5 S12 C51 C52 -146.7(18) 3_666 . . . ?
Ag5 S12 C51 C50 -11(3) 3_666 . . . ?
Ag5 S3 C10 C11 145(2) . . . . ?
Ag5 S3 C10 C9 -119(2) . . . . ?
Ag5 S3 C10 C32A 85(5) . . . . ?
Ag5 S3 C10 C46A -46(5) . . . . ?
Ag6 S12 C51 C52 137(2) 3_666 . . . ?
Ag6 S12 C51 C50 -87(2) 3_666 . . . ?
Ag6 S4 C16 C17 34(3) . . . . ?
Ag6 S4 C16 C15 -110(3) . . . . ?
Ag6 S4 C16 C1A 61(3) . . . . ?
Ag6 S4 C16 C2A -171(3) . . . . ?
Ag6 O27 C57 O26 -32(4) 3_666 . . . ?
Ag6 O27 C57 C56 151.0(13) 3_666 . . . ?
Ag19 S11 C40 C39 109(3) . . . . ?
Ag19 S11 C40 C41 -121(2) . . . . ?
Ag19 S11 C40 C27A 140(6) . . . . ?
Ag19 S11 C40 C31A -53(6) . . . . ?
Ag19 S1 C2 C1 177.2(15) . . . . ?
Ag19 S1 C2 C3 -52.1(18) . . . . ?
Ag19 O2 V1 V3 36.0(6) . . . 3_666 ?
Ag19 O2 V1 V4 121.7(7) . . . . ?
Ag19 O2 V1 V5 160.1(4) . . . . ?
Ag19 O2 V1 O5 112.6(4) . . . . ?
Ag19 O2 V1 O3 90.8(10) . . . . ?
Ag19 O2 V1 O8 36.9(5) . . . 3_666 ?
Ag19 O2 V1 O10 -168.3(4) . . . . ?
Ag19 O2 V1 O1 -63.2(6) . . . . ?
Ag16 S4 C16 C17 124(3) . . . . ?
Ag16 S4 C16 C15 -21(3) . . . . ?
Ag16 S4 C16 C1A 150(2) . . . . ?
Ag16 S4 C16 C2A -82(3) . . . . ?
Ag16 S3 C10 C11 60(2) . . . . ?
Ag16 S3 C10 C9 157(2) . . . . ?
Ag16 S3 C10 C32A 0(5) . . . . ?
Ag16 S3 C10 C46A -131(4) . . . . ?
Ag16 S9 C13 C12 -157(3) . . . . ?
Ag16 S9 C13 C14 -35(3) . . . . ?
Ag16 O10 V1 V3 -79.1(6) . . . 3_666 ?
Ag16 O10 V1 V4 157.5(5) . . . . ?
Ag16 O10 V1 V5 -165.1(9) . . . . ?
Ag16 O10 V1 O5 -155.2(6) . . . . ?
Ag16 O10 V1 O3 -79.3(5) . . . . ?
Ag16 O10 V1 O8 -129.3(8) . . . 3_666 ?
Ag16 O10 V1 O2 124.8(5) . . . . ?
Ag16 O10 V1 O1 19.4(6) . . . . ?
Ag1 S1 C2 C1 47.3(18) . . . . ?
Ag1 S1 C2 C3 178.0(15) . . . . ?
Ag1 S5 C27 C26 -84(7) 3_666 . . . ?
Ag1 S5 C27 C28 123(5) 3_666 . . . ?
Ag1 S5 C27 C29A -82(3) 3_666 . . . ?
Ag1 S5 C27 C74A 166(2) 3_666 . . . ?
Ag7 S4 C16 C17 -59(3) . . . . ?
Ag7 S4 C16 C15 156(3) . . . . ?
Ag7 S4 C16 C1A -33(3) . . . . ?
Ag7 S4 C16 C2A 95(3) . . . . ?
Ag7 S5 C27 C26 20(7) . . . . ?
Ag7 S5 C27 C28 -134(5) . . . . ?
Ag7 S5 C27 C29A 21(3) . . . . ?
Ag7 S5 C27 C74A -91(2) . . . . ?
Ag7 O18 C22 C21 -179(2) . . . . ?
Ag7 O18 C22 O19 33(6) . . . . ?
Ag21 S11 C40 C39 -74(3) . . . . ?
Ag21 S11 C40 C41 56(3) . . . . ?
Ag21 S11 C40 C27A -43(6) . . . . ?
Ag21 S11 C40 C31A 124(5) . . . . ?
Ag21 S13 C45 C46 -25(4) . . . . ?
Ag21 S13 C45 C44 145(4) . . . . ?
Ag21 S13 C45 C16A -67(4) . . . . ?
Ag21 S13 C45 C33A 77(4) . . . . ?
Ag21 O25 C43 O24 30(8) . . . . ?
Ag21 O25 C43 C42 -175(3) . . . . ?
Ag20 S12 C51 C52 44(2) . . . . ?
Ag20 S12 C51 C50 180(2) . . . . ?
Ag20 S11 C40 C39 -170(3) . . . . ?
Ag20 S11 C40 C41 -40(3) . . . . ?
Ag20 S11 C40 C27A -139(6) . . . . ?
Ag20 S11 C40 C31A 29(6) . . . . ?
Ag20 O26 C57 O27 -17(4) . . . . ?
Ag20 O26 C57 C56 159.8(14) . . . . ?
Ag10 S3 C10 C11 -137(2) 3_666 . . . ?
Ag10 S3 C10 C9 -41(2) 3_666 . . . ?
Ag10 S3 C10 C32A 163(5) 3_666 . . . ?
Ag10 S3 C10 C46A 32(5) 3_666 . . . ?
Ag10 S2 C5 C4 -162(3) 3_666 . . . ?
Ag10 S2 C5 C6 41(4) 3_666 . . . ?
Ag10 S2 C5 C67A -14(4) 3_666 . . . ?
Ag10 S2 C5 C44A 137(3) 3_666 . . . ?
Ag10 S6 C48 C49 40(4) . . . . ?
Ag10 S6 C48 C47 -78(4) . . . . ?
Ag10 S6 C48 C4A -27(3) . . . . ?
Ag10 S6 C48 C30A 100(2) . . . . ?
Ag23 S9 C13 C12 66(3) . . . . ?
Ag23 S9 C13 C14 -172(2) . . . . ?
Ag23 S8 C24 C23 146(7) . . . . ?
Ag23 S8 C24 C25 18(10) . . . . ?
Ag23 S8 C24 C9A -167(3) . . . . ?
Ag23 S8 C24 C40A 56(3) . . . . ?
Ag18 S11 C40 C39 25(4) . . . . ?
Ag18 S11 C40 C41 155(2) . . . . ?
Ag18 S10 C54 C53 16(5) . . . . ?
Ag18 S10 C54 C55 129(6) . . . . ?
Ag17 S9 C13 C12 -12(3) . . . . ?
Ag17 S9 C13 C14 109(2) . . . . ?
Ag17 S10 C54 C53 95(5) . . . . ?
Ag17 S10 C54 C55 -152(6) . . . . ?
V2 V4 O7 V3 -54.3(4) 3_666 . . . ?
V2 V4 O7 Ag7A 158.0(5) 3_666 . . . ?
V2 V4 O11 V5 1.0(7) 3_666 . . . ?
V2 V5 O11 V4 0.9(7) . . . . ?
V2 V5 O10 Ag16 112.0(4) . . . . ?
V2 V5 O10 V1 -54.9(4) . . . . ?
V2 V5 O14 Ag14 132.1(8) . . . . ?
Ag11 S12 C51 C52 -64(2) . . . . ?
Ag11 S12 C51 C50 72(2) . . . . ?
Ag11 S13 C45 C46 103(4) . . . . ?
Ag11 S13 C45 C44 -87(4) . . . . ?
Ag11 S6 C48 C49 -105(4) . . . . ?
Ag11 S6 C48 C47 136(4) . . . . ?
V3 V4 O7 Ag7A -147.8(8) . . . . ?
V3 V4 O11 V5 -46.5(4) . . . . ?
V3 V5 O11 V4 46.1(4) . . . . ?
V3 V5 O10 Ag16 155.9(2) . . . . ?
V3 V5 O10 V1 -11.0(6) . . . . ?
V3 V5 O14 Ag14 46.9(12) . . . . ?
Ag3 S10 C54 C53 175(5) . . . . ?
Ag3 S10 C54 C55 -72(6) . . . . ?
Ag3 S10 C54 C54A -177(5) . . . . ?
Ag3 S10 C54 C64A -37(6) . . . . ?
Ag3 S2 C5 C4 21(4) . . . . ?
Ag3 S2 C5 C6 -136(4) . . . . ?
Ag3 S2 C5 C67A 169(4) . . . . ?
Ag3 S2 C5 C44A -40(3) . . . . ?
Ag8 S5 C27 C26 -168(6) . . . . ?
Ag8 S5 C27 C28 39(5) . . . . ?
Ag8 S5 C27 C29A -166(2) . . . . ?
Ag8 S5 C27 C74A 82(2) . . . . ?
Ag8 S7 C32 C31 -3(5) . . . . ?
Ag8 S7 C32 C33 142(5) . . . . ?
Ag8 S7 C32 C41A -71(5) . . . . ?
Ag8 S7 C32 C66A 89(5) . . . . ?
V4 V2 O8 V3 142.5(3) 3_666 . . . ?
V4 V2 O8 V1 32.0(3) 3_666 . . 3_666 ?
V4 V2 O12 Ag6 -36.3(9) 3_666 . . . ?
V4 V2 O12 V5 -177.9(2) 3_666 . . . ?
V4 V3 O7 Ag7A 150.7(8) . . . . ?
V4 V3 O13 Ag8 -106.5(4) . . . . ?
V4 V3 O13 V5 39.8(4) . . . . ?
V4 V3 O9 Ag2 158.0(3) . . . 3_666 ?
V4 V5 O10 Ag16 -154.9(4) . . . . ?
V4 V5 O10 V1 38.2(4) . . . . ?
V4 V5 O14 Ag14 -44.2(14) . . . . ?
V4 O2 V1 V3 -85.7(5) . . . 3_666 ?
V4 O2 V1 V5 38.5(4) . . . . ?
V4 O2 V1 O5 -9.0(4) . . . . ?
V4 O2 V1 O3 -30.8(12) . . . . ?
V4 O2 V1 O8 -84.7(5) . . . 3_666 ?
V4 O2 V1 O10 70.1(5) . . . . ?
V4 O2 V1 O1 175.1(5) . . . . ?
V5 V2 O8 V3 -32.8(3) . . . . ?
V5 V2 O8 V1 -143.2(3) . . . 3_666 ?
V5 V2 O6 V4 177.7(2) . . . 3_666 ?
V5 V2 O12 Ag6 141.6(8) . . . . ?
V5 V3 O7 V4 -37.9(4) . . . . ?
V5 V3 O7 Ag7A 112.8(4) . . . . ?
V5 V3 O13 Ag8 -146.3(8) . . . . ?
V5 V3 O9 Ag2 66.0(7) . . . 3_666 ?
V5 V4 O7 V3 38.8(4) . . . . ?
V5 V4 O7 Ag7A -108.9(5) . . . . ?
V5 O10 V1 V3 86.0(5) . . . 3_666 ?
V5 O10 V1 V4 -37.4(4) . . . . ?
V5 O10 V1 O5 9.9(4) . . . . ?
V5 O10 V1 O3 85.8(5) . . . . ?
V5 O10 V1 O8 35.8(11) . . . 3_666 ?
V5 O10 V1 O2 -70.0(5) . . . . ?
V5 O10 V1 O1 -175.5(5) . . . . ?
Ag2 S1 C2 C1 -55.5(18) . . . . ?
Ag2 S1 C2 C3 75.2(17) . . . . ?
Ag2 S2 C5 C4 -62(3) . . . . ?
Ag2 S2 C5 C6 141(4) . . . . ?
Ag2 S2 C5 C67A 86(4) . . . . ?
Ag2 S2 C5 C44A -123(3) . . . . ?
Ag15 S4 C16 C17 -146(3) . . . . ?
Ag15 S4 C16 C15 69(3) . . . . ?
Ag15 S4 C16 C1A -120(3) . . . . ?
Ag15 S4 C16 C2A 9(3) . . . . ?
Ag15 S8 C24 C23 32(8) . . . . ?
Ag15 S8 C24 C25 -96(10) . . . . ?
Ag15 S8 C24 C9A 79(3) . . . . ?
Ag15 S8 C24 C40A -57(3) . . . . ?
Ag15 O17 C20 N1 -179(3) . . . . ?
Ag15 O17 C36A N18A -178(26) . . . . ?
Ag4 S3 C10 C11 -37(2) . . . . ?
Ag4 S3 C10 C9 59(2) . . . . ?
Ag4 O16 C8 O15 11(6) . . . . ?
Ag4 O16 C8 C7 168(2) . . . . ?
Ag14 S5 C27 C26 108(6) . . . . ?
Ag14 S5 C27 C28 -45(5) . . . . ?
Ag14 S8 C24 C23 -55(8) . . . . ?
Ag14 S8 C24 C25 178(10) . . . . ?
Ag22 S13 C45 C46 -100(4) . . . . ?
Ag22 S13 C45 C44 70(4) . . . . ?
Ag22 O24 C43 O25 -35(9) . . . . ?
Ag22 O24 C43 C42 171(2) . . . . ?
Ag22 O22 C35 C34 -150(11) . . . . ?
Ag22 O22 C35 O23 -11(21) . . . . ?
O5 V2 O8 V3 14.2(4) . . . . ?
O5 V2 O8 V3 95.5(4) 3_666 . . . ?
O5 V2 O8 V1 -15.0(4) 3_666 . . 3_666 ?
O5 V2 O8 V1 -96.2(4) . . . 3_666 ?
O5 V2 O6 V4 -1.1(4) 3_666 . . 3_666 ?
O5 V2 O6 V4 -0.9(19) . . . 3_666 ?
O5 V2 O12 Ag6 143.3(5) . . . . ?
O5 V2 O12 Ag6 145.9(14) 3_666 . . . ?
O5 V2 O12 V5 1.7(4) . . . . ?
O5 V2 O12 V5 4(2) 3_666 . . . ?
O5 V3 O7 V4 9.2(4) . . . . ?
O5 V3 O7 Ag7A 159.9(5) . . . . ?
O5 V3 O13 Ag8 -154.3(5) . . . . ?
O5 V3 O13 V5 -7.9(4) . . . . ?
O5 V4 O7 V3 -9.0(4) . . . . ?
O5 V4 O7 Ag7A -156.8(6) . . . . ?
O5 V4 O11 V5 0.1(5) . . . . ?
O5 V5 O11 V4 -0.1(5) . . . . ?
O5 V5 O10 Ag16 157.1(5) . . . . ?
O5 V5 O10 V1 -9.8(4) . . . . ?
O3 V2 O8 V3 54.6(10) . . . . ?
O3 V2 O8 V1 -55.8(10) . . . 3_666 ?
O3 V2 O6 V4 79.1(4) . . . 3_666 ?
O3 V2 O12 Ag6 63.1(5) . . . . ?
O3 V2 O12 V5 -78.5(5) . . . . ?
O3 V3 O7 V4 85.8(5) 3_666 . . . ?
O3 V3 O7 Ag7A -123.5(5) 3_666 . . . ?
O3 V3 O13 Ag8 -173.3(7) 3_666 . . . ?
O3 V3 O13 V5 -26.9(12) 3_666 . . . ?
O3 V3 O9 Ag2 -107.4(6) 3_666 . . 3_666 ?
O8 V2 O6 V4 -80.6(4) . . . 3_666 ?
O8 V2 O12 Ag6 -137.2(5) . . . . ?
O8 V2 O12 V5 81.2(5) . . . . ?
O8 V3 O7 V4 33.7(12) . . . . ?
O8 V3 O7 Ag7A -175.6(7) . . . . ?
O8 V3 O13 Ag8 129.8(5) . . . . ?
O8 V3 O13 V5 -83.8(5) . . . . ?
O8 V3 O9 Ag2 -30.2(6) . . . 3_666 ?
O6 V2 O8 V3 -179.3(4) . . . . ?
O6 V2 O8 V1 70.3(5) . . . 3_666 ?
O6 V2 O12 Ag6 -36.8(6) . . . . ?
O6 V2 O12 V5 -178.4(4) . . . . ?
O6 V4 O7 V3 -85.3(5) 3_666 . . . ?
O6 V4 O7 Ag7A 126.9(5) 3_666 . . . ?
O6 V4 O11 V5 4.7(14) 3_666 . . . ?
O7 V3 O13 Ag8 -74.8(5) . . . . ?
O7 V3 O13 V5 71.6(5) . . . . ?
O7 V3 O9 Ag2 161.9(5) . . . 3_666 ?
O7 V4 O11 V5 -78.2(5) . . . . ?
O2 V4 O7 V3 -27.7(11) . . . . ?
O2 V4 O7 Ag7A -175.5(7) . . . . ?
O2 V4 O11 V5 77.2(5) . . . . ?
O12 V2 O8 V3 -71.4(4) . . . . ?
O12 V2 O8 V1 178.1(4) . . . 3_666 ?
O12 V2 O6 V4 179.5(4) . . . 3_666 ?
O12 V5 O11 V4 5.9(14) . . . . ?
O12 V5 O10 Ag16 80.5(4) . . . . ?
O12 V5 O10 V1 -86.4(5) . . . . ?
O12 V5 O14 Ag14 131.7(10) . . . . ?
O11 V4 O7 V3 72.4(5) . . . . ?
O11 V4 O7 Ag7A -75.4(6) . . . . ?
O11 V5 O10 Ag16 -121.4(5) . . . . ?
O11 V5 O10 V1 71.7(5) . . . . ?
O11 V5 O14 Ag14 -45.5(11) . . . . ?
O10 V5 O11 V4 -78.0(5) . . . . ?
O10 V5 O14 Ag14 -141.7(10) . . . . ?
O4 V4 O7 V3 176.6(5) . . . . ?
O4 V4 O7 Ag7A 28.8(6) . . . . ?
O4 V4 O11 V5 -180.0(6) . . . . ?
O13 V3 O7 V4 -70.3(5) . . . . ?
O13 V3 O7 Ag7A 80.5(5) . . . . ?
O13 V3 O9 Ag2 63.1(6) . . . 3_666 ?
O13 V5 O11 V4 77.6(5) . . . . ?
O13 V5 O10 Ag16 139.8(8) . . . . ?
O13 V5 O10 V1 -27.1(12) . . . . ?
O13 V5 O14 Ag14 48.1(11) . . . . ?
O9 V3 O7 V4 -175.2(5) . . . . ?
O9 V3 O7 Ag7A -24.4(6) . . . . ?
O9 V3 O13 Ag8 30.1(6) . . . . ?
O9 V3 O13 V5 176.4(5) . . . . ?
O14 V5 O11 V4 178.5(6) . . . . ?
O14 V5 O10 Ag16 -16.5(6) . . . . ?
O14 V5 O10 V1 176.6(5) . . . . ?
O27 C57 C56 F16 82(3) . . . . ?
O27 C57 C56 F17 -164(2) . . . . ?
O27 C57 C56 F18 -45(3) . . . . ?
O27 C57 C56 F01{ 151(3) . . . . ?
O27 C57 C56 F0 -107(3) . . . . ?
O27 C57 C56 F19 40(4) . . . . ?
O26 C57 C56 F16 -95(3) . . . . ?
O26 C57 C56 F17 19(3) . . . . ?
O26 C57 C56 F18 138(3) . . . . ?
O26 C57 C56 F01{ -26(4) . . . . ?
O26 C57 C56 F0 76(4) . . . . ?
O26 C57 C56 F19 -138(3) . . . . ?
V1 V3 O7 V4 86.2(5) 3_666 . . . ?
V1 V3 O7 Ag7A -123.0(4) 3_666 . . . ?
V1 V3 O13 Ag8 129.1(3) 3_666 . . . ?
V1 V3 O13 V5 -84.6(5) 3_666 . . . ?
V1 V3 O9 Ag2 -68.0(5) 3_666 . . 3_666 ?
V1 V4 O7 V3 -10.2(6) . . . . ?
V1 V4 O7 Ag7A -158.0(4) . . . . ?
V1 V4 O11 V5 46.5(4) . . . . ?
V1 V5 O11 V4 -46.8(4) . . . . ?
V1 V5 O10 Ag16 166.9(8) . . . . ?
V1 V5 O14 Ag14 -139.1(8) . . . . ?
Ag9 S6 C48 C49 152(4) . . . . ?
Ag9 S6 C48 C47 34(4) . . . . ?
Ag9 S7 C32 C31 -79(4) . . . . ?
Ag9 S7 C32 C33 66(5) . . . . ?
Ag9 O21 C30 C29 -168(2) . . . . ?
Ag9 O21 C30 O20 -54(4) . . . . ?
Ag12 S13 C45 C46 -176(4) . . . . ?
Ag12 S13 C45 C44 -5(4) . . . . ?
Ag12 S7 C32 C31 -153(4) . . . . ?
Ag12 S7 C32 C33 -8(5) . . . . ?
Ag13 S8 C24 C23 -133(7) . . . . ?
Ag13 S8 C24 C25 100(10) . . . . ?
Ag13 S7 C32 C31 97(4) . . . . ?
Ag13 S7 C32 C33 -117(5) . . . . ?
Ag8A S13 C45 C16A -175(4) . . . . ?
Ag8A S13 C45 C33A -31(4) . . . . ?
Ag8A S7 C32 C41A 102(5) . . . . ?
Ag8A S7 C32 C66A -98(5) . . . . ?
Ag7A S6 C48 C4A 128(3) . . . . ?
Ag7A S6 C48 C30A -106(2) . . . . ?
Ag7A S7 C32 C41A 177(5) . . . . ?
Ag7A S7 C32 C66A -23(5) . . . . ?
Ag6A S6 C48 C4A 55(3) . . . . ?
Ag6A S6 C48 C30A -178(2) . . . . ?
Ag6A C30 O66A Ag2 -18(9) . . . 3_666 ?
Ag6A C30 O9A Ag8 40(10) . . . . ?
Ag4A S12 C51 C52 -40(2) . . . . ?
Ag4A S12 C51 C50 96(2) . . . . ?
Ag4A S13 C45 C16A 37(5) . . . . ?
Ag4A S13 C45 C33A -179(3) . . . . ?
O17 C36A N18A C35A 9(48) . . . . ?
O17 C36A N18A C38A -139(28) . . . . ?
F5 C21 C22 O18 101(4) . . . . ?
F5 C21 C22 O19 -113(5) . . . . ?
F6 C21 C22 O18 -146(4) . . . . ?
F6 C21 C22 O19 0(6) . . . . ?
Ag S9 C13 C12 -22(3) . . . . ?
Ag S9 C13 C14 100(3) . . . . ?
Ag S10 C54 C54A 109(5) . . . . ?
Ag S10 C54 C64A -111(6) . . . . ?
C21 C22 O64A Ag26 -177(3) . . . . ?
C21 C22 O2A Ag7 -175(3) . . . . ?
F15 C42 C43 O25 48(6) . . . . ?
F15 C42 C43 O24 -155(5) . . . . ?
F13 C42 C43 O25 171(6) . . . . ?
F13 C42 C43 O24 -31(7) . . . . ?
F14 C42 C43 O25 -60(6) . . . . ?
F14 C42 C43 O24 98(5) . . . . ?
F7 C29 C30 O21 125(4) . . . . ?
F7 C29 C30 O20 14(5) . . . . ?
C19 N1 C20 O17 178(4) . . . . ?
F9 C29 C30 O21 -105(5) . . . . ?
F9 C29 C30 O20 144(5) . . . . ?
F8 C29 C30 O21 4(5) . . . . ?
F8 C29 C30 O20 -107(6) . . . . ?
C29 C30 O20 Ag8 122(4) . . . . ?
C29 C30 O66A Ag2 -179(7) . . . 3_666 ?
C29 C30 O9A Ag8 -172(9) . . . . ?
C29 C30 O9A Ag6A 148(2) . . . . ?
C18 N1 C20 O17 36(8) . . . . ?
F4 C21 C22 O18 -33(6) . . . . ?
F4 C21 C22 O19 113(6) . . . . ?
F2 C7 C8 O16 -74(6) . . . . ?
F2 C7 C8 O15 84(5) . . . . ?
F1 C7 C8 O16 163(6) . . . . ?
F1 C7 C8 O15 -39(5) . . . . ?
F3 C7 C8 O16 37(6) . . . . ?
F3 C7 C8 O15 -165(5) . . . . ?
C7 C8 O15A Ag27 174(2) . . . . ?
F1A C42 C43 O24A 151(11) . . . . ?
F1A C42 C43 O25A 32(10) . . . . ?
F7A C42 C43 O24A 36(12) . . . . ?
F7A C42 C43 O25A -83(10) . . . . ?
F29A C42 C43 O24A -86(11) . . . . ?
F29A C42 C43 O25A 155(10) . . . . ?
F8A C21 C22 O64A -100(5) . . . . ?
F8A C21 C22 O2A 44(7) . . . . ?
F17A C21 C22 O64A 37(7) . . . . ?
F17A C21 C22 O2A -180(6) . . . . ?
F28A C21 C22 O64A 152(5) . . . . ?
F28A C21 C22 O2A -65(6) . . . . ?
F6A C7 C8 O15A 74(10) . . . . ?
F6A C7 C8 O16A -80(9) . . . . ?
F3A C7 C8 O15A -51(10) . . . . ?
F3A C7 C8 O16A 154(9) . . . . ?
F4A C7 C8 O15A -163(10) . . . . ?
F4A C7 C8 O16A 42(9) . . . . ?
F16A C29 C30 Ag6A -30(5) . . . . ?
F16A C29 C30 O66A 117(5) . . . . ?
F16A C29 C30 O9A -132(6) . . . . ?
F19A C29 C30 Ag6A 73(6) . . . . ?
F19A C29 C30 O66A -140(6) . . . . ?
F19A C29 C30 O9A -30(6) . . . . ?
F9A C29 C30 Ag6A -138(4) . . . . ?
F9A C29 C30 O66A 9(5) . . . . ?
F9A C29 C30 O9A 119(5) . . . . ?
O64A C22 O2A Ag7 -45(9) . . . . ?
O2A C22 O64A Ag26 52(10) . . . . ?
Ag24 S8 C24 C9A -108(3) . . . . ?
Ag24 S8 C24 C40A 116(3) . . . . ?
Ag24 S7 C32 C41A 53(5) . . . . ?
Ag24 S7 C32 C66A -147(5) . . . . ?
O21 C30 O20 Ag8 9(7) . . . . ?
O66A C30 O9A Ag8 -75(12) . . . . ?
O66A C30 O9A Ag6A -115(6) . . . . ?
O9A C30 O66A Ag2 83(9) . . . 3_666 ?
C34 C35 O22A Ag8A -170(3) . . . . ?
F12 C34 C35 O22 -30(10) . . . . ?
F12 C34 C35 O23 -174(8) . . . . ?
F11 C34 C35 O22 -149(10) . . . . ?
F11 C34 C35 O23 67(8) . . . . ?
F10 C34 C35 O22 91(10) . . . . ?
F10 C34 C35 O23 -53(8) . . . . ?
Ag25 S11 C40 C27A 42(6) . . . . ?
Ag25 S11 C40 C31A -151(6) . . . . ?
Ag25 S10 C54 C54A 16(5) . . . . ?
Ag25 S10 C54 C64A 156(6) . . . . ?
Ag26 S5 C27 C29A 98(2) . . . . ?
Ag26 S5 C27 C74A -14(2) . . . . ?
Ag26 S8 C24 C9A 2(3) . . . . ?
Ag26 S8 C24 C40A -134(3) . . . . ?
Ag27 S3 C10 C32A -114(5) . . . . ?
Ag27 S3 C10 C46A 115(5) . . . . ?
Ag27 S2 C5 C67A -109(4) . . . . ?
Ag27 S2 C5 C44A 43(3) . . . . ?
O16A C8 O15A Ag27 -34(11) . . . . ?
F12A C34 C35 O23A -164(11) . . . . ?
F12A C34 C35 O22A 37(14) . . . . ?
F11A C34 C35 O23A 76(11) . . . . ?
F11A C34 C35 O22A -84(14) . . . . ?
F10A C34 C35 O23A -45(11) . . . . ?
F10A C34 C35 O22A 155(15) . . . . ?
O23A C35 O22A Ag8A 35(16) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 -0.077 0.175 0.530 131.0 13.9 '0.8 CH4O'
2 -0.077 0.325 0.030 131.0 12.9 '0.8 CH4O'
3 0.077 0.675 -0.030 131.0 15.3 '0.8 CH4O'
4 0.077 0.825 0.470 131.0 14.3 '0.8 CH4O'

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_exptl_crystal_mounting_method nothing
_olex2_submission_original_sample_id xyh01
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_xyh20211229_158_1_3_0m_a
_database_code_depnum_ccdc_archive 'CCDC 2180651'
loop_
_audit_author_name
_audit_author_address
'Yuhan Xia'
;Huazhong University of Scienceand Technology
China
;
_audit_update_record             
;
2022-06-21 deposited with the CCDC.	2022-08-26 downloaded from the CCDC.
;
_audit_creation_date             2022-06-20
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        xyh03
_chemical_formula_moiety         'C35 H46 Ag10 O12 S5.5'
_chemical_formula_sum            'C35 H46 Ag10 O12 S5.50'
_chemical_formula_weight         1913.75
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   30.032(2)
_cell_length_b                   26.7363(18)
_cell_length_c                   15.9173(12)
_cell_angle_alpha                90
_cell_angle_beta                 97.531(2)
_cell_angle_gamma                90
_cell_volume                     12670.4(16)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    9944
_cell_measurement_temperature    296.3
_cell_measurement_theta_max      24.20
_cell_measurement_theta_min      2.67
_shelx_estimated_absorpt_T_max   0.738
_shelx_estimated_absorpt_T_min   0.660
_exptl_absorpt_coefficient_mu    3.242
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.4559
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0981 before and 0.0615 after correction.
The Ratio of minimum to maximum transmission is 0.6118.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    2.006
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             7280
_exptl_crystal_preparation       
;
stir for 2h
solvothermal
;
_exptl_crystal_recrystallization_method 'at room temperature'
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0489
_diffrn_reflns_av_unetI/netI     0.0647
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_h_min       -36
_diffrn_reflns_limit_k_max       32
_diffrn_reflns_limit_k_min       -32
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            36753
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.443
_diffrn_reflns_theta_min         2.323
_diffrn_ambient_temperature      296.3
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           30.0
_diffrn_source_power             1.35
_diffrn_source_voltage           45.0
_diffrn_special_details          nothing
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6159
_reflns_number_total             11636
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.3 (Bourhis et al., 2015)'
_refine_diff_density_max         1.519
_refine_diff_density_min         -1.167
_refine_diff_density_rms         0.189
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     733
_refine_ls_number_reflns         11636
_refine_ls_number_restraints     269
_refine_ls_R_factor_all          0.1454
_refine_ls_R_factor_gt           0.0799
_refine_ls_restrained_S_all      1.044
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0855P)²+452.5862P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1953
_refine_ls_wR_factor_ref         0.2505
_refine_special_details          nothing
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Restrained distances
 C35-C34 = C41-C34 = C33-C34 = C36-C34 = C8-C9 = C01T-C9 = C10-C9 = C40-C9 =
 C39-C2 = C3-C2 = C38-C2 = C1-C2 = C01Q-C31 = C14A-C31 = C32-C31 = C30-C31 =
 C21-C20 = C01N-C20 = C19-C20 = C37-C20
 1.54 with sigma of 0.01
 O6A-C7 = C7-O5A
 1.2 with sigma of 0.02
 O6A-O5A
 2.078 with sigma of 0.04
 S3-C01T \\sim S3-C8 \\sim S3-C10 \\sim S3-C40
 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
S1 \\sim O2 \\sim O1 \\sim O4 \\sim O3 \\sim C34 \\sim C33 \\sim C35 \\sim C36
\\sim C41 \\sim C9 \\sim C10 \\sim C8 \\sim C40 \\sim C01T \\sim C2 \\sim C1
\\sim C3 \\sim C38 \\sim C39 \\sim C20 \\sim C19 \\sim C21 \\sim C37 \\sim C01N
\\sim C01Q \\sim C14A \\sim C32 \\sim C31 \\sim C30: within 2A with sigma of
0.01 and sigma for terminal atoms of 0.02 within 2A
O5 \\sim O6 \\sim C7 \\sim O6A \\sim O5A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
4. Others
 Sof(H31A)=Sof(C14A)=Sof(H14B)=Sof(H14C)=Sof(H14D)=Sof(C01Q)=Sof(H01A)=
 Sof(H01B)=Sof(H01C)=1-FVAR(1)
 Sof(H31)=Sof(C32)=Sof(H32A)=Sof(H32B)=Sof(H32C)=Sof(C30)=Sof(H30A)=Sof(H30B)=
 Sof(H30C)=FVAR(1)
 Sof(H9B)=Sof(C01T)=Sof(H01D)=Sof(H01E)=Sof(H01F)=Sof(C40)=Sof(H40A)=Sof(H40B)=
 Sof(H40C)=1-FVAR(2)
 Sof(H9A)=Sof(C10)=Sof(H10A)=Sof(H10B)=Sof(H10C)=Sof(C8)=Sof(H8A)=Sof(H8B)=
 Sof(H8C)=FVAR(2)
 Sof(H34A)=Sof(C36)=Sof(H36A)=Sof(H36B)=Sof(H36C)=Sof(C41)=Sof(H41A)=Sof(H41B)=
 Sof(H41C)=1-FVAR(3)
 Sof(H34)=Sof(C33)=Sof(H33A)=Sof(H33B)=Sof(H33C)=Sof(C35)=Sof(H35A)=Sof(H35B)=
 Sof(H35C)=FVAR(3)
 Sof(H20A)=Sof(C37)=Sof(H37A)=Sof(H37B)=Sof(H37C)=Sof(C01N)=Sof(H01G)=
 Sof(H01H)=Sof(H01I)=1-FVAR(4)
 Sof(H20)=Sof(C19)=Sof(H19A)=Sof(H19B)=Sof(H19C)=Sof(C21)=Sof(H21A)=Sof(H21B)=
 Sof(H21C)=FVAR(4)
 Sof(H2B)=Sof(C38)=Sof(H38A)=Sof(H38B)=Sof(H38C)=Sof(C39)=Sof(H39A)=Sof(H39B)=
 Sof(H39C)=1-FVAR(5)
 Sof(H2A)=Sof(C1)=Sof(H1A)=Sof(H1B)=Sof(H1C)=Sof(C3)=Sof(H3A)=Sof(H3B)=
 Sof(H3C)=FVAR(5)
 Sof(Ag0B)=1-FVAR(6)
 Sof(Ag7)=FVAR(6)
 Sof(Ag)=1-FVAR(7)
 Sof(Ag5)=FVAR(7)
 Sof(O6A)=Sof(O5A)=1-FVAR(8)
 Sof(O5)=Sof(O6)=FVAR(8)
 Fixed Sof: O2(0.5) O1(0.5) O4(0.5) O3(0.5)
5.a Riding coordinates:
 C33(H33A,H33B,H33C), C30(H30A,H30B,H30C), C40(H40A,H40B,H40C), C38(H38A,H38B,
 H38C), C39(H39A,H39B,H39C)
5.b Ternary CH refined with riding coordinates:
 C34(H34), C34(H34A), C20(H20), C20(H20A), C2(H2A), C2(H2B), C9(H9A), C9(H9B),
 C31(H31), C31(H31A)
5.c Aromatic/amide H refined with riding coordinates:
 C14(H14A), C13(H13), C17(H17), C16(H16), C24(H24), C25(H25), C27(H27),
 C28(H28), C6(H6), C4(H4)
5.d Idealised Me refined as rotating group:
 C1(H1A,H1B,H1C), C3(H3A,H3B,H3C), C10(H10A,H10B,H10C), C19(H19A,H19B,H19C),
 C21(H21A,H21B,H21C), C32(H32A,H32B,H32C), C35(H35A,H35B,H35C), C8(H8A,H8B,H8C),
  C14A(H14B,H14C,H14D), C01Q(H01A,H01B,H01C), C01T(H01D,H01E,H01F), C36(H36A,
 H36B,H36C), C41(H41A,H41B,H41C), C37(H37A,H37B,H37C), C01N(H01G,H01H,H01I)
5.e Idealised tetrahedral OH refined as rotating group:
 O14(H14)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag3 Ag 0.82142(4) 0.59095(5) 0.41874(10) 0.0712(4) Uani 1 1 d . . . . .
Ag9 Ag 0.85387(5) 0.21617(5) 0.12549(10) 0.0737(4) Uani 1 1 d . . . . .
Ag2 Ag 0.88857(5) 0.67324(5) 0.42145(10) 0.0743(4) Uani 1 1 d . . . . .
Ag4 Ag 0.72543(5) 0.57450(5) 0.43812(10) 0.0748(4) Uani 1 1 d . . . . .
Ag10 Ag 0.76322(5) 0.18019(6) 0.17894(10) 0.0807(4) Uani 1 1 d . . . . .
Ag8 Ag 0.77709(5) 0.85935(6) 0.40668(11) 0.0871(5) Uani 1 1 d . . . . .
Ag6 Ag 0.59070(5) 0.71117(6) 0.53890(12) 0.0892(5) Uani 1 1 d . . . . .
Ag5 Ag 0.6260(3) 0.6212(2) 0.4783(8) 0.0777(15) Uani 0.72(5) 1 d . . P A 1
Ag1 Ag 0.83153(6) 0.75290(6) 0.32251(14) 0.1044(6) Uani 1 1 d . . . . .
Ag7 Ag 0.6647(4) 0.8342(3) 0.4260(8) 0.089(3) Uani 0.69(3) 1 d . . P B 1
S4 S 0.67065(13) 0.62863(13) 0.3545(3) 0.0537(9) Uani 1 1 d . . . . .
S1 S 0.750000 0.750000 0.500000 0.0650(15) Uani 1 2 d S U P C 1
S2 S 0.84944(14) 0.83728(16) 0.3714(3) 0.0641(11) Uani 1 1 d . . . . .
S6 S 0.71347(15) 0.90529(15) 0.4403(3) 0.0649(11) Uani 1 1 d . . . . .
S3 S 0.81955(15) 0.66358(15) 0.3148(3) 0.0683(12) Uani 1 1 d D . . . .
S5 S 0.59997(14) 0.77916(15) 0.4415(3) 0.0678(12) Uani 1 1 d . . . . .
O13 O 0.3474(4) 0.4819(4) 0.5135(9) 0.083(4) Uani 1 1 d . . . . .
O14 O 0.3268(5) 0.5526(5) 0.5676(12) 0.106(5) Uani 1 1 d . . . . .
H14 H 0.305996 0.534984 0.578630 0.159 Uiso 1 1 calc R U . . .
O10 O 0.5241(4) 0.6693(4) 0.5191(10) 0.087(4) Uani 1 1 d . . . . .
O5 O 0.9477(13) 0.6153(10) 0.413(3) 0.089(6) Uani 0.63(5) 1 d . U P D 1
O8 O 0.7405(4) 0.4946(4) 0.3943(9) 0.085(4) Uani 1 1 d . . . . .
O9 O 0.5530(4) 0.5992(5) 0.4723(9) 0.089(4) Uani 1 1 d . . . . .
O7 O 0.8066(5) 0.5132(4) 0.3566(10) 0.095(5) Uani 1 1 d . . . . .
O11 O 0.8411(5) 0.2736(6) 0.2308(12) 0.122(6) Uani 1 1 d . . . . .
C29 C 0.3552(5) 0.5256(6) 0.5323(11) 0.063(4) Uani 1 1 d . . . . .
C12 C 0.7850(5) 0.4297(5) 0.3473(11) 0.060(4) Uani 1 1 d . . . . .
C26 C 0.3973(5) 0.5509(6) 0.5195(11) 0.060(4) Uani 1 1 d . . . . .
C23 C 0.4773(6) 0.6002(6) 0.5010(10) 0.061(4) Uani 1 1 d . . . . .
O12 O 0.7764(7) 0.2495(5) 0.2694(12) 0.133(7) Uani 1 1 d . . . . .
C14 C 0.8351(6) 0.3657(6) 0.3131(12) 0.077(5) Uani 1 1 d . . . . .
H14A H 0.863882 0.355702 0.305160 0.092 Uiso 1 1 calc R U . . .
C13 C 0.8277(6) 0.4128(7) 0.3393(13) 0.083(6) Uani 1 1 d . . . . .
H13 H 0.851960 0.434342 0.352146 0.100 Uiso 1 1 calc R U . . .
C15 C 0.7985(7) 0.3316(6) 0.2978(12) 0.076(5) Uani 1 1 d . . . . .
C17 C 0.7499(6) 0.3958(6) 0.3349(13) 0.075(5) Uani 1 1 d . . . . .
H17 H 0.721391 0.404975 0.346187 0.090 Uiso 1 1 calc R U . . .
C16 C 0.7572(6) 0.3484(6) 0.3057(13) 0.078(5) Uani 1 1 d . . . . .
H16 H 0.732747 0.327411 0.291059 0.093 Uiso 1 1 calc R U . . .
C24 C 0.4690(6) 0.5525(6) 0.4702(13) 0.076(5) Uani 1 1 d . . . . .
H24 H 0.490086 0.536514 0.441556 0.091 Uiso 1 1 calc R U . . .
C25 C 0.4289(6) 0.5279(7) 0.4817(14) 0.084(6) Uani 1 1 d . . . . .
H25 H 0.424301 0.495190 0.462851 0.101 Uiso 1 1 calc R U . . .
C22 C 0.5213(6) 0.6247(6) 0.4955(14) 0.079(6) Uani 1 1 d . . . . .
C34 C 0.7002(6) 0.9594(7) 0.3754(14) 0.095(5) Uani 1 1 d D U . . .
H34 H 0.702293 0.943362 0.320693 0.113 Uiso 0.47(4) 1 calc R U P E 1
H34A H 0.688367 0.948681 0.317926 0.113 Uiso 0.53(4) 1 calc R U P E 2
C20 C 0.6441(7) 0.5988(8) 0.2574(13) 0.110(7) Uani 1 1 d D U . . .
H20 H 0.626582 0.572284 0.280324 0.132 Uiso 0.53(6) 1 calc R U P F 1
H20A H 0.619775 0.575054 0.263193 0.132 Uiso 0.47(6) 1 calc R U P F 2
C2 C 0.8701(6) 0.8761(6) 0.2882(13) 0.088(5) Uani 1 1 d D U . . .
H2A H 0.851159 0.869821 0.234338 0.105 Uiso 0.91(3) 1 calc R U P G 1
H2B H 0.872806 0.858551 0.235123 0.105 Uiso 0.09(3) 1 calc R U P G 2
C27 C 0.4053(6) 0.6004(6) 0.5495(13) 0.077(5) Uani 1 1 d . . . . .
H27 H 0.383563 0.617069 0.575391 0.092 Uiso 1 1 calc R U . . .
C18 C 0.8083(9) 0.2796(8) 0.2676(13) 0.096(7) Uani 1 1 d . . . . .
C28 C 0.4445(6) 0.6233(6) 0.5406(12) 0.072(5) Uani 1 1 d . . . . .
H28 H 0.449522 0.655551 0.561708 0.087 Uiso 1 1 calc R U . . .
C11 C 0.7758(7) 0.4824(6) 0.3661(12) 0.071(5) Uani 1 1 d . . . . .
O6 O 0.8955(7) 0.5717(12) 0.476(3) 0.096(6) Uani 0.63(5) 1 d . U P D 1
C5 C 0.9679(6) 0.5356(7) 0.4765(12) 0.078(5) Uani 1 1 d . . . . .
C7 C 0.9340(7) 0.5769(9) 0.4544(15) 0.093(5) Uani 1 1 d D U . . .
C33 C 0.7383(17) 0.998(2) 0.372(9) 0.097(9) Uani 0.47(4) 1 d D U P E 1
H33A H 0.736781 1.021461 0.416512 0.146 Uiso 0.47(4) 1 d R U P E 1
H33B H 0.735311 1.014471 0.318402 0.146 Uiso 0.47(4) 1 d R U P E 1
H33C H 0.766680 0.980511 0.380982 0.146 Uiso 0.47(4) 1 d R U P E 1
C1 C 0.9189(6) 0.8620(9) 0.2783(15) 0.094(6) Uani 0.91(3) 1 d D U P G 1
H1A H 0.935563 0.856575 0.333219 0.140 Uiso 0.91(3) 1 calc R U P G 1
H1B H 0.932450 0.888608 0.250164 0.140 Uiso 0.91(3) 1 calc R U P G 1
H1C H 0.918984 0.831931 0.245305 0.140 Uiso 0.91(3) 1 calc R U P G 1
C3 C 0.8650(10) 0.9312(6) 0.3124(16) 0.099(6) Uani 0.91(3) 1 d D U P G 1
H3A H 0.833855 0.938433 0.314927 0.149 Uiso 0.91(3) 1 calc R U P G 1
H3B H 0.875828 0.952233 0.270541 0.149 Uiso 0.91(3) 1 calc R U P G 1
H3C H 0.881998 0.937492 0.366691 0.149 Uiso 0.91(3) 1 calc R U P G 1
C9 C 0.8335(6) 0.6369(10) 0.2157(13) 0.118(7) Uani 1 1 d D U . . .
H9A H 0.847535 0.666261 0.193405 0.142 Uiso 0.56(5) 1 calc R U P H 1
H9B H 0.827154 0.601221 0.222177 0.142 Uiso 0.44(5) 1 calc R U P H 2
C6 C 0.9558(6) 0.4882(7) 0.5018(15) 0.093(7) Uani 1 1 d . . . . .
H6 H 0.925597 0.480452 0.501206 0.112 Uiso 1 1 calc R U . . .
C4 C 1.0122(6) 0.5473(8) 0.4723(17) 0.108(8) Uani 1 1 d . . . . .
H4 H 1.020203 0.578300 0.452617 0.130 Uiso 1 1 calc R U . . .
C10 C 0.7920(10) 0.633(2) 0.1487(18) 0.117(10) Uani 0.56(5) 1 d D U P H 1
H10A H 0.772598 0.606838 0.164990 0.176 Uiso 0.56(5) 1 calc R U P H 1
H10B H 0.801315 0.624322 0.094940 0.176 Uiso 0.56(5) 1 calc R U P H 1
H10C H 0.776282 0.663900 0.144317 0.176 Uiso 0.56(5) 1 calc R U P H 1
C19 C 0.6696(18) 0.569(2) 0.196(3) 0.119(10) Uani 0.53(6) 1 d D U P F 1
H19A H 0.678039 0.591049 0.153561 0.178 Uiso 0.53(6) 1 calc R U P F 1
H19B H 0.650671 0.542962 0.170362 0.178 Uiso 0.53(6) 1 calc R U P F 1
H19C H 0.696089 0.554616 0.227416 0.178 Uiso 0.53(6) 1 calc R U P F 1
C21 C 0.6066(19) 0.6327(19) 0.214(4) 0.114(10) Uani 0.53(6) 1 d D U P F 1
H21A H 0.589833 0.646378 0.256058 0.172 Uiso 0.53(6) 1 calc R U P F 1
H21B H 0.586948 0.613471 0.174008 0.172 Uiso 0.53(6) 1 calc R U P F 1
H21C H 0.619648 0.659389 0.185250 0.172 Uiso 0.53(6) 1 calc R U P F 1
C31 C 0.5473(7) 0.7918(13) 0.3716(17) 0.142(9) Uani 1 1 d D U . . .
H31 H 0.546299 0.820433 0.333033 0.171 Uiso 0.42(3) 1 calc R U P I 1
H31A H 0.540957 0.764971 0.329690 0.171 Uiso 0.58(3) 1 calc R U P I 2
C32 C 0.5118(19) 0.788(4) 0.433(4) 0.136(11) Uani 0.42(3) 1 d D U P I 1
H32A H 0.510436 0.754647 0.453323 0.204 Uiso 0.42(3) 1 calc R U P I 1
H32B H 0.483008 0.797782 0.403899 0.204 Uiso 0.42(3) 1 calc R U P I 1
H32C H 0.519878 0.810479 0.480017 0.204 Uiso 0.42(3) 1 calc R U P I 1
C35 C 0.6497(8) 0.971(2) 0.360(4) 0.102(9) Uani 0.47(4) 1 d D U P E 1
H35A H 0.633540 0.941554 0.339794 0.153 Uiso 0.47(4) 1 calc R U P E 1
H35B H 0.644281 0.997183 0.318675 0.153 Uiso 0.47(4) 1 calc R U P E 1
H35C H 0.639867 0.981671 0.412204 0.153 Uiso 0.47(4) 1 calc R U P E 1
C8 C 0.8748(14) 0.6025(19) 0.230(2) 0.115(10) Uani 0.56(5) 1 d D U P H 1
H8A H 0.900657 0.621710 0.252199 0.172 Uiso 0.56(5) 1 calc R U P H 1
H8B H 0.879710 0.587544 0.177224 0.172 Uiso 0.56(5) 1 calc R U P H 1
H8C H 0.869695 0.576713 0.269711 0.172 Uiso 0.56(5) 1 calc R U P H 1
O2 O 0.7785(8) 0.7913(7) 0.5203(15) 0.071(4) Uani 0.5 1 d . U P C 1
O1 O 0.7377(9) 0.7689(9) 0.4044(18) 0.090(5) Uani 0.5 1 d . U P C 1
O4 O 0.7159(9) 0.7484(11) 0.5317(19) 0.093(5) Uani 0.5 1 d . U P C 1
O3 O 0.7661(9) 0.7034(9) 0.4829(19) 0.091(5) Uani 0.5 1 d . U P C 1
C30 C 0.5338(18) 0.7399(16) 0.334(4) 0.144(13) Uani 0.42(3) 1 d D U P I 1
H30A H 0.556887 0.727631 0.303115 0.216 Uiso 0.42(3) 1 d R U P I 1
H30B H 0.506117 0.742801 0.296515 0.216 Uiso 0.42(3) 1 d R U P I 1
H30C H 0.529807 0.717031 0.378945 0.216 Uiso 0.42(3) 1 d R U P I 1
C14A C 0.5056(15) 0.803(3) 0.415(4) 0.142(11) Uani 0.58(3) 1 d D U P I 2
H14B H 0.506899 0.783803 0.466531 0.213 Uiso 0.58(3) 1 calc R U P I 2
H14C H 0.478977 0.794407 0.378047 0.213 Uiso 0.58(3) 1 calc R U P I 2
H14D H 0.504959 0.838042 0.428814 0.213 Uiso 0.58(3) 1 calc R U P I 2
C01Q C 0.5540(13) 0.8421(15) 0.327(3) 0.161(13) Uani 0.58(3) 1 d D U P I 2
H01A H 0.537615 0.867843 0.352324 0.241 Uiso 0.58(3) 1 calc R U P I 2
H01B H 0.543094 0.839407 0.268160 0.241 Uiso 0.58(3) 1 calc R U P I 2
H01C H 0.585330 0.850474 0.334401 0.241 Uiso 0.58(3) 1 calc R U P I 2
C01T C 0.8840(8) 0.637(3) 0.210(3) 0.117(10) Uani 0.44(5) 1 d D U P H 2
H01D H 0.891944 0.667771 0.183838 0.176 Uiso 0.44(5) 1 calc R U P H 2
H01E H 0.891433 0.609314 0.176118 0.176 Uiso 0.44(5) 1 calc R U P H 2
H01F H 0.900407 0.634606 0.265592 0.176 Uiso 0.44(5) 1 calc R U P H 2
C40 C 0.7992(16) 0.652(3) 0.1397(14) 0.114(11) Uani 0.44(5) 1 d D U P H 2
H40A H 0.769429 0.642559 0.148977 0.171 Uiso 0.44(5) 1 d R U P H 2
H40B H 0.806769 0.635529 0.089787 0.171 Uiso 0.44(5) 1 d R U P H 2
H40C H 0.800549 0.687539 0.132187 0.171 Uiso 0.44(5) 1 d R U P H 2
C36 C 0.7447(13) 0.988(2) 0.373(8) 0.096(9) Uani 0.53(4) 1 d D U P E 2
H36A H 0.754026 1.002605 0.427098 0.143 Uiso 0.53(4) 1 calc R U P E 2
H36B H 0.740471 1.013188 0.330251 0.143 Uiso 0.53(4) 1 calc R U P E 2
H36C H 0.767306 0.964590 0.359631 0.143 Uiso 0.53(4) 1 calc R U P E 2
C41 C 0.6662(16) 0.9948(15) 0.409(3) 0.101(9) Uani 0.53(4) 1 d D U P E 2
H41A H 0.643237 0.975542 0.430542 0.152 Uiso 0.53(4) 1 calc R U P E 2
H41B H 0.652840 1.015973 0.363885 0.152 Uiso 0.53(4) 1 calc R U P E 2
H41C H 0.681382 1.015127 0.453694 0.152 Uiso 0.53(4) 1 calc R U P E 2
C37 C 0.6843(14) 0.579(3) 0.217(4) 0.116(10) Uani 0.47(6) 1 d D U P F 2
H37A H 0.700330 0.606548 0.196274 0.175 Uiso 0.47(6) 1 calc R U P F 2
H37B H 0.673735 0.557292 0.170193 0.175 Uiso 0.47(6) 1 calc R U P F 2
H37C H 0.704015 0.560637 0.258058 0.175 Uiso 0.47(6) 1 calc R U P F 2
C01N C 0.633(3) 0.6418(16) 0.194(3) 0.115(10) Uani 0.47(6) 1 d D U P F 2
H01G H 0.608472 0.660851 0.208926 0.172 Uiso 0.47(6) 1 calc R U P F 2
H01H H 0.625728 0.628339 0.137854 0.172 Uiso 0.47(6) 1 calc R U P F 2
H01I H 0.659132 0.663147 0.194877 0.172 Uiso 0.47(6) 1 calc R U P F 2
C38 C 0.915(4) 0.890(9) 0.341(11) 0.092(8) Uani 0.09(3) 1 d D U P G 2
H38A H 0.909640 0.895723 0.398649 0.139 Uiso 0.09(3) 1 d R U P G 2
H38B H 0.927290 0.919223 0.319039 0.139 Uiso 0.09(3) 1 d R U P G 2
H38C H 0.936090 0.862603 0.340709 0.139 Uiso 0.09(3) 1 d R U P G 2
C39 C 0.841(7) 0.924(5) 0.279(17) 0.092(10) Uani 0.09(3) 1 d D U P G 2
H39A H 0.857792 0.951025 0.259610 0.138 Uiso 0.09(3) 1 d R U P G 2
H39B H 0.833692 0.930845 0.334360 0.138 Uiso 0.09(3) 1 d R U P G 2
H39C H 0.813762 0.919265 0.240360 0.138 Uiso 0.09(3) 1 d R U P G 2
Ag0B Ag 0.6452(9) 0.8490(8) 0.3998(9) 0.092(5) Uani 0.31(3) 1 d . . P B 2
Ag Ag 0.6143(15) 0.6138(11) 0.440(5) 0.101(12) Uani 0.28(5) 1 d . . P A 2
O6A O 0.8969(10) 0.5585(16) 0.437(4) 0.096(6) Uani 0.37(5) 1 d D U P D 2
O5A O 0.943(2) 0.6179(14) 0.433(4) 0.088(6) Uani 0.37(5) 1 d D U P D 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
Ag3 Ag2 2.9809(18) . ?
Ag3 Ag4 2.9718(19) . ?
Ag3 Ag7 3.164(6) 7_666 ?
Ag3 S6 2.600(5) 7_666 ?
Ag3 S3 2.547(5) . ?
Ag3 O7 2.321(12) . ?
Ag3 O6 2.35(2) . ?
Ag3 Ag0B 3.341(10) 7_666 ?
Ag3 O6A 2.41(4) . ?
Ag9 Ag10 3.109(2) . ?
Ag9 Ag6 3.283(2) 4_645 ?
Ag9 Ag5 3.131(6) 4_645 ?
Ag9 Ag7 3.290(4) 4_645 ?
Ag9 S4 2.486(4) 4_645 ?
Ag9 S5 2.506(5) 4_645 ?
Ag9 O11 2.343(15) . ?
Ag9 Ag 3.123(18) 4_645 ?
Ag2 Ag6 3.199(2) 7_666 ?
Ag2 Ag1 3.040(2) . ?
Ag2 Ag7 3.083(5) 7_666 ?
Ag2 S3 2.515(5) . ?
Ag2 S5 2.510(5) 7_666 ?
Ag2 O5 2.37(3) . ?
Ag2 Ag0B 3.199(9) 7_666 ?
Ag2 O5A 2.19(6) . ?
Ag4 Ag8 3.047(2) 7_666 ?
Ag4 Ag5 3.374(6) . ?
Ag4 S4 2.449(4) . ?
Ag4 S6 2.544(5) 7_666 ?
Ag4 O8 2.310(11) . ?
Ag10 S4 2.531(4) 4_645 ?
Ag10 S3 2.540(5) 4_645 ?
Ag10 O12 2.349(15) . ?
Ag8 Ag5 3.270(12) 7_666 ?
Ag8 S2 2.388(4) . ?
Ag8 S6 2.390(5) . ?
Ag8 O2 2.56(2) . ?
Ag6 Ag5 2.847(7) . ?
Ag6 Ag1 3.146(3) 7_666 ?
Ag6 S2 2.505(5) 7_666 ?
Ag6 S5 2.429(5) . ?
Ag6 O10 2.278(11) . ?
Ag6 Ag 3.17(5) . ?
Ag5 S4 2.532(9) . ?
Ag5 S2 2.652(14) 7_666 ?
Ag5 O9 2.261(15) . ?
Ag1 S2 2.424(5) . ?
Ag1 S3 2.416(4) . ?
Ag7 S6 2.393(5) . ?
Ag7 S5 2.475(6) . ?
Ag7 O3 2.58(3) 7_666 ?
S4 C20 1.828(19) . ?
S4 Ag 2.340(16) . ?
S1 O2 1.409(17) . ?
S1 O2 1.409(17) 7_666 ?
S1 O1 1.60(3) . ?
S1 O1 1.60(3) 7_666 ?
S1 O4 1.20(3) . ?
S1 O4 1.20(3) 7_666 ?
S1 O3 1.38(2) . ?
S1 O3 1.38(2) 7_666 ?
S2 C2 1.852(17) . ?
S6 C34 1.792(18) . ?
S6 Ag0B 2.555(14) . ?
S3 C9 1.83(2) . ?
S5 C31 1.84(2) . ?
S5 Ag0B 2.452(8) . ?
O13 C29 1.220(18) . ?
O14 H14 0.8200 . ?
O14 C29 1.301(18) . ?
O10 C22 1.25(2) . ?
O5 C7 1.32(4) . ?
O8 C11 1.25(2) . ?
O9 C22 1.26(2) . ?
O9 Ag 2.01(3) . ?
O7 C11 1.261(19) . ?
O11 C18 1.22(2) . ?
C29 C26 1.47(2) . ?
C12 C13 1.38(2) . ?
C12 C17 1.39(2) . ?
C12 C11 1.47(2) . ?
C26 C25 1.34(2) . ?
C26 C27 1.42(2) . ?
C23 C24 1.38(2) . ?
C23 C22 1.49(2) . ?
C23 C28 1.38(2) . ?
O12 C18 1.25(2) . ?
C14 H14A 0.9300 . ?
C14 C13 1.35(2) . ?
C14 C15 1.42(2) . ?
C13 H13 0.9300 . ?
C15 C16 1.34(2) . ?
C15 C18 1.51(2) . ?
C17 H17 0.9300 . ?
C17 C16 1.38(2) . ?
C16 H16 0.9300 . ?
C24 H24 0.9300 . ?
C24 C25 1.41(2) . ?
C25 H25 0.9300 . ?
C34 H34 0.9800 . ?
C34 H34A 0.9800 . ?
C34 C33 1.539(10) . ?
C34 C35 1.535(10) . ?
C34 C36 1.539(10) . ?
C34 C41 1.540(10) . ?
C20 H20 0.9800 . ?
C20 H20A 0.9800 . ?
C20 C19 1.535(10) . ?
C20 C21 1.536(10) . ?
C20 C37 1.540(10) . ?
C20 C01N 1.539(10) . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 C1 1.541(10) . ?
C2 C3 1.535(10) . ?
C2 C38 1.541(10) . ?
C2 C39 1.540(10) . ?
C27 H27 0.9300 . ?
C27 C28 1.35(2) . ?
C28 H28 0.9300 . ?
O6 C7 1.26(3) . ?
C5 C7 1.51(2) . ?
C5 C6 1.39(3) . ?
C5 C4 1.37(3) . ?
C7 O6A 1.217(19) . ?
C7 O5A 1.191(19) . ?
C33 H33A 0.9601 . ?
C33 H33B 0.9601 . ?
C33 H33C 0.9598 . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 C10 1.533(10) . ?
C9 C8 1.536(10) . ?
C9 C01T 1.533(10) . ?
C9 C40 1.536(10) . ?
C6 H6 0.9300 . ?
C6 C4 1.37(2) 5_766 ?
C4 H4 0.9300 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C31 H31 0.9800 . ?
C31 H31A 0.9800 . ?
C31 C32 1.541(10) . ?
C31 C30 1.543(10) . ?
C31 C14A 1.542(10) . ?
C31 C01Q 1.544(10) . ?
C32 H32A 0.9600 . ?
C32 H32B 0.9600 . ?
C32 H32C 0.9600 . ?
C35 H35A 0.9600 . ?
C35 H35B 0.9600 . ?
C35 H35C 0.9600 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
O2 O4 1.37(3) 7_666 ?
O2 O3 1.34(3) 7_666 ?
O1 O4 1.68(4) 7_666 ?
O4 O3 1.43(4) 7_666 ?
C30 H30A 0.9603 . ?
C30 H30B 0.9603 . ?
C30 H30C 0.9594 . ?
C14A H14B 0.9600 . ?
C14A H14C 0.9600 . ?
C14A H14D 0.9600 . ?
C01Q H01A 0.9600 . ?
C01Q H01B 0.9600 . ?
C01Q H01C 0.9600 . ?
C01T H01D 0.9600 . ?
C01T H01E 0.9600 . ?
C01T H01F 0.9600 . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9599 . ?
C40 H40C 0.9599 . ?
C36 H36A 0.9600 . ?
C36 H36B 0.9600 . ?
C36 H36C 0.9600 . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
C37 H37A 0.9600 . ?
C37 H37B 0.9600 . ?
C37 H37C 0.9600 . ?
C01N H01G 0.9600 . ?
C01N H01H 0.9600 . ?
C01N H01I 0.9600 . ?
C38 H38A 0.9602 . ?
C38 H38B 0.9597 . ?
C38 H38C 0.9598 . ?
C39 H39A 0.9596 . ?
C39 H39B 0.9601 . ?
C39 H39C 0.9602 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Ag2 Ag3 Ag7 60.14(8) . 7_666 ?
Ag2 Ag3 Ag0B 60.49(13) . 7_666 ?
Ag4 Ag3 Ag2 140.47(6) . . ?
Ag4 Ag3 Ag7 92.48(15) . 7_666 ?
Ag4 Ag3 Ag0B 99.6(4) . 7_666 ?
Ag7 Ag3 Ag0B 13.4(3) 7_666 7_666 ?
S6 Ag3 Ag2 107.90(11) 7_666 . ?
S6 Ag3 Ag4 53.84(11) 7_666 . ?
S6 Ag3 Ag7 47.82(12) 7_666 7_666 ?
S6 Ag3 Ag0B 49.0(2) 7_666 7_666 ?
S3 Ag3 Ag2 53.41(11) . . ?
S3 Ag3 Ag4 103.96(12) . . ?
S3 Ag3 Ag7 90.8(3) . 7_666 ?
S3 Ag3 S6 123.65(14) . 7_666 ?
S3 Ag3 Ag0B 100.0(4) . 7_666 ?
O7 Ag3 Ag2 139.4(3) . . ?
O7 Ag3 Ag4 77.1(3) . . ?
O7 Ag3 Ag7 153.9(4) . 7_666 ?
O7 Ag3 S6 109.0(3) . 7_666 ?
O7 Ag3 S3 114.8(4) . . ?
O7 Ag3 O6 95.0(10) . . ?
O7 Ag3 Ag0B 144.9(6) . 7_666 ?
O7 Ag3 O6A 81.5(12) . . ?
O6 Ag3 Ag2 63.3(7) . . ?
O6 Ag3 Ag4 144.1(7) . . ?
O6 Ag3 Ag7 79.3(11) . 7_666 ?
O6 Ag3 S6 98.2(10) . 7_666 ?
O6 Ag3 S3 111.0(7) . . ?
O6 Ag3 Ag0B 66.9(12) . 7_666 ?
O6A Ag3 Ag2 68.9(9) . . ?
O6A Ag3 Ag4 147.6(10) . . ?
O6A Ag3 S3 107.0(12) . . ?
Ag10 Ag9 Ag6 139.39(7) . 4_645 ?
Ag10 Ag9 Ag5 97.47(11) . 4_645 ?
Ag10 Ag9 Ag7 103.86(15) . 4_645 ?
Ag10 Ag9 Ag 97.9(2) . 4_645 ?
Ag6 Ag9 Ag7 85.83(10) 4_645 4_645 ?
Ag5 Ag9 Ag6 52.64(14) 4_645 4_645 ?
Ag5 Ag9 Ag7 133.2(3) 4_645 4_645 ?
S4 Ag9 Ag10 52.35(9) 4_645 . ?
S4 Ag9 Ag6 104.66(10) 4_645 4_645 ?
S4 Ag9 Ag5 52.05(16) 4_645 4_645 ?
S4 Ag9 Ag7 153.1(3) 4_645 4_645 ?
S4 Ag9 S5 151.21(15) 4_645 4_645 ?
S4 Ag9 Ag 47.6(5) 4_645 4_645 ?
S5 Ag9 Ag10 151.31(11) 4_645 . ?
S5 Ag9 Ag6 47.30(11) 4_645 4_645 ?
S5 Ag9 Ag5 99.47(17) 4_645 4_645 ?
S5 Ag9 Ag7 48.26(15) 4_645 4_645 ?
S5 Ag9 Ag 103.7(6) 4_645 4_645 ?
O11 Ag9 Ag10 77.0(4) . . ?
O11 Ag9 Ag6 138.2(4) . 4_645 ?
O11 Ag9 Ag5 166.1(5) . 4_645 ?
O11 Ag9 Ag7 60.7(5) . 4_645 ?
O11 Ag9 S4 116.5(4) . 4_645 ?
O11 Ag9 S5 90.9(4) . 4_645 ?
O11 Ag9 Ag 154.1(16) . 4_645 ?
Ag3 Ag2 Ag6 146.07(6) . 7_666 ?
Ag3 Ag2 Ag1 100.10(6) . . ?
Ag3 Ag2 Ag7 62.88(10) . 7_666 ?
Ag3 Ag2 Ag0B 65.33(16) . 7_666 ?
Ag6 Ag2 Ag0B 94.6(3) 7_666 7_666 ?
Ag1 Ag2 Ag6 60.48(5) . 7_666 ?
Ag1 Ag2 Ag7 97.9(3) . 7_666 ?
Ag1 Ag2 Ag0B 111.6(6) . 7_666 ?
Ag7 Ag2 Ag6 90.84(9) 7_666 7_666 ?
Ag7 Ag2 Ag0B 14.1(3) 7_666 7_666 ?
S3 Ag2 Ag3 54.43(11) . . ?
S3 Ag2 Ag6 110.75(11) . 7_666 ?
S3 Ag2 Ag1 50.47(10) . . ?
S3 Ag2 Ag7 93.4(3) . 7_666 ?
S3 Ag2 Ag0B 104.6(5) . 7_666 ?
S5 Ag2 Ag3 113.72(11) 7_666 . ?
S5 Ag2 Ag6 48.53(10) 7_666 7_666 ?
S5 Ag2 Ag1 95.67(11) 7_666 . ?
S5 Ag2 Ag7 51.29(16) 7_666 7_666 ?
S5 Ag2 S3 130.24(15) 7_666 . ?
S5 Ag2 Ag0B 49.07(17) 7_666 7_666 ?
O5 Ag2 Ag3 91.6(7) . . ?
O5 Ag2 Ag6 120.9(8) . 7_666 ?
O5 Ag2 Ag1 143.4(10) . . ?
O5 Ag2 Ag7 118.1(10) . 7_666 ?
O5 Ag2 S3 116.8(11) . . ?
O5 Ag2 S5 111.2(11) . 7_666 ?
O5 Ag2 Ag0B 104.8(11) . 7_666 ?
O5A Ag2 Ag3 89.8(11) . . ?
O5A Ag2 Ag1 151.4(16) . . ?
O5A Ag2 S3 121.6(18) . . ?
Ag3 Ag4 Ag8 97.23(6) . 7_666 ?
Ag3 Ag4 Ag5 149.26(14) . . ?
Ag8 Ag4 Ag5 61.0(2) 7_666 . ?
S4 Ag4 Ag3 116.61(11) . . ?
S4 Ag4 Ag8 90.64(10) . 7_666 ?
S4 Ag4 Ag5 48.4(2) . . ?
S4 Ag4 S6 130.84(14) . 7_666 ?
S6 Ag4 Ag3 55.58(11) 7_666 . ?
S6 Ag4 Ag8 49.63(11) 7_666 7_666 ?
S6 Ag4 Ag5 110.2(3) 7_666 . ?
O8 Ag4 Ag3 82.8(3) . . ?
O8 Ag4 Ag8 143.9(4) . 7_666 ?
O8 Ag4 Ag5 127.8(3) . . ?
O8 Ag4 S4 121.8(4) . . ?
O8 Ag4 S6 106.0(4) . 7_666 ?
S4 Ag10 Ag9 51.07(9) 4_645 . ?
S4 Ag10 S3 135.40(14) 4_645 4_645 ?
S3 Ag10 Ag9 164.02(13) 4_645 . ?
O12 Ag10 Ag9 80.8(4) . . ?
O12 Ag10 S4 119.0(5) . 4_645 ?
O12 Ag10 S3 101.6(5) . 4_645 ?
Ag4 Ag8 Ag5 64.46(15) 7_666 7_666 ?
S2 Ag8 Ag4 117.01(13) . 7_666 ?
S2 Ag8 Ag5 53.18(19) . 7_666 ?
S2 Ag8 S6 163.36(16) . . ?
S2 Ag8 O2 93.4(6) . . ?
S6 Ag8 Ag4 54.18(12) . 7_666 ?
S6 Ag8 Ag5 118.15(19) . 7_666 ?
S6 Ag8 O2 98.4(6) . . ?
O2 Ag8 Ag4 80.8(5) . 7_666 ?
O2 Ag8 Ag5 77.7(5) . 7_666 ?
Ag2 Ag6 Ag9 90.69(5) 7_666 4_655 ?
Ag5 Ag6 Ag9 60.94(15) . 4_655 ?
Ag5 Ag6 Ag2 144.23(14) . 7_666 ?
Ag5 Ag6 Ag1 102.7(3) . 7_666 ?
Ag1 Ag6 Ag9 97.99(6) 7_666 4_655 ?
Ag1 Ag6 Ag2 57.26(5) 7_666 7_666 ?
Ag1 Ag6 Ag 113.9(13) 7_666 . ?
S2 Ag6 Ag9 94.27(11) 7_666 4_655 ?
S2 Ag6 Ag2 106.29(12) 7_666 7_666 ?
S2 Ag6 Ag5 59.0(3) 7_666 . ?
S2 Ag6 Ag1 49.21(11) 7_666 7_666 ?
S2 Ag6 Ag 70.6(13) 7_666 . ?
S5 Ag6 Ag9 49.32(11) . 4_655 ?
S5 Ag6 Ag2 50.76(12) . 7_666 ?
S5 Ag6 Ag5 109.7(2) . . ?
S5 Ag6 Ag1 94.73(12) . 7_666 ?
S5 Ag6 S2 128.11(15) . 7_666 ?
S5 Ag6 Ag 104.2(6) . . ?
O10 Ag6 Ag9 116.0(4) . 4_655 ?
O10 Ag6 Ag2 130.3(3) . 7_666 ?
O10 Ag6 Ag5 84.1(4) . . ?
O10 Ag6 Ag1 143.6(4) . 7_666 ?
O10 Ag6 S2 112.1(3) . 7_666 ?
O10 Ag6 S5 116.8(4) . . ?
O10 Ag6 Ag 77.2(9) . . ?
Ag9 Ag5 Ag4 87.89(13) 4_655 . ?
Ag9 Ag5 Ag8 86.98(19) 4_655 7_666 ?
Ag8 Ag5 Ag4 54.57(14) 7_666 . ?
Ag6 Ag5 Ag9 66.41(13) . 4_655 ?
Ag6 Ag5 Ag4 139.0(3) . . ?
Ag6 Ag5 Ag8 91.1(3) . 7_666 ?
S4 Ag5 Ag9 50.75(15) . 4_655 ?
S4 Ag5 Ag4 46.33(13) . . ?
S4 Ag5 Ag8 84.3(2) . 7_666 ?
S4 Ag5 Ag6 117.1(2) . . ?
S4 Ag5 S2 123.8(4) . 7_666 ?
S2 Ag5 Ag9 95.0(3) 7_666 4_655 ?
S2 Ag5 Ag4 100.2(3) 7_666 . ?
S2 Ag5 Ag8 46.1(2) 7_666 7_666 ?
S2 Ag5 Ag6 54.1(2) 7_666 . ?
O9 Ag5 Ag9 116.2(5) . 4_655 ?
O9 Ag5 Ag4 140.7(5) . . ?
O9 Ag5 Ag8 148.5(6) . 7_666 ?
O9 Ag5 Ag6 80.3(4) . . ?
O9 Ag5 S4 126.6(7) . . ?
O9 Ag5 S2 107.5(5) . 7_666 ?
Ag2 Ag1 Ag6 62.26(5) . 7_666 ?
S2 Ag1 Ag2 113.55(13) . . ?
S2 Ag1 Ag6 51.50(12) . 7_666 ?
S3 Ag1 Ag2 53.41(12) . . ?
S3 Ag1 Ag6 115.44(14) . 7_666 ?
S3 Ag1 S2 164.12(19) . . ?
Ag3 Ag7 Ag9 143.3(4) 7_666 4_655 ?
Ag2 Ag7 Ag3 56.98(11) 7_666 7_666 ?
Ag2 Ag7 Ag9 92.64(15) 7_666 4_655 ?
S6 Ag7 Ag3 53.63(16) . 7_666 ?
S6 Ag7 Ag9 150.1(3) . 4_655 ?
S6 Ag7 Ag2 110.5(2) . 7_666 ?
S6 Ag7 S5 160.4(3) . . ?
S6 Ag7 O3 79.5(7) . 7_666 ?
S5 Ag7 Ag3 108.88(19) . 7_666 ?
S5 Ag7 Ag9 49.08(12) . 4_655 ?
S5 Ag7 Ag2 52.32(14) . 7_666 ?
S5 Ag7 O3 107.4(8) . 7_666 ?
O3 Ag7 Ag3 78.1(6) 7_666 7_666 ?
O3 Ag7 Ag9 82.2(6) 7_666 4_655 ?
O3 Ag7 Ag2 89.8(8) 7_666 7_666 ?
Ag9 S4 Ag10 76.58(11) 4_655 4_655 ?
Ag9 S4 Ag5 77.20(17) 4_655 . ?
Ag4 S4 Ag9 132.53(17) . 4_655 ?
Ag4 S4 Ag10 86.93(13) . 4_655 ?
Ag4 S4 Ag5 85.3(2) . . ?
Ag10 S4 Ag5 135.8(3) 4_655 . ?
C20 S4 Ag9 114.5(6) . 4_655 ?
C20 S4 Ag4 112.9(6) . . ?
C20 S4 Ag10 109.1(8) . 4_655 ?
C20 S4 Ag5 114.0(9) . . ?
C20 S4 Ag 99(2) . . ?
Ag S4 Ag4 94.0(12) . . ?
O2 S1 O2 180.0(15) . 7_666 ?
O2 S1 O1 91.6(13) 7_666 7_666 ?
O2 S1 O1 88.4(13) 7_666 . ?
O2 S1 O1 91.6(13) . . ?
O2 S1 O1 88.4(13) . 7_666 ?
O1 S1 O1 180.0 7_666 . ?
O4 S1 O2 62.8(16) 7_666 . ?
O4 S1 O2 117.2(16) . . ?
O4 S1 O2 117.2(16) 7_666 7_666 ?
O4 S1 O2 62.8(16) . 7_666 ?
O4 S1 O1 107.9(18) 7_666 7_666 ?
O4 S1 O1 72.1(18) . 7_666 ?
O4 S1 O1 107.9(18) . . ?
O4 S1 O1 72.1(18) 7_666 . ?
O4 S1 O4 180(2) . 7_666 ?
O4 S1 O3 66.9(17) . 7_666 ?
O4 S1 O3 113.1(17) 7_666 7_666 ?
O4 S1 O3 113.1(17) . . ?
O4 S1 O3 66.9(17) 7_666 . ?
O3 S1 O2 57.5(14) . 7_666 ?
O3 S1 O2 57.5(14) 7_666 . ?
O3 S1 O2 122.5(14) . . ?
O3 S1 O2 122.5(14) 7_666 7_666 ?
O3 S1 O1 98.1(16) . . ?
O3 S1 O1 98.1(16) 7_666 7_666 ?
O3 S1 O1 81.9(16) . 7_666 ?
O3 S1 O1 81.9(16) 7_666 . ?
O3 S1 O3 180.0 . 7_666 ?
Ag8 S2 Ag6 126.91(19) . 7_666 ?
Ag8 S2 Ag5 80.70(19) . 7_666 ?
Ag8 S2 Ag1 97.76(16) . . ?
Ag6 S2 Ag5 66.9(2) 7_666 7_666 ?
Ag1 S2 Ag6 79.29(14) . 7_666 ?
Ag1 S2 Ag5 134.6(2) . 7_666 ?
C2 S2 Ag8 115.5(6) . . ?
C2 S2 Ag6 114.5(6) . 7_666 ?
C2 S2 Ag5 109.3(6) . 7_666 ?
C2 S2 Ag1 111.9(6) . . ?
Ag4 S6 Ag3 70.57(13) 7_666 7_666 ?
Ag4 S6 Ag0B 142.3(5) 7_666 . ?
Ag8 S6 Ag3 129.61(19) . 7_666 ?
Ag8 S6 Ag4 76.20(14) . 7_666 ?
Ag8 S6 Ag7 93.9(3) . . ?
Ag8 S6 Ag0B 106.2(7) . . ?
Ag7 S6 Ag3 78.5(2) . 7_666 ?
Ag7 S6 Ag4 127.8(4) . 7_666 ?
C34 S6 Ag3 112.5(7) . 7_666 ?
C34 S6 Ag4 110.5(7) . 7_666 ?
C34 S6 Ag8 114.2(6) . . ?
C34 S6 Ag7 120.0(8) . . ?
C34 S6 Ag0B 102.7(9) . . ?
Ag2 S3 Ag3 72.16(14) . . ?
Ag2 S3 Ag10 132.8(2) . 4_655 ?
Ag10 S3 Ag3 92.63(15) 4_655 . ?
Ag1 S3 Ag3 136.9(2) . . ?
Ag1 S3 Ag2 76.11(14) . . ?
Ag1 S3 Ag10 88.00(14) . 4_655 ?
C9 S3 Ag3 105.9(9) . . ?
C9 S3 Ag2 111.1(5) . . ?
C9 S3 Ag10 116.0(6) . 4_655 ?
C9 S3 Ag1 112.4(9) . . ?
Ag9 S5 Ag2 133.61(19) 4_655 7_666 ?
Ag6 S5 Ag9 83.38(14) . 4_655 ?
Ag6 S5 Ag2 80.72(16) . 7_666 ?
Ag6 S5 Ag7 131.7(4) . . ?
Ag6 S5 Ag0B 148.9(7) . . ?
Ag7 S5 Ag9 82.7(2) . 4_655 ?
Ag7 S5 Ag2 76.4(2) . 7_666 ?
C31 S5 Ag9 110.2(10) . 4_655 ?
C31 S5 Ag2 116.2(10) . 7_666 ?
C31 S5 Ag6 111.2(10) . . ?
C31 S5 Ag7 117.0(11) . . ?
C31 S5 Ag0B 99.2(13) . . ?
C29 O14 H14 109.5 . . ?
C22 O10 Ag6 122.2(11) . . ?
C7 O5 Ag2 101(2) . . ?
C11 O8 Ag4 124.1(10) . . ?
C22 O9 Ag5 127.6(11) . . ?
C22 O9 Ag 135.9(15) . . ?
C11 O7 Ag3 129.6(11) . . ?
C18 O11 Ag9 130.4(14) . . ?
O13 C29 O14 121.5(15) . . ?
O13 C29 C26 123.1(15) . . ?
O14 C29 C26 115.3(14) . . ?
C13 C12 C17 118.1(15) . . ?
C13 C12 C11 122.2(15) . . ?
C17 C12 C11 119.7(15) . . ?
C25 C26 C29 121.7(15) . . ?
C25 C26 C27 118.7(15) . . ?
C27 C26 C29 119.6(15) . . ?
C24 C23 C22 120.3(16) . . ?
C24 C23 C28 118.0(15) . . ?
C28 C23 C22 121.6(15) . . ?
C18 O12 Ag10 124.1(13) . . ?
C13 C14 H14A 120.2 . . ?
C13 C14 C15 119.7(17) . . ?
C15 C14 H14A 120.2 . . ?
C12 C13 H13 119.2 . . ?
C14 C13 C12 121.6(17) . . ?
C14 C13 H13 119.2 . . ?
C14 C15 C18 117.8(17) . . ?
C16 C15 C14 118.1(16) . . ?
C16 C15 C18 123.9(18) . . ?
C12 C17 H17 120.1 . . ?
C16 C17 C12 119.9(16) . . ?
C16 C17 H17 120.1 . . ?
C15 C16 C17 122.1(18) . . ?
C15 C16 H16 119.0 . . ?
C17 C16 H16 119.0 . . ?
C23 C24 H24 119.9 . . ?
C23 C24 C25 120.2(16) . . ?
C25 C24 H24 119.9 . . ?
C26 C25 C24 121.1(16) . . ?
C26 C25 H25 119.5 . . ?
C24 C25 H25 119.5 . . ?
O10 C22 O9 125.4(15) . . ?
O10 C22 C23 115.2(17) . . ?
O9 C22 C23 119.3(15) . . ?
S6 C34 H34 97.1 . . ?
S6 C34 H34A 109.2 . . ?
C33 C34 S6 116(4) . . ?
C33 C34 H34 97.1 . . ?
C35 C34 S6 113(2) . . ?
C35 C34 H34 97.1 . . ?
C35 C34 C33 126(4) . . ?
C36 C34 S6 106(3) . . ?
C36 C34 H34A 109.2 . . ?
C36 C34 C41 109(4) . . ?
C41 C34 S6 113.8(19) . . ?
C41 C34 H34A 109.2 . . ?
S4 C20 H20 101.4 . . ?
S4 C20 H20A 116.8 . . ?
C19 C20 S4 124(3) . . ?
C19 C20 H20 101.4 . . ?
C19 C20 C21 115(3) . . ?
C21 C20 S4 110(2) . . ?
C21 C20 H20 101.4 . . ?
C37 C20 S4 103(2) . . ?
C37 C20 H20A 116.8 . . ?
C01N C20 S4 105(2) . . ?
C01N C20 H20A 116.8 . . ?
C01N C20 C37 95(4) . . ?
S2 C2 H2A 108.6 . . ?
S2 C2 H2B 114.9 . . ?
C1 C2 S2 110.3(13) . . ?
C1 C2 H2A 108.6 . . ?
C3 C2 S2 107.8(13) . . ?
C3 C2 H2A 108.6 . . ?
C3 C2 C1 112.9(18) . . ?
C38 C2 S2 95(8) . . ?
C38 C2 H2B 114.9 . . ?
C39 C2 S2 107(9) . . ?
C39 C2 H2B 114.9 . . ?
C39 C2 C38 108(10) . . ?
C26 C27 H27 120.0 . . ?
C28 C27 C26 120.0(17) . . ?
C28 C27 H27 120.0 . . ?
O11 C18 O12 126.3(19) . . ?
O11 C18 C15 118.4(19) . . ?
O12 C18 C15 113.7(19) . . ?
C23 C28 H28 119.1 . . ?
C27 C28 C23 121.9(16) . . ?
C27 C28 H28 119.1 . . ?
O8 C11 O7 122.7(15) . . ?
O8 C11 C12 121.0(14) . . ?
O7 C11 C12 116.2(16) . . ?
C7 O6 Ag3 137(2) . . ?
C6 C5 C7 122.5(19) . . ?
C4 C5 C7 116.7(19) . . ?
C4 C5 C6 120.8(16) . . ?
O5 C7 C5 116(2) . . ?
O6 C7 O5 126(3) . . ?
O6 C7 C5 118(2) . . ?
O6A C7 C5 109(3) . . ?
O5A C7 C5 125(4) . . ?
O5A C7 O6A 123(3) . . ?
C34 C33 H33A 107.9 . . ?
C34 C33 H33B 111.1 . . ?
C34 C33 H33C 109.3 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
S3 C9 H9A 99.0 . . ?
S3 C9 H9B 102.7 . . ?
C10 C9 S3 111.8(14) . . ?
C10 C9 H9A 99.0 . . ?
C10 C9 C8 129(3) . . ?
C8 C9 S3 112.1(14) . . ?
C8 C9 H9A 99.0 . . ?
C01T C9 S3 113.0(14) . . ?
C01T C9 H9B 102.7 . . ?
C01T C9 C40 121(4) . . ?
C40 C9 S3 111.8(14) . . ?
C40 C9 H9B 102.7 . . ?
C5 C6 H6 119.5 . . ?
C4 C6 C5 121.0(18) 5_766 . ?
C4 C6 H6 119.5 5_766 . ?
C5 C4 C6 118(2) . 5_766 ?
C5 C4 H4 121.0 . . ?
C6 C4 H4 121.0 5_766 . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C20 C19 H19A 109.5 . . ?
C20 C19 H19B 109.5 . . ?
C20 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
S5 C31 H31 118.4 . . ?
S5 C31 H31A 110.7 . . ?
C32 C31 S5 103(3) . . ?
C32 C31 H31 118.4 . . ?
C32 C31 C30 91(5) . . ?
C30 C31 S5 103(2) . . ?
C30 C31 H31 118.4 . . ?
C14A C31 S5 117(3) . . ?
C14A C31 H31A 110.7 . . ?
C14A C31 C01Q 101(4) . . ?
C01Q C31 S5 106(2) . . ?
C01Q C31 H31A 110.7 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35B 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C9 C8 H8A 109.5 . . ?
C9 C8 H8B 109.5 . . ?
C9 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
S1 O2 Ag8 116.2(13) . . ?
O4 O2 Ag8 96.7(18) 7_666 . ?
O4 O2 S1 51.1(13) 7_666 . ?
O3 O2 Ag8 88.5(18) 7_666 . ?
O3 O2 S1 60.0(13) 7_666 . ?
O3 O2 O4 105(2) 7_666 7_666 ?
S1 O1 O4 42.8(12) . 7_666 ?
S1 O4 O2 66.1(15) . 7_666 ?
S1 O4 O1 65.1(16) . 7_666 ?
S1 O4 O3 62.5(16) . 7_666 ?
O2 O4 O1 90(2) 7_666 7_666 ?
O2 O4 O3 122(2) 7_666 7_666 ?
O3 O4 O1 93(2) 7_666 7_666 ?
S1 O3 Ag7 121.3(16) . 7_666 ?
S1 O3 O4 50.6(13) . 7_666 ?
O2 O3 Ag7 142(2) 7_666 7_666 ?
O2 O3 S1 62.4(13) 7_666 . ?
O2 O3 O4 107(2) 7_666 7_666 ?
O4 O3 Ag7 98.5(19) 7_666 7_666 ?
C31 C30 H30A 109.5 . . ?
C31 C30 H30B 109.3 . . ?
C31 C30 H30C 109.7 . . ?
H30A C30 H30B 109.4 . . ?
H30A C30 H30C 109.4 . . ?
H30B C30 H30C 109.5 . . ?
C31 C14A H14B 109.5 . . ?
C31 C14A H14C 109.5 . . ?
C31 C14A H14D 109.5 . . ?
H14B C14A H14C 109.5 . . ?
H14B C14A H14D 109.5 . . ?
H14C C14A H14D 109.5 . . ?
C31 C01Q H01A 109.5 . . ?
C31 C01Q H01B 109.5 . . ?
C31 C01Q H01C 109.5 . . ?
H01A C01Q H01B 109.5 . . ?
H01A C01Q H01C 109.5 . . ?
H01B C01Q H01C 109.5 . . ?
C9 C01T H01D 109.5 . . ?
C9 C01T H01E 109.5 . . ?
C9 C01T H01F 109.5 . . ?
H01D C01T H01E 109.5 . . ?
H01D C01T H01F 109.5 . . ?
H01E C01T H01F 109.5 . . ?
C9 C40 H40A 110.6 . . ?
C9 C40 H40B 109.0 . . ?
C9 C40 H40C 108.9 . . ?
H40A C40 H40B 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36B 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C34 C41 H41A 109.5 . . ?
C34 C41 H41B 109.5 . . ?
C34 C41 H41C 109.5 . . ?
H41A C41 H41B 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C20 C37 H37A 109.5 . . ?
C20 C37 H37B 109.5 . . ?
C20 C37 H37C 109.5 . . ?
H37A C37 H37B 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C20 C01N H01G 109.5 . . ?
C20 C01N H01H 109.5 . . ?
C20 C01N H01I 109.5 . . ?
H01G C01N H01H 109.5 . . ?
H01G C01N H01I 109.5 . . ?
H01H C01N H01I 109.5 . . ?
C2 C38 H38A 108.3 . . ?
C2 C38 H38B 109.8 . . ?
C2 C38 H38C 110.3 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C2 C39 H39A 110.1 . . ?
C2 C39 H39B 105.5 . . ?
C2 C39 H39C 112.7 . . ?
H39A C39 H39B 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
Ag2 Ag0B Ag3 54.18(16) 7_666 7_666 ?
S6 Ag0B Ag3 50.2(2) . 7_666 ?
S6 Ag0B Ag2 102.9(4) . 7_666 ?
S5 Ag0B Ag3 104.3(4) . 7_666 ?
S5 Ag0B Ag2 50.7(2) . 7_666 ?
S5 Ag0B S6 146.6(11) . . ?
Ag9 Ag Ag6 62.9(7) 4_655 . ?
S4 Ag Ag9 51.8(3) . 4_655 ?
S4 Ag Ag6 112.0(14) . . ?
O9 Ag Ag9 125.8(8) . 4_655 ?
O9 Ag Ag6 76.2(11) . . ?
O9 Ag S4 159(4) . . ?
C7 O6A Ag3 135(3) . . ?
C7 O5A Ag2 117(4) . . ?

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
Ag3 S6 C34 C33 105(6) 7_666 . . . ?
Ag3 S6 C34 C35 -52(3) 7_666 . . . ?
Ag3 S6 C34 C36 113(5) 7_666 . . . ?
Ag3 S6 C34 C41 -7(3) 7_666 . . . ?
Ag3 S3 C9 C10 106(3) . . . . ?
Ag3 S3 C9 C8 -47(3) . . . . ?
Ag3 S3 C9 C01T -90(4) . . . . ?
Ag3 S3 C9 C40 129(4) . . . . ?
Ag3 O7 C11 O8 20(3) . . . . ?
Ag3 O7 C11 C12 -155.9(13) . . . . ?
Ag3 O6 C7 O5 37(6) . . . . ?
Ag3 O6 C7 C5 -143(3) . . . . ?
Ag9 S4 C20 C19 133(4) 4_655 . . . ?
Ag9 S4 C20 C21 -8(4) 4_655 . . . ?
Ag9 S4 C20 C37 128(3) 4_655 . . . ?
Ag9 S4 C20 C01N 29(3) 4_655 . . . ?
Ag9 S5 C31 C32 133(5) 4_655 . . . ?
Ag9 S5 C31 C30 38(3) 4_655 . . . ?
Ag9 S5 C31 C14A 146(4) 4_655 . . . ?
Ag9 S5 C31 C01Q -102(3) 4_655 . . . ?
Ag9 O11 C18 O12 15(4) . . . . ?
Ag9 O11 C18 C15 -149.8(16) . . . . ?
Ag2 S3 C9 C10 -178(3) . . . . ?
Ag2 S3 C9 C8 29(3) . . . . ?
Ag2 S3 C9 C01T -13(4) . . . . ?
Ag2 S3 C9 C40 -154(3) . . . . ?
Ag2 S5 C31 C32 -48(5) 7_666 . . . ?
Ag2 S5 C31 C30 -142(3) 7_666 . . . ?
Ag2 S5 C31 C14A -34(4) 7_666 . . . ?
Ag2 S5 C31 C01Q 78(3) 7_666 . . . ?
Ag2 O5 C7 O6 12(4) . . . . ?
Ag2 O5 C7 C5 -168.8(16) . . . . ?
Ag4 S4 C20 C19 -45(4) . . . . ?
Ag4 S4 C20 C21 174(3) . . . . ?
Ag4 S4 C20 C37 -50(3) . . . . ?
Ag4 S4 C20 C01N -149(3) . . . . ?
Ag4 S6 C34 C33 29(6) 7_666 . . . ?
Ag4 S6 C34 C35 -129(3) 7_666 . . . ?
Ag4 S6 C34 C36 36(5) 7_666 . . . ?
Ag4 S6 C34 C41 -84(3) 7_666 . . . ?
Ag4 O8 C11 O7 -2(3) . . . . ?
Ag4 O8 C11 C12 173.9(13) . . . . ?
Ag10 S4 C20 C19 50(4) 4_655 . . . ?
Ag10 S4 C20 C21 -91(3) 4_655 . . . ?
Ag10 S4 C20 C37 44(3) 4_655 . . . ?
Ag10 S4 C20 C01N -55(3) 4_655 . . . ?
Ag10 S3 C9 C10 4(3) 4_655 . . . ?
Ag10 S3 C9 C8 -148(3) 4_655 . . . ?
Ag10 S3 C9 C01T 169(4) 4_655 . . . ?
Ag10 S3 C9 C40 28(4) 4_655 . . . ?
Ag10 O12 C18 O11 -14(4) . . . . ?
Ag10 O12 C18 C15 152.2(14) . . . . ?
Ag8 S2 C2 C1 173.8(12) . . . . ?
Ag8 S2 C2 C3 50.1(18) . . . . ?
Ag8 S2 C2 C38 126(10) . . . . ?
Ag8 S2 C2 C39 16(11) . . . . ?
Ag8 S6 C34 C33 -55(6) . . . . ?
Ag8 S6 C34 C35 148(3) . . . . ?
Ag8 S6 C34 C36 -47(5) . . . . ?
Ag8 S6 C34 C41 -167(3) . . . . ?
Ag6 S2 C2 C1 12.4(16) 7_666 . . . ?
Ag6 S2 C2 C3 -111.3(15) 7_666 . . . ?
Ag6 S2 C2 C38 -35(10) 7_666 . . . ?
Ag6 S2 C2 C39 -146(11) 7_666 . . . ?
Ag6 S5 C31 C32 42(5) . . . . ?
Ag6 S5 C31 C30 -52(3) . . . . ?
Ag6 S5 C31 C14A 56(4) . . . . ?
Ag6 S5 C31 C01Q 168(3) . . . . ?
Ag6 O10 C22 O9 -7(3) . . . . ?
Ag6 O10 C22 C23 169.1(12) . . . . ?
Ag5 S4 C20 C19 -140(4) . . . . ?
Ag5 S4 C20 C21 78(4) . . . . ?
Ag5 S2 C2 C1 85.1(14) 7_666 . . . ?
Ag5 S2 C2 C3 -38.6(17) 7_666 . . . ?
Ag5 O9 C22 O10 7(3) . . . . ?
Ag5 O9 C22 C23 -168.9(12) . . . . ?
Ag1 S2 C2 C1 -75.5(15) . . . . ?
Ag1 S2 C2 C3 160.8(15) . . . . ?
Ag1 S2 C2 C38 -123(10) . . . . ?
Ag1 S2 C2 C39 127(11) . . . . ?
Ag1 S3 C9 C10 -95(3) . . . . ?
Ag1 S3 C9 C8 113(3) . . . . ?
Ag1 S3 C9 C01T 70(4) . . . . ?
Ag1 S3 C9 C40 -71(4) . . . . ?
Ag7 S6 C34 C33 -165(5) . . . . ?
Ag7 S6 C34 C35 37(3) . . . . ?
Ag7 S5 C31 C32 -135(4) . . . . ?
Ag7 S5 C31 C30 130(3) . . . . ?
O13 C29 C26 C25 4(3) . . . . ?
O13 C29 C26 C27 -174.7(18) . . . . ?
O14 C29 C26 C25 -178(2) . . . . ?
O14 C29 C26 C27 3(3) . . . . ?
C29 C26 C25 C24 -179.8(18) . . . . ?
C29 C26 C27 C28 177.8(18) . . . . ?
C12 C17 C16 C15 8(3) . . . . ?
C26 C27 C28 C23 1(3) . . . . ?
C23 C24 C25 C26 3(3) . . . . ?
C14 C15 C16 C17 -6(3) . . . . ?
C14 C15 C18 O11 -24(3) . . . . ?
C14 C15 C18 O12 169(2) . . . . ?
C13 C12 C17 C16 -7(3) . . . . ?
C13 C12 C11 O8 -161.4(19) . . . . ?
C13 C12 C11 O7 15(3) . . . . ?
C13 C14 C15 C16 3(3) . . . . ?
C13 C14 C15 C18 179.2(19) . . . . ?
C15 C14 C13 C12 -4(3) . . . . ?
C17 C12 C13 C14 5(3) . . . . ?
C17 C12 C11 O8 20(3) . . . . ?
C17 C12 C11 O7 -163.6(18) . . . . ?
C16 C15 C18 O11 151(2) . . . . ?
C16 C15 C18 O12 -16(3) . . . . ?
C24 C23 C22 O10 174.5(18) . . . . ?
C24 C23 C22 O9 -9(3) . . . . ?
C24 C23 C28 C27 0(3) . . . . ?
C25 C26 C27 C28 -1(3) . . . . ?
C22 C23 C24 C25 174.7(19) . . . . ?
C22 C23 C28 C27 -176.7(18) . . . . ?
C27 C26 C25 C24 -1(3) . . . . ?
C18 C15 C16 C17 179(2) . . . . ?
C28 C23 C24 C25 -2(3) . . . . ?
C28 C23 C22 O10 -9(3) . . . . ?
C28 C23 C22 O9 167.8(19) . . . . ?
C11 C12 C13 C14 -172.8(19) . . . . ?
C11 C12 C17 C16 170.9(18) . . . . ?
C5 C7 O6A Ag3 167(4) . . . . ?
C5 C7 O5A Ag2 -172(2) . . . . ?
C7 C5 C6 C4 -175(2) . . . 5_766 ?
C7 C5 C4 C6 175(2) . . . 5_766 ?
C6 C5 C7 O5 -165(3) . . . . ?
C6 C5 C7 O6 15(4) . . . . ?
C6 C5 C7 O6A -21(4) . . . . ?
C6 C5 C7 O5A 180(5) . . . . ?
C6 C5 C4 C6 -3(4) . . . 5_766 ?
C4 C5 C7 O5 17(4) . . . . ?
C4 C5 C7 O6 -164(3) . . . . ?
C4 C5 C7 O6A 161(4) . . . . ?
C4 C5 C7 O5A 1(5) . . . . ?
C4 C5 C6 C4 3(4) . . . 5_766 ?
O2 S1 O1 O4 -119.3(17) 7_666 . . 7_666 ?
O2 S1 O1 O4 60.7(17) . . . 7_666 ?
O2 S1 O4 O2 180.001(4) . . . 7_666 ?
O2 S1 O4 O1 -78.5(17) . . . 7_666 ?
O2 S1 O4 O1 101.5(17) 7_666 . . 7_666 ?
O2 S1 O4 O3 -151(2) 7_666 . . 7_666 ?
O2 S1 O4 O3 29(2) . . . 7_666 ?
O2 S1 O3 Ag7 -137(3) 7_666 . . 7_666 ?
O2 S1 O3 Ag7 43(3) . . . 7_666 ?
O2 S1 O3 O2 179.998(2) . . . 7_666 ?
O2 S1 O3 O4 149(2) 7_666 . . 7_666 ?
O2 S1 O3 O4 -31(2) . . . 7_666 ?
O1 S1 O2 Ag8 -172.1(15) 7_666 . . . ?
O1 S1 O2 Ag8 7.9(15) . . . . ?
O1 S1 O2 O4 111(2) 7_666 . . 7_666 ?
O1 S1 O2 O4 -69(2) . . . 7_666 ?
O1 S1 O2 O3 -100.7(19) 7_666 . . 7_666 ?
O1 S1 O2 O3 79.3(19) . . . 7_666 ?
O1 S1 O4 O2 78.5(17) . . . 7_666 ?
O1 S1 O4 O2 -101.5(17) 7_666 . . 7_666 ?
O1 S1 O4 O1 179.997(6) . . . 7_666 ?
O1 S1 O4 O3 107.4(19) 7_666 . . 7_666 ?
O1 S1 O4 O3 -72.6(19) . . . 7_666 ?
O1 S1 O3 Ag7 140.5(17) . . . 7_666 ?
O1 S1 O3 Ag7 -39.5(17) 7_666 . . 7_666 ?
O1 S1 O3 O2 97.1(18) 7_666 . . 7_666 ?
O1 S1 O3 O2 -82.9(18) . . . 7_666 ?
O1 S1 O3 O4 -113(2) 7_666 . . 7_666 ?
O1 S1 O3 O4 67(2) . . . 7_666 ?
O4 S1 O2 Ag8 -103(2) . . . . ?
O4 S1 O2 Ag8 77(2) 7_666 . . . ?
O4 S1 O2 O4 180.000(4) . . . 7_666 ?
O4 S1 O2 O3 -32(3) . . . 7_666 ?
O4 S1 O2 O3 148(3) 7_666 . . 7_666 ?
O4 S1 O1 O4 180.002(6) . . . 7_666 ?
O4 S1 O3 Ag7 74(2) 7_666 . . 7_666 ?
O4 S1 O3 Ag7 -106(2) . . . 7_666 ?
O4 S1 O3 O2 -149(2) 7_666 . . 7_666 ?
O4 S1 O3 O2 31(2) . . . 7_666 ?
O4 S1 O3 O4 179.999(7) . . . 7_666 ?
O3 S1 O2 Ag8 -71.5(19) 7_666 . . . ?
O3 S1 O2 Ag8 108.5(19) . . . . ?
O3 S1 O2 O4 -148(3) 7_666 . . 7_666 ?
O3 S1 O2 O4 32(3) . . . 7_666 ?
O3 S1 O2 O3 180.001(1) . . . 7_666 ?
O3 S1 O1 O4 -62.5(18) . . . 7_666 ?
O3 S1 O1 O4 117.5(18) 7_666 . . 7_666 ?
O3 S1 O4 O2 151(2) 7_666 . . 7_666 ?
O3 S1 O4 O2 -29(2) . . . 7_666 ?
O3 S1 O4 O1 72.6(19) . . . 7_666 ?
O3 S1 O4 O1 -107.4(19) 7_666 . . 7_666 ?
O3 S1 O4 O3 179.998(8) . . . 7_666 ?
Ag0B S6 C34 C36 -162(5) . . . . ?
Ag0B S6 C34 C41 78(3) . . . . ?
Ag0B S5 C31 C14A -118(4) . . . . ?
Ag0B S5 C31 C01Q -6(3) . . . . ?
Ag S4 C20 C37 -148(3) . . . . ?
Ag S4 C20 C01N 113(3) . . . . ?
Ag O9 C22 O10 -13(5) . . . . ?
Ag O9 C22 C23 170(3) . . . . ?
O6A C7 O5A Ag2 32(7) . . . . ?
O5A C7 O6A Ag3 -33(8) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 -0.406 0.790 -0.554 3638.8 651.4 '36 CH4O'

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_exptl_crystal_mounting_method nothing
_olex2_submission_original_sample_id xyh03
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_xyh20210722_111_4_2_0m_a
_database_code_depnum_ccdc_archive 'CCDC 2180650'
loop_
_audit_author_name
_audit_author_address
'Yuhan Xia'
;Huazhong University of Scienceand Technology
China
;
_audit_update_record             
;
2022-06-21 deposited with the CCDC.	2022-08-26 downloaded from the CCDC.
;
_audit_creation_date             2022-06-20
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        xyh02
_chemical_formula_moiety         'C132 H250 Ag46 F24 N4 O52 S30 V10'
_chemical_formula_sum            'C132 H250 Ag46 F24 N4 O52 S30 V10'
_chemical_formula_weight         9614.57
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
V V 0.3005 0.5294 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
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                   20.0954(6)
_cell_length_b                   28.1776(9)
_cell_length_c                   22.1646(8)
_cell_angle_alpha                90
_cell_angle_beta                 93.5630(10)
_cell_angle_gamma                90
_cell_volume                     12526.2(7)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9894
_cell_measurement_temperature    298.2
_cell_measurement_theta_max      25.34
_cell_measurement_theta_min      2.59
_shelx_estimated_absorpt_T_max   0.680
_shelx_estimated_absorpt_T_min   0.573
_exptl_absorpt_coefficient_mu    4.177
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5923
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.0775 before and 0.0586 after correction.
The Ratio of minimum to maximum transmission is 0.7948.
The λ/2 correction factor is 0.00150.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear orangish orange'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   orangish
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.549
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             9148
_exptl_crystal_preparation       'stir for 2h'
_exptl_crystal_recrystallization_method 'at room temperature'
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0583
_diffrn_reflns_av_unetI/netI     0.0605
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       33
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            89067
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.420
_diffrn_reflns_theta_min         2.506
_diffrn_ambient_temperature      298.2
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           30.0
_diffrn_source_power             1.35
_diffrn_source_voltage           45.0
_diffrn_special_details          nothing
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                14491
_reflns_number_total             22940
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT v8.37A (Bruker, 2015)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT v8.37A (Bruker, 2015)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.3 (Bourhis et al., 2015)'
_refine_diff_density_max         1.483
_refine_diff_density_min         -1.173
_refine_diff_density_rms         0.127
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.028
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1867
_refine_ls_number_reflns         22940
_refine_ls_number_restraints     1167
_refine_ls_R_factor_all          0.1011
_refine_ls_R_factor_gt           0.0578
_refine_ls_restrained_S_all      1.015
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0528P)²+76.2740P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1318
_refine_ls_wR_factor_ref         0.1521
_refine_special_details          nothing
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C52A-N3 = N3-C53A
 1.43 with sigma of 0.02
 C53-N2 = N2-C52
 1.43 with sigma of 0.02
 C13-C14 = C77A-C14 = C15-C14 = C86A-C14 = C37-C36 = C97A-C36 = C35-C36 = C88A-
 C36
 1.54 with sigma of 0.01
 C25A-N2A = N2A-C24A
 1.43 with sigma of 0.02
 C49-C50 = C51-C50
 1.54 with sigma of 0.01
 C39-C38 = C39-C21 = C40-C39 = C96A-C39
 1.54 with sigma of 0.01
 C21-C39 = C39-C96A
 1.54 with sigma of 0.02
 C6-C5 = C4-C5 = C73A-C5 = C22-C5
 1.54 with sigma of 0.01
 C30-N1 = N1-C29
 1.43 with sigma of 0.02
 C1-C2 = C67A-C2 = C3-C2 = C49A-C2
 1.54 with sigma of 0.01
 C48-C47 = C46-C47
 1.54 with sigma of 0.01
 C02R-C01P = C02Q-C01P = C67-C01P = C025-C01P
 1.54 with sigma of 0.01
 C67A-C2 = C2-C49A
 1.54 with sigma of 0.02
 F10-C55 = C55-F11
 1.38 with sigma of 0.02
 F11-C55 = C55-F12
 1.38 with sigma of 0.02
 F3A-C55 = C55-F4A
 1.38 with sigma of 0.02
 F1A-C55 = C55-F3A
 1.38 with sigma of 0.02
 C42-C43 = C42-C63A = C42-C56A = C42-C41
 1.54 with sigma of 0.01
 C46-C47 = C1A-C47 = C80A-C47 = C48-C47
 1.54 with sigma of 0.01
 O10A-C28 = C28-O20A
 1.2 with sigma of 0.02
 O15-C20 = C20-O16
 1.2 with sigma of 0.02
 O21A-C45 = C45-O27
 1.2 with sigma of 0.02
 O3A-C56 = C56-O4A
 1.2 with sigma of 0.02
 O11A-C20 = C20-O12A
 1.2 with sigma of 0.02
 C23-C8 = C8-C69A
 1.54 with sigma of 0.02
 C53-C52
 2.336 with sigma of 0.04
 C52A-C53A
 2.336 with sigma of 0.04
 N3-O22A
 2.152 with sigma of 0.04
 C25A-C24A
 2.336 with sigma of 0.04
 C21-C96A
 2.515 with sigma of 0.04
 C30-C29
 2.336 with sigma of 0.04
 C67A-C49A
 2.515 with sigma of 0.04
 F10-F11
 2.254 with sigma of 0.04
 F11-F12
 2.254 with sigma of 0.04
 F3A-F4A
 2.254 with sigma of 0.04
 F1A-F3A
 2.254 with sigma of 0.04
 O10A-O20A
 2.078 with sigma of 0.04
 O15-O16
 2.078 with sigma of 0.04
 O3A-O4A
 2.078 with sigma of 0.04
 O21A-O27
 2.078 with sigma of 0.04
 O11A-O12A
 2.078 with sigma of 0.04
 C23-C69A
 2.515 with sigma of 0.04
 C54-C52 \\sim C54-C53 \\sim C54A-C53A \\sim C54A-C52A
 with sigma of 0.02
 N3-C54A \\sim N2-C54
 with sigma of 0.02
 Ag10-O22 \\sim Ag15-O19
 with sigma of 0.02
 C54-C52 \\sim C54-C53
 with sigma of 0.02
 O22A-C54A \\sim O22-C54
 with sigma of 0.02
 Ag10-O22A \\sim Ag10-O22
 with sigma of 0.02
 C24A-C20A \\sim C25A-C20A
 with sigma of 0.02
 F4-F5 \\sim F4-F6 \\sim F5-F6 \\sim F20A-F16A \\sim F20A-F14A \\sim F16A-F14A
 with sigma of 0.04
 C27-C28 \\sim C27-F4 \\sim C27-F5 \\sim C27-F6 \\sim C27-F20A \\sim C27-F16A
\\sim C27-F14A
 with sigma of 0.02
 F9-C44 \\sim F8-C44 \\sim F7-C44 \\sim F0-C44 \\sim F01Y-C44 \\sim F01V-C44
 with sigma of 0.02
 O19-C20A \\sim O19-C31
 with sigma of 0.02
 N2A-C20A \\sim N1-C31
 with sigma of 0.02
 O3A-C55 \\sim O4A-C55
 with sigma of 0.02
3. Restrained planarity
 C52A, N3, C53A, C54A, O22A
 with sigma of 0.1
4. Uiso/Uaniso restraints and constraints
O22 \\sim N2 \\sim C53 \\sim C54 \\sim C52 \\sim O22A \\sim N3 \\sim C53A \\sim
C54A \\sim C52A: within 2A with sigma of 0.01 and sigma for terminal atoms of
0.02 within 2A
C8 \\sim C7 \\sim C9 \\sim C69A \\sim C23: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
O5 \\sim O8 \\sim O13 \\sim O7 \\sim O2 \\sim O9 \\sim O3 \\sim O10 \\sim O6
\\sim O1 \\sim O12 \\sim O4 \\sim O11 \\sim O14 \\sim O25 \\sim O21 \\sim O20
\\sim O26 \\sim O24 \\sim O23 \\sim O17 \\sim O16 \\sim O15 \\sim O18 \\sim
O10A \\sim O20A \\sim O11A \\sim O12A \\sim O3A \\sim O4A \\sim O19 \\sim O22
\\sim O27 \\sim O21A \\sim O22A: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02 within 2A
O15 \\sim O12A \\sim O16 \\sim O11A \\sim C20: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
N1 \\sim C31 \\sim C30 \\sim C29 \\sim C20A \\sim N2A \\sim C25A \\sim C24A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02 within 2A
C14 \\sim C13 \\sim C15 \\sim C77A \\sim C86A \\sim C36 \\sim C35 \\sim C37
\\sim C97A \\sim C88A: within 2A with sigma of 0.01 and sigma for terminal
atoms of 0.02 within 2A
C50 \\sim C51 \\sim C49: within 2A with sigma of 0.01 and sigma for terminal
atoms of 0.02 within 2A
C5 \\sim C6 \\sim C4 \\sim C73A \\sim C22 \\sim C38 \\sim C21 \\sim C40 \\sim
C96A \\sim C39: within 2A with sigma of 0.01 and sigma for terminal atoms of
0.02 within 2A
C2 \\sim C3 \\sim C1 \\sim C67A \\sim C49A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C28 \\sim F4 \\sim F5 \\sim C27 \\sim F6 \\sim F20A \\sim F16A \\sim F14A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02 within 2A
F9 \\sim F8 \\sim F7 \\sim C44 \\sim F0 \\sim F01Y \\sim F01V: within 2A with
sigma of 0.01 and sigma for terminal atoms of 0.02 within 2A
C01P \\sim C025 \\sim C02Q \\sim C02R \\sim C67: within 2A with sigma of 0.01
and sigma for terminal atoms of 0.02 within 2A
C56 \\sim C55 \\sim F11 \\sim F12 \\sim F10 \\sim F1A \\sim F3A \\sim F4A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.02 within 2A
C42 \\sim C41 \\sim C43 \\sim C56A \\sim C63A: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
C80A \\sim C48 \\sim C47 \\sim C1A \\sim C46: within 2A with sigma of 0.01 and
sigma for terminal atoms of 0.02 within 2A
Uanis(N2) \\sim Ueq, Uanis(C53) \\sim Ueq, Uanis(C52) \\sim Ueq, Uanis(N3)
\\sim Ueq, Uanis(C53A) \\sim Ueq, Uanis(C54A) \\sim Ueq, Uanis(C52A) \\sim Ueq,
Uanis(O22) \\sim Ueq, Uanis(C54) \\sim Ueq, Uanis(O22A) \\sim Ueq: with sigma
of 0.1 and sigma for terminal atoms of 0.2
5. Others
 Sof(Ag24)=1-FVAR(1)
 Sof(Ag23)=FVAR(1)
 Sof(Ag25)=1-FVAR(2)
 Sof(Ag13)=FVAR(2)
 Sof(Ag0R)=1-FVAR(3)
 Sof(Ag9)=FVAR(3)
 Sof(Ag27)=1-FVAR(4)
 Sof(Ag14)=FVAR(4)
 Sof(H2B)=Sof(C67A)=Sof(H67A)=Sof(H67B)=Sof(H67C)=Sof(C49A)=Sof(H49D)=
 Sof(H49E)=Sof(H49F)=1-FVAR(5)
 Sof(H2A)=Sof(C3)=Sof(H3A)=Sof(H3B)=Sof(H3C)=Sof(C1)=Sof(H1A)=Sof(H1B)=
 Sof(H1C)=FVAR(5)
 Sof(H39A)=Sof(C21)=Sof(H21A)=Sof(H21B)=Sof(H21C)=Sof(C96A)=Sof(H96A)=
 Sof(H96B)=Sof(H96C)=1-FVAR(6)
 Sof(H39)=Sof(C40)=Sof(H40A)=Sof(H40B)=Sof(H40C)=Sof(C38)=Sof(H38A)=Sof(H38B)=
 Sof(H38C)=FVAR(6)
 Sof(H5B)=Sof(C73A)=Sof(H73A)=Sof(H73B)=Sof(H73C)=Sof(C22)=Sof(H22A)=Sof(H22B)=
 Sof(H22C)=1-FVAR(7)
 Sof(H5A)=Sof(C6)=Sof(H6A)=Sof(H6B)=Sof(H6C)=Sof(C4)=Sof(H4A)=Sof(H4B)=
 Sof(H4C)=FVAR(7)
 Sof(O10A)=Sof(O20A)=1-FVAR(8)
 Sof(O17)=Sof(O18)=FVAR(8)
 Sof(F20A)=Sof(F16A)=Sof(F14A)=1-FVAR(9)
 Sof(F4)=Sof(F5)=Sof(F6)=FVAR(9)
 Sof(Ag26)=1-FVAR(10)
 Sof(Ag8)=FVAR(10)
 Sof(O11A)=Sof(O12A)=1-FVAR(11)
 Sof(O16)=Sof(O15)=FVAR(11)
 Sof(F0)=Sof(F01Y)=Sof(F01V)=1-FVAR(12)
 Sof(F9)=Sof(F8)=Sof(F7)=FVAR(12)
 Sof(H01A)=Sof(C02R)=Sof(H02G)=Sof(H02H)=Sof(H02I)=Sof(C67)=Sof(H67D)=
 Sof(H67E)=Sof(H67F)=1-FVAR(13)
 Sof(H01P)=Sof(C025)=Sof(H02A)=Sof(H02B)=Sof(H02C)=Sof(C02Q)=Sof(H02D)=
 Sof(H02E)=Sof(H02F)=FVAR(13)
 Sof(F1A)=Sof(F3A)=Sof(F4A)=1-FVAR(14)
 Sof(F11)=Sof(F12)=Sof(F10)=FVAR(14)
 Sof(O3A)=Sof(O4A)=1-FVAR(15)
 Sof(O24)=Sof(O23)=FVAR(15)
 Sof(Ag0O)=1-FVAR(16)
 Sof(Ag16)=FVAR(16)
 Sof(Ag0T)=1-FVAR(17)
 Sof(Ag17)=FVAR(17)
 Sof(Ag0L)=1-FVAR(18)
 Sof(Ag18)=FVAR(18)
 Sof(C20A)=Sof(H20A)=Sof(N2A)=Sof(C25A)=Sof(H25A)=Sof(H25B)=Sof(H25C)=
 Sof(C24A)=Sof(H24D)=Sof(H24E)=Sof(H24F)=1-FVAR(19)
 Sof(N1)=Sof(C31)=Sof(H31)=Sof(C30)=Sof(H30A)=Sof(H30B)=Sof(H30C)=Sof(C29)=
 Sof(H29A)=Sof(H29B)=Sof(H29C)=FVAR(19)
 Sof(H42A)=Sof(C56A)=Sof(H56A)=Sof(H56B)=Sof(H56C)=Sof(C63A)=Sof(H63A)=
 Sof(H63B)=Sof(H63C)=1-FVAR(20)
 Sof(H42)=Sof(C41)=Sof(H41A)=Sof(H41B)=Sof(H41C)=Sof(C43)=Sof(H43A)=Sof(H43B)=
 Sof(H43C)=FVAR(20)
 Sof(H8B)=Sof(C69A)=Sof(H69A)=Sof(H69B)=Sof(H69C)=Sof(C23)=Sof(H23A)=Sof(H23B)=
 Sof(H23C)=1-FVAR(21)
 Sof(H8A)=Sof(C7)=Sof(H7A)=Sof(H7B)=Sof(H7C)=Sof(C9)=Sof(H9A)=Sof(H9B)=
 Sof(H9C)=FVAR(21)
 Sof(H47A)=Sof(C1A)=Sof(H1AA)=Sof(H1AB)=Sof(H1AC)=Sof(C80A)=Sof(H80A)=
 Sof(H80B)=Sof(H80C)=1-FVAR(22)
 Sof(H47)=Sof(C48)=Sof(H48A)=Sof(H48B)=Sof(H48C)=Sof(C46)=Sof(H46A)=Sof(H46B)=
 Sof(H46C)=FVAR(22)
 Sof(H36A)=Sof(C97A)=Sof(H97A)=Sof(H97B)=Sof(H97C)=Sof(C88A)=Sof(H88A)=
 Sof(H88B)=Sof(H88C)=1-FVAR(23)
 Sof(H36)=Sof(C35)=Sof(H35A)=Sof(H35B)=Sof(H35C)=Sof(C37)=Sof(H37A)=Sof(H37B)=
 Sof(H37C)=FVAR(23)
 Sof(H14A)=Sof(C77A)=Sof(H77A)=Sof(H77B)=Sof(H77C)=Sof(C86A)=Sof(H86A)=
 Sof(H86B)=Sof(H86C)=1-FVAR(24)
 Sof(H14)=Sof(C13)=Sof(H13A)=Sof(H13B)=Sof(H13C)=Sof(C15)=Sof(H15A)=Sof(H15B)=
 Sof(H15C)=FVAR(24)
 Sof(O27)=Sof(O21A)=1-FVAR(25)
 Sof(O21)=Sof(O20)=FVAR(25)
 Sof(O22A)=Sof(N3)=Sof(C53A)=Sof(H53D)=Sof(H53E)=Sof(H53F)=Sof(C54A)=Sof(H54C)=
 Sof(H54D)=Sof(C52A)=Sof(H52D)=Sof(H52E)=Sof(H52F)=1-FVAR(26)
 Sof(O22)=Sof(N2)=Sof(C53)=Sof(H53A)=Sof(H53B)=Sof(H53C)=Sof(C54)=Sof(H54A)=
 Sof(H54B)=Sof(C52)=Sof(H52A)=Sof(H52B)=Sof(H52C)=FVAR(26)
6.a Riding coordinates:
 C49(H49A,H49B,H49C), C21(H21A,H21B,H21C), C96A(H96A,H96B,H96C), C22(H22A,H22B,
 H22C), C30(H30A,H30B,H30C), C25A(H25A,H25B,H25C), C24A(H24D,H24E,H24F),
 C52(H52A,H52B,H52C), C69A(H69A,H69B,H69C), C23(H23A,H23B,H23C), C77A(H77A,H77B,
 H77C), C53A(H53D,H53E,H53F), C52A(H52D,H52E,H52F)
6.b Ternary CH refined with riding coordinates:
 C01P(H01P), C01P(H01A), C47(H47), C47(H47A), C14(H14), C14(H14A), C50(H50),
 C5(H5A), C5(H5B), C17(H17), C36(H36), C36(H36A), C8(H8A), C8(H8B), C2(H2A),
 C2(H2B), C11(H11), C39(H39), C39(H39A), C58(H58), C25(H25), C33(H33), C42(H42),
  C42(H42A)
6.c Secondary CH2 refined with riding coordinates:
 C54(H54A,H54B), C54A(H54C,H54D)
6.d Aromatic/amide H refined with riding coordinates:
 C66(H66), C65(H65), C64(H64), C63(H63), C62(H62), C31(H31), C20A(H20A)
6.e Fitted hexagon refined as free rotating group:
 C61(C66,C65,C64,C63,C62)
6.f Idealised Me refined as rotating group:
 C025(H02A,H02B,H02C), C02Q(H02D,H02E,H02F), C51(H51A,H51B,H51C), C7(H7A,H7B,
 H7C), C18(H18A,H18B,H18C), C13(H13A,H13B,H13C), C15(H15A,H15B,H15C), C35(H35A,
 H35B,H35C), C37(H37A,H37B,H37C), C9(H9A,H9B,H9C), C3(H3A,H3B,H3C), C1(H1A,H1B,
 H1C), C48(H48A,H48B,H48C), C46(H46A,H46B,H46C), C12(H12A,H12B,H12C), C10(H10A,
 H10B,H10C), C6(H6A,H6B,H6C), C40(H40A,H40B,H40C), C4(H4A,H4B,H4C), C38(H38A,
 H38B,H38C), C59(H59A,H59B,H59C), C57(H57A,H57B,H57C), C26(H26A,H26B,H26C),
 C24(H24A,H24B,H24C), C34(H34A,H34B,H34C), C32(H32A,H32B,H32C), C41(H41A,H41B,
 H41C), C43(H43A,H43B,H43C), C16(H16A,H16B,H16C), C67A(H67A,H67B,H67C),
 C49A(H49D,H49E,H49F), C73A(H73A,H73B,H73C), C02R(H02G,H02H,H02I), C67(H67D,
 H67E,H67F), C29(H29A,H29B,H29C), C56A(H56A,H56B,H56C), C63A(H63A,H63B,H63C),
 C53(H53A,H53B,H53C), C1A(H1AA,H1AB,H1AC), C80A(H80A,H80B,H80C), C97A(H97A,H97B,
 H97C), C88A(H88A,H88B,H88C), C86A(H86A,H86B,H86C)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag21 Ag 0.30358(4) 0.55189(3) 0.56084(4) 0.0608(2) Uani 1 1 d . . . . .
Ag3 Ag 0.44783(5) 0.45349(3) 0.28956(4) 0.0706(3) Uani 1 1 d . . . . .
Ag6 Ag 0.69679(4) 0.35934(3) 0.52891(5) 0.0721(3) Uani 1 1 d . . . . .
Ag12 Ag 0.39564(5) 0.63467(3) 0.62058(4) 0.0757(3) Uani 1 1 d . . . . .
Ag19 Ag 0.29973(5) 0.58207(3) 0.28734(5) 0.0754(3) Uani 1 1 d . . . . .
Ag2 Ag 0.42311(5) 0.55769(3) 0.22851(5) 0.0762(3) Uani 1 1 d . . . . .
Ag22 Ag 0.20120(4) 0.48387(4) 0.49546(5) 0.0763(3) Uani 1 1 d . . . . .
Ag15 Ag 0.48318(5) 0.22418(3) 0.54843(5) 0.0806(3) Uani 1 1 d D . . . .
Ag4 Ag 0.42532(6) 0.33957(4) 0.40533(5) 0.0844(3) Uani 1 1 d . . . . .
Ag7 Ag 0.62559(6) 0.25110(4) 0.53604(6) 0.0936(4) Uani 1 1 d . . . . .
Ag11 Ag 0.41147(6) 0.56805(4) 0.75807(5) 0.0899(3) Uani 1 1 d . . . . .
Ag10 Ag 0.39592(6) 0.47405(4) 0.82705(5) 0.0946(3) Uani 1 1 d D . . . .
Ag20 Ag 0.18956(6) 0.56752(5) 0.37425(5) 0.1084(4) Uani 1 1 d . . . . .
Ag1 Ag 0.40465(6) 0.66206(5) 0.31744(6) 0.1002(4) Uani 1 1 d . . . . .
Ag13 Ag 0.32133(10) 0.48922(5) 0.70447(11) 0.0730(8) Uani 0.739(5) 1 d . . P A
1
Ag14 Ag 0.30050(6) 0.39570(5) 0.64307(7) 0.0770(5) Uani 0.772(3) 1 d . . P A 1
Ag23 Ag 0.22732(7) 0.37923(5) 0.52534(8) 0.0734(6) Uani 0.720(4) 1 d . . P A 1
Ag5 Ag 0.54588(6) 0.26553(5) 0.41839(6) 0.1136(5) Uani 1 1 d . . . . .
Ag8 Ag 0.4601(3) 0.2825(3) 0.6596(4) 0.0877(15) Uani 0.74(3) 1 d . . P A 1
Ag18 Ag 0.2468(6) 0.4860(3) 0.3040(4) 0.117(3) Uani 0.83(2) 1 d . . P B 1
V3 V 0.47664(6) 0.53583(4) 0.55360(6) 0.0261(3) Uani 1 1 d . . . . .
V4 V 0.60225(6) 0.46994(5) 0.57645(6) 0.0298(3) Uani 1 1 d . . . . .
Ag16 Ag 0.3726(5) 0.3014(2) 0.5318(4) 0.0832(19) Uani 0.62(3) 1 d . . P A 1
V2 V 0.39117(6) 0.44546(5) 0.51083(6) 0.0304(3) Uani 1 1 d . . . . .
V1 V 0.51635(7) 0.38261(5) 0.53742(7) 0.0328(3) Uani 1 1 d . . . . .
Ag9 Ag 0.40581(13) 0.34824(10) 0.7526(3) 0.0810(12) Uani 0.667(12) 1 d . . P A
1
V5 V 0.46938(7) 0.44800(5) 0.63439(6) 0.0339(3) Uani 1 1 d . . . . .
Ag17 Ag 0.2797(3) 0.4133(6) 0.3759(4) 0.104(3) Uani 0.66(3) 1 d . . P B 1
S8 S 0.32419(12) 0.56807(9) 0.66961(12) 0.0505(6) Uani 1 1 d . . . . .
S3 S 0.49820(14) 0.48590(10) 0.19924(12) 0.0578(7) Uani 1 1 d . . . . .
S5 S 0.65571(13) 0.30281(9) 0.45023(12) 0.0539(6) Uani 1 1 d . . . . .
S4 S 0.37773(14) 0.39235(9) 0.32895(12) 0.0576(7) Uani 1 1 d . . . . .
S9 S 0.21427(12) 0.57574(10) 0.48527(12) 0.0529(6) Uani 1 1 d . . . . .
S7 S 0.32385(14) 0.41867(10) 0.76391(13) 0.0622(7) Uani 1 1 d . . . . .
S15 S 0.30909(14) 0.51422(11) 0.22211(13) 0.0635(7) Uani 1 1 d . . . . .
S12 S 0.43156(14) 0.26050(10) 0.45469(15) 0.0643(8) Uani 1 1 d . . . . .
S1 S 0.29023(15) 0.64726(10) 0.35457(14) 0.0662(8) Uani 1 1 d . . . . .
S10 S 0.20242(13) 0.44195(11) 0.59384(14) 0.0648(7) Uani 1 1 d . . . . .
S2 S 0.46855(16) 0.63874(11) 0.23035(15) 0.0703(8) Uani 1 1 d . . . . .
S6 S 0.56676(16) 0.25127(10) 0.63113(14) 0.0680(8) Uani 1 1 d . . . . .
S14 S 0.18090(14) 0.46208(12) 0.38346(14) 0.0699(8) Uani 1 1 d . . . . .
S11 S 0.34978(15) 0.31403(11) 0.63351(17) 0.0744(9) Uani 1 1 d . . . . .
O5 O 0.4966(2) 0.46273(17) 0.5380(2) 0.0251(11) Uani 1 1 d . . . . .
O8 O 0.5708(2) 0.53612(17) 0.5660(2) 0.0276(11) Uani 1 1 d . . . . .
O13 O 0.4597(3) 0.52072(18) 0.6243(2) 0.0324(12) Uani 1 1 d . . . . .
O7 O 0.3930(2) 0.51727(18) 0.5139(2) 0.0308(12) Uani 1 1 d . . . . .
O2 O 0.4256(3) 0.38661(18) 0.5069(3) 0.0353(13) Uani 1 1 d . . . . .
O9 O 0.4658(2) 0.59548(17) 0.5482(2) 0.0308(12) Uani 1 1 d . . . . .
O3 O 0.6002(3) 0.40645(19) 0.5583(3) 0.0363(13) Uani 1 1 d . . . . .
S13 S 0.2544(3) 0.32241(17) 0.4510(3) 0.1326(18) Uani 1 1 d . . . . .
O10 O 0.4910(3) 0.38714(19) 0.6151(3) 0.0387(13) Uani 1 1 d . . . . .
O6 O 0.6795(3) 0.4785(2) 0.5981(3) 0.0405(14) Uani 1 1 d . . . . .
O1 O 0.5303(3) 0.32700(18) 0.5287(3) 0.0410(14) Uani 1 1 d . . . . .
O12 O 0.5615(3) 0.46471(19) 0.6465(2) 0.0342(13) Uani 1 1 d . . . . .
O4 O 0.3148(3) 0.4389(2) 0.4866(3) 0.0395(14) Uani 1 1 d . . . . .
O11 O 0.3859(3) 0.44525(18) 0.5932(3) 0.0351(13) Uani 1 1 d . . . . .
O14 O 0.4484(3) 0.4446(2) 0.7024(3) 0.0446(15) Uani 1 1 d . . . . .
O25 O 0.4366(5) 0.6531(3) 0.7203(4) 0.092(3) Uani 1 1 d . . . . .
O21 O 0.3906(18) 0.2825(8) 0.8142(11) 0.107(5) Uani 0.79(5) 1 d . U P A 1
C01P C 0.1446(5) 0.6059(4) 0.5213(6) 0.080(3) Uani 1 1 d D U . . .
H01P H 0.154737 0.612746 0.564196 0.095 Uiso 0.50(4) 1 calc R U P C 1
H01A H 0.165214 0.625083 0.554236 0.095 Uiso 0.50(4) 1 calc R U P C 2
O20 O 0.4519(11) 0.2352(9) 0.7549(7) 0.116(5) Uani 0.79(5) 1 d . U P A 1
O26 O 0.4811(7) 0.7164(5) 0.6871(6) 0.141(5) Uani 1 1 d . . . . .
F9 F 0.4366(11) 0.2201(6) 0.9011(7) 0.134(5) Uani 0.661(17) 1 d D U P D 1
C60 C 0.4593(7) 0.6925(6) 0.7269(7) 0.081(4) Uani 1 1 d . . . . .
F8 F 0.3673(7) 0.1840(7) 0.8463(10) 0.118(5) Uani 0.661(17) 1 d D U P D 1
C45 C 0.4213(7) 0.2469(6) 0.8002(8) 0.092(5) Uani 1 1 d D . . . .
F7 F 0.4731(9) 0.1746(6) 0.8398(9) 0.124(5) Uani 0.661(17) 1 d D U P D 1
C025 C 0.1275(19) 0.6506(11) 0.484(2) 0.082(7) Uani 0.50(4) 1 d D U P C 1
H02A H 0.114253 0.641699 0.443152 0.123 Uiso 0.50(4) 1 calc R U P C 1
H02B H 0.165884 0.670849 0.484094 0.123 Uiso 0.50(4) 1 calc R U P C 1
H02C H 0.091554 0.667198 0.501285 0.123 Uiso 0.50(4) 1 calc R U P C 1
C47 C 0.1208(6) 0.4260(5) 0.6201(7) 0.099(4) Uani 1 1 d D U . . .
H47 H 0.127732 0.419782 0.663566 0.119 Uiso 0.298(17) 1 calc R U P E 1
H47A H 0.110657 0.448237 0.652294 0.119 Uiso 0.702(17) 1 calc R U P E 2
C14 C 0.3545(7) 0.3538(4) 0.2646(6) 0.094(4) Uani 1 1 d D U . . .
H14 H 0.395720 0.345191 0.245831 0.113 Uiso 0.745(17) 1 calc R U P F 1
H14A H 0.377469 0.326340 0.283345 0.113 Uiso 0.255(17) 1 calc R U P F 2
C50 C 0.2452(7) 0.4053(5) 0.7992(8) 0.129(6) Uani 1 1 d D U . . .
H50 H 0.220532 0.385005 0.769616 0.155 Uiso 1 1 calc R U . . .
C5 C 0.4345(8) 0.6704(6) 0.1652(7) 0.116(5) Uani 1 1 d D U . . .
H5A H 0.451181 0.703100 0.167892 0.140 Uiso 0.58(3) 1 calc R U P G 1
H5B H 0.428336 0.704368 0.172899 0.140 Uiso 0.42(3) 1 calc R U P G 2
C02Q C 0.0855(12) 0.5713(10) 0.510(2) 0.100(7) Uani 0.50(4) 1 d D U P C 1
H02D H 0.050821 0.579495 0.536286 0.150 Uiso 0.50(4) 1 calc R U P C 1
H02E H 0.100344 0.539478 0.518919 0.150 Uiso 0.50(4) 1 calc R U P C 1
H02F H 0.068720 0.573364 0.468888 0.150 Uiso 0.50(4) 1 calc R U P C 1
C44 C 0.4250(6) 0.2055(5) 0.8445(7) 0.110(4) Uani 1 1 d D U . . .
C17 C 0.1014(8) 0.4339(7) 0.3578(9) 0.125(6) Uani 1 1 d . . . . .
H17 H 0.099715 0.403771 0.379719 0.150 Uiso 1 1 calc R U . . .
C51 C 0.2026(8) 0.4497(5) 0.8024(9) 0.135(6) Uani 1 1 d D U . . .
H51A H 0.159270 0.441255 0.814968 0.202 Uiso 1 1 calc R U . . .
H51B H 0.198073 0.464335 0.763222 0.202 Uiso 1 1 calc R U . . .
H51C H 0.223439 0.471501 0.830928 0.202 Uiso 1 1 calc R U . . .
C36 C 0.3781(6) 0.2182(4) 0.4105(6) 0.089(4) Uani 1 1 d D U . . .
H36 H 0.338574 0.235137 0.393787 0.106 Uiso 0.58(3) 1 calc R U P H 1
H36A H 0.357684 0.235400 0.375665 0.106 Uiso 0.42(3) 1 calc R U P H 2
C8 C 0.2564(12) 0.5255(7) 0.1512(10) 0.149(7) Uani 1 1 d D U . . .
H8A H 0.289236 0.524053 0.120388 0.178 Uiso 0.85(2) 1 calc R U P I 1
H8B H 0.256858 0.559455 0.141950 0.178 Uiso 0.15(2) 1 calc R U P I 2
C7 C 0.2164(14) 0.4815(9) 0.1381(12) 0.159(8) Uani 0.85(2) 1 d . U P I 1
H7A H 0.181560 0.479336 0.165683 0.238 Uiso 0.85(2) 1 calc R U P I 1
H7B H 0.244844 0.454228 0.142710 0.238 Uiso 0.85(2) 1 calc R U P I 1
H7C H 0.197096 0.482779 0.097379 0.238 Uiso 0.85(2) 1 calc R U P I 1
C18 C 0.0461(8) 0.4608(10) 0.3752(10) 0.196(13) Uani 1 1 d . . . . .
H18A H 0.047227 0.491752 0.357173 0.295 Uiso 1 1 calc R U . . .
H18B H 0.048114 0.463825 0.418390 0.295 Uiso 1 1 calc R U . . .
H18C H 0.005503 0.445021 0.361727 0.295 Uiso 1 1 calc R U . . .
C13 C 0.3227(13) 0.3078(6) 0.2854(9) 0.118(6) Uani 0.745(17) 1 d D U P F 1
H13A H 0.280375 0.314773 0.301297 0.177 Uiso 0.745(17) 1 calc R U P F 1
H13B H 0.351383 0.293184 0.316280 0.177 Uiso 0.745(17) 1 calc R U P F 1
H13C H 0.316197 0.286538 0.251709 0.177 Uiso 0.745(17) 1 calc R U P F 1
C15 C 0.3105(11) 0.3802(6) 0.2173(8) 0.110(6) Uani 0.745(17) 1 d D U P F 1
H15A H 0.266982 0.384712 0.231945 0.165 Uiso 0.745(17) 1 calc R U P F 1
H15B H 0.306818 0.362029 0.180603 0.165 Uiso 0.745(17) 1 calc R U P F 1
H15C H 0.329937 0.410556 0.209456 0.165 Uiso 0.745(17) 1 calc R U P F 1
C35 C 0.3556(19) 0.1804(10) 0.4550(12) 0.107(7) Uani 0.58(3) 1 d D U P H 1
H35A H 0.317736 0.163624 0.437154 0.161 Uiso 0.58(3) 1 calc R U P H 1
H35B H 0.343598 0.195579 0.491569 0.161 Uiso 0.58(3) 1 calc R U P H 1
H35C H 0.391373 0.158484 0.464101 0.161 Uiso 0.58(3) 1 calc R U P H 1
C37 C 0.4149(14) 0.1977(12) 0.3579(12) 0.095(7) Uani 0.58(3) 1 d D U P H 1
H37A H 0.453926 0.180972 0.373536 0.142 Uiso 0.58(3) 1 calc R U P H 1
H37B H 0.427903 0.223038 0.332219 0.142 Uiso 0.58(3) 1 calc R U P H 1
H37C H 0.386078 0.176220 0.335120 0.142 Uiso 0.58(3) 1 calc R U P H 1
C9 C 0.2296(12) 0.5674(8) 0.1414(10) 0.147(8) Uani 0.85(2) 1 d . U P I 1
H9A H 0.199818 0.574371 0.172468 0.221 Uiso 0.85(2) 1 calc R U P I 1
H9B H 0.205292 0.567594 0.102749 0.221 Uiso 0.85(2) 1 calc R U P I 1
H9C H 0.264134 0.590980 0.141892 0.221 Uiso 0.85(2) 1 calc R U P I 1
C49 C 0.2598(9) 0.3733(7) 0.8532(9) 0.178(8) Uani 1 1 d D U . . .
H49A H 0.302488 0.381434 0.872298 0.267 Uiso 1 1 d R U . . .
H49B H 0.260358 0.340774 0.840298 0.267 Uiso 1 1 d R U . . .
H49C H 0.225978 0.377494 0.881428 0.267 Uiso 1 1 d R U . . .
C2 C 0.2372(9) 0.6935(6) 0.3202(7) 0.134(6) Uani 1 1 d D U . . .
H2A H 0.271724 0.716678 0.311626 0.161 Uiso 0.72(2) 1 calc R U P J 1
H2B H 0.250299 0.703157 0.280127 0.161 Uiso 0.28(2) 1 calc R U P J 2
C3 C 0.2004(14) 0.7221(10) 0.3662(10) 0.143(8) Uani 0.72(2) 1 d D U P J 1
H3A H 0.181680 0.700838 0.394497 0.215 Uiso 0.72(2) 1 calc R U P J 1
H3B H 0.165378 0.740101 0.345689 0.215 Uiso 0.72(2) 1 calc R U P J 1
H3C H 0.231088 0.743254 0.387483 0.215 Uiso 0.72(2) 1 calc R U P J 1
C1 C 0.2108(13) 0.6832(7) 0.2557(8) 0.136(8) Uani 0.72(2) 1 d D U P J 1
H1A H 0.198602 0.650331 0.252157 0.204 Uiso 0.72(2) 1 calc R U P J 1
H1B H 0.244740 0.690166 0.228397 0.204 Uiso 0.72(2) 1 calc R U P J 1
H1C H 0.172380 0.702606 0.245885 0.204 Uiso 0.72(2) 1 calc R U P J 1
C61 C 0.4648(6) 0.7142(4) 0.7882(4) 0.100(5) Uani 1 1 d G . . . .
C66 C 0.5008(6) 0.7558(5) 0.7989(7) 0.141(7) Uani 1 1 d G . . . .
H66 H 0.521392 0.770587 0.767453 0.169 Uiso 1 1 calc R U . . .
C65 C 0.5061(7) 0.7754(4) 0.8566(8) 0.170(10) Uani 1 1 d G . . . .
H65 H 0.530234 0.803192 0.863732 0.204 Uiso 1 1 calc R U . . .
C64 C 0.4754(8) 0.7533(6) 0.9036(6) 0.189(12) Uani 1 1 d G . . . .
H64 H 0.478964 0.766380 0.942166 0.226 Uiso 1 1 calc R U . . .
C63 C 0.4394(8) 0.7117(5) 0.8929(5) 0.165(9) Uani 1 1 d G . . . .
H63 H 0.418850 0.696962 0.924322 0.199 Uiso 1 1 calc R U . . .
C62 C 0.4341(6) 0.6922(4) 0.8352(6) 0.123(6) Uani 1 1 d G . . . .
H62 H 0.410006 0.664356 0.828043 0.148 Uiso 1 1 calc R U . . .
C48 C 0.0695(19) 0.4664(13) 0.614(3) 0.112(8) Uani 0.298(17) 1 d D U P E 1
H48A H 0.078610 0.489336 0.644965 0.168 Uiso 0.298(17) 1 calc R U P E 1
H48B H 0.025482 0.453735 0.616614 0.168 Uiso 0.298(17) 1 calc R U P E 1
H48C H 0.072356 0.481339 0.574847 0.168 Uiso 0.298(17) 1 calc R U P E 1
C46 C 0.092(2) 0.3798(13) 0.592(3) 0.110(7) Uani 0.298(17) 1 d D U P E 1
H46A H 0.063945 0.364742 0.618972 0.165 Uiso 0.298(17) 1 calc R U P E 1
H46B H 0.128453 0.358886 0.583367 0.165 Uiso 0.298(17) 1 calc R U P E 1
H46C H 0.067254 0.387119 0.554472 0.165 Uiso 0.298(17) 1 calc R U P E 1
C11 C 0.4548(7) 0.4603(5) 0.1307(6) 0.082(4) Uani 1 1 d . . . . .
H11 H 0.408158 0.455163 0.139673 0.099 Uiso 1 1 calc R U . . .
C12 C 0.4552(10) 0.4960(6) 0.0812(7) 0.133(7) Uani 1 1 d . . . . .
H12A H 0.455681 0.527365 0.098176 0.200 Uiso 1 1 calc R U . . .
H12B H 0.415983 0.492164 0.054594 0.200 Uiso 1 1 calc R U . . .
H12C H 0.494141 0.491575 0.058857 0.200 Uiso 1 1 calc R U . . .
C39 C 0.1862(9) 0.2811(8) 0.4332(10) 0.169(7) Uani 1 1 d D U . . .
H39 H 0.195066 0.261310 0.398190 0.203 Uiso 0.67(3) 1 calc R U P K 1
H39A H 0.209758 0.256022 0.412447 0.203 Uiso 0.33(3) 1 calc R U P K 2
C10 C 0.4829(10) 0.4134(7) 0.1157(9) 0.161(9) Uani 1 1 d . . . . .
H10A H 0.505144 0.415810 0.078670 0.241 Uiso 1 1 calc R U . . .
H10B H 0.447644 0.390502 0.110928 0.241 Uiso 1 1 calc R U . . .
H10C H 0.514290 0.403579 0.147685 0.241 Uiso 1 1 calc R U . . .
C6 C 0.3577(9) 0.6723(12) 0.1668(16) 0.120(8) Uani 0.58(3) 1 d D U P G 1
H6A H 0.340229 0.695475 0.138312 0.180 Uiso 0.58(3) 1 calc R U P G 1
H6B H 0.345926 0.680813 0.206666 0.180 Uiso 0.58(3) 1 calc R U P G 1
H6C H 0.339391 0.641694 0.156355 0.180 Uiso 0.58(3) 1 calc R U P G 1
C40 C 0.1169(10) 0.3030(11) 0.4265(19) 0.169(9) Uani 0.67(3) 1 d D U P K 1
H40A H 0.102780 0.311610 0.465596 0.254 Uiso 0.67(3) 1 calc R U P K 1
H40B H 0.086123 0.280481 0.408007 0.254 Uiso 0.67(3) 1 calc R U P K 1
H40C H 0.118032 0.330852 0.401542 0.254 Uiso 0.67(3) 1 calc R U P K 1
C4 C 0.452(2) 0.6501(13) 0.1042(11) 0.133(7) Uani 0.58(3) 1 d D U P G 1
H4A H 0.437525 0.617805 0.100857 0.200 Uiso 0.58(3) 1 calc R U P G 1
H4B H 0.499759 0.651378 0.101275 0.200 Uiso 0.58(3) 1 calc R U P G 1
H4C H 0.430867 0.668540 0.072090 0.200 Uiso 0.58(3) 1 calc R U P G 1
C38 C 0.1777(17) 0.2508(13) 0.4895(13) 0.173(9) Uani 0.67(3) 1 d D U P K 1
H38A H 0.195864 0.219741 0.483537 0.259 Uiso 0.67(3) 1 calc R U P K 1
H38B H 0.131135 0.248100 0.496384 0.259 Uiso 0.67(3) 1 calc R U P K 1
H38C H 0.200681 0.265480 0.523840 0.259 Uiso 0.67(3) 1 calc R U P K 1
C58 C 0.2472(6) 0.5997(4) 0.6899(6) 0.075(3) Uani 1 1 d . . . . .
H58 H 0.234078 0.619066 0.654324 0.090 Uiso 1 1 calc R U . . .
C59 C 0.2612(8) 0.6340(6) 0.7388(7) 0.114(6) Uani 1 1 d . . . . .
H59A H 0.271614 0.617288 0.775960 0.170 Uiso 1 1 calc R U . . .
H59B H 0.222734 0.653647 0.743047 0.170 Uiso 1 1 calc R U . . .
H59C H 0.298382 0.653476 0.729517 0.170 Uiso 1 1 calc R U . . .
C57 C 0.1921(7) 0.5655(6) 0.6950(10) 0.139(8) Uani 1 1 d . . . . .
H57A H 0.199370 0.547521 0.731534 0.209 Uiso 1 1 calc R U . . .
H57B H 0.190363 0.544451 0.660877 0.209 Uiso 1 1 calc R U . . .
H57C H 0.150636 0.582422 0.695786 0.209 Uiso 1 1 calc R U . . .
C25 C 0.7230(6) 0.2758(5) 0.4087(6) 0.083(4) Uani 1 1 d . . . . .
H25 H 0.751410 0.301734 0.395788 0.100 Uiso 1 1 calc R U . . .
C26 C 0.7651(7) 0.2441(6) 0.4467(8) 0.111(5) Uani 1 1 d . . . . .
H26A H 0.782216 0.260954 0.481978 0.166 Uiso 1 1 calc R U . . .
H26B H 0.801466 0.233068 0.424391 0.166 Uiso 1 1 calc R U . . .
H26C H 0.739150 0.217513 0.458719 0.166 Uiso 1 1 calc R U . . .
C33 C 0.5826(9) 0.1997(5) 0.6803(6) 0.098(5) Uani 1 1 d . . . . .
H33 H 0.539304 0.186072 0.688783 0.118 Uiso 1 1 calc R U . . .
C24 C 0.6941(9) 0.2514(7) 0.3519(7) 0.144(8) Uani 1 1 d . . . . .
H24A H 0.674216 0.221799 0.362627 0.216 Uiso 1 1 calc R U . . .
H24B H 0.728960 0.245488 0.325194 0.216 Uiso 1 1 calc R U . . .
H24C H 0.660780 0.271349 0.332092 0.216 Uiso 1 1 calc R U . . .
C34 C 0.6149(10) 0.2150(6) 0.7378(9) 0.140(7) Uani 1 1 d . . . . .
H34A H 0.641537 0.242607 0.731435 0.210 Uiso 1 1 calc R U . . .
H34B H 0.642893 0.189938 0.754267 0.210 Uiso 1 1 calc R U . . .
H34C H 0.581575 0.222448 0.765496 0.210 Uiso 1 1 calc R U . . .
C32 C 0.6204(13) 0.1632(7) 0.6527(10) 0.186(11) Uani 1 1 d . . . . .
H32A H 0.662626 0.175762 0.642509 0.279 Uiso 1 1 calc R U . . .
H32B H 0.596227 0.152091 0.616702 0.279 Uiso 1 1 calc R U . . .
H32C H 0.627513 0.137244 0.680471 0.279 Uiso 1 1 calc R U . . .
C42 C 0.2888(9) 0.2690(5) 0.6517(8) 0.124(5) Uani 1 1 d D U . . .
H42 H 0.254514 0.272608 0.618584 0.149 Uiso 0.65(3) 1 calc R U P L 1
H42A H 0.304295 0.257414 0.691806 0.149 Uiso 0.35(3) 1 calc R U P L 2
C41 C 0.3131(15) 0.2186(6) 0.6424(16) 0.118(8) Uani 0.65(3) 1 d D U P L 1
H41A H 0.347134 0.210962 0.673245 0.177 Uiso 0.65(3) 1 calc R U P L 1
H41B H 0.331031 0.215990 0.603422 0.177 Uiso 0.65(3) 1 calc R U P L 1
H41C H 0.276495 0.196901 0.644827 0.177 Uiso 0.65(3) 1 calc R U P L 1
C43 C 0.2504(16) 0.2797(9) 0.7069(12) 0.128(8) Uani 0.65(3) 1 d D U P L 1
H43A H 0.209600 0.261840 0.704758 0.191 Uiso 0.65(3) 1 calc R U P L 1
H43B H 0.240435 0.312948 0.708057 0.191 Uiso 0.65(3) 1 calc R U P L 1
H43C H 0.276847 0.270920 0.742701 0.191 Uiso 0.65(3) 1 calc R U P L 1
C16 C 0.0988(9) 0.4219(9) 0.2952(10) 0.185(12) Uani 1 1 d . . . . .
H16A H 0.056967 0.406836 0.284024 0.277 Uiso 1 1 calc R U . . .
H16B H 0.134618 0.400506 0.287735 0.277 Uiso 1 1 calc R U . . .
H16C H 0.103117 0.450149 0.271571 0.277 Uiso 1 1 calc R U . . .
Ag24 Ag 0.2654(2) 0.37344(16) 0.5752(3) 0.105(2) Uani 0.280(4) 1 d . . P A 2
Ag25 Ag 0.2923(2) 0.4741(2) 0.6674(3) 0.0765(18) Uani 0.261(5) 1 d . . P A 2
Ag0R Ag 0.4159(2) 0.3653(4) 0.7933(7) 0.104(4) Uani 0.333(12) 1 d . . P A 2
O24 O 0.3484(7) 0.5835(6) 0.8515(6) 0.129(5) Uani 0.882(17) 1 d . U P A 1
O23 O 0.3430(10) 0.5151(6) 0.9029(7) 0.141(5) Uani 0.882(17) 1 d . U P A 1
F3 F -0.0050(8) 0.6168(6) 0.2349(8) 0.214(7) Uani 1 1 d . . . . .
C20 C 0.0836(9) 0.5763(9) 0.2818(9) 0.138(6) Uani 1 1 d D U . . .
F2 F -0.0206(7) 0.5496(7) 0.2440(7) 0.219(8) Uani 1 1 d . . . . .
C56 C 0.3321(12) 0.5551(12) 0.8888(12) 0.159(7) Uani 1 1 d D U . . .
O17 O 0.630(2) 0.1753(14) 0.507(2) 0.151(7) Uani 0.51(2) 1 d . U P A 1
O16 O 0.1384(8) 0.5665(9) 0.2754(10) 0.139(6) Uani 0.67(2) 1 d D U P B 1
O15 O 0.0634(11) 0.5913(9) 0.3296(9) 0.149(7) Uani 0.67(2) 1 d D U P B 1
C28 C 0.5941(13) 0.1506(6) 0.4718(13) 0.145(6) Uani 1 1 d D U . . .
F4 F 0.5782(12) 0.0844(6) 0.4112(9) 0.158(6) Uani 0.586(13) 1 d D U P M 1
C19 C 0.0272(9) 0.5781(9) 0.2333(10) 0.124(6) Uani 1 1 d . . . . .
F5 F 0.6655(8) 0.0836(6) 0.4645(12) 0.155(6) Uani 0.586(13) 1 d D U P M 1
C27 C 0.6013(8) 0.1012(5) 0.4657(7) 0.150(5) Uani 1 1 d D U . . .
F1 F 0.0427(8) 0.5743(8) 0.1805(7) 0.232(9) Uani 1 1 d . . . . .
F6 F 0.5789(14) 0.0714(7) 0.5079(11) 0.168(6) Uani 0.586(13) 1 d D U P M 1
Ag27 Ag 0.3386(3) 0.37283(18) 0.6886(3) 0.095(2) Uani 0.228(3) 1 d . . P A 2
C67A C 0.1644(13) 0.6769(16) 0.320(3) 0.137(8) Uani 0.28(2) 1 d D U P J 2
H67A H 0.161010 0.651607 0.348933 0.206 Uiso 0.28(2) 1 calc R U P J 2
H67B H 0.149834 0.665844 0.280681 0.206 Uiso 0.28(2) 1 calc R U P J 2
H67C H 0.136808 0.702942 0.331322 0.206 Uiso 0.28(2) 1 calc R U P J 2
C49A C 0.242(3) 0.7340(19) 0.367(3) 0.138(10) Uani 0.28(2) 1 d D U P J 2
H49D H 0.244274 0.720803 0.407170 0.207 Uiso 0.28(2) 1 calc R U P J 2
H49E H 0.203729 0.754117 0.361726 0.207 Uiso 0.28(2) 1 calc R U P J 2
H49F H 0.281706 0.752307 0.361833 0.207 Uiso 0.28(2) 1 calc R U P J 2
C21 C 0.136(3) 0.251(3) 0.467(3) 0.175(9) Uani 0.33(3) 1 d D U P K 2
H21A H 0.148271 0.218433 0.471975 0.262 Uiso 0.33(3) 1 d R U P K 2
H21B H 0.094631 0.253693 0.443775 0.262 Uiso 0.33(3) 1 d R U P K 2
H21C H 0.132201 0.265373 0.506105 0.262 Uiso 0.33(3) 1 d R U P K 2
C96A C 0.143(3) 0.302(2) 0.380(3) 0.162(10) Uani 0.33(3) 1 d D U P K 2
H96A H 0.098243 0.309300 0.390344 0.243 Uiso 0.33(3) 1 d R U P K 2
H96B H 0.141173 0.278720 0.348234 0.243 Uiso 0.33(3) 1 d R U P K 2
H96C H 0.164093 0.330170 0.366724 0.243 Uiso 0.33(3) 1 d R U P K 2
C73A C 0.374(2) 0.6478(16) 0.130(2) 0.127(8) Uani 0.42(3) 1 d D U P G 2
H73A H 0.379740 0.613938 0.129989 0.191 Uiso 0.42(3) 1 calc R U P G 2
H73B H 0.371644 0.659406 0.089438 0.191 Uiso 0.42(3) 1 calc R U P G 2
H73C H 0.334411 0.655851 0.149364 0.191 Uiso 0.42(3) 1 calc R U P G 2
C22 C 0.486(2) 0.6605(18) 0.1183(18) 0.123(9) Uani 0.42(3) 1 d D U P G 2
H22A H 0.505973 0.629745 0.125191 0.185 Uiso 0.42(3) 1 d R U P G 2
H22B H 0.520854 0.684195 0.120601 0.185 Uiso 0.42(3) 1 d R U P G 2
H22C H 0.463593 0.661355 0.078961 0.185 Uiso 0.42(3) 1 d R U P G 2
O18 O 0.5389(17) 0.1570(8) 0.4949(13) 0.147(7) Uani 0.51(2) 1 d . U P A 1
O10A O 0.5789(13) 0.1747(7) 0.4258(12) 0.133(8) Uani 0.49(2) 1 d D U P A 2
O20A O 0.6452(16) 0.1642(12) 0.4988(17) 0.141(9) Uani 0.49(2) 1 d D U P A 2
F20A F 0.6277(18) 0.0765(9) 0.5142(11) 0.157(7) Uani 0.414(13) 1 d D U P M 2
F16A F 0.6314(18) 0.0806(10) 0.4198(14) 0.168(7) Uani 0.414(13) 1 d D U P M 2
F14A F 0.5395(10) 0.0793(9) 0.4582(17) 0.157(7) Uani 0.414(13) 1 d D U P M 2
Ag26 Ag 0.4643(5) 0.2999(11) 0.6834(12) 0.094(5) Uani 0.26(3) 1 d . . P A 2
O11A O 0.111(2) 0.5412(13) 0.2589(17) 0.141(6) Uani 0.33(2) 1 d D U P B 2
O12A O 0.098(2) 0.5887(17) 0.3311(14) 0.140(6) Uani 0.33(2) 1 d D U P B 2
F0 F 0.429(2) 0.1632(8) 0.8182(14) 0.126(6) Uani 0.339(17) 1 d D U P D 2
F01Y F 0.3737(15) 0.1983(15) 0.8767(17) 0.119(7) Uani 0.339(17) 1 d D U P D 2
F01V F 0.4763(15) 0.2090(13) 0.8837(16) 0.128(7) Uani 0.339(17) 1 d D U P D 2
C55 C 0.3033(9) 0.5813(7) 0.9430(9) 0.177(6) Uani 1 1 d D U . . .
C02R C 0.0968(15) 0.5719(10) 0.551(2) 0.092(7) Uani 0.50(4) 1 d D U P C 2
H02G H 0.069444 0.589405 0.576741 0.138 Uiso 0.50(4) 1 calc R U P C 2
H02H H 0.121994 0.548496 0.573653 0.138 Uiso 0.50(4) 1 calc R U P C 2
H02I H 0.069009 0.556509 0.519677 0.138 Uiso 0.50(4) 1 calc R U P C 2
C67 C 0.1070(17) 0.6409(14) 0.4784(19) 0.081(7) Uani 0.50(4) 1 d D U P C 2
H67D H 0.137624 0.654979 0.452007 0.122 Uiso 0.50(4) 1 calc R U P C 2
H67E H 0.087266 0.665380 0.501621 0.122 Uiso 0.50(4) 1 calc R U P C 2
H67F H 0.072721 0.624397 0.454814 0.122 Uiso 0.50(4) 1 calc R U P C 2
F11 F 0.2361(11) 0.5891(16) 0.9300(15) 0.191(8) Uani 0.433(13) 1 d D U P N 1
F12 F 0.3285(18) 0.6259(10) 0.9557(17) 0.187(8) Uani 0.433(13) 1 d D U P N 1
F10 F 0.311(2) 0.5619(14) 0.9985(10) 0.178(8) Uani 0.433(13) 1 d D U P N 1
F1A F 0.3558(12) 0.5904(12) 0.9856(12) 0.190(7) Uani 0.567(13) 1 d D U P N 2
F3A F 0.2587(13) 0.5541(9) 0.9726(12) 0.188(7) Uani 0.567(13) 1 d D U P N 2
F4A F 0.2770(16) 0.6242(8) 0.9343(12) 0.186(7) Uani 0.567(13) 1 d D U P N 2
O3A O 0.294(3) 0.539(3) 0.850(3) 0.132(9) Uani 0.118(17) 1 d D U P A 2
O4A O 0.383(4) 0.532(4) 0.899(4) 0.136(6) Uani 0.118(17) 1 d D U P A 2
O19 O 0.4332(9) 0.1553(5) 0.5924(8) 0.185(7) Uani 1 1 d D . . . .
N1 N 0.428(2) 0.0793(10) 0.6040(17) 0.225(9) Uani 0.78(2) 1 d D U P O 1
C31 C 0.438(3) 0.1177(9) 0.575(3) 0.226(9) Uani 0.78(2) 1 d D U P O 1
H31 H 0.451919 0.114357 0.535927 0.271 Uiso 0.78(2) 1 calc R U P O 1
C30 C 0.414(2) 0.0839(11) 0.6658(17) 0.243(10) Uani 0.78(2) 1 d D U P O 1
H30A H 0.406950 0.116209 0.677514 0.364 Uiso 0.78(2) 1 d R U P O 1
H30B H 0.454130 0.072079 0.686224 0.364 Uiso 0.78(2) 1 d R U P O 1
H30C H 0.376890 0.064849 0.676614 0.364 Uiso 0.78(2) 1 d R U P O 1
C29 C 0.424(2) 0.0327(10) 0.5795(18) 0.239(10) Uani 0.78(2) 1 d D U P O 1
H29A H 0.415180 0.034493 0.536436 0.358 Uiso 0.78(2) 1 calc R U P O 1
H29B H 0.388018 0.015750 0.596798 0.358 Uiso 0.78(2) 1 calc R U P O 1
H29C H 0.464947 0.016300 0.588632 0.358 Uiso 0.78(2) 1 calc R U P O 1
Ag0O Ag 0.3477(7) 0.3126(4) 0.5154(6) 0.0987(19) Uani 0.38(3) 1 d . . P A 2
Ag0T Ag 0.2668(5) 0.3926(4) 0.3907(6) 0.0956(18) Uani 0.34(3) 1 d . . P A 2
Ag0L Ag 0.2190(9) 0.4947(4) 0.2840(9) 0.062(5) Uani 0.17(2) 1 d . . P B 2
C20A C 0.443(8) 0.1160(14) 0.587(8) 0.226(10) Uani 0.22(2) 1 d D U P O 2
H20A H 0.472370 0.111143 0.556801 0.271 Uiso 0.22(2) 1 calc R U P O 2
N2A N 0.427(6) 0.076(4) 0.610(6) 0.227(9) Uani 0.22(2) 1 d D U P O 2
C25A C 0.472(5) 0.044(4) 0.642(7) 0.235(11) Uani 0.22(2) 1 d D U P O 2
H25A H 0.509504 0.057064 0.665364 0.353 Uiso 0.22(2) 1 d R U P O 2
H25B H 0.488634 0.025624 0.608984 0.353 Uiso 0.22(2) 1 d R U P O 2
H25C H 0.447304 0.023654 0.666634 0.353 Uiso 0.22(2) 1 d R U P O 2
C24A C 0.360(5) 0.060(4) 0.616(7) 0.234(11) Uani 0.22(2) 1 d D U P O 2
H24D H 0.342394 0.031731 0.634187 0.352 Uiso 0.22(2) 1 d R U P O 2
H24E H 0.326764 0.083811 0.612817 0.352 Uiso 0.22(2) 1 d R U P O 2
H24F H 0.397584 0.070961 0.641867 0.352 Uiso 0.22(2) 1 d R U P O 2
C56A C 0.292(3) 0.2254(13) 0.611(2) 0.121(9) Uani 0.35(3) 1 d D U P L 2
H56A H 0.259225 0.228759 0.577074 0.181 Uiso 0.35(3) 1 calc R U P L 2
H56B H 0.281916 0.197415 0.633063 0.181 Uiso 0.35(3) 1 calc R U P L 2
H56C H 0.335300 0.222783 0.595710 0.181 Uiso 0.35(3) 1 calc R U P L 2
C63A C 0.2172(13) 0.2854(16) 0.659(3) 0.123(9) Uani 0.35(3) 1 d D U P L 2
H63A H 0.216460 0.307037 0.692325 0.184 Uiso 0.35(3) 1 calc R U P L 2
H63B H 0.189798 0.258367 0.666488 0.184 Uiso 0.35(3) 1 calc R U P L 2
H63C H 0.200435 0.300969 0.622627 0.184 Uiso 0.35(3) 1 calc R U P L 2
O22 O 0.4168(15) 0.4156(13) 0.9127(13) 0.223(9) Uani 0.69(2) 1 d D U P A 1
N2 N 0.3574(17) 0.3745(13) 0.9944(15) 0.220(8) Uani 0.69(2) 1 d D U P A 1
C53 C 0.3083(17) 0.3667(15) 1.0386(15) 0.215(10) Uani 0.69(2) 1 d D U P A 1
H53A H 0.329576 0.368039 1.078512 0.322 Uiso 0.69(2) 1 calc R U P A 1
H53B H 0.288100 0.336132 1.032032 0.322 Uiso 0.69(2) 1 calc R U P A 1
H53C H 0.274609 0.390879 1.034361 0.322 Uiso 0.69(2) 1 calc R U P A 1
C54 C 0.3648(19) 0.4174(15) 0.9596(17) 0.221(8) Uani 0.69(2) 1 d D U P A 1
H54A H 0.376158 0.443148 0.987324 0.266 Uiso 0.69(2) 1 calc R U P A 1
H54B H 0.322050 0.424871 0.939111 0.266 Uiso 0.69(2) 1 calc R U P A 1
C52 C 0.4006(18) 0.3330(11) 0.9933(17) 0.221(10) Uani 0.69(2) 1 d D U P A 1
H52A H 0.416226 0.324865 1.033756 0.331 Uiso 0.69(2) 1 d R U P A 1
H52B H 0.437936 0.339815 0.969756 0.331 Uiso 0.69(2) 1 d R U P A 1
H52C H 0.375816 0.306835 0.975416 0.331 Uiso 0.69(2) 1 d R U P A 1
C69A C 0.283(5) 0.498(4) 0.098(4) 0.154(10) Uani 0.15(2) 1 d D U P I 2
H69A H 0.238747 0.489027 0.083850 0.231 Uiso 0.15(2) 1 d R U P I 2
H69B H 0.303467 0.471657 0.120410 0.231 Uiso 0.15(2) 1 d R U P I 2
H69C H 0.308907 0.505117 0.064410 0.231 Uiso 0.15(2) 1 d R U P I 2
C23 C 0.185(3) 0.510(5) 0.163(5) 0.151(9) Uani 0.15(2) 1 d D U P I 2
H23A H 0.177611 0.503490 0.204709 0.227 Uiso 0.15(2) 1 d R U P I 2
H23B H 0.153481 0.493310 0.137359 0.227 Uiso 0.15(2) 1 d R U P I 2
H23C H 0.180081 0.543810 0.156149 0.227 Uiso 0.15(2) 1 d R U P I 2
C1A C 0.1192(11) 0.3759(6) 0.6463(13) 0.119(7) Uani 0.702(17) 1 d D U P E 2
H1AA H 0.133289 0.353555 0.616984 0.179 Uiso 0.702(17) 1 calc R U P E 2
H1AB H 0.074626 0.368371 0.656456 0.179 Uiso 0.702(17) 1 calc R U P E 2
H1AC H 0.148668 0.374158 0.682060 0.179 Uiso 0.702(17) 1 calc R U P E 2
C80A C 0.0665(9) 0.4316(9) 0.5687(9) 0.114(6) Uani 0.702(17) 1 d D U P E 2
H80A H 0.023745 0.424627 0.583574 0.170 Uiso 0.702(17) 1 calc R U P E 2
H80B H 0.075187 0.410116 0.536519 0.170 Uiso 0.702(17) 1 calc R U P E 2
H80C H 0.066729 0.463619 0.553863 0.170 Uiso 0.702(17) 1 calc R U P E 2
C97A C 0.4204(17) 0.1779(12) 0.386(2) 0.094(8) Uani 0.42(3) 1 d D U P H 2
H97A H 0.433401 0.156362 0.417876 0.140 Uiso 0.42(3) 1 calc R U P H 2
H97B H 0.459495 0.191094 0.369392 0.140 Uiso 0.42(3) 1 calc R U P H 2
H97C H 0.394708 0.161239 0.354555 0.140 Uiso 0.42(3) 1 calc R U P H 2
C88A C 0.3213(19) 0.1976(16) 0.4457(19) 0.102(8) Uani 0.42(3) 1 d D U P H 2
H88A H 0.308942 0.167009 0.429583 0.154 Uiso 0.42(3) 1 calc R U P H 2
H88B H 0.283534 0.218503 0.441882 0.154 Uiso 0.42(3) 1 calc R U P H 2
H88C H 0.335922 0.194497 0.487542 0.154 Uiso 0.42(3) 1 calc R U P H 2
C77A C 0.2853(17) 0.331(2) 0.268(3) 0.109(7) Uani 0.255(17) 1 d D U P F 2
H77A H 0.273817 0.329639 0.309778 0.163 Uiso 0.255(17) 1 d R U P F 2
H77B H 0.285937 0.299419 0.252088 0.163 Uiso 0.255(17) 1 d R U P F 2
H77C H 0.252917 0.349699 0.245408 0.163 Uiso 0.255(17) 1 d R U P F 2
C86A C 0.391(3) 0.349(2) 0.2060(17) 0.113(9) Uani 0.255(17) 1 d D U P F 2
H86A H 0.414308 0.377540 0.198420 0.169 Uiso 0.255(17) 1 calc R U P F 2
H86B H 0.358816 0.342530 0.172930 0.169 Uiso 0.255(17) 1 calc R U P F 2
H86C H 0.421862 0.322863 0.209990 0.169 Uiso 0.255(17) 1 calc R U P F 2
O27 O 0.432(4) 0.254(3) 0.7491(15) 0.112(6) Uani 0.21(5) 1 d D U P A 2
O21A O 0.398(7) 0.277(3) 0.831(3) 0.104(11) Uani 0.21(5) 1 d D U P A 2
O22A O 0.385(3) 0.420(3) 0.916(3) 0.223(9) Uani 0.31(2) 1 d D U P A 2
N3 N 0.352(3) 0.3772(18) 1.000(2) 0.221(9) Uani 0.31(2) 1 d D U P A 2
C53A C 0.346(4) 0.341(3) 1.048(3) 0.219(10) Uani 0.31(2) 1 d D U P A 2
H53D H 0.362034 0.310965 1.034448 0.328 Uiso 0.31(2) 1 d R U P A 2
H53E H 0.299814 0.338325 1.055878 0.328 Uiso 0.31(2) 1 d R U P A 2
H53F H 0.371274 0.350545 1.083938 0.328 Uiso 0.31(2) 1 d R U P A 2
C54A C 0.399(3) 0.376(2) 0.954(3) 0.222(9) Uani 0.31(2) 1 d D U P A 2
H54C H 0.392185 0.347573 0.929655 0.267 Uiso 0.31(2) 1 calc R U P A 2
H54D H 0.443952 0.376167 0.971884 0.267 Uiso 0.31(2) 1 calc R U P A 2
C52A C 0.302(3) 0.412(3) 1.013(3) 0.220(10) Uani 0.31(2) 1 d D U P A 2
H52D H 0.284072 0.424077 0.974976 0.330 Uiso 0.31(2) 1 d R U P A 2
H52E H 0.322522 0.436897 1.036526 0.330 Uiso 0.31(2) 1 d R U P A 2
H52F H 0.267692 0.397257 1.034216 0.330 Uiso 0.31(2) 1 d R U P A 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
Ag21 Ag6 3.1957(14) 3_666 ?
Ag21 Ag12 3.2113(14) . ?
Ag21 Ag22 3.1041(14) . ?
Ag21 S8 2.463(3) . ?
Ag21 S9 2.471(3) . ?
Ag21 O7 2.344(5) . ?
Ag21 Ag25 3.241(4) . ?
Ag3 Ag2 3.2580(13) . ?
Ag3 Ag11 3.1383(15) 3_666 ?
Ag3 S3 2.474(3) . ?
Ag3 S4 2.422(3) . ?
Ag6 Ag7 3.3768(15) . ?
Ag6 S5 2.466(3) . ?
Ag6 S9 2.590(3) 3_666 ?
Ag6 S1 2.586(3) 3_666 ?
Ag6 O3 2.473(5) . ?
Ag12 Ag5 3.1874(18) 3_666 ?
Ag12 S8 2.638(3) . ?
Ag12 S5 2.536(3) 3_666 ?
Ag12 O9 2.462(5) . ?
Ag12 O25 2.368(10) . ?
Ag19 Ag2 2.9532(15) . ?
Ag19 Ag20 3.0513(17) . ?
Ag19 Ag1 3.1298(16) . ?
Ag19 Ag18 2.940(5) . ?
Ag19 S15 2.411(3) . ?
Ag19 S1 2.380(3) . ?
Ag19 Ag0L 2.947(16) . ?
Ag2 S3 2.629(3) . ?
Ag2 S15 2.594(3) . ?
Ag2 S2 2.459(3) . ?
Ag22 Ag23 3.0603(18) . ?
Ag22 S9 2.613(3) . ?
Ag22 S10 2.479(3) . ?
Ag22 S14 2.565(3) . ?
Ag15 Ag7 2.9897(15) . ?
Ag15 Ag8 3.023(11) . ?
Ag15 Ag16 3.115(12) . ?
Ag15 S12 2.485(3) . ?
Ag15 S6 2.526(4) . ?
Ag15 O18 2.53(2) . ?
Ag15 O19 2.418(11) . ?
Ag4 Ag5 3.1966(19) . ?
Ag4 Ag16 3.242(5) . ?
Ag4 S4 2.406(3) . ?
Ag4 S12 2.482(3) . ?
Ag4 Ag0O 3.072(8) . ?
Ag7 Ag5 3.0020(19) . ?
Ag7 S5 2.500(3) . ?
Ag7 S6 2.480(3) . ?
Ag7 O17 2.23(3) . ?
Ag11 Ag10 3.0838(17) . ?
Ag11 Ag13 3.059(3) . ?
Ag11 S8 2.548(3) . ?
Ag11 S3 2.508(3) 3_666 ?
Ag11 O25 2.597(10) . ?
Ag11 O24 2.532(13) . ?
Ag10 Ag13 3.050(3) . ?
Ag10 S3 2.509(3) 3_666 ?
Ag10 S7 2.498(3) . ?
Ag10 Ag0R 3.185(14) . ?
Ag10 O23 2.350(15) . ?
Ag10 O4A 2.31(6) . ?
Ag10 O22 2.528(17) . ?
Ag10 O22A 2.521(19) . ?
Ag20 Ag18 3.040(7) . ?
Ag20 S9 2.491(3) . ?
Ag20 O16 2.36(2) . ?
Ag20 O12A 2.10(4) . ?
Ag20 Ag0L 2.950(15) . ?
Ag1 Ag8 3.149(9) 3_666 ?
Ag1 S1 2.525(3) . ?
Ag1 S2 2.473(4) . ?
Ag1 S6 2.741(3) 3_666 ?
Ag1 Ag26 2.844(10) 3_666 ?
Ag13 Ag14 2.983(3) . ?
Ag13 S8 2.354(3) . ?
Ag13 S7 2.384(3) . ?
Ag14 Ag23 2.951(2) . ?
Ag14 S7 2.767(3) . ?
Ag14 S10 2.551(3) . ?
Ag14 S11 2.519(3) . ?
Ag14 O11 2.521(5) . ?
Ag23 S10 2.403(3) . ?
Ag23 S13 2.384(5) . ?
Ag5 S5 2.506(3) . ?
Ag5 S12 2.485(3) . ?
Ag5 O26 2.421(12) 3_666 ?
Ag8 Ag16 3.283(15) . ?
Ag8 Ag9 3.024(10) . ?
Ag8 S6 2.438(4) . ?
Ag8 S11 2.424(5) . ?
Ag8 O20 2.51(2) . ?
Ag18 Ag17 2.65(2) . ?
Ag18 S15 2.404(4) . ?
Ag18 S14 2.366(4) . ?
V3 V1 3.0672(19) 3_666 ?
V3 V5 3.0635(19) . ?
V3 O5 2.133(5) 3_666 ?
V3 O5 2.131(5) . ?
V3 O8 1.894(5) . ?
V3 O13 1.678(5) . ?
V3 O7 1.922(5) . ?
V3 O9 1.698(5) . ?
V4 V2 3.0779(19) 3_666 ?
V4 V1 3.0981(19) . ?
V4 V5 3.0963(18) . ?
V4 O5 2.247(5) . ?
V4 O8 1.978(5) . ?
V4 O7 2.042(6) 3_666 ?
V4 O3 1.834(6) . ?
V4 O6 1.614(5) . ?
V4 O12 1.806(5) . ?
Ag16 S12 2.430(5) . ?
Ag16 S11 2.355(6) . ?
Ag16 S13 2.945(15) . ?
V2 V1 3.1028(19) . ?
V2 V5 3.073(2) . ?
V2 O5 2.220(5) . ?
V2 O8 1.979(5) 3_666 ?
V2 O7 2.025(5) . ?
V2 O2 1.801(5) . ?
V2 O4 1.604(5) . ?
V2 O11 1.834(6) . ?
V1 V5 3.026(2) . ?
V1 O5 2.292(5) . ?
V1 O2 1.909(6) . ?
V1 O9 2.049(6) 3_666 ?
V1 O3 1.845(5) . ?
V1 O10 1.830(6) . ?
V1 O1 1.606(5) . ?
Ag9 S7 2.601(4) . ?
Ag9 S2 2.556(4) 3_666 ?
Ag9 S11 2.966(8) . ?
Ag9 O21 2.33(3) . ?
V5 O5 2.276(5) . ?
V5 O13 2.069(5) . ?
V5 O10 1.826(6) . ?
V5 O12 1.913(5) . ?
V5 O11 1.861(6) . ?
V5 O14 1.594(6) . ?
Ag17 S4 2.359(6) . ?
Ag17 S14 2.429(5) . ?
S8 C58 1.865(11) . ?
S8 Ag25 2.725(6) . ?
S3 C11 1.851(12) . ?
S5 C25 1.846(11) . ?
S4 C14 1.829(12) . ?
S4 Ag0T 2.686(15) . ?
S9 C01P 1.860(11) . ?
S7 C50 1.845(12) . ?
S7 Ag25 2.692(6) . ?
S7 Ag0R 2.440(5) . ?
S7 Ag27 2.146(6) . ?
S15 C8 1.867(16) . ?
S15 Ag0L 2.403(11) . ?
S12 C36 1.846(12) . ?
S12 Ag0O 2.661(12) . ?
S1 C2 1.820(13) . ?
S10 C47 1.831(12) . ?
S10 Ag24 2.359(5) . ?
S10 Ag25 2.524(8) . ?
S2 C5 1.797(15) . ?
S2 Ag0R 2.415(6) 3_666 ?
S2 Ag26 2.85(3) 3_666 ?
S6 C33 1.833(12) . ?
S6 Ag26 2.79(3) . ?
S14 C17 1.842(14) . ?
S14 Ag0T 2.609(9) . ?
S14 Ag0L 2.549(14) . ?
S11 C42 1.826(13) . ?
S11 Ag24 2.660(6) . ?
S11 Ag27 2.078(6) . ?
S11 Ag26 2.522(10) . ?
S11 Ag0O 2.616(12) . ?
S13 C39 1.82(2) . ?
S13 Ag0O 2.30(2) . ?
S13 Ag0T 2.410(17) . ?
O25 C60 1.207(15) . ?
O21 C45 1.23(2) . ?
C01P H01P 0.9800 . ?
C01P H01A 0.9800 . ?
C01P C025 1.533(10) . ?
C01P C02Q 1.543(10) . ?
C01P C02R 1.529(10) . ?
C01P C67 1.535(10) . ?
O20 C45 1.25(2) . ?
O26 C60 1.213(17) . ?
F9 C44 1.327(14) . ?
C60 C61 1.487(16) . ?
F8 C44 1.312(13) . ?
C45 C44 1.52(2) . ?
C45 O27 1.185(19) . ?
C45 O21A 1.21(2) . ?
F7 C44 1.309(13) . ?
C025 H02A 0.9600 . ?
C025 H02B 0.9600 . ?
C025 H02C 0.9600 . ?
C47 H47 0.9800 . ?
C47 H47A 0.9800 . ?
C47 C48 1.536(7) . ?
C47 C46 1.540(7) . ?
C47 C1A 1.529(10) . ?
C47 C80A 1.535(10) . ?
C14 H14 0.9800 . ?
C14 H14A 0.9800 . ?
C14 C13 1.530(10) . ?
C14 C15 1.524(10) . ?
C14 C77A 1.540(10) . ?
C14 C86A 1.535(10) . ?
C50 H50 0.9800 . ?
C50 C51 1.521(9) . ?
C50 C49 1.513(10) . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 C6 1.545(10) . ?
C5 C4 1.532(10) . ?
C5 C73A 1.532(10) . ?
C5 C22 1.544(10) . ?
C02Q H02D 0.9600 . ?
C02Q H02E 0.9600 . ?
C02Q H02F 0.9600 . ?
C44 F0 1.331(16) . ?
C44 F01Y 1.306(16) . ?
C44 F01V 1.311(16) . ?
C17 H17 0.9800 . ?
C17 C18 1.42(3) . ?
C17 C16 1.43(2) . ?
C51 H51A 0.9600 . ?
C51 H51B 0.9600 . ?
C51 H51C 0.9600 . ?
C36 H36 0.9800 . ?
C36 H36A 0.9800 . ?
C36 C35 1.538(10) . ?
C36 C37 1.531(10) . ?
C36 C97A 1.538(10) . ?
C36 C88A 1.535(10) . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 C7 1.49(3) . ?
C8 C9 1.31(2) . ?
C8 C69A 1.54(2) . ?
C8 C23 1.53(2) . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C13 H13A 0.9600 . ?
C13 H13B 0.9600 . ?
C13 H13C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C35 H35A 0.9600 . ?
C35 H35B 0.9600 . ?
C35 H35C 0.9600 . ?
C37 H37A 0.9600 . ?
C37 H37B 0.9600 . ?
C37 H37C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C49 H49A 0.9599 . ?
C49 H49B 0.9595 . ?
C49 H49C 0.9603 . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 C3 1.527(10) . ?
C2 C1 1.521(10) . ?
C2 C67A 1.536(9) . ?
C2 C49A 1.545(9) . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C61 C66 1.3900 . ?
C61 C62 1.3900 . ?
C66 H66 0.9300 . ?
C66 C65 1.3900 . ?
C65 H65 0.9300 . ?
C65 C64 1.3900 . ?
C64 H64 0.9300 . ?
C64 C63 1.3900 . ?
C63 H63 0.9300 . ?
C63 C62 1.3900 . ?
C62 H62 0.9300 . ?
C48 H48A 0.9600 . ?
C48 H48B 0.9600 . ?
C48 H48C 0.9600 . ?
C46 H46A 0.9600 . ?
C46 H46B 0.9600 . ?
C46 H46C 0.9600 . ?
C11 H11 0.9800 . ?
C11 C12 1.490(19) . ?
C11 C10 1.48(2) . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C39 H39 0.9800 . ?
C39 H39A 0.9800 . ?
C39 C40 1.523(10) . ?
C39 C38 1.530(10) . ?
C39 C21 1.539(9) . ?
C39 C96A 1.538(9) . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C4 H4A 0.9600 . ?
C4 H4B 0.9600 . ?
C4 H4C 0.9600 . ?
C38 H38A 0.9600 . ?
C38 H38B 0.9600 . ?
C38 H38C 0.9600 . ?
C58 H58 0.9800 . ?
C58 C59 1.467(18) . ?
C58 C57 1.478(19) . ?
C59 H59A 0.9600 . ?
C59 H59B 0.9600 . ?
C59 H59C 0.9600 . ?
C57 H57A 0.9600 . ?
C57 H57B 0.9600 . ?
C57 H57C 0.9600 . ?
C25 H25 0.9800 . ?
C25 C26 1.461(19) . ?
C25 C24 1.52(2) . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C33 H33 0.9800 . ?
C33 C34 1.46(2) . ?
C33 C32 1.44(2) . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 0.9600 . ?
C32 H32A 0.9600 . ?
C32 H32B 0.9600 . ?
C32 H32C 0.9600 . ?
C42 H42 0.9800 . ?
C42 H42A 0.9800 . ?
C42 C41 1.520(10) . ?
C42 C43 1.517(10) . ?
C42 C56A 1.532(10) . ?
C42 C63A 1.529(10) . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
C43 H43A 0.9600 . ?
C43 H43B 0.9600 . ?
C43 H43C 0.9600 . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
Ag24 Ag27 2.832(9) . ?
Ag24 Ag0O 2.775(12) . ?
Ag25 Ag27 3.028(7) . ?
Ag0R Ag27 2.720(15) . ?
Ag0R Ag26 3.25(4) . ?
O24 C56 1.21(3) . ?
O23 C56 1.19(3) . ?
F3 C19 1.27(2) . ?
C20 O16 1.153(16) . ?
C20 O15 1.233(17) . ?
C20 C19 1.51(2) . ?
C20 O11A 1.251(18) . ?
C20 O12A 1.169(19) . ?
F2 C19 1.29(2) . ?
C56 C55 1.55(3) . ?
C56 O3A 1.20(2) . ?
C56 O4A 1.22(2) . ?
O17 C28 1.25(5) . ?
C28 C27 1.406(13) . ?
C28 O18 1.26(3) . ?
C28 O10A 1.245(17) . ?
C28 O20A 1.218(19) . ?
F4 C27 1.354(14) . ?
C19 F1 1.23(2) . ?
F5 C27 1.384(14) . ?
C27 F6 1.356(14) . ?
C27 F20A 1.361(15) . ?
C27 F16A 1.347(15) . ?
C27 F14A 1.388(15) . ?
Ag27 Ag26 3.26(3) . ?
C67A H67A 0.9600 . ?
C67A H67B 0.9600 . ?
C67A H67C 0.9600 . ?
C49A H49D 0.9600 . ?
C49A H49E 0.9600 . ?
C49A H49F 0.9600 . ?
C21 H21A 0.9591 . ?
C21 H21B 0.9601 . ?
C21 H21C 0.9606 . ?
C96A H96A 0.9603 . ?
C96A H96B 0.9606 . ?
C96A H96C 0.9590 . ?
C73A H73A 0.9600 . ?
C73A H73B 0.9600 . ?
C73A H73C 0.9600 . ?
C22 H22A 0.9606 . ?
C22 H22B 0.9591 . ?
C22 H22C 0.9605 . ?
Ag26 O27 2.08(5) . ?
O11A Ag0L 2.57(4) . ?
C55 F11 1.380(14) . ?
C55 F12 1.377(19) . ?
C55 F10 1.346(18) . ?
C55 F1A 1.396(18) . ?
C55 F3A 1.376(13) . ?
C55 F4A 1.328(17) . ?
C02R H02G 0.9600 . ?
C02R H02H 0.9600 . ?
C02R H02I 0.9600 . ?
C67 H67D 0.9600 . ?
C67 H67E 0.9600 . ?
C67 H67F 0.9600 . ?
O19 C31 1.13(3) . ?
O19 C20A 1.13(3) . ?
N1 C31 1.28(3) . ?
N1 C30 1.420(19) . ?
N1 C29 1.423(19) . ?
C31 H31 0.9300 . ?
C30 H30A 0.9606 . ?
C30 H30B 0.9596 . ?
C30 H30C 0.9601 . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
Ag0L H23A 1.9133 . ?
C20A H20A 0.9300 . ?
C20A N2A 1.28(3) . ?
N2A C25A 1.44(2) . ?
N2A C24A 1.44(2) . ?
N2A H24F 0.9634 . ?
C25A H25A 0.9596 . ?
C25A H25B 0.9605 . ?
C25A H25C 0.9592 . ?
C24A H24D 0.9607 . ?
C24A H24E 0.9596 . ?
C24A H24F 0.9602 . ?
C56A H56A 0.9600 . ?
C56A H56B 0.9600 . ?
C56A H56C 0.9600 . ?
C63A H63A 0.9600 . ?
C63A H63B 0.9600 . ?
C63A H63C 0.9600 . ?
O22 C54 1.52(4) . ?
N2 C53 1.449(18) . ?
N2 C54 1.45(4) . ?
N2 C52 1.458(19) . ?
C53 H53A 0.9600 . ?
C53 H53B 0.9600 . ?
C53 H53C 0.9600 . ?
C54 H54A 0.9700 . ?
C54 H54B 0.9700 . ?
C52 H52A 0.9602 . ?
C52 H52B 0.9597 . ?
C52 H52C 0.9601 . ?
C69A H69A 0.9601 . ?
C69A H69B 0.9597 . ?
C69A H69C 0.9602 . ?
C23 H23A 0.9595 . ?
C23 H23B 0.9598 . ?
C23 H23C 0.9601 . ?
C1A H1AA 0.9600 . ?
C1A H1AB 0.9600 . ?
C1A H1AC 0.9600 . ?
C80A H80A 0.9600 . ?
C80A H80B 0.9600 . ?
C80A H80C 0.9600 . ?
C97A H97A 0.9600 . ?
C97A H97B 0.9600 . ?
C97A H97C 0.9600 . ?
C88A H88A 0.9600 . ?
C88A H88B 0.9600 . ?
C88A H88C 0.9600 . ?
C77A H77A 0.9602 . ?
C77A H77B 0.9601 . ?
C77A H77C 0.9599 . ?
C86A H86A 0.9600 . ?
C86A H86B 0.9600 . ?
C86A H86C 0.9600 . ?
O22A C54A 1.51(4) . ?
N3 C53A 1.472(19) . ?
N3 C54A 1.43(4) . ?
N3 C52A 1.425(19) . ?
C53A H53D 0.9596 . ?
C53A H53E 0.9598 . ?
C53A H53F 0.9598 . ?
C54A H54C 0.9700 . ?
C54A H54D 0.9700 . ?
C52A H52D 0.9602 . ?
C52A H52E 0.9604 . ?
C52A H52F 0.9596 . ?

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
Ag6 Ag21 Ag12 70.56(3) 3_666 . ?
Ag6 Ag21 Ag25 170.27(10) 3_666 . ?
Ag12 Ag21 Ag25 104.81(14) . . ?
Ag22 Ag21 Ag6 102.53(3) . 3_666 ?
Ag22 Ag21 Ag12 171.54(4) . . ?
Ag22 Ag21 Ag25 81.25(14) . . ?
S8 Ag21 Ag6 117.27(7) . 3_666 ?
S8 Ag21 Ag12 53.45(7) . . ?
S8 Ag21 Ag22 129.60(7) . . ?
S8 Ag21 S9 133.16(9) . . ?
S8 Ag21 Ag25 55.05(15) . . ?
S9 Ag21 Ag6 52.53(7) . 3_666 ?
S9 Ag21 Ag12 117.23(7) . . ?
S9 Ag21 Ag22 54.48(7) . . ?
S9 Ag21 Ag25 126.66(13) . . ?
O7 Ag21 Ag6 91.23(13) . 3_666 ?
O7 Ag21 Ag12 92.73(13) . . ?
O7 Ag21 Ag22 92.27(13) . . ?
O7 Ag21 S8 115.14(15) . . ?
O7 Ag21 S9 110.88(15) . . ?
O7 Ag21 Ag25 97.61(15) . . ?
Ag11 Ag3 Ag2 98.73(4) 3_666 . ?
S3 Ag3 Ag2 52.45(7) . . ?
S3 Ag3 Ag11 51.43(7) . 3_666 ?
S4 Ag3 Ag2 135.53(8) . . ?
S4 Ag3 Ag11 122.68(8) . 3_666 ?
S4 Ag3 S3 146.17(10) . . ?
Ag21 Ag6 Ag7 138.72(4) 3_666 . ?
S5 Ag6 Ag21 94.45(7) . 3_666 ?
S5 Ag6 Ag7 47.58(7) . . ?
S5 Ag6 S9 125.00(9) . 3_666 ?
S5 Ag6 S1 131.94(10) . 3_666 ?
S5 Ag6 O3 107.40(14) . . ?
S9 Ag6 Ag21 49.20(6) 3_666 3_666 ?
S9 Ag6 Ag7 160.24(7) 3_666 . ?
S1 Ag6 Ag21 132.38(8) 3_666 3_666 ?
S1 Ag6 Ag7 84.55(8) 3_666 . ?
S1 Ag6 S9 98.30(10) 3_666 3_666 ?
O3 Ag6 Ag21 76.83(13) . 3_666 ?
O3 Ag6 Ag7 97.51(13) . . ?
O3 Ag6 S9 102.23(14) . 3_666 ?
O3 Ag6 S1 78.93(15) . 3_666 ?
Ag5 Ag12 Ag21 137.87(4) 3_666 . ?
S8 Ag12 Ag21 48.60(6) . . ?
S8 Ag12 Ag5 163.44(7) . 3_666 ?
S5 Ag12 Ag21 92.73(7) 3_666 . ?
S5 Ag12 Ag5 50.36(7) 3_666 3_666 ?
S5 Ag12 S8 122.57(9) 3_666 . ?
O9 Ag12 Ag21 75.17(12) . . ?
O9 Ag12 Ag5 89.05(12) . 3_666 ?
O9 Ag12 S8 107.32(13) . . ?
O9 Ag12 S5 97.81(14) . 3_666 ?
O25 Ag12 Ag21 134.6(2) . . ?
O25 Ag12 Ag5 87.0(2) . 3_666 ?
O25 Ag12 S8 86.4(2) . . ?
O25 Ag12 S5 122.0(2) . 3_666 ?
O25 Ag12 O9 121.8(3) . . ?
Ag2 Ag19 Ag20 155.44(5) . . ?
Ag2 Ag19 Ag1 71.86(4) . . ?
Ag20 Ag19 Ag1 117.89(5) . . ?
Ag18 Ag19 Ag2 99.31(18) . . ?
Ag18 Ag19 Ag20 60.95(12) . . ?
Ag18 Ag19 Ag1 151.7(3) . . ?
S15 Ag19 Ag2 56.77(7) . . ?
S15 Ag19 Ag20 111.01(8) . . ?
S15 Ag19 Ag1 128.48(8) . . ?
S15 Ag19 Ag18 52.25(9) . . ?
S15 Ag19 Ag0L 52.1(2) . . ?
S1 Ag19 Ag2 123.92(9) . . ?
S1 Ag19 Ag20 67.60(9) . . ?
S1 Ag19 Ag1 52.41(8) . . ?
S1 Ag19 Ag18 126.01(10) . . ?
S1 Ag19 S15 178.05(11) . . ?
S1 Ag19 Ag0L 126.5(2) . . ?
Ag0L Ag19 Ag2 105.7(2) . . ?
Ag0L Ag19 Ag20 58.9(2) . . ?
Ag0L Ag19 Ag1 165.8(4) . . ?
Ag19 Ag2 Ag3 97.86(4) . . ?
S3 Ag2 Ag3 48.25(6) . . ?
S3 Ag2 Ag19 142.98(7) . . ?
S15 Ag2 Ag3 73.05(7) . . ?
S15 Ag2 Ag19 51.03(7) . . ?
S15 Ag2 S3 98.15(9) . . ?
S2 Ag2 Ag3 141.55(8) . . ?
S2 Ag2 Ag19 95.61(9) . . ?
S2 Ag2 S3 120.03(10) . . ?
S2 Ag2 S15 139.93(11) . . ?
Ag23 Ag22 Ag21 113.21(5) . . ?
S9 Ag22 Ag21 50.31(6) . . ?
S9 Ag22 Ag23 163.02(7) . . ?
S10 Ag22 Ag21 85.04(8) . . ?
S10 Ag22 Ag23 50.08(8) . . ?
S10 Ag22 S9 123.54(10) . . ?
S10 Ag22 S14 136.85(12) . . ?
S14 Ag22 Ag21 131.34(8) . . ?
S14 Ag22 Ag23 89.64(9) . . ?
S14 Ag22 S9 99.45(10) . . ?
Ag7 Ag15 Ag8 97.67(14) . . ?
Ag7 Ag15 Ag16 119.48(8) . . ?
Ag8 Ag15 Ag16 64.66(17) . . ?
S12 Ag15 Ag7 99.85(8) . . ?
S12 Ag15 Ag8 112.36(11) . . ?
S12 Ag15 Ag16 49.89(14) . . ?
S12 Ag15 S6 134.96(10) . . ?
S12 Ag15 O18 95.1(6) . . ?
S6 Ag15 Ag7 52.62(8) . . ?
S6 Ag15 Ag8 51.17(15) . . ?
S6 Ag15 Ag16 108.20(16) . . ?
S6 Ag15 O18 105.8(7) . . ?
O18 Ag15 Ag7 72.1(7) . . ?
O18 Ag15 Ag8 152.1(6) . . ?
O18 Ag15 Ag16 143.1(7) . . ?
O19 Ag15 Ag7 131.7(5) . . ?
O19 Ag15 Ag8 91.1(4) . . ?
O19 Ag15 Ag16 107.3(4) . . ?
O19 Ag15 S12 120.3(5) . . ?
O19 Ag15 S6 103.0(5) . . ?
O19 Ag15 O18 78.2(8) . . ?
Ag5 Ag4 Ag16 89.5(2) . . ?
S4 Ag4 Ag5 137.13(8) . . ?
S4 Ag4 Ag16 132.6(2) . . ?
S4 Ag4 S12 150.67(10) . . ?
S4 Ag4 Ag0O 120.8(4) . . ?
S12 Ag4 Ag5 49.98(8) . . ?
S12 Ag4 Ag16 48.00(16) . . ?
S12 Ag4 Ag0O 56.1(3) . . ?
Ag0O Ag4 Ag5 100.7(4) . . ?
Ag15 Ag7 Ag6 130.10(4) . . ?
Ag15 Ag7 Ag5 69.64(4) . . ?
Ag5 Ag7 Ag6 92.39(4) . . ?
S5 Ag7 Ag6 46.74(7) . . ?
S5 Ag7 Ag15 119.74(8) . . ?
S5 Ag7 Ag5 53.23(7) . . ?
S6 Ag7 Ag6 105.29(8) . . ?
S6 Ag7 Ag15 54.04(8) . . ?
S6 Ag7 Ag5 118.76(9) . . ?
S6 Ag7 S5 142.77(10) . . ?
O17 Ag7 Ag6 145.5(14) . . ?
O17 Ag7 Ag15 81.0(12) . . ?
O17 Ag7 Ag5 84.9(11) . . ?
O17 Ag7 S5 108.8(14) . . ?
O17 Ag7 S6 106.1(14) . . ?
Ag10 Ag11 Ag3 96.99(4) . 3_666 ?
Ag13 Ag11 Ag3 104.65(4) . 3_666 ?
Ag13 Ag11 Ag10 59.54(5) . . ?
S8 Ag11 Ag3 109.43(7) . 3_666 ?
S8 Ag11 Ag10 107.19(7) . . ?
S8 Ag11 Ag13 48.60(7) . . ?
S8 Ag11 O25 83.7(2) . . ?
S3 Ag11 Ag3 50.46(7) 3_666 3_666 ?
S3 Ag11 Ag10 52.08(7) 3_666 . ?
S3 Ag11 Ag13 95.95(8) 3_666 . ?
S3 Ag11 S8 137.55(10) 3_666 . ?
S3 Ag11 O25 122.0(2) 3_666 . ?
S3 Ag11 O24 100.6(3) 3_666 . ?
O25 Ag11 Ag3 82.7(2) . 3_666 ?
O25 Ag11 Ag10 168.4(2) . . ?
O25 Ag11 Ag13 131.8(2) . . ?
O24 Ag11 Ag3 144.7(3) . 3_666 ?
O24 Ag11 Ag10 70.8(4) . . ?
O24 Ag11 Ag13 97.3(4) . . ?
O24 Ag11 S8 105.9(3) . . ?
O24 Ag11 O25 102.8(4) . . ?
Ag11 Ag10 Ag0R 133.8(2) . . ?
Ag13 Ag10 Ag11 59.83(4) . . ?
S3 Ag10 Ag11 52.05(7) 3_666 . ?
S3 Ag10 Ag13 96.15(8) 3_666 . ?
S3 Ag10 Ag0R 104.90(10) 3_666 . ?
S3 Ag10 O22 111.3(7) 3_666 . ?
S3 Ag10 O22A 124.9(15) 3_666 . ?
S7 Ag10 Ag11 109.39(8) . . ?
S7 Ag10 Ag13 49.67(7) . . ?
S7 Ag10 S3 128.43(10) . 3_666 ?
S7 Ag10 Ag0R 49.1(2) . . ?
S7 Ag10 O22 94.4(9) . . ?
S7 Ag10 O22A 89.2(19) . . ?
O23 Ag10 Ag11 89.8(4) . . ?
O23 Ag10 Ag13 110.4(5) . . ?
O23 Ag10 S3 111.9(5) . 3_666 ?
O23 Ag10 S7 115.8(5) . . ?
O23 Ag10 O22 81.1(11) . . ?
O4A Ag10 Ag11 76(3) . . ?
O4A Ag10 S7 138(2) . . ?
O4A Ag10 Ag0R 150(3) . . ?
O4A Ag10 O22A 82(4) . . ?
O22 Ag10 Ag11 156.1(9) . . ?
O22 Ag10 Ag13 144.0(9) . . ?
O22A Ag10 Ag11 158(2) . . ?
O22A Ag10 Ag0R 68(2) . . ?
Ag18 Ag20 Ag19 57.72(6) . . ?
S9 Ag20 Ag19 120.22(7) . . ?
S9 Ag20 Ag18 121.2(3) . . ?
S9 Ag20 Ag0L 134.3(4) . . ?
O16 Ag20 Ag19 73.0(4) . . ?
O16 Ag20 Ag18 70.9(6) . . ?
O16 Ag20 S9 165.0(4) . . ?
O12A Ag20 Ag19 108.8(12) . . ?
O12A Ag20 S9 122.5(9) . . ?
O12A Ag20 Ag0L 95.5(10) . . ?
Ag0L Ag20 Ag19 58.8(3) . . ?
Ag19 Ag1 Ag8 162.72(12) . 3_666 ?
S1 Ag1 Ag19 48.35(7) . . ?
S1 Ag1 Ag8 145.49(19) . 3_666 ?
S1 Ag1 S6 100.56(11) . 3_666 ?
S1 Ag1 Ag26 158.0(8) . 3_666 ?
S2 Ag1 Ag19 91.02(8) . . ?
S2 Ag1 Ag8 76.86(18) . 3_666 ?
S2 Ag1 S1 137.58(12) . . ?
S2 Ag1 S6 117.11(11) . 3_666 ?
S2 Ag1 Ag26 64.4(8) . 3_666 ?
S6 Ag1 Ag19 148.36(8) 3_666 . ?
S6 Ag1 Ag8 48.29(15) 3_666 3_666 ?
S6 Ag1 Ag26 59.8(8) 3_666 3_666 ?
Ag26 Ag1 Ag19 151.8(8) 3_666 . ?
Ag10 Ag13 Ag11 60.63(6) . . ?
Ag14 Ag13 Ag11 151.81(6) . . ?
Ag14 Ag13 Ag10 109.25(5) . . ?
S8 Ag13 Ag11 54.29(8) . . ?
S8 Ag13 Ag10 113.82(12) . . ?
S8 Ag13 Ag14 133.59(12) . . ?
S8 Ag13 S7 165.55(17) . . ?
S7 Ag13 Ag11 113.53(13) . . ?
S7 Ag13 Ag10 53.02(9) . . ?
S7 Ag13 Ag14 60.86(9) . . ?
Ag23 Ag14 Ag13 126.18(7) . . ?
S7 Ag14 Ag13 48.80(7) . . ?
S7 Ag14 Ag23 159.69(8) . . ?
S10 Ag14 Ag13 80.01(9) . . ?
S10 Ag14 Ag23 51.16(8) . . ?
S10 Ag14 S7 112.00(11) . . ?
S11 Ag14 Ag13 143.17(11) . . ?
S11 Ag14 Ag23 87.64(10) . . ?
S11 Ag14 S7 104.55(12) . . ?
S11 Ag14 S10 136.72(12) . . ?
S11 Ag14 O11 100.78(14) . . ?
O11 Ag14 Ag13 68.34(13) . . ?
O11 Ag14 Ag23 90.84(14) . . ?
O11 Ag14 S7 102.48(15) . . ?
O11 Ag14 S10 93.35(15) . . ?
Ag14 Ag23 Ag22 96.27(5) . . ?
S10 Ag23 Ag22 52.29(8) . . ?
S10 Ag23 Ag14 55.77(8) . . ?
S13 Ag23 Ag22 122.74(16) . . ?
S13 Ag23 Ag14 126.45(16) . . ?
S13 Ag23 S10 174.83(17) . . ?
Ag12 Ag5 Ag4 71.93(4) 3_666 . ?
Ag7 Ag5 Ag12 99.74(4) . 3_666 ?
Ag7 Ag5 Ag4 121.84(5) . . ?
S5 Ag5 Ag12 51.20(7) . 3_666 ?
S5 Ag5 Ag4 113.66(8) . . ?
S5 Ag5 Ag7 53.07(7) . . ?
S12 Ag5 Ag12 120.13(9) . 3_666 ?
S12 Ag5 Ag4 49.90(7) . . ?
S12 Ag5 Ag7 99.51(9) . . ?
S12 Ag5 S5 138.47(10) . . ?
O26 Ag5 Ag12 67.5(3) 3_666 3_666 ?
O26 Ag5 Ag4 69.7(4) 3_666 . ?
O26 Ag5 Ag7 160.5(3) 3_666 . ?
O26 Ag5 S5 108.9(3) 3_666 . ?
O26 Ag5 S12 99.7(3) 3_666 . ?
Ag15 Ag8 Ag1 103.08(9) . 3_666 ?
Ag15 Ag8 Ag16 59.0(2) . . ?
Ag15 Ag8 Ag9 165.7(3) . . ?
Ag1 Ag8 Ag16 118.03(11) 3_666 . ?
Ag9 Ag8 Ag1 86.0(3) . 3_666 ?
Ag9 Ag8 Ag16 107.03(17) . . ?
S6 Ag8 Ag15 53.83(19) . . ?
S6 Ag8 Ag1 57.07(16) . 3_666 ?
S6 Ag8 Ag16 105.5(3) . . ?
S6 Ag8 Ag9 139.3(5) . . ?
S6 Ag8 O20 97.5(6) . . ?
S11 Ag8 Ag15 100.9(4) . . ?
S11 Ag8 Ag1 128.7(3) . 3_666 ?
S11 Ag8 Ag16 45.7(2) . . ?
S11 Ag8 Ag9 64.89(18) . . ?
S11 Ag8 S6 151.2(4) . . ?
S11 Ag8 O20 106.8(6) . . ?
O20 Ag8 Ag15 114.7(6) . . ?
O20 Ag8 Ag1 103.2(6) . 3_666 ?
O20 Ag8 Ag16 138.7(6) . . ?
O20 Ag8 Ag9 73.0(6) . . ?
Ag19 Ag18 Ag20 61.33(13) . . ?
Ag17 Ag18 Ag19 135.1(5) . . ?
Ag17 Ag18 Ag20 111.4(2) . . ?
S15 Ag18 Ag19 52.48(11) . . ?
S15 Ag18 Ag20 111.6(3) . . ?
S15 Ag18 Ag17 125.9(5) . . ?
S14 Ag18 Ag19 125.42(18) . . ?
S14 Ag18 Ag20 65.62(15) . . ?
S14 Ag18 Ag17 57.5(3) . . ?
S14 Ag18 S15 176.5(7) . . ?
V5 V3 V1 174.63(6) . 3_666 ?
O5 V3 V1 48.31(13) 3_666 3_666 ?
O5 V3 V1 126.93(14) . 3_666 ?
O5 V3 V5 47.95(13) . . ?
O5 V3 V5 126.58(14) 3_666 . ?
O5 V3 O5 78.6(2) . 3_666 ?
O8 V3 V1 90.34(16) . 3_666 ?
O8 V3 V5 90.13(16) . . ?
O8 V3 O5 80.31(19) . . ?
O8 V3 O5 80.2(2) . 3_666 ?
O8 V3 O7 154.8(2) . . ?
O13 V3 V1 145.51(19) . 3_666 ?
O13 V3 V5 39.62(18) . . ?
O13 V3 O5 166.2(2) . 3_666 ?
O13 V3 O5 87.6(2) . . ?
O13 V3 O8 97.1(2) . . ?
O13 V3 O7 97.8(2) . . ?
O13 V3 O9 106.5(3) . . ?
O7 V3 V1 88.68(17) . 3_666 ?
O7 V3 V5 88.62(17) . . ?
O7 V3 O5 80.2(2) . . ?
O7 V3 O5 80.4(2) . 3_666 ?
O9 V3 V1 39.02(18) . 3_666 ?
O9 V3 V5 146.11(19) . . ?
O9 V3 O5 165.9(2) . . ?
O9 V3 O5 87.3(2) . 3_666 ?
O9 V3 O8 97.4(2) . . ?
O9 V3 O7 97.6(2) . . ?
V2 V4 V1 118.99(6) 3_666 . ?
V2 V4 V5 119.16(5) 3_666 . ?
V5 V4 V1 58.49(4) . . ?
O5 V4 V2 84.74(13) . 3_666 ?
O5 V4 V1 47.58(12) . . ?
O5 V4 V5 47.20(13) . . ?
O8 V4 V2 38.95(15) . 3_666 ?
O8 V4 V1 123.20(15) . . ?
O8 V4 V5 87.66(15) . . ?
O8 V4 O5 75.71(19) . . ?
O8 V4 O7 75.7(2) . 3_666 ?
O7 V4 V2 40.60(15) 3_666 3_666 ?
O7 V4 V1 85.74(15) 3_666 . ?
O7 V4 V5 122.42(15) 3_666 . ?
O7 V4 O5 75.23(19) 3_666 . ?
O3 V4 V2 128.23(19) . 3_666 ?
O3 V4 V1 32.75(17) . . ?
O3 V4 V5 83.55(18) . . ?
O3 V4 O5 79.6(2) . . ?
O3 V4 O8 153.0(2) . . ?
O3 V4 O7 87.6(2) . 3_666 ?
O6 V4 V2 89.6(2) . 3_666 ?
O6 V4 V1 135.3(2) . . ?
O6 V4 V5 138.2(2) . . ?
O6 V4 O5 174.0(3) . . ?
O6 V4 O8 100.8(3) . . ?
O6 V4 O7 99.3(3) . 3_666 ?
O6 V4 O3 102.7(3) . . ?
O6 V4 O12 103.6(3) . . ?
O12 V4 V2 130.03(18) . 3_666 ?
O12 V4 V1 84.31(18) . . ?
O12 V4 V5 34.76(17) . . ?
O12 V4 O5 81.4(2) . . ?
O12 V4 O8 91.1(2) . . ?
O12 V4 O7 155.3(2) . 3_666 ?
O12 V4 O3 96.0(3) . . ?
Ag15 Ag16 Ag4 93.73(16) . . ?
Ag15 Ag16 Ag8 56.3(3) . . ?
Ag4 Ag16 Ag8 127.8(3) . . ?
S12 Ag16 Ag15 51.5(2) . . ?
S12 Ag16 Ag4 49.39(11) . . ?
S12 Ag16 Ag8 105.8(5) . . ?
S12 Ag16 S13 94.5(3) . . ?
S11 Ag16 Ag15 99.9(4) . . ?
S11 Ag16 Ag4 150.55(16) . . ?
S11 Ag16 Ag8 47.5(2) . . ?
S11 Ag16 S12 151.4(6) . . ?
S11 Ag16 S13 110.7(4) . . ?
S13 Ag16 Ag15 139.04(17) . . ?
S13 Ag16 Ag4 72.7(3) . . ?
S13 Ag16 Ag8 157.8(2) . . ?
V4 V2 V1 119.70(5) 3_666 . ?
V5 V2 V4 120.17(5) . 3_666 ?
V5 V2 V1 58.68(4) . . ?
O5 V2 V4 85.59(13) . 3_666 ?
O5 V2 V1 47.53(13) . . ?
O5 V2 V5 47.66(13) . . ?
O8 V2 V4 38.93(14) 3_666 3_666 ?
O8 V2 V1 87.76(15) 3_666 . ?
O8 V2 V5 123.86(15) 3_666 . ?
O8 V2 O5 76.26(19) 3_666 . ?
O8 V2 O7 76.1(2) 3_666 . ?
O7 V2 V4 41.02(15) . 3_666 ?
O7 V2 V1 123.46(15) . . ?
O7 V2 V5 86.56(16) . . ?
O7 V2 O5 75.95(19) . . ?
O2 V2 V4 130.64(19) . 3_666 ?
O2 V2 V1 34.36(17) . . ?
O2 V2 V5 83.56(19) . . ?
O2 V2 O5 81.5(2) . . ?
O2 V2 O8 91.7(2) . 3_666 ?
O2 V2 O7 156.3(2) . . ?
O2 V2 O11 95.2(3) . . ?
O4 V2 V4 87.5(2) . 3_666 ?
O4 V2 V1 138.2(2) . . ?
O4 V2 V5 136.6(2) . . ?
O4 V2 O5 173.0(3) . . ?
O4 V2 O8 98.9(3) . 3_666 ?
O4 V2 O7 98.1(2) . . ?
O4 V2 O2 103.9(3) . . ?
O4 V2 O11 102.7(3) . . ?
O11 V2 V4 129.43(17) . 3_666 ?
O11 V2 V1 84.56(17) . . ?
O11 V2 V5 34.03(17) . . ?
O11 V2 O5 81.0(2) . . ?
O11 V2 O8 155.0(2) . 3_666 ?
O11 V2 O7 88.4(2) . . ?
V3 V1 V4 62.67(4) 3_666 . ?
V3 V1 V2 61.13(4) 3_666 . ?
V4 V1 V2 91.76(5) . . ?
V5 V1 V3 92.29(5) . 3_666 ?
V5 V1 V4 60.73(4) . . ?
V5 V1 V2 60.16(4) . . ?
O5 V1 V3 44.01(12) . 3_666 ?
O5 V1 V4 46.36(12) . . ?
O5 V1 V2 45.60(12) . . ?
O5 V1 V5 48.29(13) . . ?
O2 V1 V3 78.74(16) . 3_666 ?
O2 V1 V4 123.75(16) . . ?
O2 V1 V2 32.16(15) . . ?
O2 V1 V5 83.24(17) . . ?
O2 V1 O5 77.40(19) . . ?
O2 V1 O9 82.7(2) . 3_666 ?
O9 V1 V3 31.46(14) 3_666 3_666 ?
O9 V1 V4 83.84(15) 3_666 . ?
O9 V1 V2 80.71(15) 3_666 . ?
O9 V1 V5 123.70(15) 3_666 . ?
O9 V1 O5 75.45(19) 3_666 . ?
O3 V1 V3 79.25(17) . 3_666 ?
O3 V1 V4 32.52(17) . . ?
O3 V1 V2 123.81(17) . . ?
O3 V1 V5 85.45(19) . . ?
O3 V1 O5 78.2(2) . . ?
O3 V1 O2 154.8(2) . . ?
O3 V1 O9 85.0(2) . 3_666 ?
O10 V1 V3 126.40(18) . 3_666 ?
O10 V1 V4 82.22(18) . . ?
O10 V1 V2 82.49(18) . . ?
O10 V1 V5 34.10(17) . . ?
O10 V1 O5 82.4(2) . . ?
O10 V1 O2 90.8(3) . . ?
O10 V1 O9 157.8(2) . 3_666 ?
O10 V1 O3 92.4(3) . . ?
O1 V1 V3 129.5(2) . 3_666 ?
O1 V1 V4 135.2(2) . . ?
O1 V1 V2 132.9(2) . . ?
O1 V1 V5 138.1(2) . . ?
O1 V1 O5 173.4(3) . . ?
O1 V1 O2 100.7(3) . . ?
O1 V1 O9 98.1(3) . 3_666 ?
O1 V1 O3 102.8(3) . . ?
O1 V1 O10 104.0(3) . . ?
S7 Ag9 Ag8 142.2(3) . . ?
S7 Ag9 S11 97.25(17) . . ?
S2 Ag9 Ag8 78.1(2) 3_666 . ?
S2 Ag9 S7 120.13(19) 3_666 . ?
S2 Ag9 S11 119.67(18) 3_666 . ?
S11 Ag9 Ag8 47.7(2) . . ?
O21 Ag9 Ag8 88.8(4) . . ?
O21 Ag9 S7 116.3(6) . . ?
O21 Ag9 S2 101.0(9) . 3_666 ?
O21 Ag9 S11 101.9(8) . . ?
V3 V5 V4 61.48(4) . . ?
V3 V5 V2 62.49(4) . . ?
V2 V5 V4 92.38(5) . . ?
V1 V5 V3 92.77(5) . . ?
V1 V5 V4 60.79(4) . . ?
V1 V5 V2 61.16(5) . . ?
O5 V5 V3 44.04(12) . . ?
O5 V5 V4 46.42(12) . . ?
O5 V5 V2 46.13(12) . . ?
O5 V5 V1 48.75(12) . . ?
O13 V5 V3 31.14(15) . . ?
O13 V5 V4 80.48(15) . . ?
O13 V5 V2 83.51(15) . . ?
O13 V5 V1 123.86(16) . . ?
O13 V5 O5 75.16(19) . . ?
O10 V5 V3 126.94(19) . . ?
O10 V5 V4 82.32(18) . . ?
O10 V5 V2 83.43(19) . . ?
O10 V5 V1 34.18(18) . . ?
O10 V5 O5 82.9(2) . . ?
O10 V5 O13 157.9(2) . . ?
O10 V5 O12 91.2(2) . . ?
O10 V5 O11 93.8(2) . . ?
O12 V5 V3 78.61(17) . . ?
O12 V5 V4 32.56(16) . . ?
O12 V5 V2 124.61(17) . . ?
O12 V5 V1 84.71(17) . . ?
O12 V5 O5 78.5(2) . . ?
O12 V5 O13 81.7(2) . . ?
O11 V5 V3 79.68(17) . . ?
O11 V5 V4 125.36(18) . . ?
O11 V5 V2 33.48(17) . . ?
O11 V5 V1 86.40(17) . . ?
O11 V5 O5 79.0(2) . . ?
O11 V5 O13 85.0(2) . . ?
O11 V5 O12 156.1(2) . . ?
O14 V5 V3 128.8(2) . . ?
O14 V5 V4 133.6(2) . . ?
O14 V5 V2 133.7(2) . . ?
O14 V5 V1 138.4(2) . . ?
O14 V5 O5 172.9(3) . . ?
O14 V5 O13 97.7(3) . . ?
O14 V5 O10 104.2(3) . . ?
O14 V5 O12 101.1(3) . . ?
O14 V5 O11 100.3(3) . . ?
S4 Ag17 Ag18 96.4(6) . . ?
S4 Ag17 S14 151.7(8) . . ?
S14 Ag17 Ag18 55.3(3) . . ?
Ag21 S8 Ag12 77.95(8) . . ?
Ag21 S8 Ag11 144.98(11) . . ?
Ag21 S8 Ag25 77.14(15) . . ?
Ag12 S8 Ag25 144.85(14) . . ?
Ag11 S8 Ag12 87.19(9) . . ?
Ag11 S8 Ag25 99.43(16) . . ?
Ag13 S8 Ag21 98.08(11) . . ?
Ag13 S8 Ag12 146.27(11) . . ?
Ag13 S8 Ag11 77.11(11) . . ?
C58 S8 Ag21 103.4(4) . . ?
C58 S8 Ag12 103.9(4) . . ?
C58 S8 Ag11 110.9(4) . . ?
C58 S8 Ag13 109.6(4) . . ?
C58 S8 Ag25 105.8(4) . . ?
Ag3 S3 Ag2 79.30(8) . . ?
Ag3 S3 Ag11 78.10(9) . 3_666 ?
Ag3 S3 Ag10 138.56(12) . 3_666 ?
Ag11 S3 Ag2 141.86(12) 3_666 . ?
Ag11 S3 Ag10 75.86(9) 3_666 3_666 ?
Ag10 S3 Ag2 102.67(11) 3_666 . ?
C11 S3 Ag3 108.9(5) . . ?
C11 S3 Ag2 104.7(5) . . ?
C11 S3 Ag11 111.5(5) . 3_666 ?
C11 S3 Ag10 110.4(5) . 3_666 ?
Ag6 S5 Ag12 95.42(9) . 3_666 ?
Ag6 S5 Ag7 85.68(9) . . ?
Ag6 S5 Ag5 136.07(11) . . ?
Ag7 S5 Ag12 140.12(11) . 3_666 ?
Ag7 S5 Ag5 73.70(9) . . ?
Ag5 S5 Ag12 78.44(9) . 3_666 ?
C25 S5 Ag6 113.3(5) . . ?
C25 S5 Ag12 105.0(5) . 3_666 ?
C25 S5 Ag7 111.0(5) . . ?
C25 S5 Ag5 110.3(5) . . ?
Ag3 S4 Ag0T 134.5(3) . . ?
Ag4 S4 Ag3 118.58(12) . . ?
Ag4 S4 Ag0T 87.1(3) . . ?
Ag17 S4 Ag3 120.1(5) . . ?
Ag17 S4 Ag4 98.7(4) . . ?
C14 S4 Ag3 105.5(4) . . ?
C14 S4 Ag4 104.6(4) . . ?
C14 S4 Ag17 108.2(5) . . ?
C14 S4 Ag0T 102.7(5) . . ?
Ag21 S9 Ag6 78.27(8) . 3_666 ?
Ag21 S9 Ag22 75.20(8) . . ?
Ag21 S9 Ag20 137.41(11) . . ?
Ag6 S9 Ag22 141.62(10) 3_666 . ?
Ag20 S9 Ag6 92.44(10) . 3_666 ?
Ag20 S9 Ag22 88.75(10) . . ?
C01P S9 Ag21 111.6(4) . . ?
C01P S9 Ag6 105.8(4) . 3_666 ?
C01P S9 Ag22 109.5(4) . . ?
C01P S9 Ag20 110.9(4) . . ?
Ag10 S7 Ag14 138.24(11) . . ?
Ag10 S7 Ag9 100.49(16) . . ?
Ag10 S7 Ag25 100.54(19) . . ?
Ag13 S7 Ag10 77.31(11) . . ?
Ag13 S7 Ag14 70.34(10) . . ?
Ag13 S7 Ag9 125.09(13) . . ?
Ag9 S7 Ag14 78.38(17) . . ?
C50 S7 Ag10 111.9(7) . . ?
C50 S7 Ag13 114.6(4) . . ?
C50 S7 Ag14 105.3(7) . . ?
C50 S7 Ag9 116.7(4) . . ?
C50 S7 Ag25 106.8(5) . . ?
C50 S7 Ag0R 114.6(4) . . ?
C50 S7 Ag27 111.7(7) . . ?
Ag0R S7 Ag10 80.3(4) . . ?
Ag0R S7 Ag25 135.0(3) . . ?
Ag27 S7 Ag10 135.14(18) . . ?
Ag27 S7 Ag25 76.6(2) . . ?
Ag27 S7 Ag0R 72.4(5) . . ?
Ag19 S15 Ag2 72.20(9) . . ?
Ag18 S15 Ag19 75.27(14) . . ?
Ag18 S15 Ag2 127.9(3) . . ?
C8 S15 Ag19 108.0(7) . . ?
C8 S15 Ag2 114.8(8) . . ?
C8 S15 Ag18 113.4(9) . . ?
C8 S15 Ag0L 96.4(10) . . ?
Ag0L S15 Ag19 75.5(4) . . ?
Ag0L S15 Ag2 140.5(6) . . ?
Ag15 S12 Ag5 87.01(10) . . ?
Ag15 S12 Ag0O 92.8(4) . . ?
Ag4 S12 Ag15 138.20(12) . . ?
Ag4 S12 Ag5 80.12(10) . . ?
Ag4 S12 Ag0O 73.3(3) . . ?
Ag5 S12 Ag0O 139.41(18) . . ?
Ag16 S12 Ag15 78.7(3) . . ?
Ag16 S12 Ag4 82.6(2) . . ?
Ag16 S12 Ag5 134.6(2) . . ?
C36 S12 Ag15 112.1(4) . . ?
C36 S12 Ag4 109.5(4) . . ?
C36 S12 Ag5 112.6(4) . . ?
C36 S12 Ag16 112.7(5) . . ?
C36 S12 Ag0O 105.0(5) . . ?
Ag19 S1 Ag6 124.24(12) . 3_666 ?
Ag19 S1 Ag1 79.24(10) . . ?
Ag1 S1 Ag6 107.46(12) . 3_666 ?
C2 S1 Ag6 119.3(5) . 3_666 ?
C2 S1 Ag19 111.0(5) . . ?
C2 S1 Ag1 105.5(7) . . ?
Ag22 S10 Ag14 125.80(12) . . ?
Ag22 S10 Ag25 111.41(15) . . ?
Ag23 S10 Ag22 77.63(10) . . ?
Ag23 S10 Ag14 73.07(10) . . ?
C47 S10 Ag22 115.9(5) . . ?
C47 S10 Ag14 115.0(5) . . ?
C47 S10 Ag23 104.3(5) . . ?
C47 S10 Ag24 110.9(5) . . ?
C47 S10 Ag25 120.1(5) . . ?
Ag24 S10 Ag22 102.21(18) . . ?
Ag24 S10 Ag25 92.1(2) . . ?
Ag2 S2 Ag1 92.83(11) . . ?
Ag2 S2 Ag9 119.87(13) . 3_666 ?
Ag2 S2 Ag26 137.2(2) . 3_666 ?
Ag1 S2 Ag9 113.74(19) . 3_666 ?
Ag1 S2 Ag26 64.1(4) . 3_666 ?
Ag9 S2 Ag26 52.6(5) 3_666 3_666 ?
C5 S2 Ag2 109.0(5) . . ?
C5 S2 Ag1 107.7(6) . . ?
C5 S2 Ag9 111.8(5) . 3_666 ?
C5 S2 Ag0R 99.9(6) . 3_666 ?
C5 S2 Ag26 112.2(6) . 3_666 ?
Ag0R S2 Ag2 108.3(3) 3_666 . ?
Ag0R S2 Ag1 137.3(5) 3_666 . ?
Ag0R S2 Ag26 75.7(7) 3_666 3_666 ?
Ag15 S6 Ag1 133.13(12) . 3_666 ?
Ag15 S6 Ag26 88.6(5) . . ?
Ag7 S6 Ag15 73.34(10) . . ?
Ag7 S6 Ag1 104.86(11) . 3_666 ?
Ag7 S6 Ag26 139.3(2) . . ?
Ag1 S6 Ag26 61.9(5) 3_666 . ?
Ag8 S6 Ag15 75.0(3) . . ?
Ag8 S6 Ag7 134.0(2) . . ?
Ag8 S6 Ag1 74.6(3) . 3_666 ?
C33 S6 Ag15 106.0(6) . . ?
C33 S6 Ag7 115.4(5) . . ?
C33 S6 Ag1 115.8(5) . 3_666 ?
C33 S6 Ag8 104.8(6) . . ?
C33 S6 Ag26 104.4(6) . . ?
Ag22 S14 Ag0T 93.2(2) . . ?
Ag18 S14 Ag22 126.1(2) . . ?
Ag18 S14 Ag17 67.2(5) . . ?
Ag17 S14 Ag22 96.96(15) . . ?
C17 S14 Ag22 119.0(6) . . ?
C17 S14 Ag18 114.0(7) . . ?
C17 S14 Ag17 115.5(8) . . ?
C17 S14 Ag0T 104.7(8) . . ?
C17 S14 Ag0L 100.9(8) . . ?
Ag0L S14 Ag22 135.4(5) . . ?
Ag0L S14 Ag0T 95.2(5) . . ?
Ag14 S11 Ag9 75.98(11) . . ?
Ag8 S11 Ag14 132.3(3) . . ?
Ag8 S11 Ag9 67.4(3) . . ?
Ag16 S11 Ag14 108.7(3) . . ?
Ag16 S11 Ag8 86.8(4) . . ?
Ag16 S11 Ag9 144.6(3) . . ?
C42 S11 Ag14 110.1(5) . . ?
C42 S11 Ag8 108.0(6) . . ?
C42 S11 Ag16 106.2(6) . . ?
C42 S11 Ag9 104.6(6) . . ?
C42 S11 Ag24 97.4(6) . . ?
C42 S11 Ag27 109.0(5) . . ?
C42 S11 Ag26 113.6(7) . . ?
C42 S11 Ag0O 103.9(6) . . ?
Ag27 S11 Ag24 72.2(2) . . ?
Ag27 S11 Ag26 89.8(9) . . ?
Ag27 S11 Ag0O 127.2(4) . . ?
Ag26 S11 Ag24 148.1(5) . . ?
Ag26 S11 Ag0O 113.2(8) . . ?
Ag0O S11 Ag24 63.5(4) . . ?
V3 O5 V3 101.4(2) . 3_666 ?
V3 O5 V4 91.94(19) . . ?
V3 O5 V4 94.07(18) 3_666 . ?
V3 O5 V2 94.01(18) . . ?
V3 O5 V2 92.23(19) 3_666 . ?
V3 O5 V1 87.68(18) 3_666 . ?
V3 O5 V1 170.9(3) . . ?
V3 O5 V5 170.6(2) 3_666 . ?
V3 O5 V5 88.01(18) . . ?
V4 O5 V1 86.06(16) . . ?
V4 O5 V5 86.39(17) . . ?
V2 O5 V4 170.3(2) . . ?
V2 O5 V1 86.87(17) . . ?
V2 O5 V5 86.20(17) . . ?
V5 O5 V1 82.96(16) . . ?
V3 O8 V4 108.8(2) . . ?
V3 O8 V2 108.2(2) . 3_666 ?
V4 O8 V2 102.1(2) . 3_666 ?
V3 O13 V5 109.2(3) . . ?
V3 O7 Ag21 110.9(2) . . ?
V3 O7 V4 108.0(2) . 3_666 ?
V3 O7 V2 107.5(2) . . ?
V4 O7 Ag21 116.5(2) 3_666 . ?
V2 O7 Ag21 114.7(2) . . ?
V2 O7 V4 98.4(2) . 3_666 ?
V2 O2 V1 113.5(3) . . ?
V3 O9 Ag12 118.3(3) . . ?
V3 O9 V1 109.5(3) . 3_666 ?
V1 O9 Ag12 127.5(2) 3_666 . ?
V4 O3 Ag6 125.0(3) . . ?
V4 O3 V1 114.7(3) . . ?
V1 O3 Ag6 117.3(3) . . ?
Ag23 S13 Ag16 85.70(19) . . ?
C39 S13 Ag23 112.2(8) . . ?
C39 S13 Ag16 124.8(7) . . ?
C39 S13 Ag0O 129.0(7) . . ?
C39 S13 Ag0T 120.5(7) . . ?
Ag0O S13 Ag0T 109.5(4) . . ?
V5 O10 V1 111.7(3) . . ?
V4 O12 V5 112.7(3) . . ?
V2 O11 Ag14 121.4(3) . . ?
V2 O11 V5 112.5(3) . . ?
V5 O11 Ag14 115.2(3) . . ?
Ag12 O25 Ag11 92.0(3) . . ?
C60 O25 Ag12 114.9(9) . . ?
C60 O25 Ag11 152.9(10) . . ?
C45 O21 Ag9 114.5(17) . . ?
S9 C01P H01P 112.9 . . ?
S9 C01P H01A 106.0 . . ?
C025 C01P S9 107.1(19) . . ?
C025 C01P H01P 112.9 . . ?
C025 C01P C02Q 107(2) . . ?
C02Q C01P S9 103.6(15) . . ?
C02Q C01P H01P 112.9 . . ?
C02R C01P S9 113.9(14) . . ?
C02R C01P H01A 106.0 . . ?
C02R C01P C67 111.6(19) . . ?
C67 C01P S9 112.5(19) . . ?
C67 C01P H01A 106.0 . . ?
C45 O20 Ag8 126.5(18) . . ?
C60 O26 Ag5 138.7(11) . 3_666 ?
O25 C60 O26 124.9(15) . . ?
O25 C60 C61 119.7(14) . . ?
O26 C60 C61 115.3(14) . . ?
O21 C45 O20 134.2(18) . . ?
O21 C45 C44 117.9(18) . . ?
O20 C45 C44 108.0(18) . . ?
O27 C45 C44 138(4) . . ?
O27 C45 O21A 121(4) . . ?
O21A C45 C44 100(4) . . ?
C01P C025 H02A 109.5 . . ?
C01P C025 H02B 109.5 . . ?
C01P C025 H02C 109.5 . . ?
H02A C025 H02B 109.5 . . ?
H02A C025 H02C 109.5 . . ?
H02B C025 H02C 109.5 . . ?
S10 C47 H47 106.3 . . ?
S10 C47 H47A 107.7 . . ?
C48 C47 S10 113.4(19) . . ?
C48 C47 H47 106.3 . . ?
C48 C47 C46 111(3) . . ?
C46 C47 S10 113.1(19) . . ?
C46 C47 H47 106.3 . . ?
C1A C47 S10 112.8(11) . . ?
C1A C47 H47A 107.7 . . ?
C1A C47 C80A 110.3(16) . . ?
C80A C47 S10 110.3(11) . . ?
C80A C47 H47A 107.7 . . ?
S4 C14 H14 107.3 . . ?
S4 C14 H14A 92.8 . . ?
C13 C14 S4 111.1(11) . . ?
C13 C14 H14 107.3 . . ?
C15 C14 S4 110.9(11) . . ?
C15 C14 H14 107.3 . . ?
C15 C14 C13 112.6(15) . . ?
C77A C14 S4 113(2) . . ?
C77A C14 H14A 92.8 . . ?
C86A C14 S4 127(2) . . ?
C86A C14 H14A 92.8 . . ?
C86A C14 C77A 119(3) . . ?
S7 C50 H50 104.3 . . ?
C51 C50 S7 110.6(9) . . ?
C51 C50 H50 104.3 . . ?
C49 C50 S7 109.1(10) . . ?
C49 C50 H50 104.3 . . ?
C49 C50 C51 122.4(15) . . ?
S2 C5 H5A 107.8 . . ?
S2 C5 H5B 113.0 . . ?
C6 C5 S2 109.2(13) . . ?
C6 C5 H5A 107.8 . . ?
C4 C5 S2 115.2(17) . . ?
C4 C5 H5A 107.8 . . ?
C4 C5 C6 109(2) . . ?
C73A C5 S2 116.6(18) . . ?
C73A C5 H5B 113.0 . . ?
C73A C5 C22 97(3) . . ?
C22 C5 S2 102(2) . . ?
C22 C5 H5B 113.0 . . ?
C01P C02Q H02D 109.5 . . ?
C01P C02Q H02E 109.5 . . ?
C01P C02Q H02F 109.5 . . ?
H02D C02Q H02E 109.5 . . ?
H02D C02Q H02F 109.5 . . ?
H02E C02Q H02F 109.5 . . ?
F9 C44 C45 111.8(15) . . ?
F8 C44 F9 102.5(15) . . ?
F8 C44 C45 111.6(14) . . ?
F7 C44 F9 101.2(16) . . ?
F7 C44 F8 110.6(16) . . ?
F7 C44 C45 117.7(13) . . ?
F0 C44 C45 113.9(19) . . ?
F01Y C44 C45 118(2) . . ?
F01Y C44 F0 100(3) . . ?
F01Y C44 F01V 105(3) . . ?
F01V C44 C45 112.0(19) . . ?
F01V C44 F0 107(2) . . ?
S14 C17 H17 106.0 . . ?
C18 C17 S14 111.4(15) . . ?
C18 C17 H17 106.0 . . ?
C18 C17 C16 114.2(18) . . ?
C16 C17 S14 112.4(13) . . ?
C16 C17 H17 106.0 . . ?
C50 C51 H51A 109.5 . . ?
C50 C51 H51B 109.5 . . ?
C50 C51 H51C 109.5 . . ?
H51A C51 H51B 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
S12 C36 H36 108.4 . . ?
S12 C36 H36A 107.4 . . ?
C35 C36 S12 106.9(13) . . ?
C35 C36 H36 108.4 . . ?
C37 C36 S12 110.8(13) . . ?
C37 C36 H36 108.4 . . ?
C37 C36 C35 113.8(18) . . ?
C97A C36 S12 110.4(16) . . ?
C97A C36 H36A 107.4 . . ?
C88A C36 S12 113.6(17) . . ?
C88A C36 H36A 107.4 . . ?
C88A C36 C97A 110(2) . . ?
S15 C8 H8A 102.0 . . ?
S15 C8 H8B 109.2 . . ?
C7 C8 S15 107.1(15) . . ?
C7 C8 H8A 102.0 . . ?
C9 C8 S15 119.8(16) . . ?
C9 C8 H8A 102.0 . . ?
C9 C8 C7 120(2) . . ?
C69A C8 S15 110(4) . . ?
C69A C8 H8B 109.2 . . ?
C23 C8 S15 107(5) . . ?
C23 C8 H8B 109.2 . . ?
C23 C8 C69A 112(3) . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
C8 C7 H7C 109.5 . . ?
H7A C7 H7B 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C14 C13 H13A 109.5 . . ?
C14 C13 H13B 109.5 . . ?
C14 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C14 C15 H15A 109.5 . . ?
C14 C15 H15B 109.5 . . ?
C14 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C36 C35 H35A 109.5 . . ?
C36 C35 H35B 109.5 . . ?
C36 C35 H35C 109.5 . . ?
H35A C35 H35B 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C36 C37 H37A 109.5 . . ?
C36 C37 H37B 109.5 . . ?
C36 C37 H37C 109.5 . . ?
H37A C37 H37B 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
C8 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C50 C49 H49A 109.3 . . ?
C50 C49 H49B 109.8 . . ?
C50 C49 H49C 109.3 . . ?
H49A C49 H49B 109.5 . . ?
H49A C49 H49C 109.4 . . ?
H49B C49 H49C 109.5 . . ?
S1 C2 H2A 98.9 . . ?
S1 C2 H2B 113.3 . . ?
C3 C2 S1 113.1(13) . . ?
C3 C2 H2A 98.9 . . ?
C1 C2 S1 114.7(10) . . ?
C1 C2 H2A 98.9 . . ?
C1 C2 C3 125.0(17) . . ?
C67A C2 S1 108(2) . . ?
C67A C2 H2B 113.3 . . ?
C67A C2 C49A 104(2) . . ?
C49A C2 S1 104(3) . . ?
C49A C2 H2B 113.3 . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
C66 C61 C60 120.7(11) . . ?
C66 C61 C62 120.0 . . ?
C62 C61 C60 119.3(11) . . ?
C61 C66 H66 120.0 . . ?
C61 C66 C65 120.0 . . ?
C65 C66 H66 120.0 . . ?
C66 C65 H65 120.0 . . ?
C64 C65 C66 120.0 . . ?
C64 C65 H65 120.0 . . ?
C65 C64 H64 120.0 . . ?
C63 C64 C65 120.0 . . ?
C63 C64 H64 120.0 . . ?
C64 C63 H63 120.0 . . ?
C64 C63 C62 120.0 . . ?
C62 C63 H63 120.0 . . ?
C61 C62 H62 120.0 . . ?
C63 C62 C61 120.0 . . ?
C63 C62 H62 120.0 . . ?
C47 C48 H48A 109.5 . . ?
C47 C48 H48B 109.5 . . ?
C47 C48 H48C 109.5 . . ?
H48A C48 H48B 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C47 C46 H46A 109.5 . . ?
C47 C46 H46B 109.5 . . ?
C47 C46 H46C 109.5 . . ?
H46A C46 H46B 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
S3 C11 H11 107.3 . . ?
C12 C11 S3 108.5(10) . . ?
C12 C11 H11 107.3 . . ?
C10 C11 S3 111.4(11) . . ?
C10 C11 H11 107.3 . . ?
C10 C11 C12 114.6(15) . . ?
C11 C12 H12A 109.5 . . ?
C11 C12 H12B 109.5 . . ?
C11 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
S13 C39 H39 111.3 . . ?
S13 C39 H39A 100.6 . . ?
C40 C39 S13 115.6(18) . . ?
C40 C39 H39 111.3 . . ?
C40 C39 C38 99(2) . . ?
C38 C39 S13 107.5(17) . . ?
C38 C39 H39 111.3 . . ?
C21 C39 S13 138(3) . . ?
C21 C39 H39A 100.6 . . ?
C96A C39 S13 108(2) . . ?
C96A C39 H39A 100.6 . . ?
C96A C39 C21 103(2) . . ?
C11 C10 H10A 109.5 . . ?
C11 C10 H10B 109.5 . . ?
C11 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6B 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
H40A C40 H40B 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C5 C4 H4A 109.5 . . ?
C5 C4 H4B 109.5 . . ?
C5 C4 H4C 109.5 . . ?
H4A C4 H4B 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C39 C38 H38A 109.5 . . ?
C39 C38 H38B 109.5 . . ?
C39 C38 H38C 109.5 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
S8 C58 H58 105.0 . . ?
C59 C58 S8 111.7(10) . . ?
C59 C58 H58 105.0 . . ?
C59 C58 C57 118.9(13) . . ?
C57 C58 S8 110.1(9) . . ?
C57 C58 H58 105.0 . . ?
C58 C59 H59A 109.5 . . ?
C58 C59 H59B 109.5 . . ?
C58 C59 H59C 109.5 . . ?
H59A C59 H59B 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C58 C57 H57A 109.5 . . ?
C58 C57 H57B 109.5 . . ?
C58 C57 H57C 109.5 . . ?
H57A C57 H57B 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
S5 C25 H25 107.3 . . ?
C26 C25 S5 112.3(10) . . ?
C26 C25 H25 107.3 . . ?
C26 C25 C24 112.2(13) . . ?
C24 C25 S5 110.2(9) . . ?
C24 C25 H25 107.3 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26B 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
S6 C33 H33 107.5 . . ?
C34 C33 S6 109.7(11) . . ?
C34 C33 H33 107.5 . . ?
C32 C33 S6 113.1(12) . . ?
C32 C33 H33 107.5 . . ?
C32 C33 C34 111.4(17) . . ?
C25 C24 H24A 109.5 . . ?
C25 C24 H24B 109.5 . . ?
C25 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C33 C34 H34A 109.5 . . ?
C33 C34 H34B 109.5 . . ?
C33 C34 H34C 109.5 . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C33 C32 H32A 109.5 . . ?
C33 C32 H32B 109.5 . . ?
C33 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
S11 C42 H42 102.3 . . ?
S11 C42 H42A 104.6 . . ?
C41 C42 S11 113.2(14) . . ?
C41 C42 H42 102.3 . . ?
C43 C42 S11 115.0(12) . . ?
C43 C42 H42 102.3 . . ?
C43 C42 C41 119(2) . . ?
C56A C42 S11 112(2) . . ?
C56A C42 H42A 104.6 . . ?
C63A C42 S11 117.5(19) . . ?
C63A C42 H42A 104.6 . . ?
C63A C42 C56A 112(4) . . ?
C42 C41 H41A 109.5 . . ?
C42 C41 H41B 109.5 . . ?
C42 C41 H41C 109.5 . . ?
H41A C41 H41B 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C42 C43 H43A 109.5 . . ?
C42 C43 H43B 109.5 . . ?
C42 C43 H43C 109.5 . . ?
H43A C43 H43B 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
C17 C16 H16A 109.5 . . ?
C17 C16 H16B 109.5 . . ?
C17 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
S10 Ag24 S11 139.7(3) . . ?
S10 Ag24 Ag27 96.0(2) . . ?
S10 Ag24 Ag0O 158.7(4) . . ?
S11 Ag24 Ag27 44.34(16) . . ?
S11 Ag24 Ag0O 57.5(4) . . ?
Ag0O Ag24 Ag27 97.4(4) . . ?
S8 Ag25 Ag21 47.81(9) . . ?
S8 Ag25 Ag27 147.5(2) . . ?
S7 Ag25 Ag21 161.4(2) . . ?
S7 Ag25 S8 120.4(3) . . ?
S7 Ag25 Ag27 43.58(14) . . ?
S10 Ag25 Ag21 81.47(17) . . ?
S10 Ag25 S8 121.2(2) . . ?
S10 Ag25 S7 115.4(2) . . ?
S10 Ag25 Ag27 87.9(2) . . ?
Ag27 Ag25 Ag21 135.7(2) . . ?
Ag10 Ag0R Ag26 140.3(3) . . ?
S7 Ag0R Ag10 50.6(2) . . ?
S7 Ag0R Ag27 48.8(2) . . ?
S7 Ag0R Ag26 114.0(6) . . ?
S2 Ag0R Ag10 103.5(4) 3_666 . ?
S2 Ag0R S7 134.0(2) 3_666 . ?
S2 Ag0R Ag27 108.9(5) 3_666 . ?
S2 Ag0R Ag26 58.2(4) 3_666 . ?
Ag27 Ag0R Ag10 92.99(16) . . ?
Ag27 Ag0R Ag26 65.6(4) . . ?
C56 O24 Ag11 128.0(15) . . ?
C56 O23 Ag10 111.3(17) . . ?
O16 C20 O15 124(2) . . ?
O16 C20 C19 127(2) . . ?
O15 C20 C19 109.2(19) . . ?
O11A C20 C19 94(2) . . ?
O12A C20 C19 142(3) . . ?
O12A C20 O11A 122(3) . . ?
O24 C56 C55 110(2) . . ?
O23 C56 O24 139(2) . . ?
O23 C56 C55 109(3) . . ?
O3A C56 C55 119(3) . . ?
O3A C56 O4A 115(4) . . ?
O4A C56 C55 117(3) . . ?
C28 O17 Ag7 133(3) . . ?
C20 O16 Ag20 104.3(17) . . ?
O17 C28 C27 123(3) . . ?
O17 C28 O18 99(3) . . ?
O18 C28 C27 106(2) . . ?
O10A C28 C27 119(2) . . ?
O20A C28 C27 106(2) . . ?
O20A C28 O10A 113(3) . . ?
F3 C19 C20 112(2) . . ?
F3 C19 F2 98.3(17) . . ?
F2 C19 C20 113(2) . . ?
F1 C19 F3 105(2) . . ?
F1 C19 C20 116.6(18) . . ?
F1 C19 F2 111(2) . . ?
F4 C27 C28 113.6(17) . . ?
F4 C27 F5 97.2(13) . . ?
F4 C27 F6 106.8(16) . . ?
F5 C27 C28 117.3(17) . . ?
F6 C27 C28 120.5(19) . . ?
F6 C27 F5 98.1(15) . . ?
F20A C27 C28 118(2) . . ?
F20A C27 F14A 99.7(17) . . ?
F16A C27 C28 124(2) . . ?
F16A C27 F20A 101.9(17) . . ?
F16A C27 F14A 99.2(17) . . ?
F14A C27 C28 110.7(19) . . ?
S7 Ag27 Ag24 126.7(3) . . ?
S7 Ag27 Ag25 59.85(19) . . ?
S7 Ag27 Ag0R 58.8(3) . . ?
S7 Ag27 Ag26 123.4(6) . . ?
S11 Ag27 S7 164.1(3) . . ?
S11 Ag27 Ag24 63.4(2) . . ?
S11 Ag27 Ag25 134.7(3) . . ?
S11 Ag27 Ag0R 111.2(4) . . ?
S11 Ag27 Ag26 50.6(6) . . ?
Ag24 Ag27 Ag25 73.7(2) . . ?
Ag24 Ag27 Ag26 109.5(6) . . ?
Ag25 Ag27 Ag26 144.9(3) . . ?
Ag0R Ag27 Ag24 174.5(4) . . ?
Ag0R Ag27 Ag25 111.0(3) . . ?
Ag0R Ag27 Ag26 65.1(6) . . ?
C2 C67A H67A 109.5 . . ?
C2 C67A H67B 109.5 . . ?
C2 C67A H67C 109.5 . . ?
H67A C67A H67B 109.5 . . ?
H67A C67A H67C 109.5 . . ?
H67B C67A H67C 109.5 . . ?
C2 C49A H49D 109.5 . . ?
C2 C49A H49E 109.5 . . ?
C2 C49A H49F 109.5 . . ?
H49D C49A H49E 109.5 . . ?
H49D C49A H49F 109.5 . . ?
H49E C49A H49F 109.5 . . ?
C39 C21 H21A 114.6 . . ?
C39 C21 H21B 105.7 . . ?
C39 C21 H21C 108.0 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.4 . . ?
C39 C96A H96A 113.2 . . ?
C39 C96A H96B 107.1 . . ?
C39 C96A H96C 108.1 . . ?
H96A C96A H96B 109.4 . . ?
H96A C96A H96C 109.5 . . ?
H96B C96A H96C 109.5 . . ?
C5 C73A H73A 109.5 . . ?
C5 C73A H73B 109.5 . . ?
C5 C73A H73C 109.5 . . ?
H73A C73A H73B 109.5 . . ?
H73A C73A H73C 109.5 . . ?
H73B C73A H73C 109.5 . . ?
C5 C22 H22A 110.1 . . ?
C5 C22 H22B 110.7 . . ?
C5 C22 H22C 107.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C28 O18 Ag15 136(2) . . ?
Ag1 Ag26 S2 51.5(4) 3_666 3_666 ?
Ag1 Ag26 Ag0R 96.4(10) 3_666 . ?
Ag1 Ag26 Ag27 118.9(10) 3_666 . ?
S2 Ag26 Ag0R 46.1(6) 3_666 . ?
S2 Ag26 Ag27 86.0(10) 3_666 . ?
S6 Ag26 Ag1 58.3(3) . 3_666 ?
S6 Ag26 S2 104.2(3) . 3_666 ?
S6 Ag26 Ag0R 148.7(7) . . ?
S6 Ag26 Ag27 156.6(6) . . ?
S11 Ag26 Ag1 139.3(4) . 3_666 ?
S11 Ag26 S2 125.4(14) . 3_666 ?
S11 Ag26 S6 124.9(13) . . ?
S11 Ag26 Ag0R 86.1(9) . . ?
S11 Ag26 Ag27 39.6(4) . . ?
Ag0R Ag26 Ag27 49.4(5) . . ?
O27 Ag26 S6 105(3) . . ?
O27 Ag26 S11 95(2) . . ?
O27 Ag26 Ag0R 73(2) . . ?
O27 Ag26 Ag27 95(3) . . ?
C20 O11A Ag0L 134(3) . . ?
C20 O12A Ag20 120(3) . . ?
F11 C55 C56 109(2) . . ?
F12 C55 C56 116(2) . . ?
F12 C55 F11 104(2) . . ?
F10 C55 C56 119(2) . . ?
F10 C55 F11 108(2) . . ?
F10 C55 F12 100(3) . . ?
F1A C55 C56 107.9(18) . . ?
F3A C55 C56 113(2) . . ?
F3A C55 F1A 105.5(19) . . ?
F4A C55 C56 119(2) . . ?
F4A C55 F1A 102(2) . . ?
F4A C55 F3A 108.1(18) . . ?
C01P C02R H02G 109.5 . . ?
C01P C02R H02H 109.5 . . ?
C01P C02R H02I 109.5 . . ?
H02G C02R H02H 109.5 . . ?
H02G C02R H02I 109.5 . . ?
H02H C02R H02I 109.5 . . ?
C01P C67 H67D 109.5 . . ?
C01P C67 H67E 109.5 . . ?
C01P C67 H67F 109.5 . . ?
H67D C67 H67E 109.5 . . ?
H67D C67 H67F 109.5 . . ?
H67E C67 H67F 109.5 . . ?
C56 O4A Ag10 112(4) . . ?
C31 O19 Ag15 124(2) . . ?
C20A O19 Ag15 132(6) . . ?
C31 N1 C30 117(3) . . ?
C31 N1 C29 127(3) . . ?
C30 N1 C29 116(2) . . ?
O19 C31 N1 127(4) . . ?
O19 C31 H31 116.7 . . ?
N1 C31 H31 116.7 . . ?
N1 C30 H30A 112.8 . . ?
N1 C30 H30B 102.4 . . ?
N1 C30 H30C 113.1 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.4 . . ?
H30B C30 H30C 109.4 . . ?
N1 C29 H29A 109.5 . . ?
N1 C29 H29B 109.5 . . ?
N1 C29 H29C 109.5 . . ?
H29A C29 H29B 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
S12 Ag0O Ag4 50.69(14) . . ?
S12 Ag0O Ag24 175.3(4) . . ?
S11 Ag0O Ag4 144.4(4) . . ?
S11 Ag0O S12 122.9(8) . . ?
S11 Ag0O Ag24 59.0(2) . . ?
S13 Ag0O Ag4 85.0(5) . . ?
S13 Ag0O S12 105.7(4) . . ?
S13 Ag0O S11 125.5(5) . . ?
S13 Ag0O Ag24 74.6(5) . . ?
Ag24 Ag0O Ag4 124.9(6) . . ?
S14 Ag0T S4 122.5(6) . . ?
S13 Ag0T S4 113.5(3) . . ?
S13 Ag0T S14 124.0(6) . . ?
Ag19 Ag0L Ag20 62.3(3) . . ?
Ag19 Ag0L H23A 97.0 . . ?
Ag20 Ag0L H23A 116.1 . . ?
S15 Ag0L Ag19 52.4(3) . . ?
S15 Ag0L Ag20 114.7(6) . . ?
S15 Ag0L S14 148.6(10) . . ?
S15 Ag0L O11A 114.7(12) . . ?
S15 Ag0L H23A 75.2 . . ?
S14 Ag0L Ag19 118.3(8) . . ?
S14 Ag0L Ag20 65.2(4) . . ?
S14 Ag0L O11A 94.3(10) . . ?
S14 Ag0L H23A 134.8 . . ?
O11A Ag0L Ag19 92.2(10) . . ?
O11A Ag0L Ag20 65.8(8) . . ?
O11A Ag0L H23A 54.7 . . ?
O19 C20A H20A 109.9 . . ?
O19 C20A N2A 140(10) . . ?
N2A C20A H20A 109.9 . . ?
C20A N2A C25A 126(3) . . ?
C20A N2A C24A 125(3) . . ?
C20A N2A H24F 126.9 . . ?
C25A N2A C24A 108(3) . . ?
C25A N2A H24F 87.1 . . ?
C24A N2A H24F 41.6 . . ?
N2A C25A H25A 117.9 . . ?
N2A C25A H25B 101.7 . . ?
N2A C25A H25C 108.5 . . ?
H25A C25A H25B 109.4 . . ?
H25A C25A H25C 109.4 . . ?
H25B C25A H25C 109.5 . . ?
N2A C24A H24D 133.1 . . ?
N2A C24A H24E 115.0 . . ?
N2A C24A H24F 41.8 . . ?
H24D C24A H24E 109.5 . . ?
H24D C24A H24F 109.4 . . ?
H24E C24A H24F 109.5 . . ?
C42 C56A H56A 109.5 . . ?
C42 C56A H56B 109.5 . . ?
C42 C56A H56C 109.5 . . ?
H56A C56A H56B 109.5 . . ?
H56A C56A H56C 109.5 . . ?
H56B C56A H56C 109.5 . . ?
C42 C63A H63A 109.5 . . ?
C42 C63A H63B 109.5 . . ?
C42 C63A H63C 109.5 . . ?
H63A C63A H63B 109.5 . . ?
H63A C63A H63C 109.5 . . ?
H63B C63A H63C 109.5 . . ?
C54 O22 Ag10 114(2) . . ?
C53 N2 C52 109(2) . . ?
C54 N2 C53 125.7(18) . . ?
C54 N2 C52 125.4(17) . . ?
N2 C53 H53A 109.5 . . ?
N2 C53 H53B 109.5 . . ?
N2 C53 H53C 109.5 . . ?
H53A C53 H53B 109.5 . . ?
H53A C53 H53C 109.5 . . ?
H53B C53 H53C 109.5 . . ?
O22 C54 H54A 108.3 . . ?
O22 C54 H54B 108.3 . . ?
N2 C54 O22 116(3) . . ?
N2 C54 H54A 108.3 . . ?
N2 C54 H54B 108.3 . . ?
H54A C54 H54B 107.4 . . ?
N2 C52 H52A 109.6 . . ?
N2 C52 H52B 109.6 . . ?
N2 C52 H52C 109.3 . . ?
H52A C52 H52B 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
C8 C69A H69A 91.2 . . ?
C8 C69A H69B 99.0 . . ?
C8 C69A H69C 135.8 . . ?
H69A C69A H69B 109.5 . . ?
H69A C69A H69C 109.3 . . ?
H69B C69A H69C 109.5 . . ?
C8 C23 H23A 115.4 . . ?
C8 C23 H23B 128.8 . . ?
C8 C23 H23C 77.9 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.4 . . ?
C47 C1A H1AA 109.5 . . ?
C47 C1A H1AB 109.5 . . ?
C47 C1A H1AC 109.5 . . ?
H1AA C1A H1AB 109.5 . . ?
H1AA C1A H1AC 109.5 . . ?
H1AB C1A H1AC 109.5 . . ?
C47 C80A H80A 109.5 . . ?
C47 C80A H80B 109.5 . . ?
C47 C80A H80C 109.5 . . ?
H80A C80A H80B 109.5 . . ?
H80A C80A H80C 109.5 . . ?
H80B C80A H80C 109.5 . . ?
C36 C97A H97A 109.5 . . ?
C36 C97A H97B 109.5 . . ?
C36 C97A H97C 109.5 . . ?
H97A C97A H97B 109.5 . . ?
H97A C97A H97C 109.5 . . ?
H97B C97A H97C 109.5 . . ?
C36 C88A H88A 109.5 . . ?
C36 C88A H88B 109.5 . . ?
C36 C88A H88C 109.5 . . ?
H88A C88A H88B 109.5 . . ?
H88A C88A H88C 109.5 . . ?
H88B C88A H88C 109.5 . . ?
C14 C77A H77A 109.9 . . ?
C14 C77A H77B 109.5 . . ?
C14 C77A H77C 109.1 . . ?
H77A C77A H77B 109.5 . . ?
H77A C77A H77C 109.4 . . ?
H77B C77A H77C 109.5 . . ?
C14 C86A H86A 109.5 . . ?
C14 C86A H86B 109.5 . . ?
C14 C86A H86C 109.5 . . ?
H86A C86A H86B 109.5 . . ?
H86A C86A H86C 109.5 . . ?
H86B C86A H86C 109.5 . . ?
C45 O27 Ag26 150(6) . . ?
C54A O22A Ag10 155(5) . . ?
C54A N3 C53A 125.2(19) . . ?
C52A N3 C53A 104(2) . . ?
C52A N3 C54A 130.4(19) . . ?
N3 C53A H53D 110.4 . . ?
N3 C53A H53E 108.0 . . ?
N3 C53A H53F 109.9 . . ?
H53D C53A H53E 109.5 . . ?
H53D C53A H53F 109.5 . . ?
H53E C53A H53F 109.5 . . ?
O22A C54A H54C 110.6 . . ?
O22A C54A H54D 110.6 . . ?
N3 C54A O22A 106(3) . . ?
N3 C54A H54C 110.6 . . ?
N3 C54A H54D 110.6 . . ?
H54C C54A H54D 108.7 . . ?
N3 C52A H52D 108.5 . . ?
N3 C52A H52E 109.7 . . ?
N3 C52A H52F 110.2 . . ?
H52D C52A H52E 109.4 . . ?
H52D C52A H52F 109.5 . . ?
H52E C52A H52F 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Ag21 S8 C58 C59 -148.8(10) . . . . ?
Ag21 S8 C58 C57 76.9(12) . . . . ?
Ag21 S9 C01P C025 133.3(18) . . . . ?
Ag21 S9 C01P C02Q -113.9(18) . . . . ?
Ag21 S9 C01P C02R -79(2) . . . . ?
Ag21 S9 C01P C67 152(2) . . . . ?
Ag3 S3 C11 C12 148.4(11) . . . . ?
Ag3 S3 C11 C10 -84.5(13) . . . . ?
Ag3 S4 C14 C13 167.8(14) . . . . ?
Ag3 S4 C14 C15 -66.1(13) . . . . ?
Ag3 S4 C14 C77A -149(3) . . . . ?
Ag3 S4 C14 C86A 21(3) . . . . ?
Ag6 S5 C25 C26 67.9(12) . . . . ?
Ag6 S5 C25 C24 -166.1(11) . . . . ?
Ag6 S9 C01P C025 49.9(19) 3_666 . . . ?
Ag6 S9 C01P C02Q 162.7(18) 3_666 . . . ?
Ag6 S9 C01P C02R -163(2) 3_666 . . . ?
Ag6 S9 C01P C67 69(2) 3_666 . . . ?
Ag6 S1 C2 C3 -5(2) 3_666 . . . ?
Ag6 S1 C2 C1 -156.7(16) 3_666 . . . ?
Ag6 S1 C2 C67A -80(3) 3_666 . . . ?
Ag6 S1 C2 C49A 30(3) 3_666 . . . ?
Ag12 S8 C58 C59 -68.1(11) . . . . ?
Ag12 S8 C58 C57 157.6(12) . . . . ?
Ag12 S5 C25 C26 170.8(10) 3_666 . . . ?
Ag12 S5 C25 C24 -63.3(12) 3_666 . . . ?
Ag12 O25 C60 O26 -24(2) . . . . ?
Ag12 O25 C60 C61 159.0(9) . . . . ?
Ag19 S15 C8 C7 -133.2(19) . . . . ?
Ag19 S15 C8 C9 9(3) . . . . ?
Ag19 S15 C8 C69A 154(5) . . . . ?
Ag19 S15 C8 C23 -85(5) . . . . ?
Ag19 S1 C2 C3 150.3(18) . . . . ?
Ag19 S1 C2 C1 -2(2) . . . . ?
Ag19 S1 C2 C67A 75(3) . . . . ?
Ag19 S1 C2 C49A -175(3) . . . . ?
Ag2 S3 C11 C12 64.9(12) . . . . ?
Ag2 S3 C11 C10 -168.0(13) . . . . ?
Ag2 S15 C8 C7 148.6(18) . . . . ?
Ag2 S15 C8 C9 -70(3) . . . . ?
Ag2 S15 C8 C69A 75(5) . . . . ?
Ag2 S15 C8 C23 -163(5) . . . . ?
Ag2 S2 C5 C6 60.0(18) . . . . ?
Ag2 S2 C5 C4 -63(2) . . . . ?
Ag2 S2 C5 C73A 14(3) . . . . ?
Ag2 S2 C5 C22 -91(2) . . . . ?
Ag22 S9 C01P C025 -145.4(18) . . . . ?
Ag22 S9 C01P C02Q -32.6(18) . . . . ?
Ag22 S9 C01P C02R 2(2) . . . . ?
Ag22 S9 C01P C67 -126(2) . . . . ?
Ag22 S10 C47 C48 -45(3) . . . . ?
Ag22 S10 C47 C46 82(3) . . . . ?
Ag22 S10 C47 C1A 137.0(15) . . . . ?
Ag22 S10 C47 C80A 13.1(15) . . . . ?
Ag22 S14 C17 C18 53.2(19) . . . . ?
Ag22 S14 C17 C16 -177.2(15) . . . . ?
Ag15 S12 C36 C35 24.4(19) . . . . ?
Ag15 S12 C36 C37 -100.0(18) . . . . ?
Ag15 S12 C36 C97A -66(2) . . . . ?
Ag15 S12 C36 C88A 58(2) . . . . ?
Ag15 S6 C33 C34 -164.0(12) . . . . ?
Ag15 S6 C33 C32 71.0(17) . . . . ?
Ag15 O19 C31 N1 161(4) . . . . ?
Ag15 O19 C20A N2A 171(13) . . . . ?
Ag4 S4 C14 C13 42.0(15) . . . . ?
Ag4 S4 C14 C15 168.0(12) . . . . ?
Ag4 S4 C14 C77A 85(3) . . . . ?
Ag4 S4 C14 C86A -105(3) . . . . ?
Ag4 S12 C36 C35 -152.2(18) . . . . ?
Ag4 S12 C36 C37 83.3(18) . . . . ?
Ag4 S12 C36 C97A 117(2) . . . . ?
Ag4 S12 C36 C88A -118(2) . . . . ?
Ag7 S5 C25 C26 -26.5(12) . . . . ?
Ag7 S5 C25 C24 99.4(12) . . . . ?
Ag7 S6 C33 C34 117.2(12) . . . . ?
Ag7 S6 C33 C32 -7.8(19) . . . . ?
Ag7 O17 C28 C27 -171(3) . . . . ?
Ag7 O17 C28 O18 -55(5) . . . . ?
Ag11 S8 C58 C59 24.2(12) . . . . ?
Ag11 S8 C58 C57 -110.1(12) . . . . ?
Ag11 S3 C11 C12 -127.3(11) 3_666 . . . ?
Ag11 S3 C11 C10 -0.2(15) 3_666 . . . ?
Ag11 O25 C60 O26 149.5(16) . . . . ?
Ag11 O25 C60 C61 -28(3) . . . . ?
Ag11 O24 C56 O23 12(6) . . . . ?
Ag11 O24 C56 C55 171.9(11) . . . . ?
Ag10 S3 C11 C12 -45.0(12) 3_666 . . . ?
Ag10 S3 C11 C10 82.1(14) 3_666 . . . ?
Ag10 S7 C50 C51 65.4(15) . . . . ?
Ag10 S7 C50 C49 -72.0(14) . . . . ?
Ag10 O23 C56 O24 -14(5) . . . . ?
Ag10 O23 C56 C55 -174.8(12) . . . . ?
Ag10 O22 C54 N2 156(3) . . . . ?
Ag10 O22A C54A N3 -170(9) . . . . ?
Ag20 S9 C01P C025 -49.0(19) . . . . ?
Ag20 S9 C01P C02Q 63.7(18) . . . . ?
Ag20 S9 C01P C02R 98(2) . . . . ?
Ag20 S9 C01P C67 -30(2) . . . . ?
Ag1 S1 C2 C3 -125.5(19) . . . . ?
Ag1 S1 C2 C1 82.5(18) . . . . ?
Ag1 S1 C2 C67A 159(3) . . . . ?
Ag1 S1 C2 C49A -91(3) . . . . ?
Ag1 S2 C5 C6 -39.5(18) . . . . ?
Ag1 S2 C5 C4 -162(2) . . . . ?
Ag1 S2 C5 C73A -86(3) . . . . ?
Ag1 S2 C5 C22 169(2) . . . . ?
Ag1 S6 C33 C34 -5.8(15) 3_666 . . . ?
Ag1 S6 C33 C32 -130.8(15) 3_666 . . . ?
Ag13 S8 C58 C59 107.4(11) . . . . ?
Ag13 S8 C58 C57 -26.9(13) . . . . ?
Ag13 S7 C50 C51 -20.2(16) . . . . ?
Ag13 S7 C50 C49 -157.6(12) . . . . ?
Ag14 S7 C50 C51 -95.3(14) . . . . ?
Ag14 S7 C50 C49 127.4(14) . . . . ?
Ag14 S10 C47 C48 154(3) . . . . ?
Ag14 S10 C47 C46 -79(3) . . . . ?
Ag14 S11 C42 C41 175.8(17) . . . . ?
Ag14 S11 C42 C43 -44(2) . . . . ?
Ag23 S10 C47 C48 -128(3) . . . . ?
Ag23 S10 C47 C46 -1(3) . . . . ?
Ag23 S13 C39 C40 43(2) . . . . ?
Ag23 S13 C39 C38 -67(2) . . . . ?
Ag5 S5 C25 C26 -106.2(11) . . . . ?
Ag5 S5 C25 C24 19.7(13) . . . . ?
Ag5 S12 C36 C35 120.6(18) . . . . ?
Ag5 S12 C36 C37 -3.8(19) . . . . ?
Ag5 S12 C36 C97A 30(2) . . . . ?
Ag5 S12 C36 C88A 155(2) . . . . ?
Ag5 O26 C60 O25 40(3) 3_666 . . . ?
Ag5 O26 C60 C61 -142.5(13) 3_666 . . . ?
Ag8 S6 C33 C34 -85.7(14) . . . . ?
Ag8 S6 C33 C32 149.3(16) . . . . ?
Ag8 S11 C42 C41 -34(2) . . . . ?
Ag8 S11 C42 C43 107(2) . . . . ?
Ag8 O20 C45 O21 -4(4) . . . . ?
Ag8 O20 C45 C44 175.1(12) . . . . ?
Ag18 S15 C8 C7 -52(2) . . . . ?
Ag18 S15 C8 C9 90(2) . . . . ?
Ag18 S14 C17 C18 -117.0(16) . . . . ?
Ag18 S14 C17 C16 13(2) . . . . ?
V3 V1 O3 Ag6 -106.3(3) 3_666 . . . ?
V3 V1 O3 V4 55.2(3) 3_666 . . . ?
V3 V1 O10 V5 -0.1(4) 3_666 . . . ?
V3 V5 O10 V1 -2.1(4) . . . . ?
V3 V5 O11 Ag14 -160.3(2) . . . . ?
V3 V5 O11 V2 54.8(2) . . . . ?
V4 V2 O2 V1 84.3(3) 3_666 . . . ?
V4 V2 O11 Ag14 130.80(19) 3_666 . . . ?
V4 V2 O11 V5 -86.8(3) 3_666 . . . ?
V4 V1 O3 Ag6 -161.5(5) . . . . ?
V4 V1 O10 V5 47.3(2) . . . . ?
V4 V5 O10 V1 -47.3(2) . . . . ?
V4 V5 O11 Ag14 156.09(13) . . . . ?
V4 V5 O11 V2 11.3(4) . . . . ?
Ag16 S12 C36 C35 -62.1(19) . . . . ?
Ag16 S12 C36 C37 173.4(17) . . . . ?
Ag16 S11 C42 C41 58(2) . . . . ?
Ag16 S11 C42 C43 -161.1(19) . . . . ?
Ag16 S13 C39 C40 143.2(19) . . . . ?
Ag16 S13 C39 C38 34(2) . . . . ?
V2 V4 O3 Ag6 74.7(3) 3_666 . . . ?
V2 V4 O3 V1 -85.2(3) 3_666 . . . ?
V2 V4 O12 V5 84.6(3) 3_666 . . . ?
V2 V1 O3 Ag6 -150.41(15) . . . . ?
V2 V1 O3 V4 11.1(4) . . . . ?
V2 V1 O10 V5 -45.5(3) . . . . ?
V2 V5 O10 V1 46.0(3) . . . . ?
V2 V5 O11 Ag14 144.8(4) . . . . ?
V1 V3 O8 V4 -142.8(2) 3_666 . . . ?
V1 V3 O8 V2 -32.6(2) 3_666 . . 3_666 ?
V1 V3 O13 V5 177.39(12) 3_666 . . . ?
V1 V3 O9 Ag12 157.7(4) 3_666 . . . ?
V1 V4 O3 Ag6 159.9(6) . . . . ?
V1 V4 O12 V5 -38.9(2) . . . . ?
V1 V2 O11 Ag14 -104.7(3) . . . . ?
V1 V2 O11 V5 37.6(2) . . . . ?
V1 V5 O11 Ag14 106.2(2) . . . . ?
V1 V5 O11 V2 -38.6(2) . . . . ?
Ag9 S7 C50 C51 -179.7(12) . . . . ?
Ag9 S7 C50 C49 42.9(16) . . . . ?
Ag9 S2 C5 C6 -165.1(16) 3_666 . . . ?
Ag9 S2 C5 C4 72(2) 3_666 . . . ?
Ag9 S11 C42 C41 -104.1(18) . . . . ?
Ag9 S11 C42 C43 37(2) . . . . ?
Ag9 O21 C45 O20 -13(4) . . . . ?
Ag9 O21 C45 C44 168.6(12) . . . . ?
V5 V3 O8 V4 31.9(2) . . . . ?
V5 V3 O8 V2 142.1(2) . . . 3_666 ?
V5 V3 O9 Ag12 -19.7(5) . . . . ?
V5 V3 O9 V1 -177.31(12) . . . 3_666 ?
V5 V4 O3 Ag6 -163.0(3) . . . . ?
V5 V4 O3 V1 37.2(3) . . . . ?
V5 V2 O2 V1 -40.4(3) . . . . ?
V5 V2 O11 Ag14 -142.4(5) . . . . ?
V5 V1 O3 Ag6 160.4(2) . . . . ?
V5 V1 O3 V4 -38.1(3) . . . . ?
Ag17 S4 C14 C13 -62.4(16) . . . . ?
Ag17 S4 C14 C15 63.6(14) . . . . ?
Ag17 S14 C17 C18 167.9(15) . . . . ?
Ag17 S14 C17 C16 -62.4(19) . . . . ?
O5 V3 O8 V4 -15.3(2) . . . . ?
O5 V3 O8 V4 -95.3(3) 3_666 . . . ?
O5 V3 O8 V2 14.9(2) 3_666 . . 3_666 ?
O5 V3 O8 V2 94.9(2) . . . 3_666 ?
O5 V3 O13 V5 -1.6(2) . . . . ?
O5 V3 O13 V5 -3.7(11) 3_666 . . . ?
O5 V3 O9 Ag12 159.3(3) 3_666 . . . ?
O5 V3 O9 Ag12 159.5(8) . . . . ?
O5 V3 O9 V1 1.6(2) 3_666 . . 3_666 ?
O5 V3 O9 V1 1.8(11) . . . 3_666 ?
O5 V4 O3 Ag6 149.5(3) . . . . ?
O5 V4 O3 V1 -10.4(3) . . . . ?
O5 V4 O12 V5 8.9(3) . . . . ?
O5 V2 O2 V1 7.7(3) . . . . ?
O5 V2 O11 Ag14 -152.5(3) . . . . ?
O5 V2 O11 V5 -10.2(3) . . . . ?
O5 V1 O3 Ag6 -151.3(3) . . . . ?
O5 V1 O3 V4 10.2(3) . . . . ?
O5 V1 O10 V5 0.5(3) . . . . ?
O5 V5 O10 V1 -0.5(3) . . . . ?
O5 V5 O11 Ag14 154.8(3) . . . . ?
O5 V5 O11 V2 10.0(3) . . . . ?
O8 V3 O13 V5 -81.5(3) . . . . ?
O8 V3 O9 Ag12 -121.0(3) . . . . ?
O8 V3 O9 V1 81.3(3) . . . 3_666 ?
O8 V4 O3 Ag6 125.3(4) . . . . ?
O8 V4 O3 V1 -34.6(7) . . . . ?
O8 V4 O12 V5 84.3(3) . . . . ?
O8 V2 O2 V1 83.5(3) 3_666 . . . ?
O8 V2 O11 Ag14 -177.5(4) 3_666 . . . ?
O8 V2 O11 V5 -35.1(7) 3_666 . . . ?
O13 V3 O8 V4 71.0(3) . . . . ?
O13 V3 O8 V2 -178.8(3) . . . 3_666 ?
O13 V3 O9 Ag12 -21.3(3) . . . . ?
O13 V3 O9 V1 -178.9(2) . . . 3_666 ?
O13 V5 O10 V1 -8.1(8) . . . . ?
O13 V5 O11 Ag14 -129.3(3) . . . . ?
O13 V5 O11 V2 85.8(3) . . . . ?
O7 V3 O8 V4 -55.2(6) . . . . ?
O7 V3 O8 V2 55.0(6) . . . 3_666 ?
O7 V3 O13 V5 78.2(3) . . . . ?
O7 V3 O9 Ag12 79.3(3) . . . . ?
O7 V3 O9 V1 -78.4(3) . . . 3_666 ?
O7 V4 O3 Ag6 74.0(3) 3_666 . . . ?
O7 V4 O3 V1 -85.8(3) 3_666 . . . ?
O7 V4 O12 V5 27.7(7) 3_666 . . . ?
O7 V2 O2 V1 25.6(8) . . . . ?
O7 V2 O11 Ag14 131.4(3) . . . . ?
O7 V2 O11 V5 -86.2(3) . . . . ?
O2 V2 O11 Ag14 -72.0(3) . . . . ?
O2 V2 O11 V5 70.3(3) . . . . ?
O2 V1 O3 Ag6 -136.0(5) . . . . ?
O2 V1 O3 V4 25.5(8) . . . . ?
O2 V1 O10 V5 -76.7(3) . . . . ?
O9 V3 O8 V4 178.7(3) . . . . ?
O9 V3 O8 V2 -71.1(3) . . . 3_666 ?
O9 V3 O13 V5 178.6(2) . . . . ?
O9 V1 O3 Ag6 -75.1(3) 3_666 . . . ?
O9 V1 O3 V4 86.4(3) 3_666 . . . ?
O9 V1 O10 V5 -4.4(8) 3_666 . . . ?
O3 V4 O12 V5 -69.6(3) . . . . ?
O3 V1 O10 V5 78.3(3) . . . . ?
O10 V1 O3 Ag6 127.0(3) . . . . ?
O10 V1 O3 V4 -71.5(3) . . . . ?
O10 V5 O11 Ag14 72.8(3) . . . . ?
O10 V5 O11 V2 -72.0(3) . . . . ?
O6 V4 O3 Ag6 -25.0(4) . . . . ?
O6 V4 O3 V1 175.2(3) . . . . ?
O6 V4 O12 V5 -174.3(3) . . . . ?
O1 V1 O3 Ag6 22.1(4) . . . . ?
O1 V1 O3 V4 -176.4(3) . . . . ?
O1 V1 O10 V5 -177.9(3) . . . . ?
O12 V4 O3 Ag6 -130.4(3) . . . . ?
O12 V4 O3 V1 69.7(3) . . . . ?
O12 V5 O10 V1 -78.7(3) . . . . ?
O12 V5 O11 Ag14 174.5(5) . . . . ?
O12 V5 O11 V2 29.7(7) . . . . ?
O4 V2 O2 V1 -176.9(3) . . . . ?
O4 V2 O11 Ag14 33.5(4) . . . . ?
O4 V2 O11 V5 175.9(3) . . . . ?
O11 V2 O2 V1 -72.4(3) . . . . ?
O11 V5 O10 V1 77.9(3) . . . . ?
O14 V5 O10 V1 179.5(3) . . . . ?
O14 V5 O11 Ag14 -32.4(3) . . . . ?
O14 V5 O11 V2 -177.2(3) . . . . ?
O25 C60 C61 C66 169.0(11) . . . . ?
O25 C60 C61 C62 -10.3(17) . . . . ?
O21 C45 C44 F9 -43(3) . . . . ?
O21 C45 C44 F8 71(3) . . . . ?
O21 C45 C44 F7 -159(3) . . . . ?
O20 C45 C44 F9 138.3(18) . . . . ?
O20 C45 C44 F8 -107.6(19) . . . . ?
O20 C45 C44 F7 22(2) . . . . ?
O26 C60 C61 C66 -8.5(18) . . . . ?
O26 C60 C61 C62 172.3(12) . . . . ?
C60 C61 C66 C65 -179.2(12) . . . . ?
C60 C61 C62 C63 179.3(12) . . . . ?
C44 C45 O27 Ag26 -145(9) . . . . ?
C61 C66 C65 C64 0.0 . . . . ?
C66 C61 C62 C63 0.0 . . . . ?
C66 C65 C64 C63 0.0 . . . . ?
C65 C64 C63 C62 0.0 . . . . ?
C64 C63 C62 C61 0.0 . . . . ?
C62 C61 C66 C65 0.0 . . . . ?
Ag24 S10 C47 C1A 21.1(17) . . . . ?
Ag24 S10 C47 C80A -102.8(14) . . . . ?
Ag24 S11 C42 C56A 103(3) . . . . ?
Ag24 S11 C42 C63A -28(3) . . . . ?
Ag25 S8 C58 C59 131.0(10) . . . . ?
Ag25 S8 C58 C57 -3.3(13) . . . . ?
Ag25 S7 C50 C51 -43.8(15) . . . . ?
Ag25 S7 C50 C49 178.9(13) . . . . ?
Ag25 S10 C47 C1A -84.4(16) . . . . ?
Ag25 S10 C47 C80A 151.7(13) . . . . ?
Ag0R S7 C50 C51 154.4(13) . . . . ?
Ag0R S7 C50 C49 17.1(17) . . . . ?
Ag0R S2 C5 C73A 127(3) 3_666 . . . ?
Ag0R S2 C5 C22 22(2) 3_666 . . . ?
O24 C56 C55 F11 86(3) . . . . ?
O24 C56 C55 F12 -30(3) . . . . ?
O24 C56 C55 F10 -150(3) . . . . ?
O23 C56 C55 F11 -107(3) . . . . ?
O23 C56 C55 F12 136(3) . . . . ?
O23 C56 C55 F10 17(4) . . . . ?
O17 C28 C27 F4 -154(4) . . . . ?
O17 C28 C27 F5 -42(4) . . . . ?
O17 C28 C27 F6 77(4) . . . . ?
O17 C28 O18 Ag15 34(4) . . . . ?
O16 C20 C19 F3 -130(3) . . . . ?
O16 C20 C19 F2 120(3) . . . . ?
O16 C20 C19 F1 -10(4) . . . . ?
O15 C20 O16 Ag20 10(4) . . . . ?
O15 C20 C19 F3 44(3) . . . . ?
O15 C20 C19 F2 -66(3) . . . . ?
O15 C20 C19 F1 165(3) . . . . ?
C19 C20 O16 Ag20 -176(2) . . . . ?
C19 C20 O11A Ag0L 176(4) . . . . ?
C19 C20 O12A Ag20 176(3) . . . . ?
C27 C28 O18 Ag15 163(2) . . . . ?
Ag27 S7 C50 C51 -125.6(13) . . . . ?
Ag27 S7 C50 C49 97.0(15) . . . . ?
Ag27 S11 C42 C56A 177(3) . . . . ?
Ag27 S11 C42 C63A 45(3) . . . . ?
O18 C28 C27 F4 93(3) . . . . ?
O18 C28 C27 F5 -155(2) . . . . ?
O18 C28 C27 F6 -36(3) . . . . ?
O10A C28 C27 F20A 170(3) . . . . ?
O10A C28 C27 F16A 41(4) . . . . ?
O10A C28 C27 F14A -76(3) . . . . ?
O20A C28 C27 F20A 42(4) . . . . ?
O20A C28 C27 F16A -87(4) . . . . ?
O20A C28 C27 F14A 156(3) . . . . ?
Ag26 S2 C5 C73A -154(3) 3_666 . . . ?
Ag26 S2 C5 C22 101(2) 3_666 . . . ?
Ag26 S6 C33 C34 -71.3(15) . . . . ?
Ag26 S6 C33 C32 163.7(17) . . . . ?
Ag26 S11 C42 C56A -85(3) . . . . ?
Ag26 S11 C42 C63A 144(3) . . . . ?
O11A C20 C19 F3 -167(3) . . . . ?
O11A C20 C19 F2 84(3) . . . . ?
O11A C20 C19 F1 -46(4) . . . . ?
O11A C20 O12A Ag20 19(6) . . . . ?
O12A C20 C19 F3 34(6) . . . . ?
O12A C20 C19 F2 -76(6) . . . . ?
O12A C20 C19 F1 154(5) . . . . ?
O12A C20 O11A Ag0L -18(6) . . . . ?
C55 C56 O4A Ag10 158(3) . . . . ?
O3A C56 C55 F1A 172(7) . . . . ?
O3A C56 C55 F3A 56(7) . . . . ?
O3A C56 C55 F4A -73(7) . . . . ?
O3A C56 O4A Ag10 11(11) . . . . ?
O4A C56 C55 F1A 26(8) . . . . ?
O4A C56 C55 F3A -90(8) . . . . ?
O4A C56 C55 F4A 142(8) . . . . ?
O19 C20A N2A C25A -117(20) . . . . ?
O19 C20A N2A C24A 53(34) . . . . ?
C30 N1 C31 O19 -6(8) . . . . ?
C29 N1 C31 O19 169(6) . . . . ?
Ag0O S12 C36 C97A -166(2) . . . . ?
Ag0O S12 C36 C88A -41(2) . . . . ?
Ag0O S11 C42 C56A 39(3) . . . . ?
Ag0O S11 C42 C63A -93(3) . . . . ?
Ag0O S13 C39 C21 53(5) . . . . ?
Ag0O S13 C39 C96A -171(4) . . . . ?
Ag0T S4 C14 C77A -5(3) . . . . ?
Ag0T S4 C14 C86A 165(3) . . . . ?
Ag0T S14 C17 C18 155.4(16) . . . . ?
Ag0T S14 C17 C16 -75.0(18) . . . . ?
Ag0T S13 C39 C21 -139(5) . . . . ?
Ag0T S13 C39 C96A -3(4) . . . . ?
Ag0L S15 C8 C69A -130(5) . . . . ?
Ag0L S15 C8 C23 -8(5) . . . . ?
Ag0L S14 C17 C18 -106.2(16) . . . . ?
Ag0L S14 C17 C16 23.4(19) . . . . ?
C53 N2 C54 O22 -176(3) . . . . ?
C52 N2 C54 O22 8(6) . . . . ?
O27 C45 C44 F0 -16(6) . . . . ?
O27 C45 C44 F01Y -133(6) . . . . ?
O27 C45 C44 F01V 105(6) . . . . ?
O21A C45 C44 F0 160(7) . . . . ?
O21A C45 C44 F01Y 43(8) . . . . ?
O21A C45 C44 F01V -79(7) . . . . ?
O21A C45 O27 Ag26 39(15) . . . . ?
C53A N3 C54A O22A 179(2) . . . . ?
C52A N3 C54A O22A -1(4) . . . . ?

_olex2_exptl_crystal_mounting_method nothing
_olex2_submission_original_sample_id xyh02
_olex2_submission_special_instructions 'No special instructions were received'
