# Supplementary Information (SI) for Nanoscale.
# This journal is © The Royal Society of Chemistry 2026

####################################################################### 
# 
# 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_shelx
_database_code_depnum_ccdc_archive 'CCDC 2497804'
loop_
_audit_author_name
_audit_author_address
'Sudhadevi Antharjanam'
;Sophisticated Analytical Instruments Facility (SAIF),IITM
India
;
_audit_update_record             
;
2025-10-24 deposited with the CCDC.	2026-02-20 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2019/3
_shelx_SHELXL_version_number     2019/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C61 H45 Ag F7 P3 S'
_chemical_formula_sum            'C61 H45 Ag F7 P3 S'
_chemical_formula_weight         1143.81

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'
F F 0.0171 0.0103 '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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

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

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

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

_cell_length_a                   12.5786(9)
_cell_length_b                   12.8514(10)
_cell_length_c                   16.1604(14)
_cell_angle_alpha                87.211(3)
_cell_angle_beta                 85.428(3)
_cell_angle_gamma                82.345(3)
_cell_volume                     2578.9(4)
_cell_formula_units_Z            2
_cell_measurement_temperature    143(2)

_cell_measurement_reflns_used    9716
_cell_measurement_theta_min      2.91
_cell_measurement_theta_max      28.29
_exptl_crystal_description       block
_exptl_crystal_colour            brown

_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.473
_exptl_crystal_F_000             1164
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.237
_exptl_crystal_size_mid          0.125
_exptl_crystal_size_min          0.112
_exptl_absorpt_coefficient_mu    0.590
_shelx_estimated_absorpt_T_min   0.873
_shelx_estimated_absorpt_T_max   0.937
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6966
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_process_details   'SADABS (Bruker, 2016)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      143(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a

_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_measurement_device_type  
'Bruker D8 VENTURE diffractometer equipped with PHOTON II detector'
_diffrn_measurement_method       'ω and φ scan'

_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            74543
_diffrn_reflns_av_unetI/netI     0.0183
_diffrn_reflns_av_R_equivalents  0.0343
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         3.046
_diffrn_reflns_theta_max         24.999
_diffrn_reflns_theta_full        24.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             9059
_reflns_number_gt                8271
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX4 (Bruker, v2021.4-0)'
_computing_cell_refinement       'APEX4 V8.40B (Bruker, 2021)'
_computing_data_reduction        'SAINT/XPREP (Bruker, 2021)'
_computing_structure_solution    'SHELXT-2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2019/3 (Sheldrick, 2019)'
_computing_molecular_graphics    ?
_computing_publication_material  'SHELXL-2019/3 (Sheldrick, 2019)'



_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0379P)²+4.5204P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         9059
_refine_ls_number_parameters     658
_refine_ls_number_restraints     2
_refine_ls_R_factor_all          0.0358
_refine_ls_R_factor_gt           0.0318
_refine_ls_wR_factor_ref         0.0862
_refine_ls_wR_factor_gt          0.0825
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_restrained_S_all      1.058
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.75591(2) 0.72573(2) 0.25039(2) 0.01827(7) Uani 1 1 d . U . . .
C1 C 0.72438(19) 0.9123(2) 0.41955(16) 0.0195(5) Uani 1 1 d . . . . .
C2 C 0.7990(2) 0.9694(3) 0.37578(18) 0.0324(7) Uani 1 1 d . . . . .
H2 H 0.809808 0.965107 0.317124 0.039 Uiso 1 1 calc R U . . .
C3 C 0.8577(3) 1.0322(3) 0.4167(2) 0.0389(8) Uani 1 1 d . . . . .
H3 H 0.906967 1.072055 0.385998 0.047 Uiso 1 1 calc R U . . .
C4 C 0.8442(2) 1.0367(3) 0.50251(19) 0.0351(7) Uani 1 1 d . . . . .
H4 H 0.885455 1.078181 0.531048 0.042 Uiso 1 1 calc R U . . .
C5 C 0.7704(2) 0.9804(3) 0.54630(18) 0.0337(7) Uani 1 1 d . . . . .
H5 H 0.760556 0.984127 0.605023 0.040 Uiso 1 1 calc R U . . .
C6 C 0.7106(2) 0.9185(2) 0.50541(17) 0.0264(6) Uani 1 1 d . . . . .
H6 H 0.660052 0.880268 0.536224 0.032 Uiso 1 1 calc R U . . .
C7 C 0.6172(2) 0.6696(2) 0.4686(2) 0.0330(7) Uani 1 1 d . . . . .
H7 H 0.686486 0.641780 0.445753 0.040 Uiso 1 1 calc R U . . .
C8 C 0.5693(2) 0.7664(2) 0.43970(15) 0.0187(5) Uani 1 1 d . . . . .
C9 C 0.4665(2) 0.8046(2) 0.47222(16) 0.0229(6) Uani 1 1 d . . . . .
H9 H 0.432526 0.870686 0.452700 0.028 Uiso 1 1 calc R U . . .
C10 C 0.4132(2) 0.7464(2) 0.53314(18) 0.0296(6) Uani 1 1 d . . . . .
H10 H 0.342622 0.772437 0.554502 0.035 Uiso 1 1 calc R U . . .
C11 C 0.4625(3) 0.6513(3) 0.56257(19) 0.0366(7) Uani 1 1 d . . . . .
H11 H 0.426421 0.612130 0.604770 0.044 Uiso 1 1 calc R U . . .
C12 C 0.5646(3) 0.6129(3) 0.5306(2) 0.0439(8) Uani 1 1 d . . . . .
H12 H 0.598840 0.547420 0.551120 0.053 Uiso 1 1 calc R U . . .
C13 C 0.54356(19) 0.9376(2) 0.32042(15) 0.0176(5) Uani 1 1 d . . . . .
C14 C 0.5359(2) 1.0443(2) 0.33664(17) 0.0236(6) Uani 1 1 d . . . . .
H14 H 0.585326 1.067811 0.370745 0.028 Uiso 1 1 calc R U . . .
C15 C 0.4569(2) 1.1160(2) 0.30344(19) 0.0295(6) Uani 1 1 d . . . . .
H15 H 0.452712 1.188381 0.314623 0.035 Uiso 1 1 calc R U . . .
C16 C 0.3840(2) 1.0826(2) 0.25398(18) 0.0305(6) Uani 1 1 d . . . . .
H16 H 0.329794 1.131915 0.231286 0.037 Uiso 1 1 calc R U . . .
C17 C 0.3904(2) 0.9770(2) 0.23778(17) 0.0297(6) Uani 1 1 d . . . . .
H17 H 0.340196 0.953801 0.204252 0.036 Uiso 1 1 calc R U . . .
C18 C 0.4699(2) 0.9051(2) 0.27029(16) 0.0240(6) Uani 1 1 d . . . . .
H18 H 0.474318 0.832918 0.258300 0.029 Uiso 1 1 calc R U . . .
C19 C 0.94909(19) 0.9184(2) 0.18286(15) 0.0181(5) Uani 1 1 d . . . . .
C20 C 0.9408(2) 1.0263(2) 0.16545(16) 0.0223(5) Uani 1 1 d . . . . .
H20 H 0.889157 1.058757 0.129233 0.027 Uiso 1 1 calc R U . . .
C21 C 1.0079(2) 1.0869(2) 0.20102(17) 0.0267(6) Uani 1 1 d . . . . .
H21 H 1.001002 1.160637 0.189668 0.032 Uiso 1 1 calc R U . . .
C22 C 1.0842(2) 1.0403(2) 0.25251(17) 0.0283(6) Uani 1 1 d . . . . .
H22 H 1.130425 1.081707 0.275980 0.034 Uiso 1 1 calc R U . . .
C23 C 1.0934(2) 0.9327(2) 0.27010(17) 0.0282(6) Uani 1 1 d . . . . .
H23 H 1.146173 0.900556 0.305499 0.034 Uiso 1 1 calc R U . . .
C24 C 1.0258(2) 0.8721(2) 0.23608(16) 0.0233(6) Uani 1 1 d . . . . .
H24 H 1.031671 0.798720 0.249017 0.028 Uiso 1 1 calc R U . . .
C25 C 0.9545(2) 0.7604(2) 0.06331(16) 0.0206(5) Uani 1 1 d . . . . .
C26 C 1.0561(2) 0.7868(2) 0.03818(18) 0.0284(6) Uani 1 1 d . . . . .
H26 H 1.082702 0.841963 0.063986 0.034 Uiso 1 1 calc R U . . .
C27 C 1.1189(2) 0.7327(3) -0.0245(2) 0.0370(7) Uani 1 1 d . . . . .
H27 H 1.188794 0.750305 -0.040696 0.044 Uiso 1 1 calc R U . . .
C28 C 1.0810(3) 0.6541(3) -0.0634(2) 0.0415(8) Uani 1 1 d . . . . .
H28 H 1.124028 0.617985 -0.106684 0.050 Uiso 1 1 calc R U . . .
C29 C 0.9801(3) 0.6275(3) -0.0393(2) 0.0510(10) Uani 1 1 d . . . . .
H29 H 0.953216 0.573532 -0.066398 0.061 Uiso 1 1 calc R U . . .
C30 C 0.9178(2) 0.6798(3) 0.0245(2) 0.0410(8) Uani 1 1 d . . . . .
H30 H 0.849100 0.659996 0.041730 0.049 Uiso 1 1 calc R U . . .
C31 C 0.77992(19) 0.92682(19) 0.07578(15) 0.0167(5) Uani 1 1 d . . . . .
C32 C 0.8131(2) 0.9579(2) -0.00473(16) 0.0229(6) Uani 1 1 d . . . . .
H32 H 0.880592 0.927754 -0.029355 0.027 Uiso 1 1 calc R U . . .
C33 C 0.7483(2) 1.0325(2) -0.04922(17) 0.0293(6) Uani 1 1 d . . . . .
H33 H 0.772108 1.054101 -0.103871 0.035 Uiso 1 1 calc R U . . .
C34 C 0.6491(2) 1.0759(2) -0.01438(19) 0.0305(6) Uani 1 1 d . . . . .
H34 H 0.604478 1.126423 -0.045319 0.037 Uiso 1 1 calc R U . . .
C35 C 0.6151(2) 1.0454(2) 0.06536(18) 0.0293(6) Uani 1 1 d . . . . .
H35 H 0.547173 1.075194 0.089476 0.035 Uiso 1 1 calc R U . . .
C36 C 0.6800(2) 0.9713(2) 0.11025(16) 0.0224(5) Uani 1 1 d . . . . .
H36 H 0.656212 0.950623 0.165120 0.027 Uiso 1 1 calc R U . . .
C37 C 0.6456(2) 0.6251(2) 0.07088(16) 0.0201(5) Uani 1 1 d . . . . .
C38 C 0.6259(2) 0.7282(2) 0.03901(17) 0.0233(6) Uani 1 1 d . . . . .
H38 H 0.604264 0.783785 0.075870 0.028 Uiso 1 1 calc R U . . .
C39 C 0.6377(2) 0.7506(2) -0.04587(18) 0.0294(6) Uani 1 1 d . . . . .
H39 H 0.623531 0.821004 -0.066835 0.035 Uiso 1 1 calc R U . . .
C40 C 0.6700(2) 0.6703(3) -0.09989(18) 0.0333(7) Uani 1 1 d . . . . .
H40 H 0.678266 0.685340 -0.158004 0.040 Uiso 1 1 calc R U . . .
C41 C 0.6901(3) 0.5679(3) -0.06895(19) 0.0345(7) Uani 1 1 d . . . . .
H41 H 0.712253 0.512656 -0.106044 0.041 Uiso 1 1 calc R U . . .
C42 C 0.6782(2) 0.5451(2) 0.01602(17) 0.0258(6) Uani 1 1 d . . . . .
H42 H 0.692420 0.474563 0.036648 0.031 Uiso 1 1 calc R U . . .
C43 C 0.6635(2) 0.46587(19) 0.20545(16) 0.0198(5) Uani 1 1 d . . . . .
C44 C 0.5978(2) 0.3975(2) 0.17680(18) 0.0274(6) Uani 1 1 d . . . . .
H44 H 0.538162 0.424540 0.146081 0.033 Uiso 1 1 calc R U . . .
C45 C 0.6198(2) 0.2903(2) 0.19335(19) 0.0322(7) Uani 1 1 d . . . . .
H45 H 0.576032 0.243927 0.173026 0.039 Uiso 1 1 calc R U . . .
C46 C 0.7054(3) 0.2505(2) 0.2393(2) 0.0337(7) Uani 1 1 d . . . . .
H46 H 0.720034 0.176934 0.250495 0.040 Uiso 1 1 calc R U . . .
C47 C 0.7696(2) 0.3176(2) 0.26906(19) 0.0304(6) Uani 1 1 d . . . . .
H47 H 0.827849 0.290127 0.301105 0.037 Uiso 1 1 calc R U . . .
C48 C 0.7489(2) 0.4258(2) 0.25196(16) 0.0227(5) Uani 1 1 d . . . . .
H48 H 0.793249 0.471871 0.272128 0.027 Uiso 1 1 calc R U . . .
C49 C 0.4924(2) 0.63265(19) 0.21239(16) 0.0197(5) Uani 1 1 d . . . . .
C50 C 0.4146(2) 0.6633(2) 0.15613(18) 0.0249(6) Uani 1 1 d . . . . .
H50 H 0.435219 0.670272 0.098486 0.030 Uiso 1 1 calc R U . . .
C51 C 0.3066(2) 0.6838(2) 0.1845(2) 0.0316(7) Uani 1 1 d . . . . .
H51 H 0.253965 0.704942 0.145914 0.038 Uiso 1 1 calc R U . . .
C52 C 0.2753(2) 0.6737(2) 0.2680(2) 0.0314(7) Uani 1 1 d . . . . .
H52 H 0.201409 0.687320 0.286777 0.038 Uiso 1 1 calc R U . . .
C53 C 0.3521(2) 0.6435(2) 0.32431(19) 0.0294(6) Uani 1 1 d . . . . .
H53 H 0.331061 0.636763 0.381889 0.035 Uiso 1 1 calc R U . . .
C54 C 0.4598(2) 0.6231(2) 0.29662(18) 0.0245(6) Uani 1 1 d . . . . .
H54 H 0.512100 0.602383 0.335569 0.029 Uiso 1 1 calc R U . . .
C55 C 0.9191(2) 0.6232(2) 0.41456(19) 0.0302(6) Uani 1 1 d . . . . .
C56 C 0.8727(2) 0.5477(2) 0.46595(19) 0.0307(6) Uani 1 1 d . . . . .
C57 C 0.8621(2) 0.5499(2) 0.5515(2) 0.0328(7) Uani 1 1 d . . . . .
C58 C 0.8980(2) 0.6287(2) 0.5932(2) 0.0336(7) Uani 1 1 d . . . . .
C59 C 0.9473(3) 0.7026(2) 0.5433(2) 0.0369(7) Uani 1 1 d . . . . .
C60 C 0.9581(3) 0.6997(2) 0.4587(2) 0.0352(7) Uani 1 1 d . . . . .
C61 C 0.8785(3) 0.6428(3) 0.6845(2) 0.0396(7) Uani 1 1 d . . . . .
F1 F 0.98558(19) 0.78062(16) 0.57991(13) 0.0547(6) Uani 1 1 d . . . . .
F2 F 1.00842(19) 0.77412(16) 0.41666(13) 0.0532(5) Uani 1 1 d . . . . .
F3 F 0.83318(16) 0.46874(15) 0.43107(12) 0.0449(5) Uani 1 1 d . . . . .
F4 F 0.81413(17) 0.47412(16) 0.59244(13) 0.0491(5) Uani 1 1 d . . . . .
F5 F 0.83637(19) 0.56463(17) 0.72587(13) 0.0549(5) Uani 1 1 d . . . . .
F6 F 0.8117(2) 0.73064(17) 0.70034(14) 0.0622(6) Uani 1 1 d . . . . .
F7 F 0.96955(18) 0.65356(19) 0.72066(13) 0.0575(6) Uani 1 1 d . . . . .
P1 P 0.64601(5) 0.83720(5) 0.35987(4) 0.01651(14) Uani 1 1 d . . . . .
P2 P 0.86249(5) 0.83319(5) 0.14050(4) 0.01616(13) Uani 1 1 d . U . . .
P3 P 0.63762(5) 0.60769(5) 0.18426(4) 0.01758(14) Uani 1 1 d . U . . .
S1 S 0.92826(6) 0.62017(6) 0.30771(5) 0.03094(17) Uani 1 1 d . . . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 P1 2.5342(6) . ?
Ag1 P3 2.5827(7) . ?
Ag1 P2 2.5949(7) . ?
Ag1 S1 2.6101(7) . ?
C1 C6 1.389(4) . ?
C1 C2 1.396(4) . ?
C1 P1 1.824(3) . ?
C2 C3 1.386(4) . ?
C2 H2 0.9500 . ?
C3 C4 1.387(4) . ?
C3 H3 0.9500 . ?
C4 C5 1.382(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.388(4) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
C7 C8 1.385(4) . ?
C7 C12 1.387(4) . ?
C7 H7 0.9500 . ?
C8 C9 1.391(4) . ?
C8 P1 1.829(3) . ?
C9 C10 1.390(4) . ?
C9 H9 0.9500 . ?
C10 C11 1.376(4) . ?
C10 H10 0.9500 . ?
C11 C12 1.382(5) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 C18 1.394(4) . ?
C13 C14 1.398(4) . ?
C13 P1 1.827(3) . ?
C14 C15 1.385(4) . ?
C14 H14 0.9500 . ?
C15 C16 1.386(4) . ?
C15 H15 0.9500 . ?
C16 C17 1.385(4) . ?
C16 H16 0.9500 . ?
C17 C18 1.386(4) . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C20 1.393(4) . ?
C19 C24 1.398(4) . ?
C19 P2 1.834(3) . ?
C20 C21 1.395(4) . ?
C20 H20 0.9500 . ?
C21 C22 1.377(4) . ?
C21 H21 0.9500 . ?
C22 C23 1.390(4) . ?
C22 H22 0.9500 . ?
C23 C24 1.388(4) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
C25 C30 1.385(4) . ?
C25 C26 1.390(4) . ?
C25 P2 1.834(3) . ?
C26 C27 1.389(4) . ?
C26 H26 0.9500 . ?
C27 C28 1.371(5) . ?
C27 H27 0.9500 . ?
C28 C29 1.379(5) . ?
C28 H28 0.9500 . ?
C29 C30 1.388(5) . ?
C29 H29 0.9500 . ?
C30 H30 0.9500 . ?
C31 C32 1.391(4) . ?
C31 C36 1.394(4) . ?
C31 P2 1.827(2) . ?
C32 C33 1.385(4) . ?
C32 H32 0.9500 . ?
C33 C34 1.386(4) . ?
C33 H33 0.9500 . ?
C34 C35 1.380(4) . ?
C34 H34 0.9500 . ?
C35 C36 1.385(4) . ?
C35 H35 0.9500 . ?
C36 H36 0.9500 . ?
C37 C42 1.389(4) . ?
C37 C38 1.397(4) . ?
C37 P3 1.831(3) . ?
C38 C39 1.388(4) . ?
C38 H38 0.9500 . ?
C39 C40 1.383(4) . ?
C39 H39 0.9500 . ?
C40 C41 1.383(4) . ?
C40 H40 0.9500 . ?
C41 C42 1.391(4) . ?
C41 H41 0.9500 . ?
C42 H42 0.9500 . ?
C43 C48 1.389(4) . ?
C43 C44 1.402(4) . ?
C43 P3 1.829(3) . ?
C44 C45 1.385(4) . ?
C44 H44 0.9500 . ?
C45 C46 1.384(5) . ?
C45 H45 0.9500 . ?
C46 C47 1.384(5) . ?
C46 H46 0.9500 . ?
C47 C48 1.399(4) . ?
C47 H47 0.9500 . ?
C48 H48 0.9500 . ?
C49 C50 1.394(4) . ?
C49 C54 1.394(4) . ?
C49 P3 1.837(3) . ?
C50 C51 1.393(4) . ?
C50 H50 0.9500 . ?
C51 C52 1.381(4) . ?
C51 H51 0.9500 . ?
C52 C53 1.385(4) . ?
C52 H52 0.9500 . ?
C53 C54 1.387(4) . ?
C53 H53 0.9500 . ?
C54 H54 0.9500 . ?
C55 C56 1.402(4) . ?
C55 C60 1.404(4) . ?
C55 S1 1.723(3) . ?
C56 F3 1.353(3) . ?
C56 C57 1.380(4) . ?
C57 F4 1.335(3) . ?
C57 C58 1.385(4) . ?
C58 C59 1.393(5) . ?
C58 C61 1.492(5) . ?
C59 F1 1.349(4) . ?
C59 C60 1.364(5) . ?
C60 F2 1.344(4) . ?
C61 F5 1.325(4) . ?
C61 F6 1.337(4) . ?
C61 F7 1.353(4) . ?

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
P1 Ag1 P3 110.66(2) . . ?
P1 Ag1 P2 113.63(2) . . ?
P3 Ag1 P2 112.65(2) . . ?
P1 Ag1 S1 112.08(2) . . ?
P3 Ag1 S1 112.86(2) . . ?
P2 Ag1 S1 94.09(2) . . ?
C6 C1 C2 118.7(2) . . ?
C6 C1 P1 123.4(2) . . ?
C2 C1 P1 117.8(2) . . ?
C3 C2 C1 121.0(3) . . ?
C3 C2 H2 119.5 . . ?
C1 C2 H2 119.5 . . ?
C2 C3 C4 119.7(3) . . ?
C2 C3 H3 120.1 . . ?
C4 C3 H3 120.1 . . ?
C5 C4 C3 119.6(3) . . ?
C5 C4 H4 120.2 . . ?
C3 C4 H4 120.2 . . ?
C4 C5 C6 120.7(3) . . ?
C4 C5 H5 119.6 . . ?
C6 C5 H5 119.6 . . ?
C5 C6 C1 120.2(3) . . ?
C5 C6 H6 119.9 . . ?
C1 C6 H6 119.9 . . ?
C8 C7 C12 120.4(3) . . ?
C8 C7 H7 119.8 . . ?
C12 C7 H7 119.8 . . ?
C7 C8 C9 119.0(2) . . ?
C7 C8 P1 117.4(2) . . ?
C9 C8 P1 123.6(2) . . ?
C10 C9 C8 120.3(3) . . ?
C10 C9 H9 119.8 . . ?
C8 C9 H9 119.8 . . ?
C11 C10 C9 120.2(3) . . ?
C11 C10 H10 119.9 . . ?
C9 C10 H10 119.9 . . ?
C10 C11 C12 119.8(3) . . ?
C10 C11 H11 120.1 . . ?
C12 C11 H11 120.1 . . ?
C11 C12 C7 120.2(3) . . ?
C11 C12 H12 119.9 . . ?
C7 C12 H12 119.9 . . ?
C18 C13 C14 118.6(2) . . ?
C18 C13 P1 117.48(19) . . ?
C14 C13 P1 123.9(2) . . ?
C15 C14 C13 120.6(3) . . ?
C15 C14 H14 119.7 . . ?
C13 C14 H14 119.7 . . ?
C14 C15 C16 120.3(3) . . ?
C14 C15 H15 119.9 . . ?
C16 C15 H15 119.9 . . ?
C17 C16 C15 119.7(3) . . ?
C17 C16 H16 120.2 . . ?
C15 C16 H16 120.2 . . ?
C16 C17 C18 120.3(3) . . ?
C16 C17 H17 119.9 . . ?
C18 C17 H17 119.9 . . ?
C17 C18 C13 120.6(3) . . ?
C17 C18 H18 119.7 . . ?
C13 C18 H18 119.7 . . ?
C20 C19 C24 119.0(2) . . ?
C20 C19 P2 123.19(19) . . ?
C24 C19 P2 117.78(19) . . ?
C19 C20 C21 120.3(2) . . ?
C19 C20 H20 119.9 . . ?
C21 C20 H20 119.9 . . ?
C22 C21 C20 120.3(3) . . ?
C22 C21 H21 119.9 . . ?
C20 C21 H21 119.9 . . ?
C21 C22 C23 119.9(3) . . ?
C21 C22 H22 120.0 . . ?
C23 C22 H22 120.0 . . ?
C24 C23 C22 120.2(3) . . ?
C24 C23 H23 119.9 . . ?
C22 C23 H23 119.9 . . ?
C23 C24 C19 120.3(3) . . ?
C23 C24 H24 119.8 . . ?
C19 C24 H24 119.8 . . ?
C30 C25 C26 118.6(3) . . ?
C30 C25 P2 118.1(2) . . ?
C26 C25 P2 123.2(2) . . ?
C27 C26 C25 120.2(3) . . ?
C27 C26 H26 119.9 . . ?
C25 C26 H26 119.9 . . ?
C28 C27 C26 120.6(3) . . ?
C28 C27 H27 119.7 . . ?
C26 C27 H27 119.7 . . ?
C27 C28 C29 119.8(3) . . ?
C27 C28 H28 120.1 . . ?
C29 C28 H28 120.1 . . ?
C28 C29 C30 119.9(3) . . ?
C28 C29 H29 120.0 . . ?
C30 C29 H29 120.0 . . ?
C25 C30 C29 120.9(3) . . ?
C25 C30 H30 119.6 . . ?
C29 C30 H30 119.6 . . ?
C32 C31 C36 118.7(2) . . ?
C32 C31 P2 123.32(19) . . ?
C36 C31 P2 117.90(19) . . ?
C33 C32 C31 120.4(3) . . ?
C33 C32 H32 119.8 . . ?
C31 C32 H32 119.8 . . ?
C32 C33 C34 120.3(3) . . ?
C32 C33 H33 119.8 . . ?
C34 C33 H33 119.8 . . ?
C35 C34 C33 119.8(3) . . ?
C35 C34 H34 120.1 . . ?
C33 C34 H34 120.1 . . ?
C34 C35 C36 120.0(3) . . ?
C34 C35 H35 120.0 . . ?
C36 C35 H35 120.0 . . ?
C35 C36 C31 120.7(2) . . ?
C35 C36 H36 119.6 . . ?
C31 C36 H36 119.6 . . ?
C42 C37 C38 118.7(2) . . ?
C42 C37 P3 124.7(2) . . ?
C38 C37 P3 116.3(2) . . ?
C39 C38 C37 120.8(3) . . ?
C39 C38 H38 119.6 . . ?
C37 C38 H38 119.6 . . ?
C40 C39 C38 120.0(3) . . ?
C40 C39 H39 120.0 . . ?
C38 C39 H39 120.0 . . ?
C39 C40 C41 119.7(3) . . ?
C39 C40 H40 120.1 . . ?
C41 C40 H40 120.1 . . ?
C40 C41 C42 120.5(3) . . ?
C40 C41 H41 119.7 . . ?
C42 C41 H41 119.7 . . ?
C37 C42 C41 120.3(3) . . ?
C37 C42 H42 119.8 . . ?
C41 C42 H42 119.8 . . ?
C48 C43 C44 119.7(2) . . ?
C48 C43 P3 119.1(2) . . ?
C44 C43 P3 121.2(2) . . ?
C45 C44 C43 119.9(3) . . ?
C45 C44 H44 120.1 . . ?
C43 C44 H44 120.1 . . ?
C46 C45 C44 120.4(3) . . ?
C46 C45 H45 119.8 . . ?
C44 C45 H45 119.8 . . ?
C45 C46 C47 120.1(3) . . ?
C45 C46 H46 119.9 . . ?
C47 C46 H46 119.9 . . ?
C46 C47 C48 120.0(3) . . ?
C46 C47 H47 120.0 . . ?
C48 C47 H47 120.0 . . ?
C43 C48 C47 119.9(3) . . ?
C43 C48 H48 120.1 . . ?
C47 C48 H48 120.1 . . ?
C50 C49 C54 118.8(2) . . ?
C50 C49 P3 124.6(2) . . ?
C54 C49 P3 116.6(2) . . ?
C51 C50 C49 120.0(3) . . ?
C51 C50 H50 120.0 . . ?
C49 C50 H50 120.0 . . ?
C52 C51 C50 120.8(3) . . ?
C52 C51 H51 119.6 . . ?
C50 C51 H51 119.6 . . ?
C51 C52 C53 119.6(3) . . ?
C51 C52 H52 120.2 . . ?
C53 C52 H52 120.2 . . ?
C52 C53 C54 120.0(3) . . ?
C52 C53 H53 120.0 . . ?
C54 C53 H53 120.0 . . ?
C53 C54 C49 120.9(3) . . ?
C53 C54 H54 119.6 . . ?
C49 C54 H54 119.6 . . ?
C56 C55 C60 113.4(3) . . ?
C56 C55 S1 122.8(2) . . ?
C60 C55 S1 123.8(2) . . ?
F3 C56 C57 116.9(3) . . ?
F3 C56 C55 119.3(3) . . ?
C57 C56 C55 123.8(3) . . ?
F4 C57 C56 117.3(3) . . ?
F4 C57 C58 121.3(3) . . ?
C56 C57 C58 121.4(3) . . ?
C57 C58 C59 115.6(3) . . ?
C57 C58 C61 124.3(3) . . ?
C59 C58 C61 120.0(3) . . ?
F1 C59 C60 118.5(3) . . ?
F1 C59 C58 118.7(3) . . ?
C60 C59 C58 122.8(3) . . ?
F2 C60 C59 117.8(3) . . ?
F2 C60 C55 119.2(3) . . ?
C59 C60 C55 122.9(3) . . ?
F5 C61 F6 106.9(3) . . ?
F5 C61 F7 106.4(3) . . ?
F6 C61 F7 105.4(3) . . ?
F5 C61 C58 114.3(3) . . ?
F6 C61 C58 110.9(3) . . ?
F7 C61 C58 112.3(3) . . ?
C1 P1 C13 103.09(12) . . ?
C1 P1 C8 103.58(11) . . ?
C13 P1 C8 102.71(11) . . ?
C1 P1 Ag1 114.53(8) . . ?
C13 P1 Ag1 115.22(8) . . ?
C8 P1 Ag1 115.99(8) . . ?
C31 P2 C19 101.52(11) . . ?
C31 P2 C25 102.52(11) . . ?
C19 P2 C25 102.48(11) . . ?
C31 P2 Ag1 115.10(8) . . ?
C19 P2 Ag1 115.16(8) . . ?
C25 P2 Ag1 117.82(9) . . ?
C43 P3 C37 105.51(12) . . ?
C43 P3 C49 100.97(11) . . ?
C37 P3 C49 102.85(12) . . ?
C43 P3 Ag1 117.92(9) . . ?
C37 P3 Ag1 111.55(8) . . ?
C49 P3 Ag1 116.32(8) . . ?
C55 S1 Ag1 109.58(10) . . ?

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
C6 C1 C2 C3 -0.7(5) . . . . ?
P1 C1 C2 C3 176.9(3) . . . . ?
C1 C2 C3 C4 1.6(5) . . . . ?
C2 C3 C4 C5 -1.6(5) . . . . ?
C3 C4 C5 C6 0.8(5) . . . . ?
C4 C5 C6 C1 0.1(5) . . . . ?
C2 C1 C6 C5 -0.1(4) . . . . ?
P1 C1 C6 C5 -177.6(2) . . . . ?
C12 C7 C8 C9 -1.8(5) . . . . ?
C12 C7 C8 P1 178.4(3) . . . . ?
C7 C8 C9 C10 0.4(4) . . . . ?
P1 C8 C9 C10 -179.7(2) . . . . ?
C8 C9 C10 C11 0.9(4) . . . . ?
C9 C10 C11 C12 -0.9(5) . . . . ?
C10 C11 C12 C7 -0.4(5) . . . . ?
C8 C7 C12 C11 1.8(5) . . . . ?
C18 C13 C14 C15 -0.1(4) . . . . ?
P1 C13 C14 C15 179.0(2) . . . . ?
C13 C14 C15 C16 0.4(4) . . . . ?
C14 C15 C16 C17 -0.1(4) . . . . ?
C15 C16 C17 C18 -0.5(4) . . . . ?
C16 C17 C18 C13 0.8(4) . . . . ?
C14 C13 C18 C17 -0.5(4) . . . . ?
P1 C13 C18 C17 -179.6(2) . . . . ?
C24 C19 C20 C21 -0.2(4) . . . . ?
P2 C19 C20 C21 178.8(2) . . . . ?
C19 C20 C21 C22 1.1(4) . . . . ?
C20 C21 C22 C23 -0.9(4) . . . . ?
C21 C22 C23 C24 -0.2(4) . . . . ?
C22 C23 C24 C19 1.0(4) . . . . ?
C20 C19 C24 C23 -0.8(4) . . . . ?
P2 C19 C24 C23 -179.9(2) . . . . ?
C30 C25 C26 C27 -0.1(4) . . . . ?
P2 C25 C26 C27 -175.7(2) . . . . ?
C25 C26 C27 C28 1.1(5) . . . . ?
C26 C27 C28 C29 -0.8(5) . . . . ?
C27 C28 C29 C30 -0.6(6) . . . . ?
C26 C25 C30 C29 -1.2(5) . . . . ?
P2 C25 C30 C29 174.6(3) . . . . ?
C28 C29 C30 C25 1.6(6) . . . . ?
C36 C31 C32 C33 0.7(4) . . . . ?
P2 C31 C32 C33 -177.3(2) . . . . ?
C31 C32 C33 C34 -1.0(4) . . . . ?
C32 C33 C34 C35 0.7(4) . . . . ?
C33 C34 C35 C36 -0.3(4) . . . . ?
C34 C35 C36 C31 0.0(4) . . . . ?
C32 C31 C36 C35 -0.2(4) . . . . ?
P2 C31 C36 C35 177.9(2) . . . . ?
C42 C37 C38 C39 0.6(4) . . . . ?
P3 C37 C38 C39 175.3(2) . . . . ?
C37 C38 C39 C40 -0.5(4) . . . . ?
C38 C39 C40 C41 0.2(4) . . . . ?
C39 C40 C41 C42 0.0(5) . . . . ?
C38 C37 C42 C41 -0.4(4) . . . . ?
P3 C37 C42 C41 -174.6(2) . . . . ?
C40 C41 C42 C37 0.2(4) . . . . ?
C48 C43 C44 C45 -1.5(4) . . . . ?
P3 C43 C44 C45 179.6(2) . . . . ?
C43 C44 C45 C46 1.2(4) . . . . ?
C44 C45 C46 C47 -0.1(5) . . . . ?
C45 C46 C47 C48 -0.7(4) . . . . ?
C44 C43 C48 C47 0.8(4) . . . . ?
P3 C43 C48 C47 179.7(2) . . . . ?
C46 C47 C48 C43 0.3(4) . . . . ?
C54 C49 C50 C51 0.0(4) . . . . ?
P3 C49 C50 C51 -177.8(2) . . . . ?
C49 C50 C51 C52 -0.3(4) . . . . ?
C50 C51 C52 C53 0.4(4) . . . . ?
C51 C52 C53 C54 -0.3(4) . . . . ?
C52 C53 C54 C49 0.1(4) . . . . ?
C50 C49 C54 C53 0.1(4) . . . . ?
P3 C49 C54 C53 178.0(2) . . . . ?
C60 C55 C56 F3 -179.2(3) . . . . ?
S1 C55 C56 F3 0.0(4) . . . . ?
C60 C55 C56 C57 2.5(4) . . . . ?
S1 C55 C56 C57 -178.3(2) . . . . ?
F3 C56 C57 F4 0.2(4) . . . . ?
C55 C56 C57 F4 178.6(3) . . . . ?
F3 C56 C57 C58 -178.7(3) . . . . ?
C55 C56 C57 C58 -0.4(5) . . . . ?
F4 C57 C58 C59 179.6(3) . . . . ?
C56 C57 C58 C59 -1.5(4) . . . . ?
F4 C57 C58 C61 -6.0(5) . . . . ?
C56 C57 C58 C61 173.0(3) . . . . ?
C57 C58 C59 F1 -179.1(3) . . . . ?
C61 C58 C59 F1 6.2(5) . . . . ?
C57 C58 C59 C60 1.2(5) . . . . ?
C61 C58 C59 C60 -173.5(3) . . . . ?
F1 C59 C60 F2 1.3(5) . . . . ?
C58 C59 C60 F2 -179.1(3) . . . . ?
F1 C59 C60 C55 -178.6(3) . . . . ?
C58 C59 C60 C55 1.0(5) . . . . ?
C56 C55 C60 F2 177.3(3) . . . . ?
S1 C55 C60 F2 -1.9(4) . . . . ?
C56 C55 C60 C59 -2.8(4) . . . . ?
S1 C55 C60 C59 178.0(3) . . . . ?
C57 C58 C61 F5 9.1(5) . . . . ?
C59 C58 C61 F5 -176.6(3) . . . . ?
C57 C58 C61 F6 -111.8(3) . . . . ?
C59 C58 C61 F6 62.4(4) . . . . ?
C57 C58 C61 F7 130.5(3) . . . . ?
C59 C58 C61 F7 -55.3(4) . . . . ?
C6 C1 P1 C13 99.3(2) . . . . ?
C2 C1 P1 C13 -78.2(2) . . . . ?
C6 C1 P1 C8 -7.5(3) . . . . ?
C2 C1 P1 C8 175.0(2) . . . . ?
C6 C1 P1 Ag1 -134.8(2) . . . . ?
C2 C1 P1 Ag1 47.7(2) . . . . ?
C18 C13 P1 C1 179.2(2) . . . . ?
C14 C13 P1 C1 0.1(2) . . . . ?
C18 C13 P1 C8 -73.4(2) . . . . ?
C14 C13 P1 C8 107.5(2) . . . . ?
C18 C13 P1 Ag1 53.7(2) . . . . ?
C14 C13 P1 Ag1 -125.4(2) . . . . ?
C7 C8 P1 C1 -88.0(2) . . . . ?
C9 C8 P1 C1 92.1(2) . . . . ?
C7 C8 P1 C13 165.0(2) . . . . ?
C9 C8 P1 C13 -14.9(2) . . . . ?
C7 C8 P1 Ag1 38.4(2) . . . . ?
C9 C8 P1 Ag1 -141.5(2) . . . . ?
C32 C31 P2 C19 83.0(2) . . . . ?
C36 C31 P2 C19 -95.0(2) . . . . ?
C32 C31 P2 C25 -22.7(2) . . . . ?
C36 C31 P2 C25 159.2(2) . . . . ?
C32 C31 P2 Ag1 -151.91(19) . . . . ?
C36 C31 P2 Ag1 30.1(2) . . . . ?
C20 C19 P2 C31 1.6(2) . . . . ?
C24 C19 P2 C31 -179.3(2) . . . . ?
C20 C19 P2 C25 107.4(2) . . . . ?
C24 C19 P2 C25 -73.5(2) . . . . ?
C20 C19 P2 Ag1 -123.4(2) . . . . ?
C24 C19 P2 Ag1 55.7(2) . . . . ?
C30 C25 P2 C31 -81.5(3) . . . . ?
C26 C25 P2 C31 94.1(2) . . . . ?
C30 C25 P2 C19 173.5(2) . . . . ?
C26 C25 P2 C19 -10.8(3) . . . . ?
C30 C25 P2 Ag1 46.0(3) . . . . ?
C26 C25 P2 Ag1 -138.4(2) . . . . ?
C48 C43 P3 C37 121.7(2) . . . . ?
C44 C43 P3 C37 -59.3(2) . . . . ?
C48 C43 P3 C49 -131.5(2) . . . . ?
C44 C43 P3 C49 47.4(2) . . . . ?
C48 C43 P3 Ag1 -3.6(2) . . . . ?
C44 C43 P3 Ag1 175.31(19) . . . . ?
C42 C37 P3 C43 -7.1(3) . . . . ?
C38 C37 P3 C43 178.56(19) . . . . ?
C42 C37 P3 C49 -112.5(2) . . . . ?
C38 C37 P3 C49 73.1(2) . . . . ?
C42 C37 P3 Ag1 122.1(2) . . . . ?
C38 C37 P3 Ag1 -52.2(2) . . . . ?
C50 C49 P3 C43 -112.3(2) . . . . ?
C54 C49 P3 C43 69.9(2) . . . . ?
C50 C49 P3 C37 -3.4(2) . . . . ?
C54 C49 P3 C37 178.8(2) . . . . ?
C50 C49 P3 Ag1 118.8(2) . . . . ?
C54 C49 P3 Ag1 -59.0(2) . . . . ?
C56 C55 S1 Ag1 89.7(2) . . . . ?
C60 C55 S1 Ag1 -91.2(3) . . . . ?

_refine_diff_density_max         1.988
_refine_diff_density_min         -0.893
_refine_diff_density_rms         0.070

# start Validation Reply Form
_vrf_PLAT232_shelx               
;
PROBLEM: Hirshfeld Test Diff (M-X)  Ag1      --P2       .       11.0 s.u.  
RESPONSE: The alert is expected in the bonds involving a heavy atom and light
atom.
;
_vrf_PLAT910_shelx               
;
PROBLEM: Missing # of FCF Reflection(s) Below Theta(Min).         16 Note  
RESPONSE: The intensity of these reflections are affected by the beamstop
in Bruker D8 VENTURE SC-XRD
;
# end Validation Reply Form


####################################################################### 
# 
# 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_shelx_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 2497805'
loop_
_audit_author_name
_audit_author_address
'Sudhadevi Antharjanam'
;Sophisticated Analytical Instruments Facility (SAIF),IITM
India
;
_audit_update_record             
;
2025-10-24 deposited with the CCDC.	2026-02-20 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2019/3
_shelx_SHELXL_version_number     2019/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C150 H90 Ag6 F42 P6 S6'

_chemical_formula_sum            'C150 H90 Ag6 F42 P6 S6'
_chemical_formula_weight         3715.61

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'
S S 0.1246 0.1234 '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'
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'

_space_group_crystal_system      trigonal
_space_group_IT_number           148
_space_group_name_H-M_alt        'R -3 :H'
_space_group_name_Hall           '-R 3'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'

_cell_length_a                   29.0591(12)
_cell_length_b                   29.0591(12)
_cell_length_c                   14.8748(9)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     10877.9(11)
_cell_formula_units_Z            3
_cell_measurement_temperature    298(2)

_cell_measurement_reflns_used    9892
_cell_measurement_theta_min      2.80
_cell_measurement_theta_max      26.53
_exptl_crystal_description       BLOCK
_exptl_crystal_colour            colourless



_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.702
_exptl_crystal_F_000             5508
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.123
_exptl_crystal_size_mid          0.095
_exptl_crystal_size_min          0.082
_exptl_absorpt_coefficient_mu    1.052
_shelx_estimated_absorpt_T_min   0.881
_shelx_estimated_absorpt_T_max   0.919
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6647
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_process_details   'SADABS (BRUKER, 2016)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a

_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_measurement_device_type  
'Bruker D8 VENTURE diffractometer with PHOTON II detector'
_diffrn_measurement_method       'ω and φ scan'



_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            38105
_diffrn_reflns_av_unetI/netI     0.0645
_diffrn_reflns_av_R_equivalents  0.1031
_diffrn_reflns_limit_h_min       -34
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         2.542
_diffrn_reflns_theta_max         24.987
_diffrn_reflns_theta_full        24.987
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             4248
_reflns_number_gt                3244
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX4 (Bruker, v2021.4-0)'
_computing_cell_refinement       'APEX4 V8.40B (Bruker, 2021)'
_computing_data_reduction        'SAINT/XPREP (Bruker, 2021)'
_computing_structure_solution    'SHELXT-2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2019/3 (Sheldrick, 2019)'
_computing_molecular_graphics    ?
_computing_publication_material  'SHELXL-2019/3 (Sheldrick, 2019)'


_refine_special_details          
;
 TRIFLOUROMETHYL group is disordered over two positions with
 an occupancy ratio of 55:45. Positions of disordered atoms
 were located from difference electron density peaks.
 Distance restraint SADI was used for C-F distances. 
 Anisotropic displacement parameters of atoms in the 
 disordered groups were restrained to be equal using SIMU
 restraint. Also Uij components of disordered atoms including the
 carbon atom C25, were approximated to isotropic behavior using ISOR
 restraint.

;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0635P)²+373.8723P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4248
_refine_ls_number_parameters     344
_refine_ls_number_restraints     129
_refine_ls_R_factor_all          0.1280
_refine_ls_R_factor_gt           0.0979
_refine_ls_wR_factor_ref         0.2079
_refine_ls_wR_factor_gt          0.1899
_refine_ls_goodness_of_fit_ref   1.146
_refine_ls_restrained_S_all      1.132
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.001

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 0.31532(3) 0.56312(3) 0.25860(6) 0.0396(3) Uani 1 1 d . . . . .
S1 S 0.24142(9) 0.58955(9) 0.25537(17) 0.0296(6) Uani 1 1 d . . . . .
P1 P 0.31019(10) 0.49491(10) 0.35912(18) 0.0285(6) Uani 1 1 d . . . . .
C1 C 0.3354(4) 0.4531(4) 0.3126(8) 0.039(3) Uani 1 1 d . . . . .
C2 C 0.3180(5) 0.4019(4) 0.3405(8) 0.048(3) Uani 1 1 d . . . . .
H2 H 0.290352 0.386238 0.381944 0.058 Uiso 1 1 calc R U . . .
C3 C 0.3407(6) 0.3731(6) 0.3083(11) 0.072(4) Uani 1 1 d . . . . .
H3 H 0.328641 0.338318 0.326911 0.087 Uiso 1 1 calc R U . . .
C4 C 0.3815(6) 0.3974(7) 0.2481(11) 0.074(4) Uani 1 1 d . . . . .
H4 H 0.397539 0.378793 0.226525 0.089 Uiso 1 1 calc R U . . .
C5 C 0.3995(7) 0.4477(8) 0.2188(10) 0.082(5) Uani 1 1 d . . . . .
H5 H 0.427727 0.463267 0.178469 0.099 Uiso 1 1 calc R U . . .
C6 C 0.3758(5) 0.4753(5) 0.2490(9) 0.059(3) Uani 1 1 d . . . . .
H6 H 0.386765 0.509147 0.226760 0.071 Uiso 1 1 calc R U . . .
C7 C 0.3484(4) 0.5223(4) 0.4625(7) 0.034(2) Uani 1 1 d . . . . .
C8 C 0.3733(5) 0.4992(5) 0.5083(9) 0.063(4) Uani 1 1 d . . . . .
H8 H 0.372997 0.469211 0.485487 0.076 Uiso 1 1 calc R U . . .
C9 C 0.3989(7) 0.5217(8) 0.5891(12) 0.098(6) Uani 1 1 d . . . . .
H9 H 0.417488 0.507864 0.618529 0.118 Uiso 1 1 calc R U . . .
C10 C 0.3971(7) 0.5627(7) 0.6251(10) 0.079(5) Uani 1 1 d . . . . .
H10 H 0.412371 0.575003 0.681354 0.094 Uiso 1 1 calc R U . . .
C11 C 0.3742(5) 0.5870(6) 0.5832(9) 0.062(4) Uani 1 1 d . . . . .
H11 H 0.375240 0.616854 0.607946 0.074 Uiso 1 1 calc R U . . .
C12 C 0.3488(5) 0.5662(5) 0.5017(9) 0.056(3) Uani 1 1 d . . . . .
H12 H 0.331758 0.581873 0.472685 0.067 Uiso 1 1 calc R U . . .
C13 C 0.2432(4) 0.4459(4) 0.3990(7) 0.028(2) Uani 1 1 d . . . . .
C14 C 0.2320(4) 0.4255(4) 0.4839(8) 0.046(3) Uani 1 1 d . . . . .
H14 H 0.259101 0.437381 0.526283 0.055 Uiso 1 1 calc R U . . .
C15 C 0.1806(5) 0.3873(5) 0.5082(9) 0.058(4) Uani 1 1 d . . . . .
H15 H 0.173820 0.373481 0.566213 0.069 Uiso 1 1 calc R U . . .
C16 C 0.1411(5) 0.3704(6) 0.4493(11) 0.067(4) Uani 1 1 d . . . . .
H16 H 0.107011 0.344595 0.466353 0.080 Uiso 1 1 calc R U . . .
C17 C 0.1500(5) 0.3907(6) 0.3620(11) 0.068(4) Uani 1 1 d . . . . .
H17 H 0.122216 0.379423 0.321217 0.082 Uiso 1 1 calc R U . . .
C18 C 0.2015(4) 0.4281(5) 0.3378(9) 0.053(3) Uani 1 1 d . . . . .
H18 H 0.208342 0.441646 0.279647 0.063 Uiso 1 1 calc R U . . .
C19 C 0.1868(4) 0.5466(4) 0.3221(7) 0.034(2) Uani 1 1 d . . . . .
C20 C 0.1912(4) 0.5353(4) 0.4107(8) 0.038(3) Uani 1 1 d . . . . .
C21 C 0.1482(5) 0.5029(5) 0.4645(7) 0.047(3) Uani 1 1 d . . . . .
C22 C 0.0978(5) 0.4793(5) 0.4325(9) 0.049(3) Uani 1 1 d . . . . .
C23 C 0.0923(4) 0.4879(5) 0.3433(10) 0.054(3) Uani 1 1 d . . . . .
C24 C 0.1335(4) 0.5199(4) 0.2898(8) 0.036(3) Uani 1 1 d . . . . .
F1 F 0.2397(2) 0.5578(3) 0.4479(4) 0.0505(17) Uani 1 1 d . . . . .
F2 F 0.1585(3) 0.4959(3) 0.5494(5) 0.074(2) Uani 1 1 d . . . . .
F3 F 0.0430(3) 0.4645(4) 0.3061(7) 0.101(3) Uani 1 1 d . . . . .
F4 F 0.1242(3) 0.5260(3) 0.2035(5) 0.064(2) Uani 1 1 d . . . . .
C25 C 0.0515(5) 0.4456(6) 0.4921(11) 0.087(5) Uani 1 1 d D U . . .
F5 F 0.0450(15) 0.4703(11) 0.559(2) 0.132(13) Uani 0.55(3) 1 d D U P A 1
F6 F 0.0552(10) 0.4056(10) 0.526(2) 0.118(10) Uani 0.55(3) 1 d D U P A 1
F7 F 0.0060(7) 0.4185(13) 0.449(2) 0.127(12) Uani 0.55(3) 1 d D U P A 1
F5' F 0.0223(19) 0.3975(11) 0.464(3) 0.147(17) Uani 0.45(3) 1 d D U P A 2
F6' F 0.0188(12) 0.4645(14) 0.491(3) 0.123(12) Uani 0.45(3) 1 d D U P A 2
F7' F 0.0628(15) 0.450(2) 0.5781(14) 0.143(17) Uani 0.45(3) 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
Ag1 P1 2.427(3) . ?
Ag1 S1 2.618(2) . ?
Ag1 S1 2.677(2) 2_665 ?
Ag1 S1 2.704(3) 15 ?
S1 C19 1.755(11) . ?
P1 C7 1.829(11) . ?
P1 C1 1.839(11) . ?
P1 C13 1.844(10) . ?
C1 C2 1.376(15) . ?
C1 C6 1.389(16) . ?
C2 C3 1.387(17) . ?
C2 H2 0.9300 . ?
C3 C4 1.37(2) . ?
C3 H3 0.9300 . ?
C4 C5 1.35(2) . ?
C4 H4 0.9300 . ?
C5 C6 1.370(19) . ?
C5 H5 0.9300 . ?
C6 H6 0.9300 . ?
C7 C8 1.388(17) . ?
C7 C12 1.398(16) . ?
C8 C9 1.39(2) . ?
C8 H8 0.9300 . ?
C9 C10 1.33(2) . ?
C9 H9 0.9300 . ?
C10 C11 1.34(2) . ?
C10 H10 0.9300 . ?
C11 C12 1.390(17) . ?
C11 H11 0.9300 . ?
C12 H12 0.9300 . ?
C13 C14 1.364(15) . ?
C13 C18 1.390(15) . ?
C14 C15 1.392(16) . ?
C14 H14 0.9300 . ?
C15 C16 1.328(19) . ?
C15 H15 0.9300 . ?
C16 C17 1.39(2) . ?
C16 H16 0.9300 . ?
C17 C18 1.388(16) . ?
C17 H17 0.9300 . ?
C18 H18 0.9300 . ?
C19 C20 1.380(15) . ?
C19 C24 1.426(14) . ?
C20 F1 1.342(12) . ?
C20 C21 1.381(16) . ?
C21 F2 1.336(13) . ?
C21 C22 1.356(17) . ?
C22 C23 1.374(18) . ?
C22 C25 1.497(18) . ?
C23 C24 1.349(16) . ?
C23 F3 1.359(13) . ?
C24 F4 1.341(13) . ?
C25 F5' 1.290(16) . ?
C25 F5 1.299(15) . ?
C25 F7' 1.310(16) . ?
C25 F6' 1.314(16) . ?
C25 F7 1.315(15) . ?
C25 F6 1.318(15) . ?

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
P1 Ag1 S1 121.77(9) . . ?
P1 Ag1 S1 114.20(8) . 2_665 ?
S1 Ag1 S1 108.70(10) . 2_665 ?
P1 Ag1 S1 134.30(9) . 15 ?
S1 Ag1 S1 85.83(8) . 15 ?
S1 Ag1 S1 84.68(8) 2_665 15 ?
C19 S1 Ag1 111.3(3) . . ?
C19 S1 Ag1 107.2(3) . 3_565 ?
Ag1 S1 Ag1 131.23(10) . 3_565 ?
C19 S1 Ag1 118.0(4) . 14_455 ?
Ag1 S1 Ag1 94.33(8) . 14_455 ?
Ag1 S1 Ag1 92.99(8) 3_565 14_455 ?
C7 P1 C1 104.4(5) . . ?
C7 P1 C13 104.0(4) . . ?
C1 P1 C13 103.1(5) . . ?
C7 P1 Ag1 112.8(3) . . ?
C1 P1 Ag1 115.2(4) . . ?
C13 P1 Ag1 116.1(3) . . ?
C2 C1 C6 118.4(11) . . ?
C2 C1 P1 123.3(9) . . ?
C6 C1 P1 118.2(9) . . ?
C1 C2 C3 121.3(12) . . ?
C1 C2 H2 119.3 . . ?
C3 C2 H2 119.3 . . ?
C4 C3 C2 117.8(14) . . ?
C4 C3 H3 121.1 . . ?
C2 C3 H3 121.1 . . ?
C5 C4 C3 122.5(13) . . ?
C5 C4 H4 118.7 . . ?
C3 C4 H4 118.7 . . ?
C4 C5 C6 119.3(14) . . ?
C4 C5 H5 120.3 . . ?
C6 C5 H5 120.3 . . ?
C5 C6 C1 120.5(13) . . ?
C5 C6 H6 119.7 . . ?
C1 C6 H6 119.7 . . ?
C8 C7 C12 117.9(11) . . ?
C8 C7 P1 123.6(9) . . ?
C12 C7 P1 118.3(9) . . ?
C7 C8 C9 118.7(15) . . ?
C7 C8 H8 120.6 . . ?
C9 C8 H8 120.6 . . ?
C10 C9 C8 121.3(16) . . ?
C10 C9 H9 119.3 . . ?
C8 C9 H9 119.3 . . ?
C9 C10 C11 122.3(15) . . ?
C9 C10 H10 118.8 . . ?
C11 C10 H10 118.8 . . ?
C10 C11 C12 118.2(14) . . ?
C10 C11 H11 120.9 . . ?
C12 C11 H11 120.9 . . ?
C11 C12 C7 121.4(13) . . ?
C11 C12 H12 119.3 . . ?
C7 C12 H12 119.3 . . ?
C14 C13 C18 118.1(10) . . ?
C14 C13 P1 124.3(8) . . ?
C18 C13 P1 117.6(8) . . ?
C13 C14 C15 121.0(12) . . ?
C13 C14 H14 119.5 . . ?
C15 C14 H14 119.5 . . ?
C16 C15 C14 120.5(13) . . ?
C16 C15 H15 119.7 . . ?
C14 C15 H15 119.7 . . ?
C15 C16 C17 120.9(12) . . ?
C15 C16 H16 119.5 . . ?
C17 C16 H16 119.5 . . ?
C18 C17 C16 118.2(13) . . ?
C18 C17 H17 120.9 . . ?
C16 C17 H17 120.9 . . ?
C17 C18 C13 121.2(12) . . ?
C17 C18 H18 119.4 . . ?
C13 C18 H18 119.4 . . ?
C20 C19 C24 113.4(10) . . ?
C20 C19 S1 123.5(8) . . ?
C24 C19 S1 123.1(8) . . ?
F1 C20 C19 118.5(10) . . ?
F1 C20 C21 117.7(10) . . ?
C19 C20 C21 123.8(10) . . ?
F2 C21 C22 121.4(11) . . ?
F2 C21 C20 117.2(11) . . ?
C22 C21 C20 121.4(11) . . ?
C21 C22 C23 116.2(10) . . ?
C21 C22 C25 120.9(12) . . ?
C23 C22 C25 122.8(12) . . ?
C24 C23 F3 117.0(12) . . ?
C24 C23 C22 123.5(11) . . ?
F3 C23 C22 119.5(11) . . ?
F4 C24 C23 119.2(10) . . ?
F4 C24 C19 119.1(10) . . ?
C23 C24 C19 121.6(11) . . ?
F5' C25 F7' 115(3) . . ?
F5' C25 F6' 103(3) . . ?
F7' C25 F6' 100(3) . . ?
F5 C25 F7 109(3) . . ?
F5 C25 F6 107(3) . . ?
F7 C25 F6 99(2) . . ?
F5' C25 C22 114(2) . . ?
F5 C25 C22 115.2(17) . . ?
F7' C25 C22 114.4(19) . . ?
F6' C25 C22 108.5(17) . . ?
F7 C25 C22 114.2(17) . . ?
F6 C25 C22 111.0(13) . . ?

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
C7 P1 C1 C2 82.5(10) . . . . ?
C13 P1 C1 C2 -25.9(11) . . . . ?
Ag1 P1 C1 C2 -153.3(9) . . . . ?
C7 P1 C1 C6 -94.4(10) . . . . ?
C13 P1 C1 C6 157.2(10) . . . . ?
Ag1 P1 C1 C6 29.8(11) . . . . ?
C6 C1 C2 C3 1.6(19) . . . . ?
P1 C1 C2 C3 -175.3(10) . . . . ?
C1 C2 C3 C4 1(2) . . . . ?
C2 C3 C4 C5 -1(3) . . . . ?
C3 C4 C5 C6 -1(3) . . . . ?
C4 C5 C6 C1 3(2) . . . . ?
C2 C1 C6 C5 -4(2) . . . . ?
P1 C1 C6 C5 173.6(12) . . . . ?
C1 P1 C7 C8 -22.0(11) . . . . ?
C13 P1 C7 C8 85.7(11) . . . . ?
Ag1 P1 C7 C8 -147.7(9) . . . . ?
C1 P1 C7 C12 163.6(9) . . . . ?
C13 P1 C7 C12 -88.7(9) . . . . ?
Ag1 P1 C7 C12 37.9(9) . . . . ?
C12 C7 C8 C9 -2.0(19) . . . . ?
P1 C7 C8 C9 -176.4(12) . . . . ?
C7 C8 C9 C10 4(3) . . . . ?
C8 C9 C10 C11 -5(3) . . . . ?
C9 C10 C11 C12 4(2) . . . . ?
C10 C11 C12 C7 -2(2) . . . . ?
C8 C7 C12 C11 1.2(18) . . . . ?
P1 C7 C12 C11 175.9(10) . . . . ?
C7 P1 C13 C14 -17.1(10) . . . . ?
C1 P1 C13 C14 91.6(10) . . . . ?
Ag1 P1 C13 C14 -141.5(8) . . . . ?
C7 P1 C13 C18 163.7(9) . . . . ?
C1 P1 C13 C18 -87.6(9) . . . . ?
Ag1 P1 C13 C18 39.2(9) . . . . ?
C18 C13 C14 C15 1.4(17) . . . . ?
P1 C13 C14 C15 -177.9(9) . . . . ?
C13 C14 C15 C16 -1(2) . . . . ?
C14 C15 C16 C17 0(2) . . . . ?
C15 C16 C17 C18 2(2) . . . . ?
C16 C17 C18 C13 -1(2) . . . . ?
C14 C13 C18 C17 -0.3(18) . . . . ?
P1 C13 C18 C17 179.0(10) . . . . ?
Ag1 S1 C19 C20 52.3(9) . . . . ?
Ag1 S1 C19 C20 -97.1(8) 3_565 . . . ?
Ag1 S1 C19 C20 159.8(7) 14_455 . . . ?
Ag1 S1 C19 C24 -127.6(7) . . . . ?
Ag1 S1 C19 C24 83.0(8) 3_565 . . . ?
Ag1 S1 C19 C24 -20.1(9) 14_455 . . . ?
C24 C19 C20 F1 179.3(8) . . . . ?
S1 C19 C20 F1 -0.7(13) . . . . ?
C24 C19 C20 C21 -2.3(15) . . . . ?
S1 C19 C20 C21 177.8(9) . . . . ?
F1 C20 C21 F2 -1.0(15) . . . . ?
C19 C20 C21 F2 -179.5(10) . . . . ?
F1 C20 C21 C22 179.0(10) . . . . ?
C19 C20 C21 C22 0.5(18) . . . . ?
F2 C21 C22 C23 -177.7(11) . . . . ?
C20 C21 C22 C23 2.3(18) . . . . ?
F2 C21 C22 C25 1.8(19) . . . . ?
C20 C21 C22 C25 -178.2(11) . . . . ?
C21 C22 C23 C24 -3.3(19) . . . . ?
C25 C22 C23 C24 177.2(12) . . . . ?
C21 C22 C23 F3 178.6(12) . . . . ?
C25 C22 C23 F3 -1(2) . . . . ?
F3 C23 C24 F4 -1.6(16) . . . . ?
C22 C23 C24 F4 -179.8(11) . . . . ?
F3 C23 C24 C19 179.7(10) . . . . ?
C22 C23 C24 C19 1.5(18) . . . . ?
C20 C19 C24 F4 -177.5(8) . . . . ?
S1 C19 C24 F4 2.5(13) . . . . ?
C20 C19 C24 C23 1.3(14) . . . . ?
S1 C19 C24 C23 -178.8(9) . . . . ?
C21 C22 C25 F5' -122(4) . . . . ?
C23 C22 C25 F5' 58(4) . . . . ?
C21 C22 C25 F5 63(3) . . . . ?
C23 C22 C25 F5 -117(3) . . . . ?
C21 C22 C25 F7' 14(4) . . . . ?
C23 C22 C25 F7' -167(3) . . . . ?
C21 C22 C25 F6' 124(3) . . . . ?
C23 C22 C25 F6' -56(3) . . . . ?
C21 C22 C25 F7 -170(2) . . . . ?
C23 C22 C25 F7 10(3) . . . . ?
C21 C22 C25 F6 -59(2) . . . . ?
C23 C22 C25 F6 121(2) . . . . ?

_refine_diff_density_max         0.786
_refine_diff_density_min         -1.693
_refine_diff_density_rms         0.148

# start Validation Reply Form
_vrf_PLAT342_shelx               
;
PROBLEM: Low Bond Precision on  C-C Bonds ...............    0.02084 Ang.  
RESPONSE: The diffraction of the crystal at higher angles is very weak.
However, reflections up to 25 degrees were included in the refinement.
Low resolution of the crystal may lead to inaccuracies in C-C bonds.
;
# end Validation Reply Form


