# Supplementary Information (SI) for Chemical Science.
# This journal is © The Royal Society of Chemistry 2025

####################################################################### 
# 
# 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 
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data_p-1_final
_database_code_depnum_ccdc_archive 'CCDC 2471678'
loop_
_audit_author_name
_audit_author_address
'Robin Sievers'
;Freie Universitaet Berlin
Germany
;
_audit_update_record             
;
2025-07-10 deposited with the CCDC.	2025-11-06 downloaded from the CCDC.
;
_audit_creation_date             2024-09-26
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C18 H12 Ag F6, B2 C37 F30 N'
_chemical_formula_sum            'C55 H12 Ag B2 F36 N'
_chemical_formula_weight         1500.15
_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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.4773(4)
_cell_length_b                   15.0019(7)
_cell_length_c                   17.3790(7)
_cell_angle_alpha                111.9500(10)
_cell_angle_beta                 96.586(2)
_cell_angle_gamma                109.0740(10)
_cell_volume                     2525.48(18)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9247
_cell_measurement_temperature    100.00
_cell_measurement_theta_max      25.36
_cell_measurement_theta_min      2.40
_shelx_estimated_absorpt_T_max   0.945
_shelx_estimated_absorpt_T_min   0.945
_exptl_absorpt_coefficient_mu    0.577
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.6636
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0817 before and 0.0552 after correction.
The Ratio of minimum to maximum transmission is 0.8905.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.973
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1460
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0368
_diffrn_reflns_av_unetI/netI     0.0266
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            48637
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.361
_diffrn_reflns_theta_min         1.950
_diffrn_ambient_temperature      100.00
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                8149
_reflns_number_total             9238
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         0.373
_refine_diff_density_min         -1.025
_refine_diff_density_rms         0.066
_refine_ls_extinction_coef       0.00064(17)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.085
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     938
_refine_ls_number_reflns         9238
_refine_ls_number_restraints     5
_refine_ls_R_factor_all          0.0388
_refine_ls_R_factor_gt           0.0318
_refine_ls_restrained_S_all      1.086
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0277P)²+2.8833P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0745
_refine_ls_wR_factor_ref         0.0805
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2. Shared sites
{N1, C01}
{C02, N2}
3. Restrained distances
 F00V-C01Z \\sim F00V-C0
 with sigma of 0.02
 C01E-C01Z \\sim C01E-C0
 with sigma of 0.02
 C01W-C02C \\sim C01W-C1
 with sigma of 0.02
 C01Z-C02C \\sim C0-C1
 with sigma of 0.02
 C01Z-F3 \\sim C0-F3
 with sigma of 0.02
 C02C-F4 \\sim C1-F4
 with sigma of 0.02
 C02C-F9 \\sim C1-F9
 with sigma of 0.02
 F00V-C02C \\sim F00V-C1
 with sigma of 0.04
 C01E-C02C \\sim C01E-C1
 with sigma of 0.04
 C01W-C01Z \\sim C01W-C0
 with sigma of 0.04
 C01Z-F4 \\sim C0-F4
 with sigma of 0.04
 C01Z-F9 \\sim C0-F9
 with sigma of 0.04
 C02C-F3 \\sim C1-F3
 with sigma of 0.04
4. Uiso/Uaniso restraints and constraints
Uanis(C02) = Uanis(N2)
Uanis(N1) = Uanis(C01)
Uanis(C4) = Uanis(C5) = Uanis(C9) = Uanis(C2A)
Uanis(C01Z) = Uanis(C02C) = Uanis(C0) = Uanis(C1)
5. Others
 Fixed Sof: F00V(0.5) C02(0.5) N1(0.5) C01Z(0.5) C02C(0.5) H02D(0.5) F1(0.5)
 H02G(0.5) F4(0.5) C5(0.5) H5(0.5) C7(0.5) H7(0.5) C9(0.5) H9(0.5) F6(0.5)
 F5(0.5) C6(0.5) H6(0.5) C3(0.5) C8(0.5) F7(0.5) F8(0.5) C4(0.5) H4(0.5)
 C7A(0.5) C6A(0.5) C2A(0.5) H2A(0.5) C3A(0.5) H3A(0.5) C8A(0.5) H8A(0.5)
 C01(0.5) N2(0.5) F2(0.5) F9(0.5) F3(0.5) C0(0.5) C1(0.5)
6.a Aromatic/amide H refined with riding coordinates:
 C024(H024), C025(H025), C026(H026), C027(H027), C029(H029), C02B(H02B),
 C02D(H02D), C02E(H02E), C02G(H02G), C5(H5), C7(H7), C9(H9), C6(H6), C4(H4),
 C2A(H2A), C3A(H3A), C8A(H8A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Ag01 Ag 0.72062(2) 0.97406(2) 0.72737(2) 0.03342(8) Uani 1 1 d . . . . .
F002 F 0.59671(12) 0.35622(10) 0.54823(8) 0.0233(3) Uani 1 1 d . . . . .
F003 F 0.95422(12) 0.66905(10) 0.61411(8) 0.0231(3) Uani 1 1 d . . . . .
F004 F 0.62273(14) 0.62773(11) 1.01791(8) 0.0272(3) Uani 1 1 d . . . . .
F005 F 0.91394(13) 0.69455(10) 0.79092(9) 0.0269(3) Uani 1 1 d . . . . .
F006 F 0.52337(14) 0.29688(10) 0.85829(9) 0.0289(3) Uani 1 1 d . . . . .
F007 F 0.61898(14) 0.62992(11) 0.74557(8) 0.0288(3) Uani 1 1 d . . . . .
F008 F 0.48287(13) 0.37368(11) 0.41580(9) 0.0287(3) Uani 1 1 d . . . . .
F009 F 0.83705(14) 0.68613(11) 0.48331(9) 0.0298(3) Uani 1 1 d . . . . .
F00A F 0.86459(13) 0.62944(11) 0.95842(9) 0.0302(3) Uani 1 1 d . . . . .
F00B F 0.63930(14) 0.82527(11) 1.08239(9) 0.0323(3) Uani 1 1 d . . . . .
F00C F 0.53247(14) 0.29395(11) 0.68386(9) 0.0335(3) Uani 1 1 d . . . . .
F00D F 0.98426(14) 0.59040(12) 1.07502(9) 0.0329(3) Uani 1 1 d . . . . .
F00E F 0.59958(15) 0.54194(12) 0.38346(9) 0.0339(3) Uani 1 1 d . . . . .
F00F F 0.37341(14) 0.51482(12) 0.87484(10) 0.0375(4) Uani 1 1 d . . . . .
F00G F 1.10701(14) 0.46742(12) 0.64993(11) 0.0395(4) Uani 1 1 d . . . . .
F00H F 1.14533(15) 0.84318(11) 0.88408(9) 0.0356(4) Uani 1 1 d . . . . .
F00I F 0.09198(15) 0.20666(13) 0.63753(11) 0.0430(4) Uani 1 1 d . . . . .
F00J F 0.64537(16) 0.25997(12) 0.97430(11) 0.0399(4) Uani 1 1 d . . . . .
F00K F 0.84804(16) 0.17932(11) 0.40537(11) 0.0390(4) Uani 1 1 d . . . . .
F00L F 1.35929(14) 0.80552(12) 0.86424(11) 0.0410(4) Uani 1 1 d . . . . .
F00M F 0.63411(16) 0.92265(11) 0.97952(10) 0.0391(4) Uani 1 1 d . . . . .
F00N F 0.62545(16) 0.82230(12) 0.81022(10) 0.0385(4) Uani 1 1 d . . . . .
F00O F 0.87913(19) 0.37895(12) 0.48665(12) 0.0473(5) Uani 1 1 d . . . . .
F00P F 0.13652(14) 0.38213(13) 0.78216(12) 0.0424(4) Uani 1 1 d . . . . .
F00Q F 0.87819(16) 0.40536(14) 1.08364(11) 0.0441(4) Uani 1 1 d . . . . .
F00R F 0.29382(16) 0.16531(12) 0.58947(10) 0.0454(4) Uani 1 1 d . . . . .
F00S F 0.80333(18) 0.05412(12) 0.48686(11) 0.0475(4) Uani 1 1 d . . . . .
F00T F 1.33514(14) 0.61594(14) 0.74459(13) 0.0529(5) Uani 1 1 d . . . . .
F00U F 1.15390(16) 1.05066(14) 0.68886(13) 0.0542(5) Uani 1 1 d . . . . .
F00V F 0.8448(5) 0.3357(5) 0.7334(4) 0.0277(11) Uani 0.5 1 d . . P A 1
F00W F 1.12666(17) 1.20100(16) 0.86790(13) 0.0589(5) Uani 1 1 d . . . . .
F00X F 1.07778(17) 1.09461(16) 0.96334(12) 0.0566(5) Uani 1 1 d . . . . .
C02 C 0.76590(19) 0.48742(15) 0.72491(13) 0.0189(4) Uani 0.5 1 d . . P B 2
N1 N 0.7007(2) 0.49283(16) 0.76995(13) 0.0209(4) Uani 0.5 1 d . . P B 2
C011 C 0.9968(2) 0.57177(18) 0.71668(14) 0.0207(5) Uani 1 1 d . . . . .
C012 C 0.7825(2) 0.51036(17) 0.58780(13) 0.0174(4) Uani 1 1 d . . . . .
C013 C 1.0164(2) 0.67044(18) 0.77847(15) 0.0207(5) Uani 1 1 d . . . . .
C014 C 0.6608(2) 0.44021(17) 0.53453(14) 0.0187(4) Uani 1 1 d . . . . .
C015 C 0.8371(2) 0.59363(17) 0.56788(14) 0.0188(4) Uani 1 1 d . . . . .
C016 C 0.7779(2) 0.60436(18) 0.49996(14) 0.0220(5) Uani 1 1 d . . . . .
C017 C 0.5996(2) 0.44738(18) 0.46588(14) 0.0215(5) Uani 1 1 d . . . . .
C018 C 0.6365(2) 0.37435(18) 0.91167(15) 0.0224(5) Uani 1 1 d . . . . .
C019 C 0.6845(2) 0.46790(18) 0.90504(14) 0.0208(5) Uani 1 1 d . . . . .
C01A C 0.4674(2) 0.41507(18) 0.78189(14) 0.0207(5) Uani 1 1 d . . . . .
C01B C 0.6240(2) 0.61904(18) 0.87879(14) 0.0206(5) Uani 1 1 d . . . . .
C01C C 0.6275(2) 0.67405(18) 0.96429(15) 0.0220(5) Uani 1 1 d . . . . .
C01D C 0.4375(2) 0.32217(19) 0.70910(15) 0.0250(5) Uani 1 1 d . . . . .
C01E C 0.8447(2) 0.36430(18) 0.61383(15) 0.0215(5) Uani 1 1 d D . . . .
C01F C 0.6585(2) 0.53089(19) 0.44832(15) 0.0245(5) Uani 1 1 d . . . . .
C01G C 0.8041(2) 0.53717(18) 0.96150(15) 0.0233(5) Uani 1 1 d . . . . .
C01H C 0.8402(2) 0.21761(18) 0.48670(16) 0.0254(5) Uani 1 1 d . . . . .
C01I C 0.6248(2) 0.67446(19) 0.83019(15) 0.0237(5) Uani 1 1 d . . . . .
C01J C 0.8537(2) 0.32010(18) 0.53007(17) 0.0249(5) Uani 1 1 d . . . . .
C01K C 0.6321(2) 0.77467(19) 0.99894(15) 0.0249(5) Uani 1 1 d . . . . .
C01L C 0.8689(2) 0.51903(19) 1.02194(15) 0.0253(5) Uani 1 1 d . . . . .
C01M C 0.8154(3) 0.4254(2) 1.02641(16) 0.0290(5) Uani 1 1 d . . . . .
C01N C 0.6313(2) 0.82492(19) 0.94704(17) 0.0282(5) Uani 1 1 d . . . . .
C01O C 0.2124(2) 0.2731(2) 0.68409(17) 0.0308(6) Uani 1 1 d . . . . .
C01P C 0.6990(3) 0.35285(19) 0.97101(17) 0.0281(5) Uani 1 1 d . . . . .
C01Q C 0.3607(2) 0.43045(18) 0.80356(16) 0.0261(5) Uani 1 1 d . . . . .
C01R C 1.2430(2) 0.7307(2) 0.81646(16) 0.0293(5) Uani 1 1 d . . . . .
C01S C 1.1093(2) 0.55845(19) 0.70832(16) 0.0279(5) Uani 1 1 d . . . . .
C01T C 1.1346(2) 0.74888(18) 0.82698(15) 0.0255(5) Uani 1 1 d . . . . .
C01U C 0.6275(2) 0.7742(2) 0.86229(16) 0.0275(5) Uani 1 1 d . . . . .
C01V C 0.3146(3) 0.25287(19) 0.66021(15) 0.0303(6) Uani 1 1 d . . . . .
C01W C 0.8166(3) 0.15402(19) 0.52753(18) 0.0335(6) Uani 1 1 d D . . . .
C01X C 0.2359(2) 0.3622(2) 0.75678(17) 0.0299(5) Uani 1 1 d . . . . .
C01Y C 1.2301(2) 0.6348(2) 0.75643(18) 0.0333(6) Uani 1 1 d . . . . .
C01Z C 0.8407(10) 0.3002(8) 0.6553(7) 0.0250(14) Uani 0.5 1 d D . P A 1
C021 C 0.9814(3) 1.1096(2) 0.92491(17) 0.0384(7) Uani 1 1 d . . . . .
C022 C 1.0385(3) 0.9831(2) 0.6833(2) 0.0415(7) Uani 1 1 d . . . . .
C023 C 1.0074(3) 1.1644(2) 0.87568(18) 0.0405(7) Uani 1 1 d . . . . .
C024 C 0.8050(3) 0.8428(2) 0.6729(2) 0.0409(7) Uani 1 1 d . . . . .
H024 H 0.724653 0.793827 0.669221 0.049 Uiso 1 1 calc R U . . .
C025 C 0.7649(3) 1.0873(2) 0.89417(18) 0.0401(7) Uani 1 1 d . . . . .
H025 H 0.681063 1.061445 0.900640 0.048 Uiso 1 1 calc R U . . .
C026 C 0.8618(3) 1.0694(2) 0.93372(17) 0.0391(7) Uani 1 1 d . . . . .
H026 H 0.844745 1.029980 0.966095 0.047 Uiso 1 1 calc R U . . .
C027 C 0.9129(3) 1.1810(2) 0.83508(18) 0.0407(7) Uani 1 1 d . . . . .
H027 H 0.930419 1.217656 0.800673 0.049 Uiso 1 1 calc R U . . .
B028 B 0.8529(2) 0.4846(2) 0.65989(16) 0.0187(5) Uani 1 1 d . . . . .
C029 C 0.8167(3) 0.8801(2) 0.61113(19) 0.0470(8) Uani 1 1 d . . . . .
H029 H 0.744573 0.857492 0.565040 0.056 Uiso 1 1 calc R U . . .
B02A B 0.6149(3) 0.4982(2) 0.83654(16) 0.0210(5) Uani 1 1 d . . . . .
C02B C 0.7906(3) 1.1430(2) 0.84513(17) 0.0402(7) Uani 1 1 d . . . . .
H02B H 0.724205 1.155138 0.818403 0.048 Uiso 1 1 calc R U . . .
C02C C 0.8306(7) 0.1981(7) 0.6125(5) 0.0250(14) Uani 0.5 1 d D . P A 1
C02D C 1.0272(3) 0.9463(3) 0.7442(3) 0.0506(8) Uani 1 1 d . . . . .
H02D H 1.100201 0.968825 0.789536 0.061 Uiso 0.5 1 calc R U P C 1
C02E C 0.9112(3) 0.8770(2) 0.7403(2) 0.0494(8) Uani 1 1 d . . . . .
H02E H 0.903365 0.852565 0.783357 0.059 Uiso 1 1 calc R U . . .
F1 F 1.1331(3) 0.9691(3) 0.7915(2) 0.0491(9) Uani 0.5 1 d . . P D 2
C02G C 0.9357(3) 0.9515(3) 0.61754(19) 0.0534(9) Uani 1 1 d . . . . .
H02G H 0.944834 0.978024 0.575780 0.064 Uiso 0.5 1 calc R U P E 2
F4 F 0.8233(4) 0.1386(3) 0.6517(3) 0.0336(8) Uani 0.5 1 d . . P A 1
C5 C 0.4919(17) 0.8713(17) 0.6254(13) 0.035(2) Uani 0.5 1 d . . P F 1
H5 H 0.513559 0.814607 0.594505 0.042 Uiso 0.5 1 calc R U P F 1
C7 C 0.5375(8) 0.9659(7) 0.6153(6) 0.0339(19) Uani 0.5 1 d . . P F 1
H7 H 0.585015 0.971133 0.574704 0.041 Uiso 0.5 1 calc R U P F 1
C9 C 0.4348(10) 1.0385(6) 0.7219(9) 0.035(2) Uani 0.5 1 d . . P F 1
H9 H 0.413700 1.094604 0.755155 0.042 Uiso 0.5 1 calc R U P F 1
F6 F 0.4760(3) 1.0760(3) 0.5826(3) 0.0516(9) Uani 0.5 1 d . . P F 2
F5 F 0.5086(3) 0.8981(3) 0.5181(2) 0.0497(9) Uani 0.5 1 d . . P F 2
C6 C 0.5115(8) 1.0496(7) 0.6652(6) 0.041(2) Uani 0.5 1 d . . P F 1
H6 H 0.545053 1.114311 0.661442 0.049 Uiso 0.5 1 calc R U P F 1
C3 C 0.3923(7) 0.9472(6) 0.7278(5) 0.0348(16) Uani 0.5 1 d . . P F 1
C8 C 0.4189(6) 0.8637(5) 0.6785(5) 0.0291(13) Uani 0.5 1 d . . P F 1
F7 F 0.3676(3) 0.7728(3) 0.6839(3) 0.0485(9) Uani 0.5 1 d . . P F 1
F8 F 0.3185(4) 0.9360(3) 0.7809(3) 0.0557(10) Uani 0.5 1 d . . P F 1
C4 C 0.4810(17) 0.8714(18) 0.6381(13) 0.035(2) Uani 0.5 1 d . . P F 2
H4 H 0.491149 0.807123 0.613108 0.042 Uiso 0.5 1 calc R U P F 2
C7A C 0.4875(7) 0.9294(6) 0.5968(5) 0.0279(16) Uani 0.5 1 d . . P F 2
C6A C 0.4688(7) 1.0209(6) 0.6298(5) 0.0310(17) Uani 0.5 1 d . . P F 2
C2A C 0.4489(10) 1.0576(6) 0.7076(9) 0.035(2) Uani 0.5 1 d . . P F 2
H2A H 0.440383 1.122743 0.730551 0.042 Uiso 0.5 1 calc R U P F 2
C3A C 0.4405(7) 0.9993(8) 0.7548(5) 0.0407(18) Uani 0.5 1 d . . P F 2
H3A H 0.422732 1.023277 0.809190 0.049 Uiso 0.5 1 calc R U P F 2
C8A C 0.4582(6) 0.9067(6) 0.7226(5) 0.0351(14) Uani 0.5 1 d . . P F 2
H8A H 0.455391 0.867395 0.754899 0.042 Uiso 0.5 1 calc R U P F 2
C01 C 0.7007(2) 0.49283(16) 0.76995(13) 0.0209(4) Uani 0.5 1 d . . P B 1
N2 N 0.76590(19) 0.48742(15) 0.72491(13) 0.0189(4) Uani 0.5 1 d . . P B 1
F2 F 0.9659(3) 0.9677(3) 0.5569(2) 0.0500(9) Uani 0.5 1 d . . P G 1
F9 F 0.7561(4) 0.1260(3) 0.6516(3) 0.0322(8) Uani 0.5 1 d . . P A 2
F3 F 0.7960(5) 0.3266(5) 0.7374(4) 0.0272(11) Uani 0.5 1 d . . P A 2
C0 C 0.8085(10) 0.2942(8) 0.6499(7) 0.0250(14) Uani 0.5 1 d D . P A 2
C1 C 0.7893(7) 0.1906(7) 0.6089(5) 0.0250(14) Uani 0.5 1 d D . 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
Ag01 C024 2.404(3) . ?
Ag01 C025 2.639(3) . ?
Ag01 C029 2.584(3) . ?
Ag01 C02B 2.382(3) . ?
Ag01 C5 2.580(18) . ?
Ag01 C7 2.635(8) . ?
Ag01 C4 2.609(18) . ?
F002 C014 1.358(2) . ?
F003 C015 1.346(3) . ?
F004 C01C 1.351(3) . ?
F005 C013 1.356(3) . ?
F006 C018 1.352(3) . ?
F007 C01I 1.352(3) . ?
F008 C017 1.349(3) . ?
F009 C016 1.348(3) . ?
F00A C01G 1.355(3) . ?
F00B C01K 1.340(3) . ?
F00C C01D 1.353(3) . ?
F00D C01L 1.344(3) . ?
F00E C01F 1.340(3) . ?
F00F C01Q 1.350(3) . ?
F00G C01S 1.353(3) . ?
F00H C01T 1.345(3) . ?
F00I C01O 1.341(3) . ?
F00J C01P 1.353(3) . ?
F00K C01H 1.339(3) . ?
F00L C01R 1.342(3) . ?
F00M C01N 1.347(3) . ?
F00N C01U 1.354(3) . ?
F00O C01J 1.347(3) . ?
F00P C01X 1.350(3) . ?
F00Q C01M 1.341(3) . ?
F00R C01V 1.347(3) . ?
F00S C01W 1.343(3) . ?
F00T C01Y 1.346(3) . ?
F00U C022 1.346(3) . ?
F00V C01Z 1.249(12) . ?
F00W C023 1.341(4) . ?
F00X C021 1.351(3) . ?
C02 N1 1.143(3) . ?
C02 B028 1.589(3) . ?
N1 B02A 1.600(3) . ?
C011 C013 1.390(3) . ?
C011 C01S 1.384(3) . ?
C011 B028 1.632(3) . ?
C012 C014 1.389(3) . ?
C012 C015 1.391(3) . ?
C012 B028 1.645(3) . ?
C013 C01T 1.374(3) . ?
C014 C017 1.372(3) . ?
C015 C016 1.382(3) . ?
C016 C01F 1.374(3) . ?
C017 C01F 1.378(3) . ?
C018 C019 1.384(3) . ?
C018 C01P 1.383(3) . ?
C019 C01G 1.387(3) . ?
C019 B02A 1.639(3) . ?
C01A C01D 1.389(3) . ?
C01A C01Q 1.385(3) . ?
C01A B02A 1.640(3) . ?
C01B C01C 1.392(3) . ?
C01B C01I 1.388(3) . ?
C01B B02A 1.643(3) . ?
C01C C01K 1.380(3) . ?
C01D C01V 1.378(4) . ?
C01E C01J 1.388(3) . ?
C01E C01Z 1.393(9) . ?
C01E B028 1.643(3) . ?
C01E C0 1.392(10) . ?
C01G C01L 1.377(3) . ?
C01H C01J 1.381(3) . ?
C01H C01W 1.367(4) . ?
C01I C01U 1.376(4) . ?
C01K C01N 1.376(4) . ?
C01L C01M 1.373(4) . ?
C01M C01P 1.367(4) . ?
C01N C01U 1.369(4) . ?
C01O C01V 1.375(4) . ?
C01O C01X 1.371(4) . ?
C01Q C01X 1.384(4) . ?
C01R C01T 1.375(4) . ?
C01R C01Y 1.372(4) . ?
C01S C01Y 1.384(4) . ?
C01W C02C 1.337(9) . ?
C01W C1 1.427(9) . ?
C01Z C02C 1.388(7) . ?
C021 C023 1.386(4) . ?
C021 C026 1.359(4) . ?
C022 C02D 1.364(5) . ?
C022 C02G 1.358(5) . ?
C023 C027 1.367(4) . ?
C024 H024 0.9500 . ?
C024 C029 1.385(5) . ?
C024 C02E 1.391(5) . ?
C025 H025 0.9500 . ?
C025 C026 1.393(4) . ?
C025 C02B 1.393(4) . ?
C026 H026 0.9500 . ?
C027 H027 0.9500 . ?
C027 C02B 1.390(4) . ?
B028 N2 1.589(3) . ?
C029 H029 0.9500 . ?
C029 C02G 1.394(4) . ?
B02A C01 1.600(3) . ?
C02B H02B 0.9500 . ?
C02C F4 1.299(9) . ?
C02D H02D 0.9500 . ?
C02D C02E 1.371(4) . ?
C02D F1 1.248(5) . ?
C02E H02E 0.9500 . ?
C02G H02G 0.9500 . ?
C02G F2 1.230(4) . ?
C5 H5 0.9500 . ?
C5 C7 1.43(3) . ?
C5 C8 1.33(2) . ?
C7 H7 0.9500 . ?
C7 C6 1.381(14) . ?
C9 H9 0.9500 . ?
C9 C6 1.414(18) . ?
C9 C3 1.344(11) . ?
F6 C6A 1.357(9) . ?
F5 C7A 1.349(8) . ?
C6 H6 0.9500 . ?
C3 C8 1.381(10) . ?
C3 F8 1.342(8) . ?
C8 F7 1.341(7) . ?
C4 H4 0.9500 . ?
C4 C7A 1.31(3) . ?
C4 C8A 1.45(2) . ?
C7A C6A 1.375(13) . ?
C6A C2A 1.334(17) . ?
C2A H2A 0.9500 . ?
C2A C3A 1.396(13) . ?
C3A H3A 0.9500 . ?
C3A C8A 1.383(12) . ?
C8A H8A 0.9500 . ?
C01 N2 1.143(3) . ?
F9 C1 1.412(9) . ?
F3 C0 1.455(13) . ?
C0 C1 1.372(7) . ?

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
C024 Ag01 C025 121.77(11) . . ?
C024 Ag01 C029 31.98(11) . . ?
C024 Ag01 C5 99.0(3) . . ?
C024 Ag01 C7 115.8(2) . . ?
C024 Ag01 C4 101.6(4) . . ?
C029 Ag01 C025 143.84(10) . . ?
C029 Ag01 C7 94.1(2) . . ?
C029 Ag01 C4 97.3(3) . . ?
C02B Ag01 C024 136.81(11) . . ?
C02B Ag01 C025 31.70(10) . . ?
C02B Ag01 C029 136.22(11) . . ?
C02B Ag01 C5 123.9(3) . . ?
C02B Ag01 C7 104.8(2) . . ?
C02B Ag01 C4 120.7(3) . . ?
C5 Ag01 C025 122.0(4) . . ?
C5 Ag01 C029 92.4(3) . . ?
C5 Ag01 C7 31.8(7) . . ?
C7 Ag01 C025 120.7(2) . . ?
C4 Ag01 C025 116.5(4) . . ?
N1 C02 B028 176.0(2) . . ?
C02 N1 B02A 176.3(2) . . ?
C013 C011 B028 121.1(2) . . ?
C01S C011 C013 113.4(2) . . ?
C01S C011 B028 125.4(2) . . ?
C014 C012 C015 113.7(2) . . ?
C014 C012 B028 119.76(19) . . ?
C015 C012 B028 126.3(2) . . ?
F005 C013 C011 119.2(2) . . ?
F005 C013 C01T 116.3(2) . . ?
C01T C013 C011 124.5(2) . . ?
F002 C014 C012 119.28(19) . . ?
F002 C014 C017 116.1(2) . . ?
C017 C014 C012 124.6(2) . . ?
F003 C015 C012 121.0(2) . . ?
F003 C015 C016 115.61(19) . . ?
C016 C015 C012 123.4(2) . . ?
F009 C016 C015 120.4(2) . . ?
F009 C016 C01F 119.5(2) . . ?
C01F C016 C015 120.1(2) . . ?
F008 C017 C014 120.6(2) . . ?
F008 C017 C01F 120.1(2) . . ?
C014 C017 C01F 119.3(2) . . ?
F006 C018 C019 120.7(2) . . ?
F006 C018 C01P 115.7(2) . . ?
C01P C018 C019 123.6(2) . . ?
C018 C019 C01G 113.6(2) . . ?
C018 C019 B02A 125.9(2) . . ?
C01G C019 B02A 120.5(2) . . ?
C01D C01A B02A 123.0(2) . . ?
C01Q C01A C01D 113.5(2) . . ?
C01Q C01A B02A 123.5(2) . . ?
C01C C01B B02A 124.2(2) . . ?
C01I C01B C01C 113.8(2) . . ?
C01I C01B B02A 122.0(2) . . ?
F004 C01C C01B 119.9(2) . . ?
F004 C01C C01K 116.2(2) . . ?
C01K C01C C01B 123.9(2) . . ?
F00C C01D C01A 119.7(2) . . ?
F00C C01D C01V 116.0(2) . . ?
C01V C01D C01A 124.2(2) . . ?
C01J C01E C01Z 112.9(5) . . ?
C01J C01E B028 121.9(2) . . ?
C01J C01E C0 114.6(5) . . ?
C01Z C01E B028 124.9(5) . . ?
C0 C01E B028 122.7(5) . . ?
F00E C01F C016 120.4(2) . . ?
F00E C01F C017 120.8(2) . . ?
C016 C01F C017 118.8(2) . . ?
F00A C01G C019 119.5(2) . . ?
F00A C01G C01L 116.0(2) . . ?
C01L C01G C019 124.5(2) . . ?
F00K C01H C01J 121.3(2) . . ?
F00K C01H C01W 119.6(2) . . ?
C01W C01H C01J 119.1(2) . . ?
F007 C01I C01B 120.3(2) . . ?
F007 C01I C01U 115.9(2) . . ?
C01U C01I C01B 123.8(2) . . ?
F00O C01J C01E 119.7(2) . . ?
F00O C01J C01H 116.0(2) . . ?
C01H C01J C01E 124.2(2) . . ?
F00B C01K C01C 121.5(2) . . ?
F00B C01K C01N 119.1(2) . . ?
C01N C01K C01C 119.4(2) . . ?
F00D C01L C01G 121.1(2) . . ?
F00D C01L C01M 119.8(2) . . ?
C01M C01L C01G 119.2(2) . . ?
F00Q C01M C01L 120.1(2) . . ?
F00Q C01M C01P 120.8(2) . . ?
C01P C01M C01L 119.1(2) . . ?
F00M C01N C01K 120.2(2) . . ?
F00M C01N C01U 120.7(2) . . ?
C01U C01N C01K 119.1(2) . . ?
F00I C01O C01V 120.7(2) . . ?
F00I C01O C01X 120.5(2) . . ?
C01X C01O C01V 118.7(2) . . ?
F00J C01P C018 120.2(2) . . ?
F00J C01P C01M 119.8(2) . . ?
C01M C01P C018 120.0(2) . . ?
F00F C01Q C01A 120.8(2) . . ?
F00F C01Q C01X 115.2(2) . . ?
C01X C01Q C01A 124.0(2) . . ?
F00L C01R C01T 120.5(2) . . ?
F00L C01R C01Y 120.6(2) . . ?
C01Y C01R C01T 118.9(2) . . ?
F00G C01S C011 120.9(2) . . ?
F00G C01S C01Y 115.1(2) . . ?
C01Y C01S C011 124.0(2) . . ?
F00H C01T C013 120.7(2) . . ?
F00H C01T C01R 119.8(2) . . ?
C013 C01T C01R 119.5(2) . . ?
F00N C01U C01I 120.2(2) . . ?
F00N C01U C01N 119.8(2) . . ?
C01N C01U C01I 120.0(2) . . ?
F00R C01V C01D 120.6(2) . . ?
F00R C01V C01O 119.8(2) . . ?
C01O C01V C01D 119.7(2) . . ?
F00S C01W C01H 120.3(2) . . ?
F00S C01W C1 120.2(4) . . ?
C01H C01W C1 119.0(4) . . ?
C02C C01W F00S 120.3(4) . . ?
C02C C01W C01H 118.3(4) . . ?
F00P C01X C01O 119.5(2) . . ?
F00P C01X C01Q 120.7(2) . . ?
C01O C01X C01Q 119.8(2) . . ?
F00T C01Y C01R 119.8(2) . . ?
F00T C01Y C01S 120.5(2) . . ?
C01R C01Y C01S 119.7(2) . . ?
F00V C01Z C01E 118.7(9) . . ?
F00V C01Z C02C 119.0(7) . . ?
C02C C01Z C01E 122.3(7) . . ?
F00X C021 C023 118.5(3) . . ?
F00X C021 C026 119.8(3) . . ?
C026 C021 C023 121.7(3) . . ?
F00U C022 C02D 118.9(3) . . ?
F00U C022 C02G 120.3(3) . . ?
C02G C022 C02D 120.8(3) . . ?
F00W C023 C021 119.3(3) . . ?
F00W C023 C027 120.1(3) . . ?
C027 C023 C021 120.6(3) . . ?
Ag01 C024 H024 86.3 . . ?
C029 C024 Ag01 81.22(18) . . ?
C029 C024 H024 120.1 . . ?
C029 C024 C02E 119.9(3) . . ?
C02E C024 Ag01 102.57(19) . . ?
C02E C024 H024 120.1 . . ?
Ag01 C025 H025 100.1 . . ?
C026 C025 Ag01 105.36(18) . . ?
C026 C025 H025 119.9 . . ?
C026 C025 C02B 120.2(3) . . ?
C02B C025 Ag01 63.92(15) . . ?
C02B C025 H025 119.9 . . ?
C021 C026 C025 118.4(3) . . ?
C021 C026 H026 120.8 . . ?
C025 C026 H026 120.8 . . ?
C023 C027 H027 120.7 . . ?
C023 C027 C02B 118.7(3) . . ?
C02B C027 H027 120.7 . . ?
C02 B028 C011 106.67(18) . . ?
C02 B028 C012 104.15(17) . . ?
C02 B028 C01E 107.36(18) . . ?
C011 B028 C012 114.90(18) . . ?
C011 B028 C01E 113.56(18) . . ?
C01E B028 C012 109.46(18) . . ?
N2 B028 C011 106.67(18) . . ?
N2 B028 C012 104.15(17) . . ?
N2 B028 C01E 107.36(18) . . ?
Ag01 C029 H029 93.7 . . ?
C024 C029 Ag01 66.80(15) . . ?
C024 C029 H029 120.5 . . ?
C024 C029 C02G 119.1(3) . . ?
C02G C029 Ag01 109.2(2) . . ?
C02G C029 H029 120.5 . . ?
N1 B02A C019 102.70(18) . . ?
N1 B02A C01A 107.66(18) . . ?
N1 B02A C01B 106.27(18) . . ?
C019 B02A C01A 114.86(19) . . ?
C019 B02A C01B 113.82(18) . . ?
C01A B02A C01B 110.65(19) . . ?
C01 B02A C019 102.70(18) . . ?
C01 B02A C01A 107.66(18) . . ?
C01 B02A C01B 106.27(18) . . ?
Ag01 C02B H02B 90.1 . . ?
C025 C02B Ag01 84.38(17) . . ?
C025 C02B H02B 119.8 . . ?
C027 C02B Ag01 95.51(18) . . ?
C027 C02B C025 120.4(3) . . ?
C027 C02B H02B 119.8 . . ?
C01W C02C C01Z 121.2(6) . . ?
F4 C02C C01W 117.2(7) . . ?
F4 C02C C01Z 121.3(6) . . ?
C022 C02D H02D 119.8 . . ?
C022 C02D C02E 120.5(3) . . ?
C02E C02D H02D 119.8 . . ?
F1 C02D C022 112.6(3) . . ?
F1 C02D C02E 126.0(4) . . ?
C024 C02E H02E 120.2 . . ?
C02D C02E C024 119.6(3) . . ?
C02D C02E H02E 120.2 . . ?
C022 C02G C029 120.2(3) . . ?
C022 C02G H02G 119.9 . . ?
C029 C02G H02G 119.9 . . ?
F2 C02G C022 112.8(3) . . ?
F2 C02G C029 124.1(3) . . ?
Ag01 C5 H5 90.5 . . ?
C7 C5 Ag01 76.3(9) . . ?
C7 C5 H5 120.4 . . ?
C8 C5 Ag01 103.2(11) . . ?
C8 C5 H5 120.4 . . ?
C8 C5 C7 119.3(11) . . ?
Ag01 C7 H7 96.2 . . ?
C5 C7 Ag01 72.0(8) . . ?
C5 C7 H7 120.4 . . ?
C6 C7 Ag01 101.6(5) . . ?
C6 C7 C5 119.1(9) . . ?
C6 C7 H7 120.4 . . ?
C6 C9 H9 120.6 . . ?
C3 C9 H9 120.6 . . ?
C3 C9 C6 118.8(10) . . ?
C7 C6 C9 119.6(8) . . ?
C7 C6 H6 120.2 . . ?
C9 C6 H6 120.2 . . ?
C9 C3 C8 121.7(9) . . ?
F8 C3 C9 119.0(9) . . ?
F8 C3 C8 119.3(7) . . ?
C5 C8 C3 121.3(11) . . ?
C5 C8 F7 119.9(11) . . ?
F7 C8 C3 118.7(6) . . ?
Ag01 C4 H4 92.5 . . ?
C7A C4 Ag01 94.5(12) . . ?
C7A C4 H4 120.5 . . ?
C7A C4 C8A 119.0(13) . . ?
C8A C4 Ag01 83.0(8) . . ?
C8A C4 H4 120.5 . . ?
F5 C7A C6A 118.0(7) . . ?
C4 C7A F5 120.0(9) . . ?
C4 C7A C6A 122.0(9) . . ?
F6 C6A C7A 118.3(7) . . ?
C2A C6A F6 120.1(7) . . ?
C2A C6A C7A 121.5(8) . . ?
C6A C2A H2A 120.4 . . ?
C6A C2A C3A 119.3(8) . . ?
C3A C2A H2A 120.4 . . ?
C2A C3A H3A 119.9 . . ?
C8A C3A C2A 120.1(8) . . ?
C8A C3A H3A 119.9 . . ?
C4 C8A H8A 121.0 . . ?
C3A C8A C4 118.0(12) . . ?
C3A C8A H8A 121.0 . . ?
N2 C01 B02A 176.3(2) . . ?
C01 N2 B028 176.0(2) . . ?
C01E C0 F3 122.4(8) . . ?
C1 C0 C01E 123.7(7) . . ?
C1 C0 F3 113.8(6) . . ?
F9 C1 C01W 121.5(7) . . ?
C0 C1 C01W 118.4(6) . . ?
C0 C1 F9 119.7(5) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Ag01 C024 C029 C02G 99.9(3) . . . . ?
Ag01 C024 C02E C02D -88.1(3) . . . . ?
Ag01 C025 C026 C021 70.0(3) . . . . ?
Ag01 C025 C02B C027 -93.1(2) . . . . ?
Ag01 C029 C02G C022 73.9(4) . . . . ?
Ag01 C029 C02G F2 -127.1(4) . . . . ?
Ag01 C5 C7 C6 -93.4(8) . . . . ?
Ag01 C5 C8 C3 77.7(13) . . . . ?
Ag01 C5 C8 F7 -103.4(9) . . . . ?
Ag01 C7 C6 C9 -79.1(8) . . . . ?
Ag01 C4 C7A F5 95.6(8) . . . . ?
Ag01 C4 C7A C6A -86.8(9) . . . . ?
Ag01 C4 C8A C3A 93.1(8) . . . . ?
F002 C014 C017 F008 -0.4(3) . . . . ?
F002 C014 C017 C01F 179.65(19) . . . . ?
F003 C015 C016 F009 0.1(3) . . . . ?
F003 C015 C016 C01F 179.4(2) . . . . ?
F004 C01C C01K F00B 3.9(3) . . . . ?
F004 C01C C01K C01N -177.1(2) . . . . ?
F005 C013 C01T F00H 0.9(3) . . . . ?
F005 C013 C01T C01R -178.7(2) . . . . ?
F006 C018 C019 C01G -177.05(19) . . . . ?
F006 C018 C019 B02A 0.9(3) . . . . ?
F006 C018 C01P F00J -1.3(3) . . . . ?
F006 C018 C01P C01M 178.5(2) . . . . ?
F007 C01I C01U F00N -0.6(3) . . . . ?
F007 C01I C01U C01N 179.0(2) . . . . ?
F008 C017 C01F F00E 2.2(3) . . . . ?
F008 C017 C01F C016 -179.5(2) . . . . ?
F009 C016 C01F F00E -2.0(3) . . . . ?
F009 C016 C01F C017 179.6(2) . . . . ?
F00A C01G C01L F00D 1.0(3) . . . . ?
F00A C01G C01L C01M -177.5(2) . . . . ?
F00B C01K C01N F00M -1.8(4) . . . . ?
F00B C01K C01N C01U 178.2(2) . . . . ?
F00C C01D C01V F00R -3.0(3) . . . . ?
F00C C01D C01V C01O 176.7(2) . . . . ?
F00D C01L C01M F00Q 0.1(3) . . . . ?
F00D C01L C01M C01P -178.9(2) . . . . ?
F00F C01Q C01X F00P 0.9(3) . . . . ?
F00F C01Q C01X C01O -178.9(2) . . . . ?
F00G C01S C01Y F00T -0.8(4) . . . . ?
F00G C01S C01Y C01R 178.9(2) . . . . ?
F00I C01O C01V F00R -0.2(4) . . . . ?
F00I C01O C01V C01D -179.9(2) . . . . ?
F00I C01O C01X F00P 1.0(4) . . . . ?
F00I C01O C01X C01Q -179.3(2) . . . . ?
F00K C01H C01J F00O -2.0(3) . . . . ?
F00K C01H C01J C01E 178.9(2) . . . . ?
F00K C01H C01W F00S 1.0(4) . . . . ?
F00K C01H C01W C02C 168.9(4) . . . . ?
F00K C01H C01W C1 -170.6(4) . . . . ?
F00L C01R C01T F00H 1.6(4) . . . . ?
F00L C01R C01T C013 -178.8(2) . . . . ?
F00L C01R C01Y F00T -0.8(4) . . . . ?
F00L C01R C01Y C01S 179.5(2) . . . . ?
F00M C01N C01U F00N -0.5(4) . . . . ?
F00M C01N C01U C01I 179.9(2) . . . . ?
F00Q C01M C01P F00J 0.7(4) . . . . ?
F00Q C01M C01P C018 -179.1(2) . . . . ?
F00S C01W C02C C01Z -178.1(4) . . . . ?
F00S C01W C02C F4 -3.9(8) . . . . ?
F00S C01W C1 F9 4.3(8) . . . . ?
F00S C01W C1 C0 177.7(4) . . . . ?
F00U C022 C02D C02E -179.7(3) . . . . ?
F00U C022 C02D F1 -10.2(5) . . . . ?
F00U C022 C02G C029 178.9(3) . . . . ?
F00U C022 C02G F2 17.7(5) . . . . ?
F00V C01Z C02C C01W 175.1(9) . . . . ?
F00V C01Z C02C F4 1.2(8) . . . . ?
F00W C023 C027 C02B -179.3(3) . . . . ?
F00X C021 C023 F00W -0.2(4) . . . . ?
F00X C021 C023 C027 179.5(3) . . . . ?
F00X C021 C026 C025 179.2(2) . . . . ?
C011 C013 C01T F00H 178.4(2) . . . . ?
C011 C013 C01T C01R -1.2(4) . . . . ?
C011 C01S C01Y F00T 180.0(2) . . . . ?
C011 C01S C01Y C01R -0.3(4) . . . . ?
C012 C014 C017 F008 177.8(2) . . . . ?
C012 C014 C017 C01F -2.2(3) . . . . ?
C012 C015 C016 F009 -178.89(19) . . . . ?
C012 C015 C016 C01F 0.4(3) . . . . ?
C013 C011 C01S F00G -178.9(2) . . . . ?
C013 C011 C01S C01Y 0.2(4) . . . . ?
C013 C011 B028 C02 -43.7(3) . . . . ?
C013 C011 B028 C012 71.1(3) . . . . ?
C013 C011 B028 C01E -161.8(2) . . . . ?
C013 C011 B028 N2 -43.7(3) . . . . ?
C014 C012 C015 F003 179.24(18) . . . . ?
C014 C012 C015 C016 -1.8(3) . . . . ?
C014 C012 B028 C02 -65.1(2) . . . . ?
C014 C012 B028 C011 178.58(19) . . . . ?
C014 C012 B028 C01E 49.4(3) . . . . ?
C014 C012 B028 N2 -65.1(2) . . . . ?
C014 C017 C01F F00E -177.9(2) . . . . ?
C014 C017 C01F C016 0.5(3) . . . . ?
C015 C012 C014 F002 -179.14(18) . . . . ?
C015 C012 C014 C017 2.7(3) . . . . ?
C015 C012 B028 C02 120.9(2) . . . . ?
C015 C012 B028 C011 4.6(3) . . . . ?
C015 C012 B028 C01E -124.5(2) . . . . ?
C015 C012 B028 N2 120.9(2) . . . . ?
C015 C016 C01F F00E 178.7(2) . . . . ?
C015 C016 C01F C017 0.3(3) . . . . ?
C018 C019 C01G F00A 176.61(19) . . . . ?
C018 C019 C01G C01L -2.9(3) . . . . ?
C018 C019 B02A N1 -107.6(2) . . . . ?
C018 C019 B02A C01A 9.0(3) . . . . ?
C018 C019 B02A C01B 138.0(2) . . . . ?
C018 C019 B02A C01 -107.6(2) . . . . ?
C019 C018 C01P F00J 179.2(2) . . . . ?
C019 C018 C01P C01M -1.0(4) . . . . ?
C019 C01G C01L F00D -179.4(2) . . . . ?
C019 C01G C01L C01M 2.0(4) . . . . ?
C01A C01D C01V F00R 178.7(2) . . . . ?
C01A C01D C01V C01O -1.6(4) . . . . ?
C01A C01Q C01X F00P 179.7(2) . . . . ?
C01A C01Q C01X C01O -0.1(4) . . . . ?
C01B C01C C01K F00B -178.0(2) . . . . ?
C01B C01C C01K C01N 1.0(4) . . . . ?
C01B C01I C01U F00N -178.7(2) . . . . ?
C01B C01I C01U C01N 0.9(4) . . . . ?
C01C C01B C01I F007 -178.6(2) . . . . ?
C01C C01B C01I C01U -0.6(3) . . . . ?
C01C C01B B02A N1 -143.4(2) . . . . ?
C01C C01B B02A C019 -31.1(3) . . . . ?
C01C C01B B02A C01A 100.0(3) . . . . ?
C01C C01B B02A C01 -143.4(2) . . . . ?
C01C C01K C01N F00M 179.2(2) . . . . ?
C01C C01K C01N C01U -0.8(4) . . . . ?
C01D C01A C01Q F00F 177.1(2) . . . . ?
C01D C01A C01Q C01X -1.6(3) . . . . ?
C01D C01A B02A N1 32.2(3) . . . . ?
C01D C01A B02A C019 -81.5(3) . . . . ?
C01D C01A B02A C01B 148.0(2) . . . . ?
C01D C01A B02A C01 32.2(3) . . . . ?
C01E C01Z C02C C01W -4.0(8) . . . . ?
C01E C01Z C02C F4 -177.9(8) . . . . ?
C01E C0 C1 C01W 4.8(7) . . . . ?
C01E C0 C1 F9 178.3(8) . . . . ?
C01G C019 B02A N1 70.2(2) . . . . ?
C01G C019 B02A C01A -173.2(2) . . . . ?
C01G C019 B02A C01B -44.2(3) . . . . ?
C01G C019 B02A C01 70.2(2) . . . . ?
C01G C01L C01M F00Q 178.6(2) . . . . ?
C01G C01L C01M C01P -0.3(4) . . . . ?
C01H C01W C02C C01Z 14.1(6) . . . . ?
C01H C01W C02C F4 -171.8(4) . . . . ?
C01H C01W C1 F9 175.9(4) . . . . ?
C01H C01W C1 C0 -10.8(5) . . . . ?
C01I C01B C01C F004 177.7(2) . . . . ?
C01I C01B C01C C01K -0.3(3) . . . . ?
C01I C01B B02A N1 38.6(3) . . . . ?
C01I C01B B02A C019 150.9(2) . . . . ?
C01I C01B B02A C01A -78.0(3) . . . . ?
C01I C01B B02A C01 38.6(3) . . . . ?
C01J C01E C01Z F00V 173.3(7) . . . . ?
C01J C01E C01Z C02C -7.6(8) . . . . ?
C01J C01E B028 C02 148.5(2) . . . . ?
C01J C01E B028 C011 -93.9(3) . . . . ?
C01J C01E B028 C012 36.0(3) . . . . ?
C01J C01E B028 N2 148.5(2) . . . . ?
C01J C01E C0 F3 179.0(6) . . . . ?
C01J C01E C0 C1 3.2(8) . . . . ?
C01J C01H C01W F00S -179.9(2) . . . . ?
C01J C01H C01W C02C -12.0(5) . . . . ?
C01J C01H C01W C1 8.6(5) . . . . ?
C01K C01N C01U F00N 179.4(2) . . . . ?
C01K C01N C01U C01I -0.1(4) . . . . ?
C01L C01M C01P F00J 179.6(2) . . . . ?
C01L C01M C01P C018 -0.2(4) . . . . ?
C01P C018 C019 C01G 2.4(3) . . . . ?
C01P C018 C019 B02A -179.7(2) . . . . ?
C01Q C01A C01D F00C -175.8(2) . . . . ?
C01Q C01A C01D C01V 2.5(3) . . . . ?
C01Q C01A B02A N1 -147.7(2) . . . . ?
C01Q C01A B02A C019 98.6(3) . . . . ?
C01Q C01A B02A C01B -32.0(3) . . . . ?
C01Q C01A B02A C01 -147.7(2) . . . . ?
C01S C011 C013 F005 177.9(2) . . . . ?
C01S C011 C013 C01T 0.5(3) . . . . ?
C01S C011 B028 C02 138.0(2) . . . . ?
C01S C011 B028 C012 -107.2(3) . . . . ?
C01S C011 B028 C01E 19.9(3) . . . . ?
C01S C011 B028 N2 138.0(2) . . . . ?
C01T C01R C01Y F00T 179.3(2) . . . . ?
C01T C01R C01Y C01S -0.4(4) . . . . ?
C01V C01O C01X F00P -178.6(2) . . . . ?
C01V C01O C01X C01Q 1.1(4) . . . . ?
C01W C01H C01J F00O 178.8(2) . . . . ?
C01W C01H C01J C01E -0.2(4) . . . . ?
C01X C01O C01V F00R 179.4(2) . . . . ?
C01X C01O C01V C01D -0.3(4) . . . . ?
C01Y C01R C01T F00H -178.5(2) . . . . ?
C01Y C01R C01T C013 1.1(4) . . . . ?
C01Z C01E C01J F00O -169.4(5) . . . . ?
C01Z C01E C01J C01H 9.6(6) . . . . ?
C01Z C01E B028 C011 79.6(6) . . . . ?
C01Z C01E B028 C012 -150.5(5) . . . . ?
C01Z C01E B028 N2 -38.0(6) . . . . ?
C021 C023 C027 C02B 0.9(4) . . . . ?
C022 C02D C02E C024 1.2(5) . . . . ?
C023 C021 C026 C025 -2.1(4) . . . . ?
C023 C027 C02B Ag01 -88.1(3) . . . . ?
C023 C027 C02B C025 -1.4(4) . . . . ?
C024 C029 C02G C022 0.4(5) . . . . ?
C024 C029 C02G F2 159.4(4) . . . . ?
C026 C021 C023 F00W -178.9(3) . . . . ?
C026 C021 C023 C027 0.9(4) . . . . ?
C026 C025 C02B Ag01 93.3(2) . . . . ?
C026 C025 C02B C027 0.1(4) . . . . ?
B028 C011 C013 F005 -0.6(3) . . . . ?
B028 C011 C013 C01T -178.0(2) . . . . ?
B028 C011 C01S F00G -0.4(4) . . . . ?
B028 C011 C01S C01Y 178.7(2) . . . . ?
B028 C012 C014 F002 6.2(3) . . . . ?
B028 C012 C014 C017 -172.0(2) . . . . ?
B028 C012 C015 F003 -6.5(3) . . . . ?
B028 C012 C015 C016 172.4(2) . . . . ?
B028 C01E C01J F00O 4.9(3) . . . . ?
B028 C01E C01J C01H -176.1(2) . . . . ?
B028 C01E C01Z F00V -0.7(11) . . . . ?
B028 C01E C01Z C02C 178.4(4) . . . . ?
B028 C01E C0 F3 -10.6(10) . . . . ?
B028 C01E C0 C1 173.6(4) . . . . ?
C029 C024 C02E C02D -1.1(5) . . . . ?
B02A C019 C01G F00A -1.4(3) . . . . ?
B02A C019 C01G C01L 179.0(2) . . . . ?
B02A C01A C01D F00C 4.3(3) . . . . ?
B02A C01A C01D C01V -177.5(2) . . . . ?
B02A C01A C01Q F00F -2.9(3) . . . . ?
B02A C01A C01Q C01X 178.4(2) . . . . ?
B02A C01B C01C F004 -0.4(3) . . . . ?
B02A C01B C01C C01K -178.4(2) . . . . ?
B02A C01B C01I F007 -0.5(3) . . . . ?
B02A C01B C01I C01U 177.5(2) . . . . ?
C02B C025 C026 C021 1.6(4) . . . . ?
C02D C022 C02G C029 -0.3(5) . . . . ?
C02D C022 C02G F2 -161.6(3) . . . . ?
C02E C024 C029 Ag01 -99.5(3) . . . . ?
C02E C024 C029 C02G 0.3(4) . . . . ?
F1 C02D C02E C024 -166.8(4) . . . . ?
C02G C022 C02D C02E -0.5(5) . . . . ?
C02G C022 C02D F1 169.0(3) . . . . ?
C5 C7 C6 C9 -3.4(17) . . . . ?
C7 C5 C8 C3 -4(2) . . . . ?
C7 C5 C8 F7 175.1(10) . . . . ?
C9 C3 C8 C5 2.6(17) . . . . ?
C9 C3 C8 F7 -176.3(8) . . . . ?
F6 C6A C2A C3A 179.4(7) . . . . ?
F5 C7A C6A F6 -1.8(10) . . . . ?
F5 C7A C6A C2A -179.2(7) . . . . ?
C6 C9 C3 C8 -1.7(14) . . . . ?
C6 C9 C3 F8 -179.4(7) . . . . ?
C3 C9 C6 C7 2.2(14) . . . . ?
C8 C5 C7 Ag01 97.7(15) . . . . ?
C8 C5 C7 C6 4(2) . . . . ?
F8 C3 C8 C5 -179.7(11) . . . . ?
F8 C3 C8 F7 1.5(10) . . . . ?
C4 C7A C6A F6 -179.4(11) . . . . ?
C4 C7A C6A C2A 3.1(17) . . . . ?
C7A C4 C8A C3A 1.8(19) . . . . ?
C7A C6A C2A C3A -3.2(14) . . . . ?
C6A C2A C3A C8A 2.7(13) . . . . ?
C2A C3A C8A C4 -2.0(16) . . . . ?
C8A C4 C7A F5 -179.9(10) . . . . ?
C8A C4 C7A C6A -2.4(19) . . . . ?
F3 C0 C1 C01W -171.4(7) . . . . ?
F3 C0 C1 F9 2.1(7) . . . . ?
C0 C01E C01J F00O 175.3(5) . . . . ?
C0 C01E C01J C01H -5.7(6) . . . . ?
C0 C01E B028 C02 -21.2(5) . . . . ?
C0 C01E B028 C011 96.5(5) . . . . ?
C0 C01E B028 C012 -133.7(5) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_p21_c_num_smr
_database_code_depnum_ccdc_archive 'CCDC 2471679'
loop_
_audit_author_name
_audit_author_address
'Robin Sievers'
;Freie Universitaet Berlin
Germany
;
_audit_update_record             
;
2025-07-10 deposited with the CCDC.	2025-11-06 downloaded from the CCDC.
;
_audit_creation_date             2024-10-16
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'0.9(C6 H4 Ag Cl4 Ni O4), B2 C37 F30 N, 0.1(C2 H4 Ag Cl4), 0.1(C H2 Cl2), 1[CH2Cl2]'
_chemical_formula_sum            'C43.70 H6.20 Ag B2 Cl6.20 F30 N Ni0.90 O3.60'
_chemical_formula_weight         1574.82
_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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ni Ni 0.3393 1.1124 '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'

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

_cell_length_a                   13.2880(5)
_cell_length_b                   28.0807(10)
_cell_length_c                   13.7219(4)
_cell_angle_alpha                90
_cell_angle_beta                 91.6140(10)
_cell_angle_gamma                90
_cell_volume                     5118.1(3)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9812
_cell_measurement_temperature    100.0
_cell_measurement_theta_max      25.37
_cell_measurement_theta_min      2.23
_shelx_estimated_absorpt_T_max   0.890
_shelx_estimated_absorpt_T_min   0.890
_exptl_absorpt_coefficient_mu    1.194
_exptl_absorpt_correction_T_max  0.2394
_exptl_absorpt_correction_T_min  0.1634
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1351 before and 0.0634 after correction.
The Ratio of minimum to maximum transmission is 0.6825.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    2.044
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             3047
_exptl_crystal_preparation       ?
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0445
_diffrn_reflns_av_unetI/netI     0.0279
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       33
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            64186
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.372
_diffrn_reflns_theta_min         2.076
_diffrn_ambient_temperature      100.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                7579
_reflns_number_total             9383
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.38A (Bruker, 2018)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.38A (Bruker, 2018)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.5 (Bourhis et al., 2015)'
_refine_diff_density_max         1.183
_refine_diff_density_min         -0.993
_refine_diff_density_rms         0.088
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     835
_refine_ls_number_reflns         9383
_refine_ls_number_restraints     2
_refine_ls_R_factor_all          0.0595
_refine_ls_R_factor_gt           0.0444
_refine_ls_restrained_S_all      1.059
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0423P)²+15.1622P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1064
_refine_ls_wR_factor_ref         0.1188
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H,H) groups
2. Shared sites
{N014, C39}
{C016, N1}
3. Restrained distances
 Cl5-C37
 1.78 with sigma of 0.02
 C37-Cl6
 1.78 with sigma of 0.02
4. Uiso/Uaniso restraints and constraints
Uanis(C02G) = Uanis(C37)
Uanis(N014) = Uanis(C39)
Uanis(C016) = Uanis(N1)
Uanis(C40) = Uanis(C02D)
Uanis(Cl4) = Uanis(Cl5)
Uanis(Cl1) = Uanis(Cl10)
Uanis(Cl3) = Uanis(Cl9)
5. Others
 Fixed Sof: Ag1(0.9) Ni01(0.9) Cl1(0.9) Cl2(0.9) Cl3(0.9) Cl4(0.9) N014(0.5)
 O1(0.9) C016(0.5) C1(0.9) O2(0.9) O4(0.9) C3(0.9) C02D(0.9) H02A(0.9)
 H02B(0.9) C02G(0.9) H02C(0.9) H02D(0.9) C2(0.9) C4(0.9) O3(0.9) Ag2(0.1)
 Cl5(0.1) Cl6(0.1) C37(0.1) H37A(0.1) H37B(0.1) Cl7(0.1) Cl8(0.1) C38(0.1)
 H38A(0.1) H38B(0.1) C39(0.5) N1(0.5) Cl9(0.1) Cl10(0.1) C40(0.1) H40A(0.1)
 H40B(0.1)
6.a Secondary CH2 refined with riding coordinates:
 C02D(H02A,H02B), C02G(H02C,H02D), C37(H37A,H37B), C38(H38A,H38B), C40(H40A,
 H40B)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 1.07142(3) 0.63803(2) 0.31669(3) 0.04811(13) Uani 0.9 1 d . . P A 1
Ni01 Ni 1.05293(4) 0.72970(2) 0.31676(5) 0.03781(16) Uani 0.9 1 d . . P A 1
Cl1 Cl 0.88360(14) 0.59462(7) 0.25231(16) 0.0409(4) Uani 0.9 1 d . . P A 1
Cl2 Cl 1.1925(2) 0.57395(7) 0.2585(2) 0.0454(5) Uani 0.9 1 d . . P A 1
Cl3 Cl 0.96835(11) 0.57616(6) 0.44711(11) 0.0457(3) Uani 0.9 1 d . . P A 1
Cl4 Cl 1.06967(17) 0.59048(9) 0.08170(17) 0.0768(7) Uani 0.9 1 d . . P A 1
F1 F 0.34218(15) 0.52664(7) 0.11899(15) 0.0264(4) Uani 1 1 d . . . . .
F2 F 0.73852(16) 0.68873(7) 0.56674(15) 0.0298(5) Uani 1 1 d . . . . .
F3 F 0.60505(16) 0.68823(7) 0.14817(15) 0.0297(5) Uani 1 1 d . . . . .
F4 F 0.46442(15) 0.76165(7) 0.47015(16) 0.0299(5) Uani 1 1 d . . . . .
F5 F 0.46842(16) 0.56430(8) -0.02660(15) 0.0289(5) Uani 1 1 d . . . . .
F6 F 0.54139(17) 0.83971(7) 0.39331(16) 0.0330(5) Uani 1 1 d . . . . .
F7 F 0.73332(16) 0.67179(7) 0.34351(16) 0.0308(5) Uani 1 1 d . . . . .
F8 F 0.53997(16) 0.70286(8) 0.63644(15) 0.0307(5) Uani 1 1 d . . . . .
F9 F 0.53393(16) 0.55837(8) 0.46705(16) 0.0315(5) Uani 1 1 d . . . . .
F10 F 0.32993(17) 0.43767(8) 0.17909(16) 0.0334(5) Uani 1 1 d . . . . .
F11 F 0.80770(16) 0.75087(8) 0.26652(17) 0.0352(5) Uani 1 1 d . . . . .
F12 F 0.66004(16) 0.54104(8) 0.28292(17) 0.0354(5) Uani 1 1 d . . . . .
F13 F 0.71340(17) 0.83613(8) 0.29166(16) 0.0337(5) Uani 1 1 d . . . . .
F14 F 0.65900(16) 0.52690(8) 0.06236(17) 0.0362(5) Uani 1 1 d . . . . .
F15 F 0.77230(18) 0.71252(8) 0.05631(16) 0.0376(5) Uani 1 1 d . . . . .
F16 F 0.32577(18) 0.59938(9) -0.14968(15) 0.0383(5) Uani 1 1 d . . . . .
F17 F 0.86147(17) 0.62890(9) 0.66162(17) 0.0383(5) Uani 1 1 d . . . . .
F18 F 0.33959(17) 0.62368(9) 0.39646(16) 0.0382(6) Uani 1 1 d . . . . .
F19 F 0.37223(19) 0.67596(8) 0.21176(16) 0.0396(6) Uani 1 1 d . . . . .
F20 F 0.4808(2) 0.39748(8) 0.28896(17) 0.0409(6) Uani 1 1 d . . . . .
F21 F 0.65979(19) 0.49897(8) 0.56200(18) 0.0410(6) Uani 1 1 d . . . . .
F22 F 0.20336(18) 0.67051(9) -0.09128(17) 0.0408(6) Uani 1 1 d . . . . .
F23 F 0.38018(18) 0.70788(9) 0.75118(16) 0.0412(6) Uani 1 1 d . . . . .
F24 F 0.82481(17) 0.55244(9) -0.02915(18) 0.0419(6) Uani 1 1 d . . . . .
F25 F 0.88254(17) 0.64503(10) -0.03549(17) 0.0434(6) Uani 1 1 d . . . . .
F26 F 0.23130(19) 0.70928(9) 0.08970(19) 0.0455(6) Uani 1 1 d . . . . .
F27 F 0.6451(2) 0.45066(9) 0.34241(18) 0.0443(6) Uani 1 1 d . . . . .
F28 F 0.82434(18) 0.53373(9) 0.66155(18) 0.0433(6) Uani 1 1 d . . . . .
F29 F 0.19827(18) 0.67323(11) 0.68774(18) 0.0490(7) Uani 1 1 d . . . . .
F30 F 0.18149(18) 0.63121(11) 0.50835(19) 0.0508(7) Uani 1 1 d . . . . .
N014 N 0.5247(2) 0.62030(11) 0.2691(2) 0.0233(7) Uani 0.5 1 d . . P B 1
O1 O 1.0015(3) 0.83160(15) 0.3033(3) 0.0486(9) Uani 0.9 1 d . . P A 1
C016 C 0.5307(2) 0.63523(11) 0.3467(2) 0.0239(7) Uani 0.5 1 d . . P B 1
C1 C 1.0168(9) 0.7928(3) 0.3058(8) 0.0272(17) Uani 0.9 1 d . . P A 1
C41 C 0.4104(3) 0.60035(13) 0.0051(3) 0.0237(7) Uani 1 1 d . . . . .
C42 C 0.6756(3) 0.79648(13) 0.3298(3) 0.0255(8) Uani 1 1 d . . . . .
C43 C 0.5507(3) 0.75648(13) 0.4221(2) 0.0238(7) Uani 1 1 d . . . . .
C44 C 0.6318(3) 0.62638(13) 0.5084(2) 0.0240(7) Uani 1 1 d . . . . .
C5 C 0.4209(3) 0.51009(13) 0.1740(2) 0.0223(7) Uani 1 1 d . . . . .
C6 C 0.7229(3) 0.75344(14) 0.3183(3) 0.0261(8) Uani 1 1 d . . . . .
C7 C 0.5960(3) 0.71218(12) 0.4132(2) 0.0223(7) Uani 1 1 d . . . . .
C8 C 0.4273(3) 0.61761(13) 0.0988(2) 0.0226(7) Uani 1 1 d . . . . .
C9 C 0.5884(3) 0.79773(13) 0.3817(3) 0.0256(8) Uani 1 1 d . . . . .
C10 C 0.4123(3) 0.46344(13) 0.2047(3) 0.0267(8) Uani 1 1 d . . . . .
C11 C 0.7160(3) 0.64202(13) 0.5619(3) 0.0250(8) Uani 1 1 d . . . . .
C12 C 0.4482(3) 0.66349(13) 0.5111(3) 0.0243(7) Uani 1 1 d . . . . .
C13 C 0.6164(3) 0.57734(13) 0.5123(3) 0.0264(8) Uani 1 1 d . . . . .
C14 C 0.5033(3) 0.53876(13) 0.1963(2) 0.0244(7) Uani 1 1 d . . . . .
C15 C 0.4518(3) 0.68426(13) 0.6028(3) 0.0258(8) Uani 1 1 d . . . . .
C16 C 0.3643(3) 0.65487(13) 0.1234(3) 0.0268(8) Uani 1 1 d . . . . .
C17 C 0.6832(3) 0.71323(13) 0.3599(3) 0.0240(7) Uani 1 1 d . . . . .
C18 C 0.6589(3) 0.65286(13) 0.1068(2) 0.0258(8) Uani 1 1 d . . . . .
C19 C 0.6246(3) 0.60596(13) 0.1123(2) 0.0238(7) Uani 1 1 d . . . . .
O2 O 0.9945(5) 0.7046(3) 0.1134(6) 0.076(2) Uani 0.9 1 d . . P A 1
C20 C 0.6792(3) 0.54598(13) 0.5615(3) 0.0307(8) Uani 1 1 d . . . . .
C21 C 0.3549(3) 0.64500(14) 0.4837(3) 0.0284(8) Uani 1 1 d . . . . .
C22 C 0.3378(3) 0.61728(13) -0.0591(3) 0.0264(8) Uani 1 1 d . . . . .
C23 C 0.5705(3) 0.46999(14) 0.2872(3) 0.0310(9) Uani 1 1 d . . . . .
C24 C 0.3709(3) 0.68768(14) 0.6623(3) 0.0312(9) Uani 1 1 d . . . . .
C25 C 0.6843(3) 0.57347(14) 0.0641(3) 0.0299(8) Uani 1 1 d . . . . .
C26 C 0.2904(3) 0.67319(14) 0.0610(3) 0.0299(8) Uani 1 1 d . . . . .
C27 C 0.5764(3) 0.51625(13) 0.2550(3) 0.0277(8) Uani 1 1 d . . . . .
C28 C 0.7703(3) 0.58608(15) 0.0156(3) 0.0321(9) Uani 1 1 d . . . . .
C29 C 0.2796(3) 0.66965(15) 0.6313(3) 0.0342(9) Uani 1 1 d . . . . .
C30 C 0.2764(3) 0.65412(14) -0.0302(3) 0.0299(8) Uani 1 1 d . . . . .
C31 C 0.7446(3) 0.66652(14) 0.0592(3) 0.0294(8) Uani 1 1 d . . . . .
C32 C 0.7624(3) 0.56348(14) 0.6121(3) 0.0325(9) Uani 1 1 d . . . . .
C33 C 0.2715(3) 0.64836(15) 0.5416(3) 0.0333(9) Uani 1 1 d . . . . .
C34 C 0.7808(3) 0.61171(15) 0.6122(3) 0.0306(8) Uani 1 1 d . . . . .
C35 C 0.8000(3) 0.63253(16) 0.0130(3) 0.0323(9) Uani 1 1 d . . . . .
C36 C 0.4876(3) 0.44320(13) 0.2611(3) 0.0319(9) Uani 1 1 d . . . . .
O4 O 0.9330(4) 0.69869(17) 0.4807(4) 0.0903(18) Uani 0.9 1 d . . P A 1
C3 C 1.1902(4) 0.72648(16) 0.3447(3) 0.0316(10) Uani 0.9 1 d . . P A 1
B1 B 0.5511(3) 0.66067(14) 0.4486(3) 0.0220(8) Uani 1 1 d . . . . .
B2 B 0.5178(3) 0.59466(14) 0.1659(3) 0.0234(8) Uani 1 1 d . . . . .
C02D C 0.8579(4) 0.5734(2) 0.3690(6) 0.0395(14) Uani 0.9 1 d . . P A 1
H02A H 0.834119 0.540021 0.364314 0.047 Uiso 0.9 1 calc R U P A 1
H02B H 0.803697 0.592731 0.397206 0.047 Uiso 0.9 1 calc R U P A 1
C02G C 1.1187(4) 0.5469(3) 0.1642(6) 0.071(2) Uani 0.9 1 d . . P A 1
H02C H 1.062469 0.529147 0.192899 0.085 Uiso 0.9 1 calc R U P A 1
H02D H 1.160573 0.524001 0.128434 0.085 Uiso 0.9 1 calc R U P A 1
C2 C 1.0184(6) 0.7106(3) 0.1940(7) 0.055(2) Uani 0.9 1 d . . P A 1
C4 C 0.9791(4) 0.70824(19) 0.4215(5) 0.0571(16) Uani 0.9 1 d . . P A 1
O3 O 1.2712(3) 0.72817(12) 0.3664(3) 0.0425(8) Uani 0.9 1 d . . P A 1
Ag2 Ag 1.0757(4) 0.6708(2) 0.3056(4) 0.0664(12) Uani 0.1 1 d . . P C 2
Cl5 Cl 1.0777(19) 0.6112(10) 0.0825(19) 0.0768(7) Uani 0.1 1 d D . P C 2
Cl6 Cl 1.188(2) 0.5936(7) 0.258(2) 0.059(7) Uani 0.1 1 d D . P C 2
C37 C 1.136(5) 0.5654(14) 0.152(3) 0.071(2) Uani 0.1 1 d D . P C 2
H37A H 1.189711 0.549988 0.114565 0.085 Uiso 0.1 1 calc R U P C 2
H37B H 1.086162 0.540963 0.169745 0.085 Uiso 0.1 1 calc R U P C 2
Cl7 Cl 1.018(3) 0.7790(14) 0.311(3) 0.096(14) Uani 0.1 1 d . . P C 2
Cl8 Cl 1.0086(14) 0.7200(11) 0.143(2) 0.058(6) Uani 0.1 1 d . . P C 2
C38 C 0.978(3) 0.7783(15) 0.178(3) 0.038(10) Uani 0.1 1 d . . P C 2
H38A H 0.904692 0.784384 0.168854 0.046 Uiso 0.1 1 calc R U P C 2
H38B H 1.015504 0.802136 0.140096 0.046 Uiso 0.1 1 calc R U P C 2
C39 C 0.5247(2) 0.62030(11) 0.2691(2) 0.0233(7) Uani 0.5 1 d . . P B 2
N1 N 0.5307(2) 0.63523(11) 0.3467(2) 0.0239(7) Uani 0.5 1 d . . P B 2
Cl9 Cl 0.9782(12) 0.5602(6) 0.4217(12) 0.0457(3) Uani 0.1 1 d . . P D 2
Cl10 Cl 0.9006(17) 0.6066(8) 0.2545(19) 0.0409(4) Uani 0.1 1 d . . P D 2
C40 C 0.880(5) 0.585(3) 0.374(6) 0.0395(14) Uani 0.1 1 d . . P D 2
H40A H 0.858325 0.611200 0.416194 0.047 Uiso 0.1 1 calc R U P D 2
H40B H 0.824207 0.560972 0.371062 0.047 Uiso 0.1 1 calc R U P D 2


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ni01 2.5858(8) . ?
Ag1 Cl1 2.8931(15) . ?
Ag1 Cl2 2.557(2) . ?
Ag1 Cl3 2.8696(16) . ?
Ni01 C1 1.841(9) . ?
Ni01 C3 1.856(5) . ?
Ni01 C2 1.814(9) . ?
Ni01 C4 1.863(6) . ?
Cl1 C02D 1.751(8) . ?
Cl2 C02G 1.772(6) . ?
Cl3 C02D 1.795(6) . ?
Cl4 C02G 1.777(9) . ?
F1 C5 1.354(4) . ?
F2 C11 1.347(4) . ?
F3 C18 1.358(4) . ?
F4 C43 1.346(4) . ?
F5 C41 1.352(4) . ?
F6 C9 1.346(4) . ?
F7 C17 1.363(4) . ?
F8 C15 1.352(4) . ?
F9 C13 1.354(4) . ?
F10 C10 1.350(4) . ?
F11 C6 1.350(4) . ?
F12 C27 1.357(4) . ?
F13 C42 1.335(4) . ?
F14 C25 1.350(5) . ?
F15 C31 1.344(4) . ?
F16 C22 1.346(4) . ?
F17 C34 1.341(4) . ?
F18 C21 1.348(4) . ?
F19 C16 1.351(4) . ?
F20 C36 1.344(4) . ?
F21 C20 1.345(4) . ?
F22 C30 1.346(4) . ?
F23 C24 1.347(4) . ?
F24 C28 1.349(4) . ?
F25 C35 1.345(4) . ?
F26 C26 1.348(4) . ?
F27 C23 1.345(4) . ?
F28 C32 1.343(4) . ?
F29 C29 1.351(4) . ?
F30 C33 1.357(5) . ?
N014 C016 1.144(5) . ?
N014 B2 1.590(5) . ?
O1 C1 1.109(10) . ?
C016 B1 1.587(5) . ?
C41 C8 1.387(5) . ?
C41 C22 1.373(5) . ?
C42 C6 1.374(5) . ?
C42 C9 1.377(5) . ?
C43 C7 1.389(5) . ?
C43 C9 1.384(5) . ?
C44 C11 1.392(5) . ?
C44 C13 1.394(5) . ?
C44 B1 1.644(5) . ?
C5 C10 1.382(5) . ?
C5 C14 1.387(5) . ?
C6 C17 1.377(5) . ?
C7 C17 1.388(5) . ?
C7 B1 1.643(5) . ?
C8 C16 1.388(5) . ?
C8 B2 1.626(5) . ?
C10 C36 1.371(6) . ?
C11 C34 1.382(5) . ?
C12 C15 1.387(5) . ?
C12 C21 1.387(5) . ?
C12 B1 1.636(5) . ?
C13 C20 1.377(5) . ?
C14 C27 1.396(5) . ?
C14 B2 1.637(5) . ?
C15 C24 1.371(5) . ?
C16 C26 1.384(5) . ?
C18 C19 1.396(5) . ?
C18 C31 1.384(5) . ?
C19 C25 1.389(5) . ?
C19 B2 1.647(5) . ?
O2 C2 1.155(11) . ?
C20 C32 1.379(6) . ?
C21 C33 1.385(5) . ?
C22 C30 1.382(5) . ?
C23 C27 1.375(6) . ?
C23 C36 1.373(6) . ?
C24 C29 1.371(6) . ?
C25 C28 1.385(5) . ?
C26 C30 1.369(6) . ?
C28 C35 1.364(6) . ?
C29 C33 1.370(6) . ?
C31 C35 1.371(6) . ?
C32 C34 1.376(6) . ?
O4 C4 1.065(7) . ?
C3 O3 1.109(5) . ?
B1 N1 1.587(5) . ?
B2 C39 1.590(5) . ?
C02D H02A 0.9900 . ?
C02D H02B 0.9900 . ?
C02G H02C 0.9900 . ?
C02G H02D 0.9900 . ?
Ag2 Cl6 2.72(2) . ?
Ag2 Cl8 2.75(3) . ?
Cl5 C37 1.77(2) . ?
Cl6 C37 1.78(2) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
Cl7 C38 1.90(6) . ?
Cl8 C38 1.76(5) . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C39 N1 1.144(5) . ?
Cl9 C40 1.60(8) . ?
Cl10 C40 1.78(9) . ?
C40 H40A 0.9900 . ?
C40 H40B 0.9900 . ?

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
Ni01 Ag1 Cl1 109.78(5) . . ?
Ni01 Ag1 Cl3 123.74(4) . . ?
Cl2 Ag1 Ni01 139.59(6) . . ?
Cl2 Ag1 Cl1 98.80(7) . . ?
Cl2 Ag1 Cl3 94.83(7) . . ?
Cl3 Ag1 Cl1 60.83(5) . . ?
C1 Ni01 Ag1 169.3(4) . . ?
C1 Ni01 C3 108.4(4) . . ?
C1 Ni01 C4 103.5(4) . . ?
C3 Ni01 Ag1 81.88(14) . . ?
C3 Ni01 C4 111.2(2) . . ?
C2 Ni01 Ag1 74.2(3) . . ?
C2 Ni01 C1 98.6(4) . . ?
C2 Ni01 C3 113.5(3) . . ?
C2 Ni01 C4 119.8(3) . . ?
C4 Ni01 Ag1 74.35(16) . . ?
C02D Cl1 Ag1 93.05(18) . . ?
C02G Cl2 Ag1 100.9(3) . . ?
C02D Cl3 Ag1 92.9(2) . . ?
C016 N014 B2 174.6(4) . . ?
N014 C016 B1 171.9(4) . . ?
O1 C1 Ni01 174.7(11) . . ?
F5 C41 C8 118.7(3) . . ?
F5 C41 C22 116.8(3) . . ?
C22 C41 C8 124.5(3) . . ?
F13 C42 C6 120.6(3) . . ?
F13 C42 C9 120.9(3) . . ?
C6 C42 C9 118.5(3) . . ?
F4 C43 C7 121.1(3) . . ?
F4 C43 C9 115.4(3) . . ?
C9 C43 C7 123.5(3) . . ?
C11 C44 C13 114.1(3) . . ?
C11 C44 B1 125.6(3) . . ?
C13 C44 B1 120.3(3) . . ?
F1 C5 C10 115.3(3) . . ?
F1 C5 C14 121.1(3) . . ?
C10 C5 C14 123.7(3) . . ?
F11 C6 C42 120.0(3) . . ?
F11 C6 C17 120.6(3) . . ?
C42 C6 C17 119.4(3) . . ?
C43 C7 B1 127.0(3) . . ?
C17 C7 C43 113.4(3) . . ?
C17 C7 B1 119.3(3) . . ?
C41 C8 C16 113.9(3) . . ?
C41 C8 B2 118.9(3) . . ?
C16 C8 B2 127.1(3) . . ?
F6 C9 C42 118.9(3) . . ?
F6 C9 C43 120.7(3) . . ?
C42 C9 C43 120.3(3) . . ?
F10 C10 C5 120.1(3) . . ?
F10 C10 C36 119.9(3) . . ?
C36 C10 C5 120.0(4) . . ?
F2 C11 C44 120.5(3) . . ?
F2 C11 C34 116.2(3) . . ?
C34 C11 C44 123.3(3) . . ?
C15 C12 B1 119.2(3) . . ?
C21 C12 C15 114.3(3) . . ?
C21 C12 B1 126.4(3) . . ?
F9 C13 C44 119.3(3) . . ?
F9 C13 C20 116.4(3) . . ?
C20 C13 C44 124.3(4) . . ?
C5 C14 C27 113.4(3) . . ?
C5 C14 B2 126.7(3) . . ?
C27 C14 B2 119.8(3) . . ?
F8 C15 C12 118.6(3) . . ?
F8 C15 C24 117.2(3) . . ?
C24 C15 C12 124.2(4) . . ?
F19 C16 C8 121.1(3) . . ?
F19 C16 C26 115.4(3) . . ?
C26 C16 C8 123.6(3) . . ?
F7 C17 C6 115.9(3) . . ?
F7 C17 C7 119.2(3) . . ?
C6 C17 C7 124.9(3) . . ?
F3 C18 C19 119.4(3) . . ?
F3 C18 C31 116.4(3) . . ?
C31 C18 C19 124.1(3) . . ?
C18 C19 B2 119.5(3) . . ?
C25 C19 C18 113.7(3) . . ?
C25 C19 B2 126.6(3) . . ?
F21 C20 C13 121.1(4) . . ?
F21 C20 C32 119.9(3) . . ?
C13 C20 C32 119.0(4) . . ?
F18 C21 C12 121.3(3) . . ?
F18 C21 C33 115.8(3) . . ?
C33 C21 C12 122.9(3) . . ?
F16 C22 C41 121.7(3) . . ?
F16 C22 C30 119.3(3) . . ?
C41 C22 C30 119.0(3) . . ?
F27 C23 C27 120.9(4) . . ?
F27 C23 C36 119.9(4) . . ?
C36 C23 C27 119.1(3) . . ?
F23 C24 C15 121.0(4) . . ?
F23 C24 C29 119.6(3) . . ?
C29 C24 C15 119.4(4) . . ?
F14 C25 C19 120.0(3) . . ?
F14 C25 C28 116.6(3) . . ?
C28 C25 C19 123.4(4) . . ?
F26 C26 C16 120.5(3) . . ?
F26 C26 C30 119.8(3) . . ?
C30 C26 C16 119.7(3) . . ?
F12 C27 C14 118.8(3) . . ?
F12 C27 C23 116.6(3) . . ?
C23 C27 C14 124.6(4) . . ?
F24 C28 C25 120.0(4) . . ?
F24 C28 C35 119.9(3) . . ?
C35 C28 C25 120.1(4) . . ?
F29 C29 C24 120.7(4) . . ?
F29 C29 C33 120.3(4) . . ?
C33 C29 C24 119.1(3) . . ?
F22 C30 C22 119.8(3) . . ?
F22 C30 C26 120.8(3) . . ?
C26 C30 C22 119.3(3) . . ?
F15 C31 C18 120.6(3) . . ?
F15 C31 C35 120.3(3) . . ?
C35 C31 C18 119.0(4) . . ?
F28 C32 C20 120.2(4) . . ?
F28 C32 C34 120.3(4) . . ?
C34 C32 C20 119.4(4) . . ?
F30 C33 C21 119.7(4) . . ?
F30 C33 C29 120.2(3) . . ?
C29 C33 C21 120.1(4) . . ?
F17 C34 C11 120.6(4) . . ?
F17 C34 C32 119.6(3) . . ?
C32 C34 C11 119.8(4) . . ?
F25 C35 C28 120.2(4) . . ?
F25 C35 C31 120.2(4) . . ?
C28 C35 C31 119.6(3) . . ?
F20 C36 C10 120.2(4) . . ?
F20 C36 C23 120.6(4) . . ?
C10 C36 C23 119.2(4) . . ?
O3 C3 Ni01 173.6(4) . . ?
C016 B1 C44 105.6(3) . . ?
C016 B1 C7 101.0(3) . . ?
C016 B1 C12 111.1(3) . . ?
C7 B1 C44 115.2(3) . . ?
C12 B1 C44 108.0(3) . . ?
C12 B1 C7 115.3(3) . . ?
N1 B1 C44 105.6(3) . . ?
N1 B1 C7 101.0(3) . . ?
N1 B1 C12 111.1(3) . . ?
N014 B2 C8 110.4(3) . . ?
N014 B2 C14 102.2(3) . . ?
N014 B2 C19 106.4(3) . . ?
C8 B2 C14 115.7(3) . . ?
C8 B2 C19 107.7(3) . . ?
C14 B2 C19 114.1(3) . . ?
C39 B2 C8 110.4(3) . . ?
C39 B2 C14 102.2(3) . . ?
C39 B2 C19 106.4(3) . . ?
Cl1 C02D Cl3 110.7(3) . . ?
Cl1 C02D H02A 109.5 . . ?
Cl1 C02D H02B 109.5 . . ?
Cl3 C02D H02A 109.5 . . ?
Cl3 C02D H02B 109.5 . . ?
H02A C02D H02B 108.1 . . ?
Cl2 C02G Cl4 110.9(4) . . ?
Cl2 C02G H02C 109.5 . . ?
Cl2 C02G H02D 109.5 . . ?
Cl4 C02G H02C 109.5 . . ?
Cl4 C02G H02D 109.5 . . ?
H02C C02G H02D 108.1 . . ?
O2 C2 Ni01 171.3(8) . . ?
O4 C4 Ni01 175.0(6) . . ?
Cl6 Ag2 Cl8 111.9(8) . . ?
C37 Cl6 Ag2 110(2) . . ?
Cl5 C37 Cl6 106(2) . . ?
Cl5 C37 H37A 110.6 . . ?
Cl5 C37 H37B 110.6 . . ?
Cl6 C37 H37A 110.6 . . ?
Cl6 C37 H37B 110.6 . . ?
H37A C37 H37B 108.7 . . ?
C38 Cl8 Ag2 108.6(18) . . ?
Cl7 C38 H38A 111.3 . . ?
Cl7 C38 H38B 111.3 . . ?
Cl8 C38 Cl7 102(3) . . ?
Cl8 C38 H38A 111.3 . . ?
Cl8 C38 H38B 111.3 . . ?
H38A C38 H38B 109.2 . . ?
N1 C39 B2 174.6(4) . . ?
C39 N1 B1 171.9(4) . . ?
Cl9 C40 Cl10 112(5) . . ?
Cl9 C40 H40A 109.2 . . ?
Cl9 C40 H40B 109.2 . . ?
Cl10 C40 H40A 109.2 . . ?
Cl10 C40 H40B 109.2 . . ?
H40A C40 H40B 107.9 . . ?

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
Ag1 Cl1 C02D Cl3 -14.7(4) . . . . ?
Ag1 Cl2 C02G Cl4 51.2(4) . . . . ?
Ag1 Cl3 C02D Cl1 14.8(4) . . . . ?
F1 C5 C10 F10 0.4(5) . . . . ?
F1 C5 C10 C36 -179.8(3) . . . . ?
F1 C5 C14 C27 178.9(3) . . . . ?
F1 C5 C14 B2 2.3(5) . . . . ?
F2 C11 C34 F17 -0.6(5) . . . . ?
F2 C11 C34 C32 179.1(3) . . . . ?
F3 C18 C19 C25 177.7(3) . . . . ?
F3 C18 C19 B2 1.8(5) . . . . ?
F3 C18 C31 F15 0.9(5) . . . . ?
F3 C18 C31 C35 -177.7(3) . . . . ?
F4 C43 C7 C17 178.9(3) . . . . ?
F4 C43 C7 B1 5.5(5) . . . . ?
F4 C43 C9 F6 1.6(5) . . . . ?
F4 C43 C9 C42 -179.2(3) . . . . ?
F5 C41 C8 C16 179.4(3) . . . . ?
F5 C41 C8 B2 1.4(5) . . . . ?
F5 C41 C22 F16 -0.9(5) . . . . ?
F5 C41 C22 C30 180.0(3) . . . . ?
F8 C15 C24 F23 -1.4(5) . . . . ?
F8 C15 C24 C29 179.6(3) . . . . ?
F9 C13 C20 F21 1.5(5) . . . . ?
F9 C13 C20 C32 -177.6(3) . . . . ?
F10 C10 C36 F20 1.6(5) . . . . ?
F10 C10 C36 C23 -179.5(3) . . . . ?
F11 C6 C17 F7 -1.3(5) . . . . ?
F11 C6 C17 C7 -179.2(3) . . . . ?
F13 C42 C6 F11 -1.1(5) . . . . ?
F13 C42 C6 C17 178.8(3) . . . . ?
F13 C42 C9 F6 0.2(5) . . . . ?
F13 C42 C9 C43 -179.1(3) . . . . ?
F14 C25 C28 F24 -0.7(5) . . . . ?
F14 C25 C28 C35 179.2(3) . . . . ?
F15 C31 C35 F25 0.0(6) . . . . ?
F15 C31 C35 C28 -179.2(3) . . . . ?
F16 C22 C30 F22 2.3(5) . . . . ?
F16 C22 C30 C26 -178.3(3) . . . . ?
F18 C21 C33 F30 -0.8(6) . . . . ?
F18 C21 C33 C29 -179.7(4) . . . . ?
F19 C16 C26 F26 -0.7(5) . . . . ?
F19 C16 C26 C30 -179.9(3) . . . . ?
F21 C20 C32 F28 0.3(6) . . . . ?
F21 C20 C32 C34 -179.1(3) . . . . ?
F23 C24 C29 F29 2.0(6) . . . . ?
F23 C24 C29 C33 -178.8(4) . . . . ?
F24 C28 C35 F25 1.1(6) . . . . ?
F24 C28 C35 C31 -179.6(3) . . . . ?
F26 C26 C30 F22 -1.0(6) . . . . ?
F26 C26 C30 C22 179.7(3) . . . . ?
F27 C23 C27 F12 -0.8(5) . . . . ?
F27 C23 C27 C14 178.9(3) . . . . ?
F27 C23 C36 F20 -1.0(5) . . . . ?
F27 C23 C36 C10 -179.9(3) . . . . ?
F28 C32 C34 F17 0.4(6) . . . . ?
F28 C32 C34 C11 -179.4(3) . . . . ?
F29 C29 C33 F30 0.7(6) . . . . ?
F29 C29 C33 C21 179.6(4) . . . . ?
C41 C8 C16 F19 -179.1(3) . . . . ?
C41 C8 C16 C26 0.5(5) . . . . ?
C41 C8 B2 N014 179.0(3) . . . . ?
C41 C8 B2 C14 -65.6(4) . . . . ?
C41 C8 B2 C19 63.3(4) . . . . ?
C41 C8 B2 C39 179.0(3) . . . . ?
C41 C22 C30 F22 -178.5(3) . . . . ?
C41 C22 C30 C26 0.9(6) . . . . ?
C42 C6 C17 F7 178.7(3) . . . . ?
C42 C6 C17 C7 0.9(6) . . . . ?
C43 C7 C17 F7 -178.1(3) . . . . ?
C43 C7 C17 C6 -0.4(5) . . . . ?
C43 C7 B1 C016 112.7(4) . . . . ?
C43 C7 B1 C44 -134.1(4) . . . . ?
C43 C7 B1 C12 -7.1(5) . . . . ?
C43 C7 B1 N1 112.7(4) . . . . ?
C44 C11 C34 F17 179.2(3) . . . . ?
C44 C11 C34 C32 -1.0(6) . . . . ?
C44 C13 C20 F21 -179.8(3) . . . . ?
C44 C13 C20 C32 1.1(6) . . . . ?
C5 C10 C36 F20 -178.2(3) . . . . ?
C5 C10 C36 C23 0.7(5) . . . . ?
C5 C14 C27 F12 -179.1(3) . . . . ?
C5 C14 C27 C23 1.2(5) . . . . ?
C5 C14 B2 N014 117.3(4) . . . . ?
C5 C14 B2 C8 -2.6(5) . . . . ?
C5 C14 B2 C19 -128.4(4) . . . . ?
C5 C14 B2 C39 117.3(4) . . . . ?
C6 C42 C9 F6 -179.9(3) . . . . ?
C6 C42 C9 C43 0.8(5) . . . . ?
C7 C43 C9 F6 -179.6(3) . . . . ?
C7 C43 C9 C42 -0.3(6) . . . . ?
C8 C41 C22 F16 179.2(3) . . . . ?
C8 C41 C22 C30 0.1(6) . . . . ?
C8 C16 C26 F26 179.6(3) . . . . ?
C8 C16 C26 C30 0.4(6) . . . . ?
C9 C42 C6 F11 179.0(3) . . . . ?
C9 C42 C6 C17 -1.1(5) . . . . ?
C9 C43 C7 C17 0.1(5) . . . . ?
C9 C43 C7 B1 -173.2(3) . . . . ?
C10 C5 C14 C27 -1.3(5) . . . . ?
C10 C5 C14 B2 -178.0(3) . . . . ?
C11 C44 C13 F9 176.7(3) . . . . ?
C11 C44 C13 C20 -1.9(5) . . . . ?
C11 C44 B1 C016 136.2(3) . . . . ?
C11 C44 B1 C7 25.6(5) . . . . ?
C11 C44 B1 C12 -104.9(4) . . . . ?
C11 C44 B1 N1 136.2(3) . . . . ?
C12 C15 C24 F23 179.2(3) . . . . ?
C12 C15 C24 C29 0.2(6) . . . . ?
C12 C21 C33 F30 177.2(4) . . . . ?
C12 C21 C33 C29 -1.7(6) . . . . ?
C13 C44 C11 F2 -178.3(3) . . . . ?
C13 C44 C11 C34 1.9(5) . . . . ?
C13 C44 B1 C016 -46.9(4) . . . . ?
C13 C44 B1 C7 -157.4(3) . . . . ?
C13 C44 B1 C12 72.0(4) . . . . ?
C13 C44 B1 N1 -46.9(4) . . . . ?
C13 C20 C32 F28 179.3(3) . . . . ?
C13 C20 C32 C34 0.0(6) . . . . ?
C14 C5 C10 F10 -179.4(3) . . . . ?
C14 C5 C10 C36 0.5(5) . . . . ?
C15 C12 C21 F18 180.0(3) . . . . ?
C15 C12 C21 C33 2.0(6) . . . . ?
C15 C12 B1 C016 179.4(3) . . . . ?
C15 C12 B1 C44 64.0(4) . . . . ?
C15 C12 B1 C7 -66.5(4) . . . . ?
C15 C12 B1 N1 179.4(3) . . . . ?
C15 C24 C29 F29 -178.9(4) . . . . ?
C15 C24 C29 C33 0.3(6) . . . . ?
C16 C8 B2 N014 1.4(5) . . . . ?
C16 C8 B2 C14 116.7(4) . . . . ?
C16 C8 B2 C19 -114.4(4) . . . . ?
C16 C8 B2 C39 1.4(5) . . . . ?
C16 C26 C30 F22 178.3(3) . . . . ?
C16 C26 C30 C22 -1.1(6) . . . . ?
C17 C7 B1 C016 -60.3(4) . . . . ?
C17 C7 B1 C44 52.9(4) . . . . ?
C17 C7 B1 C12 179.9(3) . . . . ?
C17 C7 B1 N1 -60.3(4) . . . . ?
C18 C19 C25 F14 -179.1(3) . . . . ?
C18 C19 C25 C28 0.5(5) . . . . ?
C18 C19 B2 N014 -50.7(4) . . . . ?
C18 C19 B2 C8 67.6(4) . . . . ?
C18 C19 B2 C14 -162.5(3) . . . . ?
C18 C19 B2 C39 -50.7(4) . . . . ?
C18 C31 C35 F25 178.6(3) . . . . ?
C18 C31 C35 C28 -0.6(6) . . . . ?
C19 C18 C31 F15 179.3(3) . . . . ?
C19 C18 C31 C35 0.7(6) . . . . ?
C19 C25 C28 F24 179.6(3) . . . . ?
C19 C25 C28 C35 -0.5(6) . . . . ?
C20 C32 C34 F17 179.8(3) . . . . ?
C20 C32 C34 C11 0.0(6) . . . . ?
C21 C12 C15 F8 179.3(3) . . . . ?
C21 C12 C15 C24 -1.3(6) . . . . ?
C21 C12 B1 C016 2.5(5) . . . . ?
C21 C12 B1 C44 -112.9(4) . . . . ?
C21 C12 B1 C7 116.5(4) . . . . ?
C21 C12 B1 N1 2.5(5) . . . . ?
C22 C41 C8 C16 -0.8(5) . . . . ?
C22 C41 C8 B2 -178.8(3) . . . . ?
C24 C29 C33 F30 -178.5(4) . . . . ?
C24 C29 C33 C21 0.4(6) . . . . ?
C25 C19 B2 N014 134.0(4) . . . . ?
C25 C19 B2 C8 -107.7(4) . . . . ?
C25 C19 B2 C14 22.2(5) . . . . ?
C25 C19 B2 C39 134.0(4) . . . . ?
C25 C28 C35 F25 -178.8(3) . . . . ?
C25 C28 C35 C31 0.5(6) . . . . ?
C27 C14 B2 N014 -59.1(4) . . . . ?
C27 C14 B2 C8 -179.0(3) . . . . ?
C27 C14 B2 C19 55.2(4) . . . . ?
C27 C14 B2 C39 -59.1(4) . . . . ?
C27 C23 C36 F20 178.1(3) . . . . ?
C27 C23 C36 C10 -0.8(6) . . . . ?
C31 C18 C19 C25 -0.7(5) . . . . ?
C31 C18 C19 B2 -176.5(3) . . . . ?
C36 C23 C27 F12 -179.9(3) . . . . ?
C36 C23 C27 C14 -0.1(6) . . . . ?
B1 C44 C11 F2 -1.2(5) . . . . ?
B1 C44 C11 C34 179.0(3) . . . . ?
B1 C44 C13 F9 -0.6(5) . . . . ?
B1 C44 C13 C20 -179.2(3) . . . . ?
B1 C7 C17 F7 -4.2(5) . . . . ?
B1 C7 C17 C6 173.5(3) . . . . ?
B1 C12 C15 F8 2.0(5) . . . . ?
B1 C12 C15 C24 -178.6(3) . . . . ?
B1 C12 C21 F18 -2.9(6) . . . . ?
B1 C12 C21 C33 179.1(4) . . . . ?
B2 C8 C16 F19 -1.4(6) . . . . ?
B2 C8 C16 C26 178.3(4) . . . . ?
B2 C14 C27 F12 -2.2(5) . . . . ?
B2 C14 C27 C23 178.1(3) . . . . ?
B2 C19 C25 F14 -3.6(6) . . . . ?
B2 C19 C25 C28 176.0(4) . . . . ?
Ag2 Cl6 C37 Cl5 30(4) . . . . ?
Ag2 Cl8 C38 Cl7 5(3) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 0.000 0.500 203.7 84.4 '2 CH2Cl2'
2 0.000 0.500 0.000 203.7 84.4 '2 CH2Cl2'

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
