# Electronic Supplementary Material (ESI) for Nanoscale.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# 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_ag17
_database_code_depnum_ccdc_archive 'CCDC 2327808'
loop_
_audit_author_name
_audit_author_address
Maqingqing
;zhengzhou university
China
;
_audit_update_record             
;
2024-01-24 deposited with the CCDC.	2024-04-11 downloaded from the CCDC.
;
_audit_creation_date             2023-06-28
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2019/2
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '1(C228 H156 Ag17 N12 O24 P6 S12)'
_chemical_formula_sum            'C228 H150 Ag17 N12 O24 P6 S12'
_chemical_formula_weight         5845.80
_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'
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'
P P 0.1023 0.0942 '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      trigonal
_space_group_IT_number           163
_space_group_name_H-M_alt        'P -3 1 c'
_space_group_name_Hall           '-P 3 2c'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-y, -x, -z+1/2'
'-x+y, y, -z+1/2'
'x, x-y, -z+1/2'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'y, x, z-1/2'
'x-y, -y, z-1/2'
'-x, -x+y, z-1/2'

_cell_length_a                   25.5265(11)
_cell_length_b                   25.5265(11)
_cell_length_c                   28.9926(8)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     16360.6(15)
_cell_formula_units_Z            2.00004
_cell_measurement_reflns_used    12466
_cell_measurement_temperature    200.00(10)
_cell_measurement_theta_max      26.9080
_cell_measurement_theta_min      2.3790
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    1.143
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.66845
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.39.27b (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    1.187
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       ?
_exptl_crystal_F_000             5750
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0663
_diffrn_reflns_av_unetI/netI     0.0667
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.920
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            74066
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.920
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.766
_diffrn_reflns_theta_min         1.842
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      200.00(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.920
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -99.00 -15.00   0.50    7.19    --  -10.60 -82.00 -30.00  168
  2  ω    -82.00 -56.00   0.50    7.19    --  -10.60 -57.00  90.00   52
  3  ω    -70.00  13.00   0.50    7.19    --   10.70 -57.00   0.00  166
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB AFC12 (RINC): Kappa single'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0128666000
_diffrn_orient_matrix_UB_12      -0.0200124000
_diffrn_orient_matrix_UB_13      0.0189508000
_diffrn_orient_matrix_UB_21      0.0268064000
_diffrn_orient_matrix_UB_22      0.0175858000
_diffrn_orient_matrix_UB_23      0.0129279000
_diffrn_orient_matrix_UB_31      -0.0120719000
_diffrn_orient_matrix_UB_32      0.0178373000
_diffrn_orient_matrix_UB_33      0.0085043000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6859
_reflns_number_total             13088
_reflns_odcompleteness_completeness 99.91
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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       'CrysAlisPro 1.171.39.27b (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.39.27b (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.39.27b (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         4.066
_refine_diff_density_min         -2.099
_refine_diff_density_rms         0.325
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.954
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     146
_refine_ls_number_reflns         13088
_refine_ls_number_restraints     6
_refine_ls_R_factor_all          0.2728
_refine_ls_R_factor_gt           0.1816
_refine_ls_restrained_S_all      1.954
_refine_ls_shift/su_max          0.040
_refine_ls_shift/su_mean         0.006
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.2000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.4891
_refine_ls_wR_factor_ref         0.5555
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All O(H) groups
2. Restrained distances
 C018-C00A = C013-C00C
 1.5 with sigma of 0.02
 O019-C013
 1.2 with sigma of 0.02
 C013-O00E
 1.35 with sigma of 0.02
3. Restrained planarity
 C00A, C018, O37, O15
 with sigma of 0.1
 O00E, C013, O019, C00C
 with sigma of 0.1
4. Uiso/Uaniso restraints and constraints
: with sigma of 0.01 and sigma for terminal atoms of 0.02
: with sigma of 0.005 and sigma for terminal atoms of 0.01
5.a Riding coordinates:
 O00E(H00E)
5.b Aromatic/amide H refined with riding coordinates:
 C009(H009), C00U(H00U), C015(H015), C00X(H00X), C00L(H00L), C00B(H00B),
 C01C(H01C), C01A(H01A), C00W(H00W), C00S(H00S), C00R(H00R), C00T(H00T),
 C014(H014), C01D(H01D), C00N(H00N), C01F(H01F), C01B(H01B), C011(H011),
 C016(H016), C01E(H01E), C2(H2), C010(H010), C012(H012), C00M(H00M), C00V(H00V)
5.c Fitted hexagon refined as free rotating group:
 C00R(C00T,C014,C01D,C00N,C00P), C01F(C01B,C00Z,C011,C016,C01E), C2(C010,C012,
 C00F,C00M,C00V)
5.d Naphthalene refined as free rotating group:
 C00A(C009,C00D,N00J,C00K,C00G,C00U,C015,C00X,C00L), N00I(C008,C00B,C00C,C00Q,
 C00O,C01C,C01A,C00W,C00S)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag2 Ag 0.333333 0.666667 0.66918(6) 0.0549(6) Uani 1 3 d S T P . .
Ag5 Ag 0.29678(4) 0.70322(4) 0.750000 0.0521(5) Uani 1 2 d S T P . .
Ag11 Ag 0.31027(7) 0.77896(7) 0.64041(4) 0.0739(6) Uani 1 1 d . . . . .
Ag17 Ag 0.44554(8) 0.85468(6) 0.68780(4) 0.0815(6) Uani 1 1 d . . . . .
S005 S 0.3451(2) 0.81648(19) 0.73609(13) 0.0654(12) Uani 1 1 d . . . . .
S006 S 0.4285(2) 0.7632(2) 0.63817(13) 0.0661(12) Uani 1 1 d . . . . .
P007 P 0.5063(4) 0.9485(2) 0.64879(16) 0.106(2) Uani 1 1 d . . . . .
O00E O 0.2497(9) 0.9261(9) 0.8149(8) 0.144(7) Uiso 1 1 d D . . . .
H00E H 0.259353 0.932060 0.842217 0.216 Uiso 1 1 d R . . . .
O019 O 0.2124(13) 0.9673(12) 0.7669(10) 0.206(11) Uiso 1 1 d D . . . .
C00A C 0.4273(5) 0.7869(5) 0.5002(3) 0.086(6) Uiso 1 1 d D . . . .
C009 C 0.4386(5) 0.7683(5) 0.5423(4) 0.080(5) Uiso 1 1 d G U . . .
H009 H 0.462824 0.750656 0.543435 0.096 Uiso 1 1 calc R . . . .
C00D C 0.4138(5) 0.7762(5) 0.5825(3) 0.076(5) Uiso 1 1 d G . . . .
N00J N 0.3777(4) 0.8026(4) 0.5808(2) 0.078(4) Uiso 1 1 d G . . . .
C00K C 0.3663(3) 0.8212(3) 0.5387(3) 0.064(4) Uiso 1 1 d G . . . .
C00G C 0.3911(4) 0.8133(4) 0.4984(2) 0.079(5) Uiso 1 1 d G . . . .
C00U C 0.3797(6) 0.8319(6) 0.4564(3) 0.130(9) Uiso 1 1 d G . . . .
H00U H 0.396321 0.826598 0.429445 0.156 Uiso 1 1 calc R . . . .
C015 C 0.3436(6) 0.8583(6) 0.4546(4) 0.124(9) Uiso 1 1 d G . . . .
H015 H 0.335955 0.870685 0.426501 0.149 Uiso 1 1 calc R . . . .
C00X C 0.3188(6) 0.8661(6) 0.4949(4) 0.114(8) Uiso 1 1 d G . . . .
H00X H 0.294560 0.883801 0.493736 0.136 Uiso 1 1 calc R . . . .
C00L C 0.3301(5) 0.8476(5) 0.5370(4) 0.087(6) Uiso 1 1 d G . . . .
H00L H 0.313529 0.852830 0.563916 0.104 Uiso 1 1 calc R . . . .
N00I N 0.2717(5) 0.8288(5) 0.6803(4) 0.080(4) Uiso 1 1 d . . . . .
C008 C 0.2959(5) 0.8409(5) 0.7245(4) 0.076(5) Uiso 1 1 d G . . . .
C00B C 0.2816(5) 0.8737(6) 0.7551(3) 0.074(5) Uiso 1 1 d G . . . .
H00B H 0.297840 0.881771 0.784729 0.089 Uiso 1 1 calc R . . . .
C00C C 0.2430(6) 0.8945(6) 0.7415(4) 0.100(6) Uiso 1 1 d DG . . . .
C00Q C 0.2187(4) 0.8825(4) 0.6973(4) 0.120(8) Uiso 1 1 d G . . . .
C00O C 0.2331(4) 0.8496(4) 0.6667(3) 0.104(7) Uiso 1 1 d G . . . .
C01C C 0.2088(6) 0.8376(7) 0.6225(3) 0.144(11) Uiso 1 1 d G . . . .
H01C H 0.218382 0.815593 0.601968 0.173 Uiso 1 1 calc R . . . .
C01A C 0.1702(7) 0.8584(8) 0.6088(4) 0.199(17) Uiso 1 1 d G . . . .
H01A H 0.153957 0.850326 0.579253 0.238 Uiso 1 1 calc R . . . .
C00W C 0.1559(7) 0.8912(8) 0.6395(6) 0.145(10) Uiso 1 1 d G . . . .
H00W H 0.130039 0.905166 0.630358 0.174 Uiso 1 1 calc R . . . .
C00S C 0.1801(6) 0.9033(7) 0.6837(5) 0.185(15) Uiso 1 1 d G . . . .
H00S H 0.170545 0.925271 0.704177 0.222 Uiso 1 1 calc R . . . .
C00R C 0.5004(5) 1.0535(7) 0.6320(6) 0.120(8) Uiso 1 1 d . . . . .
H00R H 0.542255 1.074599 0.634911 0.144 Uiso 1 1 calc R . . . .
C00T C 0.4698(8) 1.0843(6) 0.6216(6) 0.131(9) Uiso 1 1 d G . . . .
H00T H 0.491202 1.125965 0.617460 0.157 Uiso 1 1 calc R . . . .
C014 C 0.4071(8) 1.0527(8) 0.6173(6) 0.110(7) Uiso 1 1 d G . . . .
H014 H 0.386678 1.073272 0.610302 0.132 Uiso 1 1 calc R . . . .
C01D C 0.3751(6) 0.9903(8) 0.6235(6) 0.143(10) Uiso 1 1 d G . . . .
H01D H 0.333206 0.969211 0.620596 0.172 Uiso 1 1 calc R . . . .
C00N C 0.4057(7) 0.9596(6) 0.6339(6) 0.104(7) Uiso 1 1 d G . . . .
H00N H 0.384258 0.917844 0.638048 0.125 Uiso 1 1 calc R . . . .
C00P C 0.4683(7) 0.9911(7) 0.6382(6) 0.103(7) Uiso 1 1 d G . . . .
C01F C 0.6834(6) 1.0730(8) 0.6823(7) 0.134(10) Uiso 1 1 d . . . . .
H01F H 0.720255 1.096531 0.667569 0.160 Uiso 1 1 calc R . . . .
C01B C 0.6317(8) 1.0369(8) 0.6566(5) 0.117(8) Uiso 1 1 d G . . . .
H01B H 0.633946 1.036411 0.624566 0.141 Uiso 1 1 calc R . . . .
C00Z C 0.5765(7) 1.0017(7) 0.6786(5) 0.095(6) Uiso 1 1 d G . . . .
C011 C 0.5731(7) 1.0025(8) 0.7264(6) 0.109(7) Uiso 1 1 d G . . . .
H011 H 0.536257 0.978922 0.741199 0.131 Uiso 1 1 calc R . . . .
C016 C 0.6248(10) 1.0385(10) 0.7522(4) 0.168(13) Uiso 1 1 d G . . . .
H016 H 0.622564 1.039041 0.784203 0.202 Uiso 1 1 calc R . . . .
C01E C 0.6800(8) 1.0737(9) 0.7301(7) 0.173(14) Uiso 1 1 d G . . . .
H01E H 0.714564 1.097846 0.747389 0.208 Uiso 1 1 calc R . . . .
C013 C 0.2319(10) 0.9338(9) 0.7736(8) 0.158(12) Uiso 1 1 d D . . . .
C018 C 0.4550(14) 0.7723(10) 0.4595(8) 0.123(9) Uiso 1 1 d D . . . .
O15 O 0.5047(10) 0.7843(9) 0.4637(8) 0.140(6) Uiso 1 1 d . . . . .
O37 O 0.4255(11) 0.7543(10) 0.4296(10) 0.165(8) Uiso 1 1 d . . . . .
C2 C 0.5821(8) 0.9235(9) 0.5113(5) 0.155(12) Uiso 1 1 d . U . . .
H2 H 0.597699 0.918429 0.483791 0.186 Uiso 1 1 calc R . . . .
C010 C 0.5491(8) 0.9534(8) 0.5115(5) 0.107(7) Uiso 1 1 d G . . . .
H010 H 0.542615 0.968246 0.484129 0.128 Uiso 1 1 calc R . . . .
C012 C 0.5257(7) 0.9610(7) 0.5527(6) 0.144(11) Uiso 1 1 d G . . . .
H012 H 0.503665 0.980972 0.552813 0.173 Uiso 1 1 calc R . . . .
C00F C 0.5354(7) 0.9388(7) 0.5936(5) 0.086(6) Uiso 1 1 d G . . . .
C00M C 0.5684(7) 0.9089(7) 0.5934(5) 0.106(7) Uiso 1 1 d G . . . .
H00M H 0.574884 0.894065 0.620820 0.127 Uiso 1 1 calc R . . . .
C00V C 0.5918(8) 0.9013(8) 0.5523(7) 0.141(10) Uiso 1 1 d G . . . .
H00V H 0.613834 0.881338 0.552137 0.169 Uiso 1 1 calc R . . . .


_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
Ag2 Ag5 2.8464(17) . ?
Ag2 Ag5 2.8464(17) 3_565 ?
Ag2 Ag5 2.8464(17) 2_665 ?
Ag2 Ag11 3.3086(16) 2_665 ?
Ag2 Ag11 3.3086(16) 3_565 ?
Ag2 Ag11 3.3086(16) . ?
Ag2 S006 2.606(4) 2_665 ?
Ag2 S006 2.606(4) 3_565 ?
Ag2 S006 2.606(4) . ?
Ag5 Ag5 2.799(3) 2_665 ?
Ag5 Ag5 2.799(3) 3_565 ?
Ag5 S005 2.545(4) 4_666 ?
Ag5 S005 2.545(4) . ?
Ag11 Ag17 3.297(2) . ?
Ag11 S005 2.924(4) . ?
Ag11 S006 2.549(5) 2_665 ?
Ag11 N00J 2.297(8) . ?
Ag11 N00I 2.276(8) . ?
Ag17 S005 2.626(4) 5_556 ?
Ag17 S005 2.643(5) . ?
Ag17 S006 2.589(5) . ?
Ag17 P007 2.388(5) . ?
S005 C008 1.690(10) . ?
S006 C00D 1.725(8) . ?
P007 C00P 1.810(14) . ?
P007 C00Z 1.836(15) . ?
P007 C00F 1.832(14) . ?
O00E C013 1.329(17) . ?
O019 C013 1.201(17) . ?
C00A C009 1.3900 . ?
C00A C00G 1.3900 . ?
C00A C018 1.515(17) . ?
C009 C00D 1.3900 . ?
C00D N00J 1.3900 . ?
N00J C00K 1.3900 . ?
C00K C00G 1.3900 . ?
C00K C00L 1.3900 . ?
C00G C00U 1.3900 . ?
C00U C015 1.3900 . ?
C015 C00X 1.3900 . ?
C00X C00L 1.3900 . ?
N00I C008 1.3900 . ?
N00I C00O 1.3900 . ?
C008 C00B 1.3900 . ?
C00B C00C 1.3900 . ?
C00C C00Q 1.3900 . ?
C00C C013 1.495(17) . ?
C00Q C00O 1.3900 . ?
C00Q C00S 1.3900 . ?
C00O C01C 1.3900 . ?
C01C C01A 1.3900 . ?
C01A C00W 1.3900 . ?
C00W C00S 1.3900 . ?
C00R C00T 1.3900 . ?
C00R C00P 1.3900 . ?
C00T C014 1.3900 . ?
C014 C01D 1.3900 . ?
C01D C00N 1.3900 . ?
C00N C00P 1.3900 . ?
C01F C01B 1.3900 . ?
C01F C01E 1.3900 . ?
C01B C00Z 1.3900 . ?
C00Z C011 1.3900 . ?
C011 C016 1.3900 . ?
C016 C01E 1.3900 . ?
C018 O15 1.15(3) . ?
C018 O37 1.09(3) . ?
C2 C010 1.3900 . ?
C2 C00V 1.3900 . ?
C010 C012 1.3900 . ?
C012 C00F 1.3900 . ?
C00F C00M 1.3900 . ?
C00M C00V 1.3900 . ?

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
Ag5 Ag2 Ag5 58.90(5) . 3_565 ?
Ag5 Ag2 Ag5 58.90(5) . 2_665 ?
Ag5 Ag2 Ag5 58.90(5) 3_565 2_665 ?
Ag5 Ag2 Ag11 129.31(5) 3_565 2_665 ?
Ag5 Ag2 Ag11 107.16(3) 2_665 3_565 ?
Ag5 Ag2 Ag11 129.31(5) . 3_565 ?
Ag5 Ag2 Ag11 72.19(4) 2_665 2_665 ?
Ag5 Ag2 Ag11 72.19(3) . . ?
Ag5 Ag2 Ag11 72.19(4) 3_565 3_565 ?
Ag5 Ag2 Ag11 107.16(3) 3_565 . ?
Ag5 Ag2 Ag11 107.16(3) . 2_665 ?
Ag5 Ag2 Ag11 129.31(5) 2_665 . ?
Ag11 Ag2 Ag11 113.87(3) 2_665 3_565 ?
Ag11 Ag2 Ag11 113.87(3) . 2_665 ?
Ag11 Ag2 Ag11 113.87(3) . 3_565 ?
S006 Ag2 Ag5 138.47(10) 3_565 . ?
S006 Ag2 Ag5 106.11(10) 3_565 3_565 ?
S006 Ag2 Ag5 79.97(9) 2_665 . ?
S006 Ag2 Ag5 106.11(10) 2_665 2_665 ?
S006 Ag2 Ag5 106.11(10) . . ?
S006 Ag2 Ag5 79.97(9) 3_565 2_665 ?
S006 Ag2 Ag5 138.47(10) 2_665 3_565 ?
S006 Ag2 Ag5 138.47(10) . 2_665 ?
S006 Ag2 Ag5 79.97(9) . 3_565 ?
S006 Ag2 Ag11 49.31(11) 2_665 . ?
S006 Ag2 Ag11 144.24(11) . 2_665 ?
S006 Ag2 Ag11 49.31(11) 3_565 2_665 ?
S006 Ag2 Ag11 65.14(11) . . ?
S006 Ag2 Ag11 65.14(11) 3_565 3_565 ?
S006 Ag2 Ag11 144.24(11) 3_565 . ?
S006 Ag2 Ag11 65.14(11) 2_665 2_665 ?
S006 Ag2 Ag11 144.24(11) 2_665 3_565 ?
S006 Ag2 Ag11 49.31(11) . 3_565 ?
S006 Ag2 S006 108.75(10) . 3_565 ?
S006 Ag2 S006 108.75(10) 2_665 3_565 ?
S006 Ag2 S006 108.75(10) 2_665 . ?
Ag2 Ag5 Ag2 110.82(7) 4_666 . ?
Ag5 Ag5 Ag2 60.55(3) 3_565 4_666 ?
Ag5 Ag5 Ag2 60.55(3) 2_665 . ?
Ag5 Ag5 Ag2 60.55(3) 2_665 4_666 ?
Ag5 Ag5 Ag2 60.55(3) 3_565 . ?
Ag5 Ag5 Ag5 60.0 3_565 2_665 ?
S005 Ag5 Ag2 116.79(9) . 4_666 ?
S005 Ag5 Ag2 116.79(9) 4_666 . ?
S005 Ag5 Ag2 100.94(9) 4_666 4_666 ?
S005 Ag5 Ag2 100.94(10) . . ?
S005 Ag5 Ag5 94.78(12) . 3_565 ?
S005 Ag5 Ag5 94.78(12) 4_666 2_665 ?
S005 Ag5 Ag5 153.34(12) 4_666 3_565 ?
S005 Ag5 Ag5 153.34(12) . 2_665 ?
S005 Ag5 S005 111.3(2) . 4_666 ?
Ag17 Ag11 Ag2 79.34(4) . . ?
S005 Ag11 Ag2 83.56(9) . . ?
S005 Ag11 Ag17 49.83(11) . . ?
S006 Ag11 Ag2 50.84(10) 2_665 . ?
S006 Ag11 Ag17 129.53(12) 2_665 . ?
S006 Ag11 S005 109.09(13) 2_665 . ?
N00J Ag11 Ag2 89.0(2) . . ?
N00J Ag11 Ag17 74.5(2) . . ?
N00J Ag11 S005 124.3(3) . . ?
N00J Ag11 S006 107.9(3) . 2_665 ?
N00I Ag11 Ag2 132.1(3) . . ?
N00I Ag11 Ag17 94.6(3) . . ?
N00I Ag11 S005 58.7(3) . . ?
N00I Ag11 S006 111.8(3) . 2_665 ?
N00I Ag11 N00J 135.4(4) . . ?
S005 Ag17 Ag11 57.73(10) . . ?
S005 Ag17 Ag11 121.08(10) 5_556 . ?
S005 Ag17 S005 78.18(17) 5_556 . ?
S006 Ag17 Ag11 65.48(11) . . ?
S006 Ag17 S005 95.29(14) . 5_556 ?
S006 Ag17 S005 105.49(14) . . ?
P007 Ag17 Ag11 110.81(18) . . ?
P007 Ag17 S005 127.75(19) . 5_556 ?
P007 Ag17 S005 130.1(2) . . ?
P007 Ag17 S006 111.92(17) . . ?
Ag5 S005 Ag11 83.28(12) . . ?
Ag5 S005 Ag17 109.44(16) . . ?
Ag5 S005 Ag17 98.44(13) . 5_556 ?
Ag17 S005 Ag11 161.7(2) 5_556 . ?
Ag17 S005 Ag11 72.44(11) . . ?
Ag17 S005 Ag17 89.96(16) 5_556 . ?
C008 S005 Ag5 115.0(4) . . ?
C008 S005 Ag11 76.8(4) . . ?
C008 S005 Ag17 121.4(4) . . ?
C008 S005 Ag17 118.0(4) . 5_556 ?
Ag11 S006 Ag2 79.85(13) 3_565 . ?
Ag11 S006 Ag17 134.57(18) 3_565 . ?
Ag17 S006 Ag2 108.54(16) . . ?
C00D S006 Ag2 108.4(4) . . ?
C00D S006 Ag11 111.8(4) . 3_565 ?
C00D S006 Ag17 107.5(4) . . ?
C00P P007 Ag17 114.1(7) . . ?
C00P P007 C00Z 104.7(8) . . ?
C00P P007 C00F 108.0(8) . . ?
C00Z P007 Ag17 115.0(6) . . ?
C00F P007 Ag17 112.5(6) . . ?
C00F P007 C00Z 101.5(8) . . ?
C009 C00A C018 113.3(12) . . ?
C00G C00A C018 126.6(12) . . ?
C00D C009 C00A 120.0 . . ?
C009 C00D S006 126.8(6) . . ?
C009 C00D N00J 120.0 . . ?
N00J C00D S006 112.9(6) . . ?
C00D N00J Ag11 115.9(4) . . ?
C00D N00J C00K 120.0 . . ?
C00K N00J Ag11 119.6(4) . . ?
N00J C00K C00L 120.0 . . ?
C00G C00K N00J 120.0 . . ?
C00G C00K C00L 120.0 . . ?
C00K C00G C00A 120.0 . . ?
C00K C00G C00U 120.0 . . ?
C00U C00G C00A 120.0 . . ?
C015 C00U C00G 120.0 . . ?
C00X C015 C00U 120.0 . . ?
C00L C00X C015 120.0 . . ?
C00X C00L C00K 120.0 . . ?
C008 N00I Ag11 108.8(5) . . ?
C00O N00I Ag11 131.1(5) . . ?
N00I C008 S005 115.6(6) . . ?
N00I C008 C00B 120.0 . . ?
C00B C008 S005 124.3(6) . . ?
C00C C00B C008 120.0 . . ?
C00B C00C C013 119.2(12) . . ?
C00Q C00C C00B 120.0 . . ?
C00Q C00C C013 120.7(12) . . ?
C00C C00Q C00S 120.0 . . ?
C00O C00Q C00C 120.0 . . ?
C00O C00Q C00S 120.0 . . ?
C00Q C00O N00I 120.0 . . ?
C00Q C00O C01C 120.0 . . ?
C01C C00O N00I 120.0 . . ?
C00O C01C C01A 120.0 . . ?
C00W C01A C01C 120.0 . . ?
C00S C00W C01A 120.0 . . ?
C00W C00S C00Q 120.0 . . ?
C00T C00R C00P 120.0 . . ?
C00R C00T C014 120.0 . . ?
C01D C014 C00T 120.0 . . ?
C014 C01D C00N 120.0 . . ?
C00P C00N C01D 120.0 . . ?
C00R C00P P007 121.7(10) . . ?
C00N C00P P007 118.2(10) . . ?
C00N C00P C00R 120.0 . . ?
C01B C01F C01E 120.0 . . ?
C00Z C01B C01F 120.0 . . ?
C01B C00Z P007 124.1(11) . . ?
C011 C00Z P007 115.8(11) . . ?
C011 C00Z C01B 120.0 . . ?
C00Z C011 C016 120.0 . . ?
C01E C016 C011 120.0 . . ?
C016 C01E C01F 120.0 . . ?
O00E C013 C00C 105.6(19) . . ?
O019 C013 O00E 123(2) . . ?
O019 C013 C00C 131(3) . . ?
O15 C018 C00A 116(3) . . ?
O37 C018 C00A 114(3) . . ?
O37 C018 O15 129(3) . . ?
C010 C2 C00V 120.0 . . ?
C012 C010 C2 120.0 . . ?
C00F C012 C010 120.0 . . ?
C012 C00F P007 121.6(10) . . ?
C012 C00F C00M 120.0 . . ?
C00M C00F P007 118.4(10) . . ?
C00F C00M C00V 120.0 . . ?
C00M C00V C2 120.0 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Ag2 S006 C00D C009 -108.5(6) . . . . ?
Ag2 S006 C00D N00J 78.0(5) . . . . ?
Ag5 S005 C008 N00I -76.1(5) . . . . ?
Ag5 S005 C008 C00B 107.2(6) . . . . ?
Ag11 S005 C008 N00I 0.0(4) . . . . ?
Ag11 S005 C008 C00B -176.7(7) . . . . ?
Ag11 S006 C00D C009 -22.3(7) 3_565 . . . ?
Ag11 S006 C00D N00J 164.1(3) 3_565 . . . ?
Ag11 N00J C00K C00G -155.1(6) . . . . ?
Ag11 N00J C00K C00L 24.9(6) . . . . ?
Ag11 N00I C008 S005 0.0(5) . . . . ?
Ag11 N00I C008 C00B 176.9(7) . . . . ?
Ag11 N00I C00O C00Q -176.1(9) . . . . ?
Ag11 N00I C00O C01C 3.9(9) . . . . ?
Ag17 S005 C008 N00I 168.4(4) 5_556 . . . ?
Ag17 S005 C008 N00I 59.6(6) . . . . ?
Ag17 S005 C008 C00B -8.3(8) 5_556 . . . ?
Ag17 S005 C008 C00B -117.1(6) . . . . ?
Ag17 S006 C00D C009 134.4(5) . . . . ?
Ag17 S006 C00D N00J -39.2(5) . . . . ?
Ag17 P007 C00P C00R 156.0(8) . . . . ?
Ag17 P007 C00P C00N -27.3(11) . . . . ?
Ag17 P007 C00Z C01B 139.3(9) . . . . ?
Ag17 P007 C00Z C011 -36.4(11) . . . . ?
Ag17 P007 C00F C012 125.3(8) . . . . ?
Ag17 P007 C00F C00M -55.4(10) . . . . ?
S005 C008 C00B C00C 176.6(8) . . . . ?
S006 C00D N00J Ag11 -30.0(5) . . . . ?
S006 C00D N00J C00K 174.0(7) . . . . ?
P007 C00Z C011 C016 176.0(13) . . . . ?
P007 C00F C00M C00V -179.3(12) . . . . ?
C00A C009 C00D S006 -173.1(8) . . . . ?
C00A C009 C00D N00J 0.0 . . . . ?
C00A C00G C00U C015 180.0 . . . . ?
C009 C00A C00G C00K 0.0 . . . . ?
C009 C00A C00G C00U 180.0 . . . . ?
C009 C00A C018 O15 -47(2) . . . . ?
C009 C00A C018 O37 136.8(17) . . . . ?
C009 C00D N00J Ag11 156.0(6) . . . . ?
C009 C00D N00J C00K 0.0 . . . . ?
C00D N00J C00K C00G 0.0 . . . . ?
C00D N00J C00K C00L 180.0 . . . . ?
N00J C00K C00G C00A 0.0 . . . . ?
N00J C00K C00G C00U 180.0 . . . . ?
N00J C00K C00L C00X 180.0 . . . . ?
C00K C00G C00U C015 0.0 . . . . ?
C00G C00A C009 C00D 0.0 . . . . ?
C00G C00A C018 O15 136.3(17) . . . . ?
C00G C00A C018 O37 -40(2) . . . . ?
C00G C00K C00L C00X 0.0 . . . . ?
C00G C00U C015 C00X 0.0 . . . . ?
C00U C015 C00X C00L 0.0 . . . . ?
C015 C00X C00L C00K 0.0 . . . . ?
C00L C00K C00G C00A 180.0 . . . . ?
C00L C00K C00G C00U 0.0 . . . . ?
N00I C008 C00B C00C 0.0 . . . . ?
N00I C00O C01C C01A 180.0 . . . . ?
C008 N00I C00O C00Q 0.0 . . . . ?
C008 N00I C00O C01C 180.0 . . . . ?
C008 C00B C00C C00Q 0.0 . . . . ?
C008 C00B C00C C013 -175.3(13) . . . . ?
C00B C00C C00Q C00O 0.0 . . . . ?
C00B C00C C00Q C00S 180.0 . . . . ?
C00B C00C C013 O00E -17.4(18) . . . . ?
C00B C00C C013 O019 161(2) . . . . ?
C00C C00Q C00O N00I 0.0 . . . . ?
C00C C00Q C00O C01C 180.0 . . . . ?
C00C C00Q C00S C00W 180.0 . . . . ?
C00Q C00C C013 O00E 167.4(12) . . . . ?
C00Q C00C C013 O019 -14(3) . . . . ?
C00Q C00O C01C C01A 0.0 . . . . ?
C00O N00I C008 S005 -176.9(7) . . . . ?
C00O N00I C008 C00B 0.0 . . . . ?
C00O C00Q C00S C00W 0.0 . . . . ?
C00O C01C C01A C00W 0.0 . . . . ?
C01C C01A C00W C00S 0.0 . . . . ?
C01A C00W C00S C00Q 0.0 . . . . ?
C00S C00Q C00O N00I 180.0 . . . . ?
C00S C00Q C00O C01C 0.0 . . . . ?
C00R C00T C014 C01D 0.0 . . . . ?
C00T C00R C00P P007 176.6(13) . . . . ?
C00T C00R C00P C00N 0.0 . . . . ?
C00T C014 C01D C00N 0.0 . . . . ?
C014 C01D C00N C00P 0.0 . . . . ?
C01D C00N C00P P007 -176.7(12) . . . . ?
C01D C00N C00P C00R 0.0 . . . . ?
C00P P007 C00Z C01B -94.6(11) . . . . ?
C00P P007 C00Z C011 89.6(10) . . . . ?
C00P P007 C00F C012 -1.5(11) . . . . ?
C00P P007 C00F C00M 177.8(10) . . . . ?
C00P C00R C00T C014 0.0 . . . . ?
C01F C01B C00Z P007 -175.6(14) . . . . ?
C01F C01B C00Z C011 0.0 . . . . ?
C01B C01F C01E C016 0.0 . . . . ?
C01B C00Z C011 C016 0.0 . . . . ?
C00Z P007 C00P C00R 29.4(12) . . . . ?
C00Z P007 C00P C00N -153.9(10) . . . . ?
C00Z P007 C00F C012 -111.3(10) . . . . ?
C00Z P007 C00F C00M 68.0(11) . . . . ?
C00Z C011 C016 C01E 0.0 . . . . ?
C011 C016 C01E C01F 0.0 . . . . ?
C01E C01F C01B C00Z 0.0 . . . . ?
C013 C00C C00Q C00O 175.2(13) . . . . ?
C013 C00C C00Q C00S -4.8(13) . . . . ?
C018 C00A C009 C00D -177.1(14) . . . . ?
C018 C00A C00G C00K 176.7(16) . . . . ?
C018 C00A C00G C00U -3.3(16) . . . . ?
C2 C010 C012 C00F 0.0 . . . . ?
C010 C2 C00V C00M 0.0 . . . . ?
C010 C012 C00F P007 179.3(12) . . . . ?
C010 C012 C00F C00M 0.0 . . . . ?
C012 C00F C00M C00V 0.0 . . . . ?
C00F P007 C00P C00R -78.2(11) . . . . ?
C00F P007 C00P C00N 98.5(10) . . . . ?
C00F P007 C00Z C01B 17.7(12) . . . . ?
C00F P007 C00Z C011 -158.1(9) . . . . ?
C00F C00M C00V C2 0.0 . . . . ?
C00V C2 C010 C012 0.0 . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.321
_oxdiff_exptl_absorpt_empirical_full_min 0.742
####################################################################### 
# 
# 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_ag32
_database_code_depnum_ccdc_archive 'CCDC 2327952'
loop_
_audit_author_name
_audit_author_address
Maqingqing
;zhengzhou university
China
;
_audit_update_record             
;
2024-01-24 deposited with the CCDC.	2024-04-11 downloaded from the CCDC.
;
_audit_creation_date             2024-01-24
_audit_creation_method           
;
Olex2 1.5
(compiled 2023.03.06 svn.rbb2c1857 for OlexSys, GUI svn.r6748)
;
_shelx_SHELXL_version_number     2019/2
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C306 H234 Ag32 Cl2 N18 O36 P6 S18'
_chemical_formula_sum            'C306 H234 Ag32 Cl2 N18 O36 P6 S18'
_chemical_formula_weight         9024.74
_chemical_absolute_configuration ?
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      cubic
_space_group_IT_number           218
_space_group_name_H-M_alt        'P -4 3 n'
_space_group_name_Hall           'P -4n 2 3'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'y+1/2, -x+1/2, -z+1/2'
'-x, -y, z'
'-y+1/2, x+1/2, -z+1/2'
'-x+1/2, z+1/2, -y+1/2'
'x, -y, -z'
'-x+1/2, -z+1/2, y+1/2'
'-z+1/2, -y+1/2, x+1/2'
'-x, y, -z'
'z+1/2, -y+1/2, -x+1/2'
'z, x, y'
'y, z, x'
'-y, -z, x'
'z, -x, -y'
'-y, z, -x'
'-z, -x, y'
'-z, x, -y'
'y, -z, -x'
'-y+1/2, -x+1/2, z+1/2'
'y+1/2, x+1/2, z+1/2'
'x+1/2, -z+1/2, -y+1/2'
'x+1/2, z+1/2, y+1/2'
'-z+1/2, y+1/2, -x+1/2'
'z+1/2, y+1/2, x+1/2'

_cell_length_a                   44.3413(3)
_cell_length_b                   44.3413(3)
_cell_length_c                   44.3413(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     87181.5(18)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    14737
_cell_measurement_temperature    199.99(10)
_cell_measurement_theta_max      71.9630
_cell_measurement_theta_min      3.1300
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    12.749
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.02263
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.39.7b (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    1.375
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       ?
_exptl_crystal_F_000             35200
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.23
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0886
_diffrn_reflns_av_unetI/netI     0.0823
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.985
_diffrn_reflns_limit_h_max       39
_diffrn_reflns_limit_h_min       -50
_diffrn_reflns_limit_k_max       37
_diffrn_reflns_limit_k_min       -52
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -55
_diffrn_reflns_number            96491
_diffrn_reflns_point_group_measured_fraction_full 0.877
_diffrn_reflns_point_group_measured_fraction_max 0.845
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         73.906
_diffrn_reflns_theta_min         3.152
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      199.99(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -28.00  23.00   0.50    0.70    --    0.00  57.00  30.00  102
  2  ω     77.00 157.00   0.50   13.00    --   98.80  45.00-180.00  160
  3  ω     87.00 135.00   0.50   13.00    --   98.80 -82.00 -30.00   96
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Pro: Kappa single'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0118835000
_diffrn_orient_matrix_UB_12      -0.0027461000
_diffrn_orient_matrix_UB_13      -0.0325321000
_diffrn_orient_matrix_UB_21      0.0326509000
_diffrn_orient_matrix_UB_22      0.0001706000
_diffrn_orient_matrix_UB_23      -0.0119210000
_diffrn_orient_matrix_UB_31      0.0011163000
_diffrn_orient_matrix_UB_32      -0.0346255000
_diffrn_orient_matrix_UB_33      0.0024810000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage         0.647
_reflns_Friedel_fraction_full    0.744
_reflns_Friedel_fraction_max     0.692
_reflns_number_gt                16148
_reflns_number_total             24931
_reflns_odcompleteness_completeness 99.94
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_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       'CrysAlisPro 1.171.39.7b (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.39.7b (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.39.7b (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    ?
_refine_diff_density_max         1.106
_refine_diff_density_min         -1.130
_refine_diff_density_rms         0.147
_refine_ls_abs_structure_details 
;
 Flack x determined using 4999 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.000(7)
_refine_ls_extinction_coef       0.0000023(18)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2019/2 (Sheldrick 2019)'
_refine_ls_goodness_of_fit_ref   0.998
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1268
_refine_ls_number_reflns         24931
_refine_ls_number_restraints     101
_refine_ls_R_factor_all          0.1104
_refine_ls_R_factor_gt           0.0679
_refine_ls_restrained_S_all      0.998
_refine_ls_shift/su_max          0.493
_refine_ls_shift/su_mean         0.005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1223P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1781
_refine_ls_wR_factor_ref         0.2033
_refine_special_details          ?
_olex2_refinement_description    
;
1. Restrained distances
 C5-O126
 1.2 with sigma of 0.01
 O17-C5
 1.4 with sigma of 0.01
 O1-C128
 1.2 with sigma of 0.01
 C5-O17
 1.35 with sigma of 0.02
 C128-O141
 1.35 with sigma of 0.02
2. Uiso/Uaniso restraints and constraints
Uanis(O17) \\sim Ueq, Uanis(C6AA) \\sim Ueq, Uanis(C165) \\sim Ueq, Uanis(C168)
\\sim Ueq, Uanis(C7) \\sim Ueq, Uanis(C24) \\sim Ueq, Uanis(C94) \\sim Ueq,
Uanis(C15) \\sim Ueq, Uanis(C21) \\sim Ueq, Uanis(C0BA) \\sim Ueq, Uanis(C79)
\\sim Ueq, Uanis(C42) \\sim Ueq, Uanis(C0CA) \\sim Ueq: with sigma of 0.01 and
sigma for terminal atoms of 0.02
Uanis(C8AA) \\sim Ueq, Uanis(C0CA) \\sim Ueq: with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(C128) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C4BA) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
3.a Aromatic/amide H refined with riding coordinates:
 C3(H3), C54(H54), C137(H137), C98(H98), C155(H155), C165(H165), C183(H183),
 C48(H48), C163(H163), C168(H168), C4(H4), C18(H18), C29(H29), C34(H34),
 C41(H41), C45(H45), C93(H93), C175(H175), C188(H188), C0AA(H0AA), C13(H13),
 C1AA(H1AA), C23(H23), C39(H39), C60(H60), C81(H81), C101(H101), C123(H123),
 C24(H24), C2AA(H2AA), C88(H88), C113(H113), C169(H169), C21(H21), C106(H106),
 C110(H110), C161(H161), C177(H177), C7AA(H7AA), C144(H144), C6(H6), C9(H9),
 C10(H10), C79(H79), C2BA(H2BA), C6BA(H6BA), C8BA(H8BA), C5BA(H5BA), C37(H37),
 C42(H42), C115(H115), C0CA(H0CA), C25(H25), C125(H125)
3.b Idealised Me refined as rotating group:
 C94(H94A,H94B,H94C), C63(H63A,H63B,H63C), C6AA(H6AA,H6AB,H6AC), C8AA(H8AA,
 H8AB,H8AC), C5AA(H5AB,H5AC,H5AD), C0BA(H0BA,H0BB,H0BC)
3.c Idealised tetrahedral OH refined as rotating group:
 O5AA(H5AA), O17(H17), O68(H68), O141(H141), O16(H16), O93(H93A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag -0.68976(3) -0.22985(3) -0.24374(3) 0.0555(3) Uani 1 1 d . . . . .
Ag2 Ag -0.72638(3) -0.19019(3) -0.21053(3) 0.0539(3) Uani 1 1 d . . . . .
Ag3 Ag -0.75686(3) -0.22457(3) -0.16154(3) 0.0545(3) Uani 1 1 d . . . . .
Ag4 Ag -0.78143(3) -0.21857(3) -0.21857(3) 0.0538(5) Uani 1 3 d S T P . .
Ag5 Ag -0.77796(4) -0.16443(3) -0.17775(3) 0.0596(4) Uani 1 1 d . . . . .
Ag6 Ag -0.72262(3) -0.26495(3) -0.19621(3) 0.0546(3) Uani 1 1 d . . . . .
Ag7 Ag -0.74748(3) -0.25252(3) -0.25252(3) 0.0565(6) Uani 1 3 d S T P . .
Ag8 Ag -0.76071(4) -0.29032(4) -0.10742(3) 0.0680(4) Uani 1 1 d . . . . .
Ag9 Ag -0.63281(4) -0.20329(3) -0.21987(4) 0.0650(4) Uani 1 1 d . . . . .
Ag10 Ag -0.69503(3) -0.29529(3) -0.24838(3) 0.0578(4) Uani 1 1 d . . . . .
Ag11 Ag -0.65210(3) -0.15811(4) -0.27071(4) 0.0657(4) Uani 1 1 d . . . . .
Ag12 Ag -0.71574(4) -0.23315(4) -0.11040(4) 0.0687(4) Uani 1 1 d . . . . .
S13 S -0.65796(10) -0.21548(11) -0.28862(11) 0.0564(11) Uani 1 1 d . . . . .
S1 S -0.78947(12) -0.23846(12) -0.11733(10) 0.0598(12) Uani 1 1 d . . . . .
S0AA S -0.68007(11) -0.15368(11) -0.21946(12) 0.0571(11) Uani 1 1 d . . . . .
S1AA S -0.71414(11) -0.29276(11) -0.14382(10) 0.0537(11) Uani 1 1 d . . . . .
S5 S -0.66461(11) -0.24809(12) -0.19505(12) 0.0597(12) Uani 1 1 d . . . . .
P2 P -0.60473(12) -0.13995(13) -0.28912(14) 0.0651(14) Uani 1 1 d . . . . .
P3 P -0.76836(15) -0.30129(14) -0.05480(12) 0.0683(14) Uani 1 1 d . . . . .
Cl4 Cl -0.69419(12) -0.30581(12) -0.30581(12) 0.067(2) Uani 1 3 d S T P . .
C3 C -0.5620(5) -0.1852(5) -0.3035(7) 0.078(7) Uani 1 1 d . . . . .
H3 H -0.551956 -0.179800 -0.285909 0.094 Uiso 1 1 calc R . . . .
C54 C -0.6011(6) -0.1763(7) -0.3388(7) 0.099(9) Uani 1 1 d . . . . .
H54 H -0.617338 -0.164886 -0.345582 0.119 Uiso 1 1 calc R . . . .
C137 C -0.5514(5) -0.2093(5) -0.3205(6) 0.077(7) Uani 1 1 d . . . . .
H137 H -0.535009 -0.220476 -0.313784 0.093 Uiso 1 1 calc R . . . .
C184 C -0.5868(5) -0.1692(6) -0.3122(6) 0.075(6) Uani 1 1 d . . . . .
Cl2A Cl -0.83528(12) -0.16472(12) -0.16472(12) 0.068(2) Uani 1 3 d S T P . .
C82 C -0.7635(7) -0.1705(6) -0.0460(5) 0.082(7) Uani 1 1 d . . . . .
C83 C -0.5776(5) -0.1297(5) -0.2597(6) 0.076(6) Uani 1 1 d . . . . .
C98 C -0.5504(5) -0.1169(7) -0.2674(7) 0.098(9) Uani 1 1 d . . . . .
H98 H -0.545080 -0.114667 -0.287587 0.117 Uiso 1 1 calc R . . . .
C147 C -0.7428(7) -0.1922(5) -0.0586(5) 0.079(7) Uani 1 1 d . . . . .
C155 C -0.5308(6) -0.1074(7) -0.2448(10) 0.124(13) Uani 1 1 d . . . . .
H155 H -0.513388 -0.096917 -0.250025 0.148 Uiso 1 1 calc R . . . .
N161 N -0.7504(5) -0.2121(5) -0.0801(3) 0.073(5) Uani 1 1 d . . . . .
C165 C -0.7022(8) -0.1748(7) -0.0248(7) 0.105(9) Uani 1 1 d . U . . .
H165 H -0.683221 -0.177301 -0.016238 0.126 Uiso 1 1 calc R . . . .
C183 C -0.7120(7) -0.1928(6) -0.0482(4) 0.089(8) Uani 1 1 d . . . . .
H183 H -0.698418 -0.205768 -0.057478 0.106 Uiso 1 1 calc R . . . .
C28 C -0.6407(4) -0.2787(5) -0.2047(5) 0.066(6) Uani 1 1 d . . . . .
C48 C -0.5883(7) -0.1015(7) -0.3379(6) 0.097(9) Uani 1 1 d . . . . .
H48 H -0.571643 -0.113835 -0.341049 0.116 Uiso 1 1 calc R . . . .
N130 N -0.6466(3) -0.2955(4) -0.2279(4) 0.062(4) Uani 1 1 d . . . . .
C163 C -0.7541(10) -0.1507(7) -0.0236(7) 0.125(13) Uani 1 1 d . . . . .
H163 H -0.766900 -0.136699 -0.014543 0.150 Uiso 1 1 calc R . . . .
C168 C -0.7208(8) -0.1540(8) -0.0154(7) 0.109(9) Uani 1 1 d . U . . .
H168 H -0.712879 -0.139749 -0.002207 0.131 Uiso 1 1 calc R . . . .
C191 C -0.6069(5) -0.1078(5) -0.3155(6) 0.079(7) Uani 1 1 d . . . . .
C2 C -0.7592(5) -0.1253(5) -0.1162(5) 0.064(5) Uani 1 1 d . . . . .
C4 C -0.7871(7) -0.1149(6) -0.1200(6) 0.092(8) Uani 1 1 d . . . . .
H4 H -0.799164 -0.123490 -0.134855 0.111 Uiso 1 1 calc R . . . .
C18 C -0.7512(9) -0.0872(7) -0.0792(7) 0.103(9) Uani 1 1 d . . . . .
H18 H -0.738733 -0.077431 -0.065422 0.123 Uiso 1 1 calc R . . . .
C19 C -0.5369(6) -0.1133(7) -0.2133(7) 0.094(8) Uani 1 1 d . . . . .
C29 C -0.7788(10) -0.0783(6) -0.0826(7) 0.113(11) Uani 1 1 d . . . . .
H29 H -0.785776 -0.062209 -0.071095 0.136 Uiso 1 1 calc R . . . .
C30 C -0.6130(9) -0.0591(7) -0.3546(7) 0.105(10) Uani 1 1 d . . . . .
C34 C -0.7985(7) -0.0921(6) -0.1029(7) 0.099(9) Uani 1 1 d . . . . .
H34 H -0.818444 -0.085950 -0.104738 0.119 Uiso 1 1 calc R . . . .
C41 C -0.7885(6) -0.2523(6) -0.0186(5) 0.087(7) Uani 1 1 d . . . . .
H41 H -0.769423 -0.252177 -0.009780 0.105 Uiso 1 1 calc R . . . .
C45 C -0.5925(9) -0.0782(8) -0.3557(8) 0.117(11) Uani 1 1 d . . . . .
H45 H -0.578371 -0.075680 -0.370963 0.140 Uiso 1 1 calc R . . . .
C61 C -0.7341(6) -0.2988(5) -0.0328(5) 0.070(6) Uani 1 1 d . . . . .
C80 C -0.7102(6) -0.1233(5) -0.0945(5) 0.075(7) Uani 1 1 d . . . . .
C93 C -0.5646(7) -0.1275(7) -0.2070(7) 0.106(9) Uani 1 1 d . . . . .
H93 H -0.569615 -0.131677 -0.187062 0.128 Uiso 1 1 calc R . . . .
C107 C -0.7226(5) -0.1604(5) -0.1311(5) 0.072(6) Uani 1 1 d . . . . .
C108 C -0.7948(5) -0.2742(6) -0.0398(5) 0.072(6) Uani 1 1 d . . . . .
C175 C -0.5851(6) -0.1356(6) -0.2302(7) 0.091(8) Uani 1 1 d . . . . .
H175 H -0.603389 -0.144797 -0.225543 0.110 Uiso 1 1 calc R . . . .
C188 C -0.7027(5) -0.1486(5) -0.1103(4) 0.067(6) Uani 1 1 d . . . . .
H188 H -0.684163 -0.157885 -0.107069 0.081 Uiso 1 1 calc R . . . .
S131 S -0.71030(12) -0.19193(12) -0.15172(11) 0.0586(11) Uani 1 1 d . . . . .
C40 C -0.7398(7) -0.1118(5) -0.0962(5) 0.080(7) Uani 1 1 d . . . . .
C0AA C -0.8014(6) -0.1909(5) -0.0801(5) 0.078(7) Uani 1 1 d . . . . .
H0AA H -0.820917 -0.190805 -0.087862 0.093 Uiso 1 1 calc R . . . .
C112 C -0.7923(7) -0.1712(6) -0.0579(6) 0.090(8) Uani 1 1 d . . . . .
C7 C -0.6260(6) -0.2804(7) -0.0958(6) 0.092(7) Uani 1 1 d . U . . .
C13 C -0.7003(8) -0.3168(6) 0.0046(6) 0.098(9) Uani 1 1 d . . . . .
H13 H -0.696799 -0.328171 0.021887 0.118 Uiso 1 1 calc R . . . .
C1AA C -0.8439(5) -0.2530(6) -0.0424(5) 0.074(6) Uani 1 1 d . . . . .
H1AA H -0.863481 -0.253596 -0.049919 0.089 Uiso 1 1 calc R . . . .
C23 C -0.6185(8) -0.2204(11) -0.0682(7) 0.127(13) Uani 1 1 d . . . . .
H23 H -0.616368 -0.201103 -0.060143 0.152 Uiso 1 1 calc R . . . .
C31 C -0.6782(4) -0.2895(5) -0.1265(4) 0.052(5) Uani 1 1 d . . . . .
C39 C -0.8233(6) -0.2729(6) -0.0512(5) 0.081(7) Uani 1 1 d . . . . .
H39 H -0.828661 -0.286684 -0.066005 0.097 Uiso 1 1 calc R . . . .
C60 C -0.6422(6) -0.2284(7) -0.0849(5) 0.090(8) Uani 1 1 d . . . . .
H60 H -0.656697 -0.213643 -0.088561 0.108 Uiso 1 1 calc R . . . .
C81 C -0.5986(10) -0.2413(10) -0.0639(7) 0.126(13) Uani 1 1 d . . . . .
H81 H -0.582044 -0.236747 -0.051853 0.151 Uiso 1 1 calc R . . . .
C101 C -0.6566(5) -0.3097(5) -0.1271(5) 0.066(5) Uani 1 1 d . . . . .
H101 H -0.659498 -0.326453 -0.139457 0.079 Uiso 1 1 calc R . . . .
C123 C -0.7107(7) -0.2807(8) -0.0422(6) 0.105(9) Uani 1 1 d . . . . .
H123 H -0.714697 -0.268330 -0.058670 0.126 Uiso 1 1 calc R . . . .
C167 C -0.7790(6) -0.2115(5) -0.0904(4) 0.072(7) Uani 1 1 d . . . . .
C24 C -0.6000(8) -0.2706(9) -0.0763(8) 0.118(10) Uani 1 1 d . U . . .
H24 H -0.584593 -0.284243 -0.072252 0.141 Uiso 1 1 calc R . . . .
C2AA C -0.6316(6) -0.0883(6) -0.3115(6) 0.082(7) Uani 1 1 d . . . . .
H2AA H -0.646119 -0.091438 -0.296690 0.099 Uiso 1 1 calc R . . . .
C32 C -0.8352(8) -0.2314(7) -0.0216(5) 0.097(9) Uani 1 1 d . . . . .
C94 C -0.5176(8) -0.1037(8) -0.1893(9) 0.130(11) Uani 1 1 d . U . . .
H94A H -0.506051 -0.120622 -0.182190 0.196 Uiso 1 1 calc GR . . . .
H94B H -0.529579 -0.095846 -0.173106 0.196 Uiso 1 1 calc GR . . . .
H94C H -0.504176 -0.088359 -0.196527 0.196 Uiso 1 1 calc GR . . . .
N104 N -0.6750(4) -0.2626(5) -0.1124(3) 0.072(5) Uani 1 1 d . . . . .
C3AA C -0.6313(5) -0.3084(6) -0.1120(6) 0.077(6) Uani 1 1 d . . . . .
C15 C -0.6769(8) -0.2996(8) -0.0072(7) 0.107(9) Uani 1 1 d . U . . .
C4AA C -0.6100(7) -0.3324(8) -0.1084(8) 0.099(9) Uani 1 1 d . . . . .
C63 C -0.8581(8) -0.2082(8) -0.0113(7) 0.120(11) Uani 1 1 d . . . . .
H63A H -0.857480 -0.191126 -0.024549 0.180 Uiso 1 1 calc GR . . . .
H63B H -0.853350 -0.201911 0.008867 0.180 Uiso 1 1 calc GR . . . .
H63C H -0.877892 -0.216956 -0.011659 0.180 Uiso 1 1 calc GR . . . .
C76 C -0.6473(5) -0.2574(6) -0.0978(5) 0.078(7) Uani 1 1 d . . . . .
C88 C -0.7278(6) -0.3177(7) -0.0081(5) 0.089(8) Uani 1 1 d . . . . .
H88 H -0.742570 -0.330550 -0.000585 0.107 Uiso 1 1 calc R . . . .
C113 C -0.6325(9) -0.0643(6) -0.3311(8) 0.119(13) Uani 1 1 d . . . . .
H113 H -0.647840 -0.050223 -0.328205 0.143 Uiso 1 1 calc R . . . .
C169 C -0.8080(7) -0.2316(6) -0.0101(6) 0.089(8) Uani 1 1 d . . . . .
H169 H -0.802474 -0.217122 0.004031 0.107 Uiso 1 1 calc R . . . .
C21 C -0.5824(5) -0.3497(6) -0.2249(7) 0.085(7) Uani 1 1 d . U . . .
H21 H -0.566736 -0.355741 -0.212385 0.102 Uiso 1 1 calc R . . . .
C6AA C -0.6182(9) -0.0329(7) -0.3765(8) 0.122(11) Uani 1 1 d . U . . .
H6AA H -0.609838 -0.014730 -0.368150 0.183 Uiso 1 1 calc GR . . . .
H6AB H -0.639485 -0.030179 -0.379654 0.183 Uiso 1 1 calc GR . . . .
H6AC H -0.608630 -0.037195 -0.395423 0.183 Uiso 1 1 calc GR . . . .
C57 C -0.5675(7) -0.3093(10) -0.1717(8) 0.106(10) Uani 1 1 d . . . . .
O5AA O -0.5674(4) -0.2884(7) -0.1500(6) 0.127(8) Uani 1 1 d . . . . .
H5AA H -0.554625 -0.292676 -0.137374 0.191 Uiso 1 1 calc GR . . . .
C106 C -0.6111(7) -0.3594(6) -0.2682(8) 0.102(9) Uani 1 1 d . . . . .
H106 H -0.615299 -0.370537 -0.285455 0.123 Uiso 1 1 calc R . . . .
C110 C -0.5874(7) -0.3657(7) -0.2519(10) 0.113(11) Uani 1 1 d . . . . .
H110 H -0.573993 -0.380619 -0.258008 0.135 Uiso 1 1 calc R . . . .
C114 C -0.5998(5) -0.3254(6) -0.2162(6) 0.077(7) Uani 1 1 d . . . . .
O116 O -0.5482(4) -0.3269(6) -0.1723(5) 0.120(8) Uani 1 1 d . . . . .
C131 C -0.5956(5) -0.3064(7) -0.1912(7) 0.085(8) Uani 1 1 d . . . . .
C161 C -0.6295(6) -0.3362(6) -0.2598(7) 0.090(8) Uani 1 1 d . . . . .
H161 H -0.645845 -0.331516 -0.272183 0.108 Uiso 1 1 calc R . . . .
C177 C -0.5908(7) -0.2012(7) -0.3555(7) 0.100(9) Uani 1 1 d . . . . .
H177 H -0.601340 -0.207387 -0.372459 0.120 Uiso 1 1 calc R . . . .
O17 O -0.8122(10) -0.1353(10) -0.0224(9) 0.215(15) Uani 1 1 d D U . . .
H17 H -0.797432 -0.143307 -0.014774 0.322 Uiso 1 1 calc GR . . . .
C8AA C -0.6391(8) -0.2943(10) 0.0030(9) 0.147(13) Uani 1 1 d . U . . .
H8AA H -0.637459 -0.293662 0.024561 0.221 Uiso 1 1 calc GR . . . .
H8AB H -0.631879 -0.275662 -0.005352 0.221 Uiso 1 1 calc GR . . . .
H8AC H -0.627179 -0.310696 -0.004664 0.221 Uiso 1 1 calc GR . . . .
O61 O -0.5920(5) -0.3379(6) -0.0900(6) 0.136(9) Uani 1 1 d . . . . .
O68 O -0.6116(5) -0.3502(6) -0.1312(7) 0.136(9) Uani 1 1 d . . . . .
H68 H -0.628975 -0.356368 -0.133060 0.204 Uiso 1 1 calc GR . . . .
C7AA C -0.6830(6) -0.2786(8) -0.0305(6) 0.104(10) Uani 1 1 d . . . . .
H7AA H -0.668919 -0.264550 -0.037170 0.125 Uiso 1 1 calc R . . . .
C133 C -0.6253(4) -0.3190(5) -0.2336(6) 0.067(6) Uani 1 1 d . . . . .
C144 C -0.6157(5) -0.2830(5) -0.1854(5) 0.068(6) Uani 1 1 d . . . . .
H144 H -0.612742 -0.270278 -0.168937 0.081 Uiso 1 1 calc R . . . .
C5AA C -0.5533(7) -0.2398(8) -0.3663(10) 0.142(16) Uani 1 1 d . . . . .
H5AB H -0.532301 -0.236187 -0.370013 0.213 Uiso 1 1 calc GR . . . .
H5AC H -0.564071 -0.239818 -0.385092 0.213 Uiso 1 1 calc GR . . . .
H5AD H -0.555713 -0.259049 -0.356628 0.213 Uiso 1 1 calc GR . . . .
C5 C -0.8184(9) -0.1490(10) -0.0501(7) 0.141(15) Uani 1 1 d D . . . .
C6 C -0.8166(8) -0.3682(9) -0.0175(7) 0.115(11) Uani 1 1 d . . . . .
H6 H -0.831684 -0.370154 -0.003033 0.138 Uiso 1 1 calc R . . . .
C9 C -0.8043(6) -0.3411(6) -0.0230(5) 0.084(7) Uani 1 1 d . . . . .
H9 H -0.810019 -0.324558 -0.011419 0.100 Uiso 1 1 calc R . . . .
C10 C -0.7756(7) -0.3623(6) -0.0610(6) 0.091(8) Uani 1 1 d . . . . .
H10 H -0.760490 -0.360719 -0.075447 0.109 Uiso 1 1 calc R . . . .
C9AA C -0.7840(5) -0.3376(6) -0.0451(6) 0.079(7) Uani 1 1 d . . . . .
C124 C -0.5652(5) -0.2163(7) -0.3470(8) 0.096(9) Uani 1 1 d . . . . .
N225 N -0.7505(4) -0.1497(4) -0.1344(3) 0.059(4) Uani 1 1 d . . . . .
C26 C -0.8066(7) -0.3936(8) -0.0336(8) 0.111(10) Uani 1 1 d . . . . .
C0BA C -0.8200(11) -0.4256(10) -0.0283(10) 0.168(17) Uani 1 1 d . U . . .
H0BA H -0.804429 -0.438838 -0.021029 0.252 Uiso 1 1 calc GR . . . .
H0BB H -0.827871 -0.433364 -0.046924 0.252 Uiso 1 1 calc GR . . . .
H0BC H -0.835887 -0.424485 -0.013654 0.252 Uiso 1 1 calc GR . . . .
C79 C -0.7886(8) -0.3883(8) -0.0560(8) 0.115(10) Uani 1 1 d . U . . .
H79 H -0.784610 -0.403927 -0.069341 0.138 Uiso 1 1 calc R . . . .
O126 O -0.8411(7) -0.1484(7) -0.0648(8) 0.145(10) Uani 1 1 d D . . . .
O1 O -0.6612(5) -0.1251(5) -0.0731(4) 0.109(6) Uani 1 1 d D . . . .
O141 O -0.6922(7) -0.0885(6) -0.0562(6) 0.151(10) Uani 1 1 d D . . . .
H141 H -0.705508 -0.078533 -0.064323 0.227 Uiso 1 1 calc GR . . . .
C128 C -0.6850(6) -0.1117(6) -0.0738(7) 0.099(8) Uani 1 1 d D U . . .
C1 C -0.6175(6) -0.1406(6) -0.1402(5) 0.075(6) Uani 1 1 d . . . . .
O1BA O -0.6170(6) -0.0771(5) -0.1210(5) 0.128(8) Uani 1 1 d . . . . .
O16 O -0.6648(5) -0.0753(4) -0.1307(5) 0.105(6) Uani 1 1 d . . . . .
H16 H -0.676819 -0.085373 -0.120821 0.158 Uiso 1 1 calc GR . . . .
C2BA C -0.6584(5) -0.1221(5) -0.1702(5) 0.067(6) Uani 1 1 d . . . . .
H2BA H -0.674015 -0.108369 -0.173090 0.080 Uiso 1 1 calc R . . . .
N60 N -0.6362(4) -0.1686(4) -0.1824(4) 0.062(4) Uani 1 1 d . . . . .
C6BA C -0.5419(5) -0.2521(7) -0.2171(7) 0.091(8) Uani 1 1 d . . . . .
H6BA H -0.530633 -0.246018 -0.200488 0.109 Uiso 1 1 calc R . . . .
C8BA C -0.6154(5) -0.2597(5) -0.2993(5) 0.068(6) Uani 1 1 d . . . . .
H8BA H -0.626599 -0.263232 -0.316709 0.082 Uiso 1 1 calc R . . . .
C1BA C -0.5833(4) -0.2460(5) -0.2487(6) 0.068(6) Uani 1 1 d . . . . .
C7BA C -0.5833(6) -0.2989(7) -0.3144(8) 0.094(9) Uani 1 1 d . . . . .
C3BA C -0.6176(5) -0.1660(5) -0.1586(5) 0.067(6) Uani 1 1 d . . . . .
C5BA C -0.5982(6) -0.1390(7) -0.1149(7) 0.094(8) Uani 1 1 d . . . . .
H5BA H -0.596797 -0.121359 -0.103629 0.113 Uiso 1 1 calc R . . . .
C33 C -0.6381(6) -0.1174(6) -0.1479(5) 0.078(7) Uani 1 1 d . . . . .
C37 C -0.5819(6) -0.1885(9) -0.1238(6) 0.105(10) Uani 1 1 d . . . . .
H37 H -0.570061 -0.204723 -0.117829 0.126 Uiso 1 1 calc R . . . .
C42 C -0.5823(8) -0.1629(9) -0.1074(8) 0.110(10) Uani 1 1 d . U . . .
H42 H -0.570776 -0.162159 -0.089870 0.132 Uiso 1 1 calc R . . . .
C4BA C -0.6395(8) -0.0888(7) -0.1314(6) 0.090(8) Uani 1 1 d . U . . .
C115 C -0.6003(5) -0.1903(7) -0.1510(6) 0.088(8) Uani 1 1 d . . . . .
H115 H -0.600196 -0.207562 -0.162902 0.106 Uiso 1 1 calc R . . . .
C170 C -0.6561(5) -0.1478(4) -0.1892(5) 0.060(5) Uani 1 1 d . . . . .
O2 O -0.5605(6) -0.3117(5) -0.3164(6) 0.135(9) Uani 1 1 d . . . . .
C0CA C -0.5325(6) -0.2771(7) -0.2329(7) 0.088(7) Uani 1 1 d . U . . .
H0CA H -0.515479 -0.287750 -0.226921 0.106 Uiso 1 1 calc R . . . .
C25 C -0.5661(5) -0.2365(6) -0.2243(6) 0.079(7) Uani 1 1 d . . . . .
H25 H -0.571543 -0.219504 -0.213274 0.095 Uiso 1 1 calc R . . . .
C38 C -0.6250(4) -0.2361(5) -0.2803(5) 0.061(5) Uani 1 1 d . . . . .
C86 C -0.5917(5) -0.2774(5) -0.2943(6) 0.071(6) Uani 1 1 d . . . . .
O93 O -0.6026(7) -0.3091(5) -0.3306(6) 0.127(8) Uani 1 1 d . . . . .
H93A H -0.598419 -0.326603 -0.334918 0.190 Uiso 1 1 calc GR . . . .
C9BA C -0.5738(4) -0.2701(5) -0.2681(7) 0.077(7) Uani 1 1 d . . . . .
N122 N -0.6098(4) -0.2287(4) -0.2569(4) 0.069(5) Uani 1 1 d . . . . .
C125 C -0.5486(5) -0.2857(6) -0.2572(7) 0.096(9) Uani 1 1 d . . . . .
H125 H -0.542524 -0.302995 -0.267409 0.116 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag2 2.810(2) . ?
Ag1 Ag6 2.998(2) . ?
Ag1 Ag6 2.912(2) 15_454 ?
Ag1 Ag7 2.7769(15) . ?
Ag1 Ag9 2.981(2) . ?
Ag1 Ag10 2.913(2) 15_454 ?
Ag1 Ag10 2.918(2) . ?
Ag1 S13 2.521(5) . ?
Ag1 S5 2.561(5) . ?
Ag2 Ag3 2.9781(19) . ?
Ag2 Ag3 2.905(2) 15_454 ?
Ag2 Ag4 2.7694(14) . ?
Ag2 Ag5 2.941(2) . ?
Ag2 Ag6 3.379(2) . ?
Ag2 Ag6 3.0012(19) 15_454 ?
Ag2 S0AA 2.645(5) . ?
Ag2 S131 2.705(5) . ?
Ag3 Ag4 2.7663(15) . ?
Ag3 Ag5 2.916(2) . ?
Ag3 Ag5 2.905(2) 16_445 ?
Ag3 Ag6 2.806(2) . ?
Ag3 Ag12 2.934(2) . ?
Ag3 S1 2.513(5) . ?
Ag3 S131 2.558(5) . ?
Ag4 Ag5 3.010(2) . ?
Ag4 Ag5 3.011(2) 15_454 ?
Ag4 Ag5 3.011(2) 16_445 ?
Ag4 Ag7 2.608(3) . ?
Ag5 Ag5 3.276(3) 16_445 ?
Ag5 Ag5 3.276(3) 15_454 ?
Ag5 S1 2.647(5) 15_454 ?
Ag5 Cl2A 2.606(6) . ?
Ag5 N225 2.368(15) . ?
Ag6 Ag7 2.7845(15) . ?
Ag6 Ag10 2.942(2) . ?
Ag6 S1AA 2.657(5) . ?
Ag6 S5 2.679(5) . ?
Ag7 Ag10 3.006(2) 15_454 ?
Ag7 Ag10 3.006(2) . ?
Ag7 Ag10 3.006(2) 16_445 ?
Ag8 Ag12 3.228(2) . ?
Ag8 S1 2.666(6) . ?
Ag8 S0AA 2.589(5) 16_445 ?
Ag8 S1AA 2.623(5) . ?
Ag8 P3 2.407(5) . ?
Ag9 Ag11 3.135(2) . ?
Ag9 S5 2.673(5) . ?
Ag9 N60 2.269(18) . ?
Ag9 N122 2.239(19) . ?
Ag10 Ag10 3.287(3) 16_445 ?
Ag10 Ag10 3.288(3) 15_454 ?
Ag10 S13 2.636(5) 16_445 ?
Ag10 Cl4 2.589(6) . ?
Ag10 N130 2.333(16) . ?
Ag11 S13 2.678(5) . ?
Ag11 S0AA 2.596(5) . ?
Ag11 S1AA 2.613(5) 15_454 ?
Ag11 P2 2.393(5) . ?
Ag12 N161 2.24(2) . ?
Ag12 S131 2.599(5) . ?
Ag12 N104 2.23(2) . ?
S13 C38 1.76(2) . ?
S1 C167 1.75(2) . ?
S0AA C170 1.73(2) . ?
S1AA C31 1.775(19) . ?
S5 C28 1.78(2) . ?
P2 C184 1.83(3) . ?
P2 C83 1.83(2) . ?
P2 C191 1.85(3) . ?
P3 C61 1.81(2) . ?
P3 C108 1.80(3) . ?
P3 C9AA 1.80(3) . ?
C3 C137 1.39(3) . ?
C3 C184 1.36(3) . ?
C54 C184 1.38(4) . ?
C54 C177 1.40(4) . ?
C137 C124 1.36(4) . ?
C82 C147 1.44(4) . ?
C82 C163 1.39(4) . ?
C82 C112 1.39(4) . ?
C83 C98 1.38(3) . ?
C83 C175 1.37(4) . ?
C98 C155 1.39(4) . ?
C147 N161 1.34(3) . ?
C147 C183 1.44(4) . ?
C155 C19 1.45(5) . ?
N161 C167 1.35(3) . ?
C165 C183 1.38(4) . ?
C165 C168 1.30(4) . ?
C28 N130 1.30(3) . ?
C28 C144 1.41(3) . ?
C48 C191 1.32(3) . ?
C48 C45 1.31(4) . ?
N130 C133 1.43(3) . ?
C163 C168 1.53(5) . ?
C191 C2AA 1.40(3) . ?
C2 C4 1.33(4) . ?
C2 C40 1.37(3) . ?
C2 N225 1.41(3) . ?
C4 C34 1.36(4) . ?
C18 C29 1.30(5) . ?
C18 C40 1.42(4) . ?
C19 C93 1.41(4) . ?
C19 C94 1.43(4) . ?
C29 C34 1.39(4) . ?
C30 C45 1.24(4) . ?
C30 C113 1.37(5) . ?
C30 C6AA 1.53(4) . ?
C41 C108 1.38(3) . ?
C41 C169 1.32(4) . ?
C61 C123 1.38(4) . ?
C61 C88 1.41(3) . ?
C80 C188 1.37(3) . ?
C80 C40 1.41(4) . ?
C80 C128 1.53(4) . ?
C93 C175 1.42(4) . ?
C107 C188 1.38(3) . ?
C107 S131 1.76(3) . ?
C107 N225 1.33(3) . ?
C108 C39 1.36(3) . ?
C0AA C112 1.37(4) . ?
C0AA C167 1.43(4) . ?
C112 C5 1.56(5) . ?
C7 C24 1.50(4) . ?
C7 C3AA 1.45(4) . ?
C7 C76 1.39(4) . ?
C13 C15 1.39(4) . ?
C13 C88 1.34(4) . ?
C1AA C39 1.33(3) . ?
C1AA C32 1.38(4) . ?
C23 C60 1.34(4) . ?
C23 C81 1.30(5) . ?
C31 C101 1.31(3) . ?
C31 N104 1.35(3) . ?
C60 C76 1.42(4) . ?
C81 C24 1.41(5) . ?
C101 C3AA 1.31(3) . ?
C123 C7AA 1.34(4) . ?
C2AA C113 1.38(4) . ?
C32 C63 1.51(4) . ?
C32 C169 1.31(4) . ?
N104 C76 1.41(3) . ?
C3AA C4AA 1.43(4) . ?
C15 C8AA 1.75(5) . ?
C15 C7AA 1.42(4) . ?
C4AA O61 1.17(3) . ?
C4AA O68 1.29(4) . ?
C21 C110 1.41(4) . ?
C21 C114 1.38(3) . ?
C57 O5AA 1.33(4) . ?
C57 O116 1.16(4) . ?
C57 C131 1.53(4) . ?
C106 C110 1.30(4) . ?
C106 C161 1.37(3) . ?
C114 C131 1.40(4) . ?
C114 C133 1.40(3) . ?
C131 C144 1.39(3) . ?
C161 C133 1.40(4) . ?
C177 C124 1.37(4) . ?
O17 C5 1.394(12) . ?
C5AA C124 1.45(4) . ?
C5 O126 1.200(13) . ?
C6 C9 1.34(4) . ?
C6 C26 1.41(5) . ?
C9 C9AA 1.34(3) . ?
C10 C9AA 1.35(4) . ?
C10 C79 1.31(4) . ?
C26 C0BA 1.56(5) . ?
C26 C79 1.29(4) . ?
O1 C128 1.213(12) . ?
O141 C128 1.33(2) . ?
C1 C3BA 1.39(3) . ?
C1 C5BA 1.41(4) . ?
C1 C33 1.42(4) . ?
O1BA C4BA 1.22(3) . ?
O16 C4BA 1.27(3) . ?
C2BA C33 1.35(3) . ?
C2BA C170 1.42(3) . ?
N60 C3BA 1.34(3) . ?
N60 C170 1.31(2) . ?
C6BA C0CA 1.37(4) . ?
C6BA C25 1.32(3) . ?
C8BA C38 1.41(3) . ?
C8BA C86 1.33(3) . ?
C1BA C25 1.39(3) . ?
C1BA C9BA 1.44(3) . ?
C1BA N122 1.45(3) . ?
C7BA O2 1.16(3) . ?
C7BA C86 1.36(4) . ?
C7BA O93 1.21(3) . ?
C3BA C115 1.36(3) . ?
C5BA C42 1.32(4) . ?
C33 C4BA 1.47(4) . ?
C37 C42 1.35(4) . ?
C37 C115 1.46(4) . ?
C0CA C125 1.35(4) . ?
C38 N122 1.28(3) . ?
C86 C9BA 1.45(4) . ?
C9BA C125 1.40(3) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Ag2 Ag1 Ag6 63.23(5) . 15_454 ?
Ag2 Ag1 Ag6 71.08(5) . . ?
Ag2 Ag1 Ag9 93.22(6) . . ?
Ag2 Ag1 Ag10 122.24(6) . 15_454 ?
Ag2 Ag1 Ag10 127.80(7) . . ?
Ag6 Ag1 Ag6 106.92(7) 15_454 . ?
Ag6 Ag1 Ag9 124.31(6) 15_454 . ?
Ag6 Ag1 Ag10 114.70(6) 15_454 . ?
Ag6 Ag1 Ag10 60.67(5) 15_454 15_454 ?
Ag7 Ag1 Ag2 76.56(7) . . ?
Ag7 Ag1 Ag6 58.55(4) . 15_454 ?
Ag7 Ag1 Ag6 57.51(4) . . ?
Ag7 Ag1 Ag9 166.81(8) . . ?
Ag7 Ag1 Ag10 63.73(6) . 15_454 ?
Ag7 Ag1 Ag10 63.66(6) . . ?
Ag9 Ag1 Ag6 111.54(6) . . ?
Ag10 Ag1 Ag6 59.63(5) . . ?
Ag10 Ag1 Ag6 113.47(6) 15_454 . ?
Ag10 Ag1 Ag9 129.43(7) 15_454 . ?
Ag10 Ag1 Ag9 119.06(6) . . ?
Ag10 Ag1 Ag10 68.64(7) 15_454 . ?
S13 Ag1 Ag2 125.36(13) . . ?
S13 Ag1 Ag6 163.35(13) . . ?
S13 Ag1 Ag6 81.48(12) . 15_454 ?
S13 Ag1 Ag7 119.76(13) . . ?
S13 Ag1 Ag9 72.93(12) . . ?
S13 Ag1 Ag10 57.51(12) . 15_454 ?
S13 Ag1 Ag10 103.92(12) . . ?
S13 Ag1 S5 120.11(16) . . ?
S5 Ag1 Ag2 90.43(13) . . ?
S5 Ag1 Ag6 56.97(11) . . ?
S5 Ag1 Ag6 153.35(13) . 15_454 ?
S5 Ag1 Ag7 113.90(12) . . ?
S5 Ag1 Ag9 57.08(12) . . ?
S5 Ag1 Ag10 142.73(14) . 15_454 ?
S5 Ag1 Ag10 77.31(13) . . ?
Ag1 Ag2 Ag3 108.91(6) . . ?
Ag1 Ag2 Ag3 116.46(6) . 15_454 ?
Ag1 Ag2 Ag5 162.06(7) . . ?
Ag1 Ag2 Ag6 57.05(5) . . ?
Ag1 Ag2 Ag6 60.05(5) . 15_454 ?
Ag3 Ag2 Ag3 104.31(7) 15_454 . ?
Ag3 Ag2 Ag5 59.59(5) 15_454 . ?
Ag3 Ag2 Ag6 51.92(4) . . ?
Ag3 Ag2 Ag6 128.08(6) . 15_454 ?
Ag3 Ag2 Ag6 124.03(6) 15_454 . ?
Ag3 Ag2 Ag6 56.72(5) 15_454 15_454 ?
Ag4 Ag2 Ag1 99.06(7) . . ?
Ag4 Ag2 Ag3 57.40(4) . . ?
Ag4 Ag2 Ag3 58.30(4) . 15_454 ?
Ag4 Ag2 Ag5 63.55(6) . . ?
Ag4 Ag2 Ag6 67.79(5) . . ?
Ag4 Ag2 Ag6 73.71(5) . 15_454 ?
Ag5 Ag2 Ag3 59.02(5) . . ?
Ag5 Ag2 Ag6 109.06(6) . . ?
Ag5 Ag2 Ag6 115.04(6) . 15_454 ?
Ag6 Ag2 Ag6 96.00(6) 15_454 . ?
S0AA Ag2 Ag1 81.72(12) . . ?
S0AA Ag2 Ag3 140.80(13) . . ?
S0AA Ag2 Ag3 103.83(12) . 15_454 ?
S0AA Ag2 Ag4 160.61(12) . . ?
S0AA Ag2 Ag5 116.11(12) . . ?
S0AA Ag2 Ag6 90.34(12) . 15_454 ?
S0AA Ag2 Ag6 126.18(12) . . ?
S0AA Ag2 S131 87.55(16) . . ?
S131 Ag2 Ag1 109.58(12) . . ?
S131 Ag2 Ag3 53.25(11) . . ?
S131 Ag2 Ag3 133.62(13) . 15_454 ?
S131 Ag2 Ag4 110.09(12) . . ?
S131 Ag2 Ag5 74.90(12) . . ?
S131 Ag2 Ag6 77.16(12) . . ?
S131 Ag2 Ag6 169.62(13) . 15_454 ?
Ag2 Ag3 Ag2 106.87(7) 16_445 . ?
Ag2 Ag3 Ag5 114.66(6) 16_445 . ?
Ag2 Ag3 Ag5 60.84(5) 16_445 16_445 ?
Ag2 Ag3 Ag12 123.38(7) 16_445 . ?
Ag4 Ag3 Ag2 57.50(4) . . ?
Ag4 Ag3 Ag2 58.40(4) . 16_445 ?
Ag4 Ag3 Ag5 64.07(6) . 16_445 ?
Ag4 Ag3 Ag5 63.92(6) . . ?
Ag4 Ag3 Ag6 76.92(7) . . ?
Ag4 Ag3 Ag12 164.48(8) . . ?
Ag5 Ag3 Ag2 113.65(6) 16_445 . ?
Ag5 Ag3 Ag2 59.85(5) . . ?
Ag5 Ag3 Ag5 68.50(7) 16_445 . ?
Ag5 Ag3 Ag12 131.25(7) 16_445 . ?
Ag5 Ag3 Ag12 120.56(6) . . ?
Ag6 Ag3 Ag2 63.37(5) . 16_445 ?
Ag6 Ag3 Ag2 71.42(5) . . ?
Ag6 Ag3 Ag5 128.47(6) . . ?
Ag6 Ag3 Ag5 122.73(6) . 16_445 ?
Ag6 Ag3 Ag12 90.25(6) . . ?
Ag12 Ag3 Ag2 110.36(6) . . ?
S1 Ag3 Ag2 82.60(13) . 16_445 ?
S1 Ag3 Ag2 162.89(14) . . ?
S1 Ag3 Ag4 120.67(13) . . ?
S1 Ag3 Ag5 103.40(13) . . ?
S1 Ag3 Ag5 57.95(13) . 16_445 ?
S1 Ag3 Ag6 125.62(14) . . ?
S1 Ag3 Ag12 73.91(13) . . ?
S1 Ag3 S131 118.05(17) . . ?
S131 Ag3 Ag2 154.12(13) . 16_445 ?
S131 Ag3 Ag2 57.89(12) . . ?
S131 Ag3 Ag4 114.77(12) . . ?
S131 Ag3 Ag5 142.30(14) . 16_445 ?
S131 Ag3 Ag5 77.50(13) . . ?
S131 Ag3 Ag6 91.01(13) . . ?
S131 Ag3 Ag12 55.97(12) . . ?
Ag2 Ag4 Ag2 117.10(3) 15_454 . ?
Ag2 Ag4 Ag2 117.09(3) 15_454 16_445 ?
Ag2 Ag4 Ag2 117.09(3) 16_445 . ?
Ag2 Ag4 Ag5 61.00(5) . . ?
Ag2 Ag4 Ag5 115.87(6) 16_445 . ?
Ag2 Ag4 Ag5 116.78(6) . 16_445 ?
Ag2 Ag4 Ag5 115.87(6) 15_454 16_445 ?
Ag2 Ag4 Ag5 116.79(6) 15_454 . ?
Ag2 Ag4 Ag5 61.01(5) 15_454 15_454 ?
Ag2 Ag4 Ag5 115.87(6) . 15_454 ?
Ag2 Ag4 Ag5 116.78(6) 16_445 15_454 ?
Ag2 Ag4 Ag5 61.01(5) 16_445 16_445 ?
Ag3 Ag4 Ag2 63.29(4) 16_445 15_454 ?
Ag3 Ag4 Ag2 65.09(4) . . ?
Ag3 Ag4 Ag2 175.64(11) . 15_454 ?
Ag3 Ag4 Ag2 65.10(4) 16_445 16_445 ?
Ag3 Ag4 Ag2 63.29(4) 15_454 . ?
Ag3 Ag4 Ag2 63.30(4) . 16_445 ?
Ag3 Ag4 Ag2 65.10(4) 15_454 15_454 ?
Ag3 Ag4 Ag2 175.64(11) 16_445 . ?
Ag3 Ag4 Ag2 175.64(11) 15_454 16_445 ?
Ag3 Ag4 Ag3 114.21(4) . 16_445 ?
Ag3 Ag4 Ag3 114.21(4) 16_445 15_454 ?
Ag3 Ag4 Ag3 114.21(4) . 15_454 ?
Ag3 Ag4 Ag5 60.46(5) . . ?
Ag3 Ag4 Ag5 60.20(5) . 16_445 ?
Ag3 Ag4 Ag5 114.75(9) 16_445 . ?
Ag3 Ag4 Ag5 114.74(9) . 15_454 ?
Ag3 Ag4 Ag5 114.75(9) 15_454 16_445 ?
Ag3 Ag4 Ag5 60.46(5) 15_454 15_454 ?
Ag3 Ag4 Ag5 60.20(5) 15_454 . ?
Ag3 Ag4 Ag5 60.20(5) 16_445 15_454 ?
Ag3 Ag4 Ag5 60.46(5) 16_445 16_445 ?
Ag5 Ag4 Ag5 65.92(7) . 16_445 ?
Ag5 Ag4 Ag5 65.92(7) . 15_454 ?
Ag5 Ag4 Ag5 65.92(7) 16_445 15_454 ?
Ag7 Ag4 Ag2 80.08(6) . 15_454 ?
Ag7 Ag4 Ag2 80.08(6) . . ?
Ag7 Ag4 Ag2 80.08(6) . 16_445 ?
Ag7 Ag4 Ag3 104.17(6) . 16_445 ?
Ag7 Ag4 Ag3 104.17(6) . . ?
Ag7 Ag4 Ag3 104.17(6) . 15_454 ?
Ag7 Ag4 Ag5 141.08(4) . 15_454 ?
Ag7 Ag4 Ag5 141.08(4) . . ?
Ag7 Ag4 Ag5 141.08(4) . 16_445 ?
Ag2 Ag5 Ag4 55.45(5) . . ?
Ag2 Ag5 Ag5 103.89(4) . 15_454 ?
Ag2 Ag5 Ag5 104.63(4) . 16_445 ?
Ag3 Ag5 Ag2 59.58(5) 15_454 . ?
Ag3 Ag5 Ag2 61.12(5) . . ?
Ag3 Ag5 Ag3 105.90(7) 15_454 . ?
Ag3 Ag5 Ag4 55.62(4) . . ?
Ag3 Ag5 Ag4 55.73(4) 15_454 . ?
Ag3 Ag5 Ag5 103.48(5) . 15_454 ?
Ag3 Ag5 Ag5 55.92(6) 15_454 15_454 ?
Ag3 Ag5 Ag5 55.59(5) . 16_445 ?
Ag3 Ag5 Ag5 103.74(5) 15_454 16_445 ?
Ag4 Ag5 Ag5 57.04(3) . 15_454 ?
Ag4 Ag5 Ag5 57.04(3) . 16_445 ?
Ag5 Ag5 Ag5 60.0 16_445 15_454 ?
S1 Ag5 Ag2 79.69(12) 15_454 . ?
S1 Ag5 Ag3 140.24(13) 15_454 . ?
S1 Ag5 Ag3 53.57(12) 15_454 15_454 ?
S1 Ag5 Ag4 108.24(12) 15_454 . ?
S1 Ag5 Ag5 151.55(13) 15_454 16_445 ?
S1 Ag5 Ag5 91.57(13) 15_454 15_454 ?
Cl2A Ag5 Ag2 150.00(16) . . ?
Cl2A Ag5 Ag3 104.70(10) . . ?
Cl2A Ag5 Ag3 105.02(10) . 15_454 ?
Cl2A Ag5 Ag4 94.56(16) . . ?
Cl2A Ag5 Ag5 51.06(12) . 16_445 ?
Cl2A Ag5 Ag5 51.06(12) . 15_454 ?
Cl2A Ag5 S1 113.19(14) . 15_454 ?
N225 Ag5 Ag2 96.2(4) . . ?
N225 Ag5 Ag3 83.5(4) . . ?
N225 Ag5 Ag3 141.1(4) . 15_454 ?
N225 Ag5 Ag4 137.2(4) . . ?
N225 Ag5 Ag5 112.1(4) . 16_445 ?
N225 Ag5 Ag5 159.7(4) . 15_454 ?
N225 Ag5 S1 95.0(4) . 15_454 ?
N225 Ag5 Cl2A 108.9(4) . . ?
Ag1 Ag6 Ag1 104.29(7) 16_445 . ?
Ag1 Ag6 Ag2 127.52(6) . 16_445 ?
Ag1 Ag6 Ag2 123.70(6) 16_445 . ?
Ag1 Ag6 Ag2 56.72(5) 16_445 16_445 ?
Ag1 Ag6 Ag2 51.87(4) . . ?
Ag1 Ag6 Ag10 59.67(5) 16_445 . ?
Ag2 Ag6 Ag2 95.37(6) 16_445 . ?
Ag3 Ag6 Ag1 116.32(6) . 16_445 ?
Ag3 Ag6 Ag1 108.47(6) . . ?
Ag3 Ag6 Ag2 56.65(4) . . ?
Ag3 Ag6 Ag2 59.91(5) . 16_445 ?
Ag3 Ag6 Ag10 161.33(7) . . ?
Ag7 Ag6 Ag1 58.29(4) . 16_445 ?
Ag7 Ag6 Ag1 57.26(4) . . ?
Ag7 Ag6 Ag2 67.54(5) . . ?
Ag7 Ag6 Ag2 73.39(5) . 16_445 ?
Ag7 Ag6 Ag3 98.67(7) . . ?
Ag7 Ag6 Ag10 63.26(6) . . ?
Ag10 Ag6 Ag1 58.85(5) . . ?
Ag10 Ag6 Ag2 108.75(5) . . ?
Ag10 Ag6 Ag2 114.96(6) . 16_445 ?
S1AA Ag6 Ag1 101.55(11) . 16_445 ?
S1AA Ag6 Ag1 141.90(12) . . ?
S1AA Ag6 Ag2 90.14(12) . 16_445 ?
S1AA Ag6 Ag2 128.80(11) . . ?
S1AA Ag6 Ag3 83.90(12) . . ?
S1AA Ag6 Ag7 158.74(12) . . ?
S1AA Ag6 Ag10 114.61(12) . . ?
S1AA Ag6 S5 88.67(16) . . ?
S5 Ag6 Ag1 133.95(13) . 16_445 ?
S5 Ag6 Ag1 53.28(11) . . ?
S5 Ag6 Ag2 77.13(12) . . ?
S5 Ag6 Ag2 169.23(13) . 16_445 ?
S5 Ag6 Ag3 109.32(13) . . ?
S5 Ag6 Ag7 110.01(12) . . ?
S5 Ag6 Ag10 75.15(13) . . ?
Ag1 Ag7 Ag1 114.34(4) . 15_454 ?
Ag1 Ag7 Ag1 114.33(4) . 16_445 ?
Ag1 Ag7 Ag1 114.33(4) 15_454 16_445 ?
Ag1 Ag7 Ag6 65.23(4) 15_454 15_454 ?
Ag1 Ag7 Ag6 63.16(4) . 15_454 ?
Ag1 Ag7 Ag6 175.91(10) 16_445 15_454 ?
Ag1 Ag7 Ag6 175.91(10) . 16_445 ?
Ag1 Ag7 Ag6 65.23(4) 16_445 16_445 ?
Ag1 Ag7 Ag6 175.91(10) 15_454 . ?
Ag1 Ag7 Ag6 63.16(4) 15_454 16_445 ?
Ag1 Ag7 Ag6 63.16(4) 16_445 . ?
Ag1 Ag7 Ag6 65.23(4) . . ?
Ag1 Ag7 Ag10 115.14(9) . 16_445 ?
Ag1 Ag7 Ag10 60.46(5) 16_445 16_445 ?
Ag1 Ag7 Ag10 60.33(5) 16_445 . ?
Ag1 Ag7 Ag10 60.46(5) 15_454 15_454 ?
Ag1 Ag7 Ag10 115.14(9) 16_445 15_454 ?
Ag1 Ag7 Ag10 60.46(5) . . ?
Ag1 Ag7 Ag10 115.14(9) 15_454 . ?
Ag1 Ag7 Ag10 60.33(5) . 15_454 ?
Ag1 Ag7 Ag10 60.33(5) 15_454 16_445 ?
Ag4 Ag7 Ag1 104.01(6) . . ?
Ag4 Ag7 Ag1 104.01(6) . 16_445 ?
Ag4 Ag7 Ag1 104.01(6) . 15_454 ?
Ag4 Ag7 Ag6 79.93(6) . 15_454 ?
Ag4 Ag7 Ag6 79.93(6) . . ?
Ag4 Ag7 Ag6 79.93(6) . 16_445 ?
Ag4 Ag7 Ag10 140.85(4) . . ?
Ag4 Ag7 Ag10 140.85(4) . 15_454 ?
Ag4 Ag7 Ag10 140.85(4) . 16_445 ?
Ag6 Ag7 Ag6 117.01(3) 16_445 . ?
Ag6 Ag7 Ag6 117.01(3) 16_445 15_454 ?
Ag6 Ag7 Ag6 117.01(3) 15_454 . ?
Ag6 Ag7 Ag10 115.90(6) 16_445 15_454 ?
Ag6 Ag7 Ag10 60.92(5) 15_454 15_454 ?
Ag6 Ag7 Ag10 117.13(6) . 15_454 ?
Ag6 Ag7 Ag10 115.90(6) 15_454 . ?
Ag6 Ag7 Ag10 60.92(5) 16_445 16_445 ?
Ag6 Ag7 Ag10 117.13(6) 16_445 . ?
Ag6 Ag7 Ag10 60.93(5) . . ?
Ag6 Ag7 Ag10 117.13(6) 15_454 16_445 ?
Ag6 Ag7 Ag10 115.90(6) . 16_445 ?
Ag10 Ag7 Ag10 66.29(7) 16_445 . ?
Ag10 Ag7 Ag10 66.29(7) 16_445 15_454 ?
Ag10 Ag7 Ag10 66.30(7) 15_454 . ?
S1 Ag8 Ag12 67.13(12) . . ?
S0AA Ag8 Ag12 125.13(13) 16_445 . ?
S0AA Ag8 S1 98.30(16) 16_445 . ?
S0AA Ag8 S1AA 76.05(16) 16_445 . ?
S1AA Ag8 Ag12 61.37(11) . . ?
S1AA Ag8 S1 108.10(16) . . ?
P3 Ag8 Ag12 106.59(16) . . ?
P3 Ag8 S1 105.46(19) . . ?
P3 Ag8 S0AA 128.1(2) . 16_445 ?
P3 Ag8 S1AA 134.3(2) . . ?
Ag1 Ag9 Ag11 76.47(5) . . ?
S5 Ag9 Ag1 53.54(11) . . ?
S5 Ag9 Ag11 128.84(12) . . ?
N60 Ag9 Ag1 118.1(4) . . ?
N60 Ag9 Ag11 94.3(4) . . ?
N60 Ag9 S5 99.6(4) . . ?
N122 Ag9 Ag1 85.8(4) . . ?
N122 Ag9 Ag11 85.4(5) . . ?
N122 Ag9 S5 99.7(5) . . ?
N122 Ag9 N60 155.4(6) . . ?
Ag1 Ag10 Ag1 106.32(7) 16_445 . ?
Ag1 Ag10 Ag6 61.53(5) . . ?
Ag1 Ag10 Ag6 59.66(5) 16_445 . ?
Ag1 Ag10 Ag7 55.93(4) 16_445 . ?
Ag1 Ag10 Ag7 55.88(4) . . ?
Ag1 Ag10 Ag10 55.76(5) 16_445 16_445 ?
Ag1 Ag10 Ag10 103.74(5) 16_445 15_454 ?
Ag1 Ag10 Ag10 55.60(5) . 15_454 ?
Ag1 Ag10 Ag10 103.62(5) . 16_445 ?
Ag6 Ag10 Ag7 55.81(5) . . ?
Ag6 Ag10 Ag10 104.86(4) . 15_454 ?
Ag6 Ag10 Ag10 103.88(4) . 16_445 ?
Ag7 Ag10 Ag10 56.85(3) . 15_454 ?
Ag7 Ag10 Ag10 56.85(3) . 16_445 ?
Ag10 Ag10 Ag10 60.0 16_445 15_454 ?
S13 Ag10 Ag1 53.76(12) 16_445 16_445 ?
S13 Ag10 Ag1 139.90(12) 16_445 . ?
S13 Ag10 Ag6 79.07(12) 16_445 . ?
S13 Ag10 Ag7 108.50(12) 16_445 . ?
S13 Ag10 Ag10 152.12(13) 16_445 15_454 ?
S13 Ag10 Ag10 92.16(13) 16_445 16_445 ?
Cl4 Ag10 Ag1 104.46(10) . 16_445 ?
Cl4 Ag10 Ag1 104.31(10) . . ?
Cl4 Ag10 Ag6 149.49(16) . . ?
Cl4 Ag10 Ag7 93.70(16) . . ?
Cl4 Ag10 Ag10 50.59(11) . 16_445 ?
Cl4 Ag10 Ag10 50.59(11) . 15_454 ?
Cl4 Ag10 S13 113.99(13) . 16_445 ?
N130 Ag10 Ag1 84.4(4) . . ?
N130 Ag10 Ag1 138.4(4) . 16_445 ?
N130 Ag10 Ag6 94.5(5) . . ?
N130 Ag10 Ag7 137.7(4) . . ?
N130 Ag10 Ag10 161.6(5) . 16_445 ?
N130 Ag10 Ag10 114.9(4) . 15_454 ?
N130 Ag10 S13 92.0(4) . 16_445 ?
N130 Ag10 Cl4 111.6(5) . . ?
S13 Ag11 Ag9 68.44(12) . . ?
S0AA Ag11 Ag9 63.20(12) . . ?
S0AA Ag11 S13 106.56(16) . . ?
S0AA Ag11 S1AA 76.10(16) . 15_454 ?
S1AA Ag11 Ag9 126.51(12) 15_454 . ?
S1AA Ag11 S13 93.64(15) 15_454 . ?
P2 Ag11 Ag9 102.75(16) . . ?
P2 Ag11 S13 107.67(18) . . ?
P2 Ag11 S0AA 133.8(2) . . ?
P2 Ag11 S1AA 130.70(19) . 15_454 ?
Ag3 Ag12 Ag8 75.50(5) . . ?
N161 Ag12 Ag3 89.1(4) . . ?
N161 Ag12 Ag8 83.1(5) . . ?
N161 Ag12 S131 101.2(5) . . ?
S131 Ag12 Ag3 54.67(12) . . ?
S131 Ag12 Ag8 129.67(12) . . ?
N104 Ag12 Ag3 123.3(4) . . ?
N104 Ag12 Ag8 92.4(5) . . ?
N104 Ag12 N161 145.2(6) . . ?
N104 Ag12 S131 108.0(4) . . ?
Ag1 S13 Ag10 68.73(12) . 15_454 ?
Ag1 S13 Ag11 93.46(17) . . ?
Ag10 S13 Ag11 133.11(19) 15_454 . ?
C38 S13 Ag1 99.7(7) . . ?
C38 S13 Ag10 115.0(7) . 15_454 ?
C38 S13 Ag11 110.5(7) . . ?
Ag3 S1 Ag5 68.47(12) . 16_445 ?
Ag3 S1 Ag8 93.71(18) . . ?
Ag5 S1 Ag8 129.1(2) 16_445 . ?
C167 S1 Ag3 102.2(7) . . ?
C167 S1 Ag5 119.7(8) . 16_445 ?
C167 S1 Ag8 110.4(8) . . ?
Ag8 S0AA Ag2 98.17(17) 15_454 . ?
Ag8 S0AA Ag11 90.28(17) 15_454 . ?
Ag11 S0AA Ag2 117.1(2) . . ?
C170 S0AA Ag2 116.8(7) . . ?
C170 S0AA Ag8 117.1(6) . 15_454 ?
C170 S0AA Ag11 113.4(8) . . ?
Ag8 S1AA Ag6 114.05(19) . . ?
Ag11 S1AA Ag6 100.71(16) 16_445 . ?
Ag11 S1AA Ag8 89.16(15) 16_445 . ?
C31 S1AA Ag6 117.8(6) . . ?
C31 S1AA Ag8 115.9(6) . . ?
C31 S1AA Ag11 114.4(7) . 16_445 ?
Ag1 S5 Ag6 69.75(13) . . ?
Ag1 S5 Ag9 69.38(13) . . ?
Ag9 S5 Ag6 134.9(2) . . ?
C28 S5 Ag1 107.4(7) . . ?
C28 S5 Ag6 110.8(7) . . ?
C28 S5 Ag9 98.9(7) . . ?
C184 P2 Ag11 109.4(7) . . ?
C184 P2 C191 102.5(12) . . ?
C83 P2 Ag11 114.6(9) . . ?
C83 P2 C184 106.8(11) . . ?
C83 P2 C191 107.1(11) . . ?
C191 P2 Ag11 115.4(8) . . ?
C61 P3 Ag8 113.1(8) . . ?
C108 P3 Ag8 108.3(7) . . ?
C108 P3 C61 107.9(10) . . ?
C9AA P3 Ag8 117.8(9) . . ?
C9AA P3 C61 104.3(11) . . ?
C9AA P3 C108 104.8(12) . . ?
Ag10 Cl4 Ag10 78.8(2) 16_445 . ?
Ag10 Cl4 Ag10 78.8(2) 15_454 . ?
Ag10 Cl4 Ag10 78.8(2) 16_445 15_454 ?
C184 C3 C137 121(3) . . ?
C184 C54 C177 119(3) . . ?
C124 C137 C3 120(2) . . ?
C3 C184 P2 124(2) . . ?
C3 C184 C54 120(3) . . ?
C54 C184 P2 116(2) . . ?
Ag5 Cl2A Ag5 77.9(2) 15_454 16_445 ?
Ag5 Cl2A Ag5 77.9(2) 15_454 . ?
Ag5 Cl2A Ag5 77.9(2) 16_445 . ?
C163 C82 C147 121(3) . . ?
C163 C82 C112 124(3) . . ?
C112 C82 C147 115(2) . . ?
C98 C83 P2 120(2) . . ?
C175 C83 P2 118.1(19) . . ?
C175 C83 C98 122(2) . . ?
C83 C98 C155 119(3) . . ?
N161 C147 C82 124(2) . . ?
N161 C147 C183 117(3) . . ?
C183 C147 C82 119(2) . . ?
C98 C155 C19 122(3) . . ?
C147 N161 Ag12 122.0(18) . . ?
C147 N161 C167 118(2) . . ?
C167 N161 Ag12 116.6(14) . . ?
C168 C165 C183 117(3) . . ?
C165 C183 C147 122(3) . . ?
N130 C28 S5 120.7(15) . . ?
N130 C28 C144 124(2) . . ?
C144 C28 S5 115.1(18) . . ?
C45 C48 C191 122(3) . . ?
C28 N130 Ag10 119.5(14) . . ?
C28 N130 C133 115.3(18) . . ?
C133 N130 Ag10 122.9(14) . . ?
C82 C163 C168 113(3) . . ?
C165 C168 C163 127(3) . . ?
C48 C191 P2 127(2) . . ?
C48 C191 C2AA 117(3) . . ?
C2AA C191 P2 115.8(19) . . ?
C4 C2 C40 121(2) . . ?
C4 C2 N225 117(2) . . ?
C40 C2 N225 122(2) . . ?
C2 C4 C34 122(3) . . ?
C29 C18 C40 120(3) . . ?
C93 C19 C155 116(3) . . ?
C93 C19 C94 121(3) . . ?
C94 C19 C155 124(3) . . ?
C18 C29 C34 122(3) . . ?
C45 C30 C113 112(3) . . ?
C45 C30 C6AA 127(4) . . ?
C113 C30 C6AA 121(3) . . ?
C4 C34 C29 117(3) . . ?
C169 C41 C108 123(3) . . ?
C30 C45 C48 128(4) . . ?
C123 C61 P3 120.3(18) . . ?
C123 C61 C88 116(2) . . ?
C88 C61 P3 123(2) . . ?
C188 C80 C40 120(2) . . ?
C188 C80 C128 114(2) . . ?
C40 C80 C128 126(2) . . ?
C19 C93 C175 122(3) . . ?
C188 C107 S131 117(2) . . ?
N225 C107 C188 122(2) . . ?
N225 C107 S131 120.9(17) . . ?
C41 C108 P3 126(2) . . ?
C39 C108 P3 119.8(19) . . ?
C39 C108 C41 114(2) . . ?
C83 C175 C93 119(2) . . ?
C80 C188 C107 120(2) . . ?
Ag3 S131 Ag2 68.86(13) . . ?
Ag3 S131 Ag12 69.35(13) . . ?
Ag12 S131 Ag2 132.5(2) . . ?
C107 S131 Ag2 113.4(8) . . ?
C107 S131 Ag3 106.7(8) . . ?
C107 S131 Ag12 99.4(7) . . ?
C2 C40 C18 117(3) . . ?
C2 C40 C80 117(2) . . ?
C80 C40 C18 125(3) . . ?
C112 C0AA C167 116(3) . . ?
C82 C112 C5 126(3) . . ?
C0AA C112 C82 124(3) . . ?
C0AA C112 C5 110(3) . . ?
C3AA C7 C24 131(3) . . ?
C76 C7 C24 110(3) . . ?
C76 C7 C3AA 119(2) . . ?
C88 C13 C15 122(3) . . ?
C39 C1AA C32 118(2) . . ?
C81 C23 C60 115(4) . . ?
C101 C31 S1AA 126.1(17) . . ?
C101 C31 N104 122.4(19) . . ?
N104 C31 S1AA 111.5(15) . . ?
C1AA C39 C108 124(2) . . ?
C23 C60 C76 126(3) . . ?
C23 C81 C24 125(4) . . ?
C3AA C101 C31 126(2) . . ?
C7AA C123 C61 128(3) . . ?
N161 C167 S1 117.9(19) . . ?
N161 C167 C0AA 124(2) . . ?
C0AA C167 S1 118(2) . . ?
C81 C24 C7 122(3) . . ?
C113 C2AA C191 115(3) . . ?
C1AA C32 C63 119(3) . . ?
C169 C32 C1AA 121(3) . . ?
C169 C32 C63 120(3) . . ?
C31 N104 Ag12 116.6(13) . . ?
C31 N104 C76 117(2) . . ?
C76 N104 Ag12 126.2(17) . . ?
C101 C3AA C7 115(2) . . ?
C101 C3AA C4AA 126(3) . . ?
C4AA C3AA C7 118(2) . . ?
C13 C15 C8AA 134(3) . . ?
C13 C15 C7AA 119(3) . . ?
C7AA C15 C8AA 107(3) . . ?
O61 C4AA C3AA 133(4) . . ?
O61 C4AA O68 117(4) . . ?
O68 C4AA C3AA 110(3) . . ?
C7 C76 C60 122(2) . . ?
C7 C76 N104 120(2) . . ?
N104 C76 C60 118(2) . . ?
C13 C88 C61 119(3) . . ?
C2AA C113 C30 126(3) . . ?
C32 C169 C41 120(3) . . ?
C114 C21 C110 123(3) . . ?
O5AA C57 C131 111(3) . . ?
O116 C57 O5AA 119(3) . . ?
O116 C57 C131 130(4) . . ?
C110 C106 C161 120(4) . . ?
C106 C110 C21 119(3) . . ?
C21 C114 C131 128(3) . . ?
C21 C114 C133 117(3) . . ?
C131 C114 C133 115(2) . . ?
C114 C131 C57 120(3) . . ?
C144 C131 C57 119(3) . . ?
C144 C131 C114 121(2) . . ?
C106 C161 C133 124(3) . . ?
C124 C177 C54 121(3) . . ?
C123 C7AA C15 114(3) . . ?
C114 C133 N130 126(2) . . ?
C114 C133 C161 117(2) . . ?
C161 C133 N130 117(2) . . ?
C131 C144 C28 119(2) . . ?
O17 C5 C112 109(3) . . ?
O126 C5 C112 121(3) . . ?
O126 C5 O17 129(4) . . ?
C9 C6 C26 120(3) . . ?
C9AA C9 C6 121(3) . . ?
C79 C10 C9AA 120(3) . . ?
C9 C9AA P3 122(2) . . ?
C9 C9AA C10 118(3) . . ?
C10 C9AA P3 119(2) . . ?
C137 C124 C177 120(3) . . ?
C137 C124 C5AA 121(3) . . ?
C177 C124 C5AA 119(3) . . ?
C2 N225 Ag5 122.5(14) . . ?
C107 N225 Ag5 118.0(14) . . ?
C107 N225 C2 117.8(18) . . ?
C6 C26 C0BA 122(4) . . ?
C79 C26 C6 116(3) . . ?
C79 C26 C0BA 121(4) . . ?
C26 C79 C10 124(4) . . ?
O1 C128 C80 119(2) . . ?
O1 C128 O141 125(3) . . ?
O141 C128 C80 116(2) . . ?
C3BA C1 C5BA 121(2) . . ?
C3BA C1 C33 116(2) . . ?
C5BA C1 C33 123(2) . . ?
C33 C2BA C170 121(2) . . ?
C3BA N60 Ag9 126.1(15) . . ?
C170 N60 Ag9 110.8(14) . . ?
C170 N60 C3BA 122.2(19) . . ?
C25 C6BA C0CA 123(3) . . ?
C86 C8BA C38 125(2) . . ?
C25 C1BA C9BA 122(2) . . ?
C25 C1BA N122 119(2) . . ?
C9BA C1BA N122 119(2) . . ?
O2 C7BA C86 129(3) . . ?
O2 C7BA O93 113(3) . . ?
O93 C7BA C86 117(2) . . ?
N60 C3BA C1 122(2) . . ?
N60 C3BA C115 118(2) . . ?
C115 C3BA C1 119(2) . . ?
C42 C5BA C1 119(3) . . ?
C1 C33 C4BA 122(2) . . ?
C2BA C33 C1 120(2) . . ?
C2BA C33 C4BA 118(3) . . ?
C42 C37 C115 119(3) . . ?
C5BA C42 C37 123(3) . . ?
O1BA C4BA O16 121(3) . . ?
O1BA C4BA C33 122(3) . . ?
O16 C4BA C33 117(3) . . ?
C3BA C115 C37 118(3) . . ?
C2BA C170 S0AA 122.4(15) . . ?
N60 C170 S0AA 118.9(16) . . ?
N60 C170 C2BA 118.6(19) . . ?
C125 C0CA C6BA 118(3) . . ?
C6BA C25 C1BA 119(3) . . ?
C8BA C38 S13 120.7(15) . . ?
N122 C38 S13 118.3(17) . . ?
N122 C38 C8BA 121.1(19) . . ?
C8BA C86 C7BA 122(3) . . ?
C8BA C86 C9BA 116(2) . . ?
C7BA C86 C9BA 122(2) . . ?
C1BA C9BA C86 119.2(18) . . ?
C125 C9BA C1BA 113(3) . . ?
C125 C9BA C86 127(3) . . ?
C1BA N122 Ag9 116.8(15) . . ?
C38 N122 Ag9 118.9(14) . . ?
C38 N122 C1BA 120(2) . . ?
C0CA C125 C9BA 124(3) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
- Detector area scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 13.181
_oxdiff_exptl_absorpt_empirical_full_min 0.300
