# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2017

####################################################################### 
# 
# 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_Ag18(CCPh)14(PPh3)6Cl
_database_code_depnum_ccdc_archive 'CCDC 1563661'
_audit_update_record             
;
2017-10-01 deposited with the CCDC.
2017-10-31 downloaded from the CCDC.
;
_chemical_name_systematic        ?
_chemical_name_common            'Ag18(CCPh)14(PPh3)6Cl (SbPF6)4NEt3CH2Cl'
_chemical_formula_moiety         ?
_chemical_formula_sum            'C227 H177 Ag18 Cl2 F24 N P6 Sb4'
_chemical_formula_iupac          ?
_chemical_formula_weight         6060.07

_chemical_melting_point          ?

_space_group_crystal_system      triclinic
_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                   17.652(3)
_cell_length_b                   18.127(3)
_cell_length_c                   35.796(7)
_cell_angle_alpha                77.262(2)
_cell_angle_beta                 81.309(2)
_cell_angle_gamma                84.350(2)
_cell_volume                     11019.(3)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    29605
_cell_measurement_theta_min      2.2456
_cell_measurement_theta_max      27.5124
_cell_measurement_temperature    173.(2)

_exptl_crystal_description       plate
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.280
_exptl_crystal_size_mid          0.230
_exptl_crystal_size_min          0.180
_exptl_crystal_density_diffrn    1.827
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5872

_exptl_absorpt_coefficient_mu    2.177
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2014/4 (Bruker AXS Inc.)'
_exptl_absorpt_correction_T_min  0.61
_exptl_absorpt_correction_T_max  0.69

_exptl_special_details           
;
;

_diffrn_ambient_temperature      173.(2)

_diffrn_source                   'rotating-anode X-ray tube'
_diffrn_source_type              'Bruker Turbo X-ray Source'

_diffrn_radiation_type           MoKa
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  'multilayered conforcal mirror'

_diffrn_measurement_device_type  'Bruker D8 goniometer'
_diffrn_measurement_method       'omega scans'

_diffrn_detector_area_resol_mean 8.3333

_diffrn_reflns_number            62262
_diffrn_reflns_av_R_equivalents  0.0243
_diffrn_reflns_av_unetI/netI     0.0843
_diffrn_reflns_theta_min         1.70
_diffrn_reflns_theta_max         27.531
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.946
_diffrn_measured_fraction_theta_full 0.970
_diffrn_reflns_Laue_measured_fraction_max 0.946
_diffrn_reflns_Laue_measured_fraction_full 0.970
_diffrn_reflns_point_group_measured_fraction_max 0.946
_diffrn_reflns_point_group_measured_fraction_full 0.970
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       -46
_diffrn_reflns_limit_l_max       35

_refine_special_details          
;
;

_reflns_number_total             48056
_reflns_number_gt                21938
_reflns_threshold_expression     'I > 2σ(I)'

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_R_factor_all          0.1705
_refine_ls_R_factor_gt           0.0838
_refine_ls_wR_factor_gt          0.2026
_refine_ls_wR_factor_ref         0.2445
_refine_ls_goodness_of_fit_ref   1.019
_refine_ls_restrained_S_all      1.019
_refine_ls_number_reflns         48056
_refine_ls_number_parameters     2483
_refine_ls_number_restraints     378
_refine_ls_number_constraints    ?
_refine_ls_hydrogen_treatment    constr
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0739P)²+99.6189P] where P=(Fo²+2Fc²)/3'

_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   heavy

_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_diff_density_max         1.705
_refine_diff_density_min         -1.436
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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'
N N 0.0061 0.0033 '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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 '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'

_computing_data_collection       'APEX2(Bruker AXS)'
_computing_cell_refinement       'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_data_reduction        'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_structure_solution    'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'XSHELL V6.3.1(Bruker AXS)'
_computing_publication_material  'Generate Report (Bruker AXS)'

loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_refinement_flags_posn
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag Ag1 0.45409(6) 0.59639(6) 0.55810(3) 0.0647(3) Uani d . . . 1.0 . .
Ag Ag2 0.33987(6) 0.50025(6) 0.54492(3) 0.0658(3) Uani d . . . 1.0 . .
Ag Ag3 0.48230(5) 0.42482(6) 0.58394(3) 0.0638(3) Uani d . . . 1.0 . .
Ag Ag4 0.63516(6) 0.60843(6) 0.51645(3) 0.0673(3) Uani d . . . 1.0 . .
Ag Ag5 0.47771(5) 0.69202(6) 0.47143(3) 0.0681(3) Uani d . . . 1.0 . .
Ag Ag6 0.34842(6) 0.57623(6) 0.45353(3) 0.0666(3) Uani d . . . 1.0 . .
Ag Ag7 0.30844(6) 0.72209(6) 0.48331(3) 0.0686(3) Uani d . . . 1.0 . .
Ag Ag8 0.64267(6) 0.73016(6) 0.44488(3) 0.0637(3) Uani d . . . 1.0 . .
Ag Ag9 0.66372(6) 0.52597(6) 0.59944(3) 0.0697(3) Uani d . . . 1.0 . .
Ag Ag10 0.00323(6) 0.07102(6) 0.91488(3) 0.0676(3) Uani d . . . 1.0 . .
Ag Ag11 0.15351(6) 0.01010(6) 0.94909(3) 0.0614(3) Uani d . . . 1.0 . .
Ag Ag12 0.04642(6) -0.09736(6) 0.93967(3) 0.0673(3) Uani d . . . 1.0 . .
Ag Ag13 -0.15193(6) 0.06770(6) 0.95830(3) 0.0679(3) Uani d . . . 1.0 . .
Ag Ag14 -0.03029(6) 0.18921(6) 0.97672(3) 0.0734(3) Uani d . . . 1.0 . .
Ag Ag15 0.13402(6) 0.11866(6) 1.00863(3) 0.0607(3) Uani d . . . 1.0 . .
Ag Ag16 0.12536(6) 0.24225(5) 0.93834(3) 0.0705(3) Uani d . . . 1.0 . .
Ag Ag17 -0.19660(6) 0.21756(6) 0.98746(3) 0.0669(3) Uani d . . . 1.0 . .
Ag Ag18 -0.18246(6) -0.04192(7) 0.91373(3) 0.0727(3) Uani d . . . 1.0 . .
P P1 0.25667(18) 0.82558(19) 0.43761(11) 0.0607(9) Uani d . . D 1.0 . .
P P2 0.68891(18) 0.8443(2) 0.45343(11) 0.0599(9) Uani d . . . 1.0 . .
P P3 0.7836(2) 0.5469(2) 0.61852(11) 0.0671(10) Uani d . . . 1.0 . .
P P4 0.1652(2) 0.36406(19) 0.94066(11) 0.0651(9) Uani d . . . 1.0 . .
P P5 -0.26105(19) 0.31331(19) 0.94294(11) 0.0631(9) Uani d . . . 1.0 . .
P P6 -0.3088(2) -0.0852(2) 0.91691(11) 0.0644(9) Uani d . . . 1.0 . .
Cl Cl1 0.5 0.5 0.5 0.0520(10) Uani d . P S 1.0 . .
Cl Cl2 0 0 1.0 0.0520(10) Uani d . P S 1.0 . .
C C1 0.3817(7) 0.5108(8) 0.5985(4) 0.068(4) Uani d . . . 1.0 . .
C C2 0.3625(7) 0.4927(9) 0.6330(5) 0.075(4) Uani d . . . 1.0 . .
C C3 0.3369(13) 0.4655(13) 0.6741(5) 0.069(7) Uani d U P G 0.62(2) A 1
C C4 0.3814(12) 0.4104(13) 0.6963(7) 0.093(8) Uani d U P G 0.62(2) A 1
H H4 0.4258 0.3864 0.6843 0.112 Uiso calc U P R 0.62(2) A 1
C C5 0.3609(13) 0.3905(14) 0.7361(6) 0.109(10) Uani d U P G 0.62(2) A 1
H H5 0.3914 0.3529 0.7513 0.131 Uiso calc U P R 0.62(2) A 1
C C6 0.2959(14) 0.4257(17) 0.7537(5) 0.127(11) Uani d U P G 0.62(2) A 1
H H6 0.282 0.4121 0.7809 0.153 Uiso calc U P R 0.62(2) A 1
C C7 0.2514(12) 0.4808(16) 0.7314(6) 0.114(10) Uani d U P G 0.62(2) A 1
H H7 0.207 0.5048 0.7434 0.137 Uiso calc U P R 0.62(2) A 1
C C8 0.2719(12) 0.5007(13) 0.6916(6) 0.090(8) Uani d U P G 0.62(2) A 1
H H8 0.2414 0.5383 0.6765 0.108 Uiso calc U P R 0.62(2) A 1
C C303 0.347(2) 0.492(2) 0.6762(8) 0.069(7) Uani d . P G 0.38(2) A 2
C C304 0.389(2) 0.438(2) 0.7001(12) 0.093(8) Uani d . P G 0.38(2) A 2
H H304 0.4293 0.407 0.6892 0.112 Uiso calc U P R 0.38(2) A 2
C C305 0.373(2) 0.430(2) 0.7400(11) 0.109(10) Uani d . P G 0.38(2) A 2
H H305 0.4022 0.3927 0.7564 0.131 Uiso calc U P R 0.38(2) A 2
C C306 0.315(2) 0.475(3) 0.7560(8) 0.127(11) Uani d . P G 0.38(2) A 2
H H306 0.3037 0.4692 0.7832 0.153 Uiso calc U P R 0.38(2) A 2
C C307 0.2723(19) 0.529(3) 0.7320(10) 0.114(10) Uani d . P G 0.38(2) A 2
H H307 0.2323 0.56 0.7429 0.137 Uiso calc U P R 0.38(2) A 2
C C308 0.288(2) 0.537(2) 0.6921(10) 0.090(8) Uani d . P G 0.38(2) A 2
H H308 0.2593 0.5743 0.6758 0.108 Uiso calc U P R 0.38(2) A 2
C C9 0.5766(7) 0.6208(8) 0.5688(5) 0.066(4) Uani d . . . 1.0 . .
C C10 0.5543(8) 0.6407(8) 0.6000(5) 0.074(4) Uani d . . . 1.0 . .
C C11 0.5257(15) 0.6580(16) 0.6380(7) 0.069(6) Uani d U P G 0.70(5) B 1
C C12 0.5299(17) 0.7325(15) 0.6413(7) 0.102(8) Uani d U P G 0.70(5) B 1
H H12 0.5506 0.7687 0.6197 0.122 Uiso calc U P R 0.70(5) B 1
C C13 0.504(2) 0.7538(16) 0.6762(8) 0.141(11) Uani d U P G 0.70(5) B 1
H H13 0.5066 0.8047 0.6785 0.169 Uiso calc U P R 0.70(5) B 1
C C14 0.473(2) 0.701(2) 0.7079(7) 0.131(11) Uani d U P G 0.70(5) B 1
H H14 0.4556 0.7153 0.7318 0.158 Uiso calc U P R 0.70(5) B 1
C C15 0.4693(18) 0.6263(19) 0.7046(7) 0.112(9) Uani d U P G 0.70(5) B 1
H H15 0.4486 0.59 0.7262 0.134 Uiso calc U P R 0.70(5) B 1
C C16 0.4955(16) 0.6050(16) 0.6696(7) 0.101(8) Uani d U P G 0.70(5) B 1
H H16 0.4926 0.5541 0.6674 0.122 Uiso calc U P R 0.70(5) B 1
C C311 0.540(3) 0.681(4) 0.6306(16) 0.069(6) Uani d . P G 0.30(5) B 2
C C312 0.553(4) 0.755(3) 0.6321(17) 0.102(8) Uani d . P G 0.30(5) B 2
H H312 0.5763 0.7877 0.6098 0.122 Uiso calc U P R 0.30(5) B 2
C C313 0.531(5) 0.781(3) 0.666(2) 0.141(11) Uani d . P G 0.30(5) B 2
H H313 0.5396 0.8311 0.6672 0.169 Uiso calc U P R 0.30(5) B 2
C C314 0.496(4) 0.733(5) 0.6988(17) 0.131(11) Uani d . P G 0.30(5) B 2
H H314 0.4815 0.7505 0.7221 0.158 Uiso calc U P R 0.30(5) B 2
C C315 0.484(4) 0.659(4) 0.6974(16) 0.112(9) Uani d . P G 0.30(5) B 2
H H315 0.46 0.6264 0.7197 0.134 Uiso calc U P R 0.30(5) B 2
C C316 0.505(4) 0.633(3) 0.6632(18) 0.101(8) Uani d . P G 0.30(5) B 2
H H316 0.4967 0.583 0.6622 0.122 Uiso calc U P R 0.30(5) B 2
C C17 0.4099(7) 0.7143(8) 0.5213(5) 0.072(4) Uani d . . . 1.0 . .
C C18 0.3732(8) 0.7362(8) 0.5483(5) 0.071(4) Uani d . . . 1.0 . .
C C19 0.3260(8) 0.7606(9) 0.5814(5) 0.080(5) Uani d . . . 1.0 . .
C C20 0.3327(9) 0.7248(10) 0.6188(5) 0.088(5) Uani d . . . 1.0 . .
H H20 0.3702 0.6839 0.6237 0.105 Uiso calc U . R 1.0 . .
C C21 0.2861(10) 0.7472(13) 0.6493(6) 0.111(6) Uani d . . . 1.0 . .
H H21 0.291 0.723 0.6753 0.133 Uiso calc U . R 1.0 . .
C C22 0.2305(12) 0.8078(14) 0.6401(8) 0.131(8) Uani d . . . 1.0 . .
H H22 0.1957 0.8229 0.6605 0.157 Uiso calc U . R 1.0 . .
C C23 0.2250(12) 0.8454(13) 0.6031(7) 0.122(7) Uani d U . . 1.0 . .
H H23 0.1896 0.8882 0.5981 0.146 Uiso calc U . R 1.0 . .
C C24 0.2715(10) 0.8206(11) 0.5727(6) 0.109(6) Uani d . . . 1.0 . .
H H24 0.2663 0.8441 0.5466 0.131 Uiso calc U . R 1.0 . .
C C25 0.2739(8) 0.5938(7) 0.5017(4) 0.063(3) Uani d . . . 1.0 . .
C C26 0.2231(7) 0.6148(8) 0.5254(4) 0.061(3) Uani d . . . 1.0 . .
C C27 0.1666(7) 0.6417(8) 0.5536(4) 0.064(3) Uani d . . . 1.0 . .
C C28 0.1833(9) 0.6376(9) 0.5904(5) 0.082(4) Uani d . . . 1.0 . .
H H28 0.231 0.6149 0.5979 0.099 Uiso calc U . R 1.0 . .
C C29 0.1296(9) 0.6670(10) 0.6160(5) 0.092(5) Uani d . . . 1.0 . .
H H29 0.1398 0.6621 0.6417 0.11 Uiso calc U . R 1.0 . .
C C30 0.0633(10) 0.7022(11) 0.6060(6) 0.099(5) Uani d . . . 1.0 . .
H H30 0.0293 0.7245 0.6243 0.119 Uiso calc U . R 1.0 . .
C C31 0.0436(10) 0.7069(12) 0.5709(6) 0.111(6) Uani d . . . 1.0 . .
H H31 -0.0048 0.7299 0.5646 0.134 Uiso calc U . R 1.0 . .
C C32 0.0968(9) 0.6768(10) 0.5431(5) 0.097(5) Uani d . . . 1.0 . .
H H32 0.0849 0.6806 0.5177 0.117 Uiso calc U . R 1.0 . .
C C33 0.7089(7) 0.6082(7) 0.4643(4) 0.061(3) Uani d . . . 1.0 . .
C C34 0.7592(7) 0.6149(7) 0.4374(4) 0.062(3) Uani d . . . 1.0 . .
C C35 0.8195(8) 0.6239(8) 0.4057(4) 0.071(4) Uani d . . . 1.0 . .
C C36 0.8636(10) 0.6860(11) 0.3968(6) 0.110(6) Uani d . . . 1.0 . .
H H36 0.8557 0.7227 0.4125 0.132 Uiso calc U . R 1.0 . .
C C37 0.9196(11) 0.6944(16) 0.3645(7) 0.143(9) Uani d . . . 1.0 . .
H H37 0.9495 0.7374 0.3576 0.171 Uiso calc U . R 1.0 . .
C C38 0.9314(12) 0.6382(18) 0.3423(7) 0.148(10) Uani d . . . 1.0 . .
H H38 0.9712 0.6424 0.321 0.178 Uiso calc U . R 1.0 . .
C C39 0.8873(12) 0.5785(14) 0.3507(6) 0.121(7) Uani d U . . 1.0 . .
H H39 0.8943 0.5414 0.3352 0.145 Uiso calc U . R 1.0 . .
C C40 0.8327(9) 0.5733(10) 0.3820(5) 0.092(5) Uani d . . . 1.0 . .
H H40 0.8013 0.5315 0.3877 0.11 Uiso calc U . R 1.0 . .
C C41 0.5405(8) 0.6995(8) 0.4172(5) 0.067(4) Uani d . . . 1.0 . .
C C42 0.5749(8) 0.7217(8) 0.3845(5) 0.063(3) Uani d . . . 1.0 . .
C C43 0.6144(8) 0.7491(9) 0.3474(4) 0.074(4) Uani d . . . 1.0 . .
C C44 0.6899(11) 0.7264(12) 0.3375(5) 0.110(6) Uani d U . . 1.0 . .
H H44 0.7129 0.6887 0.3562 0.132 Uiso calc U . R 1.0 . .
C C45 0.7355(14) 0.7523(16) 0.3036(7) 0.148(9) Uani d U . . 1.0 . .
H H45 0.7864 0.7314 0.2979 0.177 Uiso calc U . R 1.0 . .
C C46 0.7025(14) 0.8112(16) 0.2781(6) 0.133(8) Uani d . . . 1.0 . .
H H46 0.7319 0.8334 0.2545 0.159 Uiso calc U . R 1.0 . .
C C47 0.6285(13) 0.8376(10) 0.2864(5) 0.107(6) Uani d . . . 1.0 . .
H H47 0.607 0.8777 0.2683 0.128 Uiso calc U . R 1.0 . .
C C48 0.5837(10) 0.8076(9) 0.3204(5) 0.092(5) Uani d . . . 1.0 . .
H H48 0.5319 0.8267 0.3254 0.11 Uiso calc U . R 1.0 . .
C C49 0.3995(7) 0.5843(8) 0.3960(4) 0.065(4) Uani d . . . 1.0 . .
C C50 0.4048(7) 0.6103(8) 0.3618(5) 0.074(4) Uani d . . . 1.0 . .
C C51 0.4090(7) 0.6502(9) 0.3214(5) 0.079(4) Uani d . . . 1.0 . .
C C52 0.4093(11) 0.7286(11) 0.3129(6) 0.117(7) Uani d . . . 1.0 . .
H H52 0.4066 0.7538 0.3338 0.141 Uiso calc U . R 1.0 . .
C C53 0.4133(13) 0.7711(15) 0.2767(8) 0.144(8) Uani d U . . 1.0 . .
H H53 0.412 0.8248 0.2723 0.172 Uiso calc U . R 1.0 . .
C C54 0.4194(13) 0.7342(16) 0.2462(7) 0.138(8) Uani d U . . 1.0 . .
H H54 0.4249 0.7631 0.2205 0.166 Uiso calc U . R 1.0 . .
C C55 0.4176(11) 0.6565(15) 0.2524(6) 0.124(7) Uani d . . . 1.0 . .
H H55 0.4202 0.632 0.2313 0.149 Uiso calc U . R 1.0 . .
C C56 0.4118(10) 0.6134(11) 0.2917(5) 0.102(6) Uani d . . . 1.0 . .
H H56 0.41 0.5599 0.2969 0.123 Uiso calc U . R 1.0 . .
C C57 0.1929(7) 0.8914(7) 0.4618(5) 0.066(4) Uani d . . . 1.0 . .
C C58 0.1533(9) 0.8666(10) 0.4961(5) 0.090(5) Uani d . . . 1.0 . .
H H58 0.1584 0.814 0.5072 0.108 Uiso calc U . R 1.0 . .
C C59 0.1052(11) 0.9130(13) 0.5165(6) 0.114(6) Uani d . . . 1.0 . .
H H59 0.0777 0.8931 0.541 0.137 Uiso calc U . R 1.0 . .
C C60 0.0986(10) 0.9879(12) 0.5003(7) 0.106(6) Uani d . . . 1.0 . .
H H60 0.068 1.0212 0.5145 0.127 Uiso calc U . R 1.0 . .
C C61 0.1345(11) 1.0172(11) 0.4643(7) 0.119(7) Uani d U . . 1.0 . .
H H61 0.1269 1.0695 0.4531 0.142 Uiso calc U . R 1.0 . .
C C62 0.1817(9) 0.9696(9) 0.4446(6) 0.108(6) Uani d . . . 1.0 . .
H H62 0.207 0.9889 0.4195 0.129 Uiso calc U . R 1.0 . .
C C63 0.337(2) 0.880(2) 0.4076(12) 0.068(4) Uani d U P DG 0.40(4) C 1
C C64 0.413(2) 0.871(3) 0.4148(13) 0.063(7) Uani d . P G 0.40(4) C 1
H H64 0.427 0.8345 0.4365 0.076 Uiso calc U P R 0.40(4) C 1
C C65 0.4675(17) 0.915(3) 0.3902(16) 0.084(6) Uani d U P G 0.40(4) C 1
H H65 0.5194 0.9084 0.3951 0.1 Uiso calc U P R 0.40(4) C 1
C C66 0.446(2) 0.968(3) 0.3584(14) 0.103(8) Uani d . P G 0.40(4) C 1
H H66 0.4839 0.9977 0.3416 0.124 Uiso calc U P R 0.40(4) C 1
C C67 0.371(3) 0.977(3) 0.3512(12) 0.105(9) Uani d U P G 0.40(4) C 1
H H67 0.3561 1.013 0.3294 0.126 Uiso calc U P R 0.40(4) C 1
C C68 0.3156(19) 0.933(2) 0.3758(13) 0.076(7) Uani d U P G 0.40(4) C 1
H H68 0.2637 0.9391 0.3708 0.091 Uiso calc U P R 0.40(4) C 1
C C363 0.3303(13) 0.8787(13) 0.4040(8) 0.068(4) Uani d . P DG 0.60(4) C 2
C C364 0.3958(18) 0.8816(18) 0.4207(7) 0.063(7) Uani d . P G 0.60(4) C 2
H H364 0.3975 0.8593 0.4472 0.076 Uiso calc U P R 0.60(4) C 2
C C365 0.4589(13) 0.917(2) 0.3986(9) 0.084(6) Uani d . P G 0.60(4) C 2
H H365 0.5037 0.9191 0.41 0.1 Uiso calc U P R 0.60(4) C 2
C C366 0.4565(13) 0.9498(19) 0.3598(9) 0.103(8) Uani d . P G 0.60(4) C 2
H H366 0.4996 0.974 0.3447 0.124 Uiso calc U P R 0.60(4) C 2
C C367 0.3910(17) 0.9468(19) 0.3431(7) 0.105(9) Uani d . P G 0.60(4) C 2
H H367 0.3893 0.9691 0.3166 0.126 Uiso calc U P R 0.60(4) C 2
C C368 0.3279(13) 0.9113(16) 0.3652(9) 0.076(7) Uani d . P G 0.60(4) C 2
H H368 0.2831 0.9093 0.3538 0.091 Uiso calc U P R 0.60(4) C 2
C C69 0.2032(7) 0.7968(7) 0.4051(4) 0.059(3) Uani d . . . 1.0 . .
C C70 0.2356(8) 0.7369(9) 0.3864(5) 0.081(4) Uani d . . . 1.0 . .
H H70 0.2835 0.712 0.3923 0.098 Uiso calc U . R 1.0 . .
C C71 0.1999(9) 0.7152(9) 0.3607(5) 0.089(5) Uani d . . . 1.0 . .
H H71 0.2225 0.6749 0.3487 0.107 Uiso calc U . R 1.0 . .
C C72 0.1322(11) 0.7500(9) 0.3515(5) 0.098(5) Uani d . . . 1.0 . .
H H72 0.1067 0.7331 0.3337 0.117 Uiso calc U . R 1.0 . .
C C73 0.0992(9) 0.8107(11) 0.3679(6) 0.106(6) Uani d . . . 1.0 . .
H H73 0.0533 0.8376 0.36 0.127 Uiso calc U . R 1.0 . .
C C74 0.1339(7) 0.8307(10) 0.3955(5) 0.096(6) Uani d . . . 1.0 . .
H H74 0.1094 0.8691 0.4083 0.115 Uiso calc U . R 1.0 . .
C C75 0.6400(7) 0.8770(7) 0.4953(4) 0.058(3) Uani d . . . 1.0 . .
C C76 0.5676(8) 0.8531(9) 0.5107(5) 0.088(5) Uani d . . . 1.0 . .
H H76 0.5464 0.8175 0.5 0.105 Uiso calc U . R 1.0 . .
C C77 0.5253(11) 0.8802(12) 0.5415(6) 0.116(6) Uani d U . . 1.0 . .
H H77 0.4739 0.867 0.5503 0.139 Uiso calc U . R 1.0 . .
C C78 0.5593(11) 0.9265(12) 0.5589(6) 0.119(7) Uani d . . . 1.0 . .
H H78 0.5325 0.9424 0.5811 0.143 Uiso calc U . R 1.0 . .
C C79 0.6311(10) 0.9499(10) 0.5444(5) 0.098(5) Uani d . . . 1.0 . .
H H79 0.652 0.985 0.5556 0.118 Uiso calc U . R 1.0 . .
C C80 0.6740(8) 0.9232(8) 0.5138(4) 0.077(4) Uani d . . . 1.0 . .
H H80 0.7256 0.936 0.5054 0.092 Uiso calc U . R 1.0 . .
C C81 0.7907(8) 0.8348(8) 0.4597(4) 0.065(3) Uani d . . . 1.0 . .
C C82 0.8151(9) 0.7735(10) 0.4866(5) 0.088(5) Uani d . . . 1.0 . .
H H82 0.7781 0.7402 0.5014 0.105 Uiso calc U . R 1.0 . .
C C83 0.8904(11) 0.7586(12) 0.4927(6) 0.110(6) Uani d . . . 1.0 . .
H H83 0.9052 0.7176 0.5124 0.133 Uiso calc U . R 1.0 . .
C C84 0.9440(9) 0.8049(12) 0.4695(6) 0.109(6) Uani d . . . 1.0 . .
H H84 0.9969 0.7951 0.4723 0.131 Uiso calc U . R 1.0 . .
C C85 0.9207(9) 0.8649(11) 0.4424(6) 0.095(5) Uani d . . . 1.0 . .
H H85 0.9579 0.8977 0.4274 0.115 Uiso calc U . R 1.0 . .
C C86 0.8449(8) 0.8796(9) 0.4359(5) 0.083(4) Uani d . . . 1.0 . .
H H86 0.8305 0.9195 0.4156 0.099 Uiso calc U . R 1.0 . .
C C87 0.6780(7) 0.9231(8) 0.4134(4) 0.062(3) Uani d . . . 1.0 . .
C C88 0.6470(8) 0.9963(8) 0.4179(5) 0.075(4) Uani d . . . 1.0 . .
H H88 0.6334 1.0072 0.4429 0.09 Uiso calc U . R 1.0 . .
C C89 0.6368(9) 1.0513(9) 0.3855(5) 0.081(4) Uani d . . . 1.0 . .
H H89 0.6166 1.1002 0.389 0.097 Uiso calc U . R 1.0 . .
C C90 0.6534(10) 1.0404(10) 0.3494(5) 0.093(5) Uani d . . . 1.0 . .
H H90 0.6453 1.0803 0.328 0.111 Uiso calc U . R 1.0 . .
C C91 0.6834(10) 0.9679(11) 0.3442(5) 0.099(6) Uani d . . . 1.0 . .
H H91 0.6957 0.9585 0.3188 0.119 Uiso calc U . R 1.0 . .
C C92 0.6952(8) 0.9097(9) 0.3758(4) 0.076(4) Uani d . . . 1.0 . .
H H92 0.715 0.8609 0.3719 0.091 Uiso calc U . R 1.0 . .
C C93 0.8655(8) 0.5106(9) 0.5900(4) 0.069(4) Uani d . . . 1.0 . .
C C94 0.9417(8) 0.5301(10) 0.5892(5) 0.096(5) Uani d . . . 1.0 . .
H H94 0.9504 0.5653 0.604 0.116 Uiso calc U . R 1.0 . .
C C95 1.0035(10) 0.5000(10) 0.5678(6) 0.111(6) Uani d . . . 1.0 . .
H H95 1.0536 0.5165 0.5659 0.133 Uiso calc U . R 1.0 . .
C C96 0.9893(11) 0.4442(12) 0.5487(6) 0.114(6) Uani d . . . 1.0 . .
H H96 1.0306 0.4208 0.5343 0.137 Uiso calc U . R 1.0 . .
C C97 0.9190(14) 0.4240(14) 0.5507(7) 0.143(8) Uani d U . . 1.0 . .
H H97 0.9111 0.3842 0.5386 0.171 Uiso calc U . R 1.0 . .
C C98 0.8561(10) 0.4587(13) 0.5698(6) 0.122(7) Uani d . . . 1.0 . .
H H98 0.8059 0.4457 0.5686 0.146 Uiso calc U . R 1.0 . .
C C99 0.7969(8) 0.6441(8) 0.6173(4) 0.068(4) Uani d . . . 1.0 . .
C C100 0.8483(8) 0.6648(9) 0.6386(5) 0.080(4) Uani d . . . 1.0 . .
H H100 0.8766 0.6266 0.6547 0.096 Uiso calc U . R 1.0 . .
C C101 0.8587(9) 0.7425(10) 0.6364(5) 0.087(5) Uani d . . . 1.0 . .
H H101 0.8935 0.756 0.6512 0.104 Uiso calc U . R 1.0 . .
C C102 0.8188(10) 0.7983(9) 0.6128(5) 0.095(5) Uani d . . . 1.0 . .
H H102 0.8264 0.8503 0.6107 0.114 Uiso calc U . R 1.0 . .
C C103 0.7671(12) 0.7769(10) 0.5924(5) 0.114(7) Uani d . . . 1.0 . .
H H103 0.7374 0.8149 0.577 0.137 Uiso calc U . R 1.0 . .
C C104 0.7578(9) 0.7030(9) 0.5938(4) 0.085(5) Uani d . . . 1.0 . .
H H104 0.7237 0.6907 0.5783 0.102 Uiso calc U . R 1.0 . .
C C105 0.7902(9) 0.5002(9) 0.6688(4) 0.073(4) Uani d . . . 1.0 . .
C C106 0.8471(11) 0.4416(9) 0.6783(5) 0.098(5) Uani d . . . 1.0 . .
H H106 0.8841 0.4274 0.6585 0.117 Uiso calc U . R 1.0 . .
C C107 0.8491(15) 0.4041(12) 0.7172(6) 0.130(8) Uani d . . . 1.0 . .
H H107 0.8882 0.3658 0.7244 0.156 Uiso calc U . R 1.0 . .
C C108 0.7934(16) 0.4248(15) 0.7435(8) 0.136(8) Uani d U . . 1.0 . .
H H108 0.7935 0.3989 0.7696 0.163 Uiso calc U . R 1.0 . .
C C109 0.7386(13) 0.4786(14) 0.7358(7) 0.125(8) Uani d . . . 1.0 . .
H H109 0.7013 0.491 0.7559 0.15 Uiso calc U . R 1.0 . .
C C110 0.7362(11) 0.5179(12) 0.6965(6) 0.118(7) Uani d . . . 1.0 . .
H H110 0.6966 0.5562 0.6902 0.141 Uiso calc U . R 1.0 . .
C C111 0.1087(7) -0.0034(8) 0.8971(4) 0.063(3) Uani d . . . 1.0 . .
C C112 0.1214(7) 0.0059(9) 0.8623(4) 0.071(4) Uani d . . . 1.0 . .
C C113 0.1351(9) 0.0196(10) 0.8205(5) 0.083(4) Uani d . . . 1.0 . .
C C114 0.1970(10) -0.0179(11) 0.8026(5) 0.105(6) Uani d . . . 1.0 . .
H H114 0.2324 -0.0486 0.8179 0.126 Uiso calc U . R 1.0 . .
C C115 0.2091(15) -0.0122(17) 0.7631(6) 0.160(10) Uani d . . . 1.0 . .
H H115 0.2521 -0.038 0.751 0.192 Uiso calc U . R 1.0 . .
C C116 0.1556(16) 0.0331(18) 0.7419(7) 0.153(10) Uani d . . . 1.0 . .
H H116 0.1614 0.0362 0.7148 0.184 Uiso calc U . R 1.0 . .
C C117 0.0950(13) 0.0734(14) 0.7581(6) 0.126(7) Uani d U . . 1.0 . .
H H117 0.0607 0.1047 0.7424 0.151 Uiso calc U . R 1.0 . .
C C118 0.0835(10) 0.0684(11) 0.7986(5) 0.099(5) Uani d . . . 1.0 . .
H H118 0.0425 0.0968 0.8105 0.118 Uiso calc U . R 1.0 . .
C C119 -0.1184(7) 0.0679(8) 0.8995(5) 0.073(4) Uani d . . . 1.0 . .
C C120 -0.1299(7) 0.0857(8) 0.8656(5) 0.070(4) Uani d . . . 1.0 . .
C C121 -0.139(3) 0.097(3) 0.8245(11) 0.066(5) Uani d U P G 0.30(3) D 1
C C122 -0.121(3) 0.043(3) 0.8019(13) 0.098(7) Uani d U P G 0.30(3) D 1
H H122 -0.098 -0.005 0.8124 0.118 Uiso calc U P R 0.30(3) D 1
C C123 -0.135(3) 0.060(3) 0.7637(12) 0.108(8) Uani d U P G 0.30(3) D 1
H H123 -0.1226 0.0233 0.7482 0.129 Uiso calc U P R 0.30(3) D 1
C C124 -0.168(3) 0.131(3) 0.7483(11) 0.117(10) Uani d U P G 0.30(3) D 1
H H124 -0.1784 0.1424 0.7222 0.14 Uiso calc U P R 0.30(3) D 1
C C125 -0.187(3) 0.185(3) 0.7709(16) 0.113(9) Uani d U P G 0.30(3) D 1
H H125 -0.2096 0.2333 0.7604 0.136 Uiso calc U P R 0.30(3) D 1
C C126 -0.172(3) 0.168(3) 0.8091(15) 0.095(8) Uani d U P G 0.30(3) D 1
H H126 -0.1849 0.2051 0.8246 0.114 Uiso calc U P R 0.30(3) D 1
C C421 -0.1521(14) 0.1198(12) 0.8269(4) 0.066(5) Uani d . P G 0.70(3) D 2
C C422 -0.1292(13) 0.0802(13) 0.7976(5) 0.098(7) Uani d . P G 0.70(3) D 2
H H422 -0.0983 0.034 0.8023 0.118 Uiso calc U P R 0.70(3) D 2
C C423 -0.1515(13) 0.1081(15) 0.7612(5) 0.108(8) Uani d . P G 0.70(3) D 2
H H423 -0.1359 0.081 0.7411 0.129 Uiso calc U P R 0.70(3) D 2
C C424 -0.1967(14) 0.1757(15) 0.7542(5) 0.117(10) Uani d . P G 0.70(3) D 2
H H424 -0.212 0.1948 0.7293 0.14 Uiso calc U P R 0.70(3) D 2
C C425 -0.2196(13) 0.2153(11) 0.7836(6) 0.113(9) Uani d . P G 0.70(3) D 2
H H425 -0.2505 0.2615 0.7788 0.136 Uiso calc U P R 0.70(3) D 2
C C426 -0.1973(13) 0.1873(11) 0.8199(5) 0.095(8) Uani d . P G 0.70(3) D 2
H H426 -0.213 0.2144 0.84 0.114 Uiso calc U P R 0.70(3) D 2
C C127 0.0205(8) 0.1962(7) 0.9208(5) 0.082(4) Uani d U . . 1.0 . .
C C128 0.0381(8) 0.2177(8) 0.8851(5) 0.071(4) Uani d . . . 1.0 . .
C C129 0.0564(9) 0.2445(8) 0.8446(4) 0.076(4) Uani d . . . 1.0 . .
C C130 0.1312(10) 0.2443(10) 0.8276(5) 0.093(5) Uani d . . . 1.0 . .
H H130 0.1714 0.2219 0.8422 0.112 Uiso calc U . R 1.0 . .
C C131 0.1477(15) 0.2779(14) 0.7881(7) 0.139(8) Uani d . . . 1.0 . .
H H131 0.1993 0.2778 0.7757 0.167 Uiso calc U . R 1.0 . .
C C132 0.091(2) 0.3099(17) 0.7680(7) 0.178(13) Uani d . . . 1.0 . .
H H132 0.1016 0.3303 0.741 0.214 Uiso calc U . R 1.0 . .
C C133 0.0159(17) 0.3132(17) 0.7864(8) 0.169(12) Uani d . . . 1.0 . .
H H133 -0.0241 0.3384 0.7723 0.203 Uiso calc U . R 1.0 . .
C C134 -0.0008(12) 0.2814(13) 0.8240(6) 0.125(7) Uani d . . . 1.0 . .
H H134 -0.0522 0.2844 0.8364 0.15 Uiso calc U . R 1.0 . .
C C135 0.1989(7) 0.1244(6) 0.9551(4) 0.056(3) Uani d . . . 1.0 . .
C C136 0.2439(8) 0.1373(7) 0.9250(4) 0.064(3) Uani d . . . 1.0 . .
C C137 0.2930(7) 0.1552(7) 0.8884(4) 0.061(3) Uani d . . . 1.0 . .
C C138 0.3343(8) 0.2186(8) 0.8799(5) 0.075(4) Uani d . . . 1.0 . .
H H138 0.3357 0.2472 0.8991 0.09 Uiso calc U . R 1.0 . .
C C139 0.3737(9) 0.2407(11) 0.8433(5) 0.097(5) Uani d . . . 1.0 . .
H H139 0.3982 0.287 0.8362 0.116 Uiso calc U . R 1.0 . .
C C140 0.3770(9) 0.1945(10) 0.8173(5) 0.085(5) Uani d . . . 1.0 . .
H H140 0.4073 0.2079 0.7928 0.102 Uiso calc U . R 1.0 . .
C C141 0.3393(10) 0.1321(9) 0.8252(5) 0.088(5) Uani d . . . 1.0 . .
H H141 0.3411 0.1017 0.8065 0.106 Uiso calc U . R 1.0 . .
C C142 0.2974(7) 0.1125(8) 0.8613(4) 0.070(4) Uani d . . . 1.0 . .
H H142 0.2707 0.0675 0.8673 0.084 Uiso calc U . R 1.0 . .
C C143 -0.2212(7) 0.0832(7) 1.0088(4) 0.059(3) Uani d . . . 1.0 . .
C C144 -0.2683(7) 0.1010(7) 1.0339(4) 0.057(3) Uani d . . . 1.0 . .
C C145 -0.3231(6) 0.1276(7) 1.0620(3) 0.054(3) Uani d . P G 0.749(11) E 1
C C146 -0.3073(6) 0.1202(7) 1.0996(4) 0.072(5) Uani d . P G 0.749(11) E 1
H H146 -0.2611 0.0937 1.1072 0.086 Uiso calc U P R 0.749(11) E 1
C C147 -0.3591(9) 0.1517(8) 1.1260(3) 0.087(6) Uani d . P G 0.749(11) E 1
H H147 -0.3484 0.1466 1.1517 0.104 Uiso calc U P R 0.749(11) E 1
C C148 -0.4267(8) 0.1905(8) 1.1149(4) 0.094(7) Uani d . P G 0.749(11) E 1
H H148 -0.4622 0.2119 1.133 0.112 Uiso calc U P R 0.749(11) E 1
C C149 -0.4425(6) 0.1979(8) 1.0773(5) 0.097(7) Uani d . P G 0.749(11) E 1
H H149 -0.4887 0.2244 1.0697 0.117 Uiso calc U P R 0.749(11) E 1
C C150 -0.3907(7) 0.1665(8) 1.0509(3) 0.089(7) Uani d . P G 0.749(11) E 1
H H150 -0.4014 0.1715 1.0252 0.107 Uiso calc U P R 0.749(11) E 1
C C445 -0.325(2) 0.124(2) 1.0692(10) 0.054(3) Uani d . P G 0.251(11) E 2
C C446 -0.353(2) 0.0695(17) 1.1008(11) 0.072(5) Uani d . P G 0.251(11) E 2
H H446 -0.3373 0.0175 1.1017 0.086 Uiso calc U P R 0.251(11) E 2
C C447 -0.402(2) 0.091(2) 1.1311(10) 0.087(6) Uani d . P G 0.251(11) E 2
H H447 -0.4213 0.0536 1.1527 0.104 Uiso calc U P R 0.251(11) E 2
C C448 -0.425(2) 0.167(3) 1.1298(11) 0.094(7) Uani d . P G 0.251(11) E 2
H H448 -0.4589 0.1818 1.1505 0.112 Uiso calc U P R 0.251(11) E 2
C C449 -0.397(3) 0.2218(19) 1.0982(14) 0.097(7) Uani d . P G 0.251(11) E 2
H H449 -0.4126 0.2738 1.0973 0.117 Uiso calc U P R 0.251(11) E 2
C C450 -0.347(2) 0.200(2) 1.0679(11) 0.086(18) Uani d U P G 0.251(11) E 2
H H450 -0.3287 0.2377 1.0463 0.104 Uiso calc U P R 0.251(11) E 2
C C151 -0.0972(7) 0.2139(7) 1.0265(4) 0.063(3) Uani d . . . 1.0 . .
C C152 -0.1361(8) 0.2374(8) 1.0530(5) 0.073(4) Uani d . . . 1.0 . .
C C153 -0.1826(8) 0.2638(10) 1.0856(6) 0.086(5) Uani d . . . 1.0 . .
C C154 -0.1751(11) 0.2293(12) 1.1230(6) 0.113(6) Uani d . . . 1.0 . .
H H154 -0.1364 0.1896 1.1282 0.136 Uiso calc U . R 1.0 . .
C C155 -0.2226(13) 0.2514(16) 1.1528(7) 0.142(9) Uani d . . . 1.0 . .
H H155 -0.2189 0.2264 1.1788 0.17 Uiso calc U . R 1.0 . .
C C156 -0.2779(17) 0.3130(18) 1.1438(8) 0.155(10) Uani d U . . 1.0 . .
H H156 -0.3134 0.3262 1.1644 0.186 Uiso calc U . R 1.0 . .
C C157 -0.2826(12) 0.3527(13) 1.1088(8) 0.134(8) Uani d . . . 1.0 . .
H H157 -0.3153 0.3977 1.1043 0.161 Uiso calc U . R 1.0 . .
C C158 -0.2366(10) 0.3255(11) 1.0776(6) 0.111(6) Uani d U . . 1.0 . .
H H158 -0.2425 0.349 1.0516 0.133 Uiso calc U . R 1.0 . .
C C159 0.0810(7) 0.1320(7) 1.0622(4) 0.059(3) Uani d . . . 1.0 . .
C C160 0.0573(8) 0.1488(9) 1.0937(5) 0.073(4) Uani d . . . 1.0 . .
C C161 0.0331(8) 0.1717(9) 1.1302(4) 0.069(4) Uani d . . . 1.0 . .
C C162 0.0377(9) 0.2457(10) 1.1330(5) 0.091(5) Uani d . . . 1.0 . .
H H162 0.057 0.2819 1.1109 0.11 Uiso calc U . R 1.0 . .
C C163 0.0144(15) 0.2672(14) 1.1678(7) 0.129(9) Uani d . . . 1.0 . .
H H163 0.0173 0.3183 1.1697 0.155 Uiso calc U . R 1.0 . .
C C164 -0.0119(13) 0.2169(18) 1.1985(8) 0.143(10) Uani d . . . 1.0 . .
H H164 -0.0272 0.2319 1.2225 0.172 Uiso calc U . R 1.0 . .
C C165 -0.0177(12) 0.1413(15) 1.1960(6) 0.124(7) Uani d . . . 1.0 . .
H H165 -0.0372 0.1057 1.2182 0.149 Uiso calc U . R 1.0 . .
C C166 0.0043(9) 0.1192(11) 1.1622(5) 0.096(5) Uani d . . . 1.0 . .
H H166 0.0001 0.0684 1.1603 0.116 Uiso calc U . R 1.0 . .
C C167 0.1453(7) 0.4364(7) 0.8993(4) 0.061(3) Uani d . . . 1.0 . .
C C168 0.1408(8) 0.4152(9) 0.8647(4) 0.075(4) Uani d . . . 1.0 . .
H H168 0.1482 0.3631 0.8637 0.09 Uiso calc U . R 1.0 . .
C C169 0.1258(9) 0.4679(12) 0.8315(5) 0.098(5) Uani d . . . 1.0 . .
H H169 0.1228 0.4519 0.8082 0.117 Uiso calc U . R 1.0 . .
C C170 0.1157(10) 0.5421(11) 0.8330(5) 0.098(6) Uani d . . . 1.0 . .
H H170 0.1049 0.5786 0.8107 0.117 Uiso calc U . R 1.0 . .
C C171 0.1208(10) 0.5652(9) 0.8663(6) 0.100(5) Uani d . . . 1.0 . .
H H171 0.116 0.6179 0.8664 0.12 Uiso calc U . R 1.0 . .
C C172 0.1329(9) 0.5133(8) 0.8999(5) 0.086(5) Uani d . . . 1.0 . .
H H172 0.1327 0.5299 0.9233 0.104 Uiso calc U . R 1.0 . .
C C173 0.2676(8) 0.3680(8) 0.9413(5) 0.078(4) Uani d . . . 1.0 . .
C C174 0.3136(8) 0.4116(10) 0.9118(5) 0.091(5) Uani d . . . 1.0 . .
H H174 0.293 0.4426 0.8901 0.109 Uiso calc U . R 1.0 . .
C C175 0.3949(11) 0.4083(15) 0.9152(8) 0.143(9) Uani d . . . 1.0 . .
H H175 0.4278 0.4387 0.8956 0.171 Uiso calc U . R 1.0 . .
C C176 0.4236(15) 0.365(2) 0.9444(10) 0.172(13) Uani d . . . 1.0 . .
H H176 0.4775 0.3608 0.9449 0.206 Uiso calc U . R 1.0 . .
C C177 0.3795(15) 0.3261(17) 0.9728(9) 0.164(11) Uani d . . . 1.0 . .
H H177 0.4013 0.298 0.9948 0.197 Uiso calc U . R 1.0 . .
C C178 0.3012(10) 0.3248(12) 0.9721(6) 0.115(7) Uani d . . . 1.0 . .
H H178 0.2708 0.2942 0.9928 0.138 Uiso calc U . R 1.0 . .
C C179 0.1208(7) 0.3999(7) 0.9825(4) 0.063(3) Uani d . . . 1.0 . .
C C180 0.1543(8) 0.4516(8) 0.9971(5) 0.074(4) Uani d . . . 1.0 . .
H H180 0.2019 0.4707 0.9846 0.089 Uiso calc U . R 1.0 . .
C C181 0.1173(8) 0.4760(9) 1.0309(5) 0.087(5) Uani d . . . 1.0 . .
H H181 0.1389 0.5124 1.0408 0.105 Uiso calc U . R 1.0 . .
C C182 0.0482(9) 0.4451(10) 1.0490(5) 0.090(5) Uani d . . . 1.0 . .
H H182 0.0216 0.4616 1.0711 0.108 Uiso calc U . R 1.0 . .
C C183 0.0196(9) 0.3920(9) 1.0353(5) 0.082(4) Uani d . . . 1.0 . .
H H183 -0.026 0.3695 1.0485 0.099 Uiso calc U . R 1.0 . .
C C184 0.0555(8) 0.3704(8) 1.0026(4) 0.074(4) Uani d . . . 1.0 . .
H H184 0.0337 0.3328 0.9936 0.089 Uiso calc U . R 1.0 . .
C C185 -0.1968(8) 0.3717(8) 0.9065(4) 0.074(4) Uani d . . . 1.0 . .
C C186 -0.2175(12) 0.4164(12) 0.8739(6) 0.116(6) Uani d U . . 1.0 . .
H H186 -0.269 0.417 0.8689 0.14 Uiso calc U . R 1.0 . .
C C187 -0.1665(13) 0.4621(13) 0.8469(6) 0.136(8) Uani d U . . 1.0 . .
H H187 -0.1836 0.492 0.8241 0.164 Uiso calc U . R 1.0 . .
C C188 -0.0951(12) 0.4640(11) 0.8530(5) 0.113(6) Uani d . . . 1.0 . .
H H188 -0.0608 0.496 0.835 0.136 Uiso calc U . R 1.0 . .
C C189 -0.0710(8) 0.4186(9) 0.8857(6) 0.093(5) Uani d . . . 1.0 . .
H H189 -0.0199 0.4194 0.8909 0.112 Uiso calc U . R 1.0 . .
C C190 -0.1220(8) 0.3712(8) 0.9114(4) 0.080(4) Uani d . . . 1.0 . .
H H190 -0.1037 0.3374 0.9329 0.096 Uiso calc U . R 1.0 . .
C C191 -0.3276(11) 0.2770(8) 0.9174(4) 0.061(4) Uani d . P G 0.73(3) F 1
C C192 -0.3792(14) 0.3232(8) 0.8953(7) 0.076(7) Uani d U P G 0.73(3) F 1
H H192 -0.3832 0.3764 0.8937 0.091 Uiso calc U P R 0.73(3) F 1
C C193 -0.4251(14) 0.2915(13) 0.8755(7) 0.104(10) Uani d . P G 0.73(3) F 1
H H193 -0.4604 0.323 0.8604 0.125 Uiso calc U P R 0.73(3) F 1
C C194 -0.4193(12) 0.2136(14) 0.8778(6) 0.110(7) Uani d . P G 0.73(3) F 1
H H194 -0.4507 0.192 0.8642 0.132 Uiso calc U P R 0.73(3) F 1
C C195 -0.3677(12) 0.1675(9) 0.8999(7) 0.102(8) Uani d U P G 0.73(3) F 1
H H195 -0.3638 0.1142 0.9014 0.122 Uiso calc U P R 0.73(3) F 1
C C196 -0.3218(10) 0.1991(8) 0.9197(6) 0.060(5) Uani d U P G 0.73(3) F 1
H H196 -0.2865 0.1676 0.9347 0.072 Uiso calc U P R 0.73(3) F 1
C C491 -0.318(3) 0.270(3) 0.9155(13) 0.061(4) Uani d . P G 0.27(3) F 2
C C492 -0.387(4) 0.313(3) 0.9111(18) 0.076(7) Uani d . P G 0.27(3) F 2
H H492 -0.3982 0.3564 0.9222 0.091 Uiso calc U P R 0.27(3) F 2
C C493 -0.439(3) 0.292(4) 0.891(2) 0.104(10) Uani d . P G 0.27(3) F 2
H H493 -0.4862 0.3214 0.8875 0.125 Uiso calc U P R 0.27(3) F 2
C C494 -0.422(3) 0.228(4) 0.8744(18) 0.110(7) Uani d . P G 0.27(3) F 2
H H494 -0.4579 0.2142 0.8603 0.132 Uiso calc U P R 0.27(3) F 2
C C495 -0.353(3) 0.186(3) 0.8788(17) 0.102(8) Uani d . P G 0.27(3) F 2
H H495 -0.3417 0.142 0.8677 0.122 Uiso calc U P R 0.27(3) F 2
C C496 -0.301(3) 0.206(3) 0.8993(17) 0.060(5) Uani d . P G 0.27(3) F 2
H H496 -0.2537 0.177 0.9023 0.072 Uiso calc U P R 0.27(3) F 2
C C197 -0.3270(16) 0.3770(18) 0.9681(8) 0.073(4) Uani d . P G 0.50(2) F 1
C C198 -0.3084(17) 0.4474(19) 0.9720(10) 0.093(9) Uani d U P G 0.50(2) F 1
H H198 -0.2634 0.4692 0.9575 0.112 Uiso calc U P R 0.50(2) F 1
C C199 -0.356(2) 0.4861(17) 0.9972(11) 0.114(11) Uani d U P G 0.50(2) F 1
H H199 -0.3428 0.5342 0.9999 0.137 Uiso calc U P R 0.50(2) F 1
C C200 -0.4213(19) 0.454(2) 1.0185(9) 0.114(10) Uani d . P G 0.50(2) F 1
H H200 -0.4536 0.4807 1.0357 0.137 Uiso calc U P R 0.50(2) F 1
C C201 -0.4400(17) 0.3838(19) 1.0146(9) 0.118(13) Uani d . P G 0.50(2) F 1
H H201 -0.485 0.3621 1.0292 0.141 Uiso calc U P R 0.50(2) F 1
C C202 -0.3928(18) 0.3452(14) 0.9894(9) 0.092(8) Uani d U P G 0.50(2) F 1
H H202 -0.4056 0.2971 0.9868 0.11 Uiso calc U P R 0.50(2) F 1
C C497 -0.3192(16) 0.3741(17) 0.9704(8) 0.073(4) Uani d . P G 0.50(2) F 2
C C498 -0.3195(18) 0.4516(18) 0.9553(7) 0.093(9) Uani d . P G 0.50(2) F 2
H H498 -0.2902 0.4702 0.9311 0.112 Uiso calc U P R 0.50(2) F 2
C C499 -0.363(2) 0.5019(14) 0.9757(10) 0.114(11) Uani d . P G 0.50(2) F 2
H H499 -0.3628 0.5549 0.9654 0.137 Uiso calc U P R 0.50(2) F 2
C C500 -0.4054(18) 0.4747(19) 1.0112(9) 0.114(10) Uani d . P G 0.50(2) F 2
H H500 -0.4349 0.5091 1.0251 0.137 Uiso calc U P R 0.50(2) F 2
C C501 -0.4052(18) 0.397(2) 1.0262(7) 0.118(13) Uani d . P G 0.50(2) F 2
H H501 -0.4344 0.3785 1.0504 0.141 Uiso calc U P R 0.50(2) F 2
C C502 -0.3621(19) 0.3468(15) 1.0058(9) 0.092(8) Uani d . P G 0.50(2) F 2
H H502 -0.3619 0.2938 1.0161 0.11 Uiso calc U P R 0.50(2) F 2
C C203 -0.3612(7) -0.0874(7) 0.9641(3) 0.049(4) Uani d . P G 0.758(15) G 1
C C204 -0.3534(6) -0.0315(7) 0.9840(3) 0.072(5) Uani d . P G 0.758(15) G 1
H H204 -0.3188 0.0069 0.9731 0.086 Uiso calc U P R 0.758(15) G 1
C C205 -0.3962(7) -0.0317(7) 1.0200(3) 0.070(5) Uani d . P G 0.758(15) G 1
H H205 -0.3908 0.0065 1.0336 0.084 Uiso calc U P R 0.758(15) G 1
C C206 -0.4468(7) -0.0879(8) 1.0360(3) 0.071(6) Uani d . P G 0.758(15) G 1
H H206 -0.476 -0.0881 1.0606 0.085 Uiso calc U P R 0.758(15) G 1
C C207 -0.4546(9) -0.1439(7) 1.0161(4) 0.097(7) Uani d U P G 0.758(15) G 1
H H207 -0.4892 -0.1823 1.0271 0.116 Uiso calc U P R 0.758(15) G 1
C C208 -0.4118(9) -0.1436(6) 0.9802(4) 0.089(8) Uani d . P G 0.758(15) G 1
H H208 -0.4171 -0.1819 0.9665 0.107 Uiso calc U P R 0.758(15) G 1
C C503 -0.393(2) -0.097(3) 0.9642(10) 0.049(4) Uani d . P G 0.242(15) G 2
C C504 -0.3702(19) -0.071(3) 0.9941(12) 0.072(5) Uani d . P G 0.242(15) G 2
H H504 -0.3212 -0.0511 0.9908 0.086 Uiso calc U P R 0.242(15) G 2
C C505 -0.419(2) -0.074(3) 1.0287(11) 0.070(5) Uani d . P G 0.242(15) G 2
H H505 -0.4029 -0.0554 1.049 0.084 Uiso calc U P R 0.242(15) G 2
C C506 -0.490(2) -0.103(2) 1.0335(10) 0.071(6) Uani d . P G 0.242(15) G 2
H H506 -0.5235 -0.1044 1.0571 0.085 Uiso calc U P R 0.242(15) G 2
C C507 -0.513(2) -0.129(3) 1.0036(13) 0.097(7) Uani d . P G 0.242(15) G 2
H H507 -0.5624 -0.1489 1.0069 0.116 Uiso calc U P R 0.242(15) G 2
C C508 -0.465(3) -0.126(3) 0.9690(11) 0.089(8) Uani d . P G 0.242(15) G 2
H H508 -0.4807 -0.1445 0.9486 0.107 Uiso calc U P R 0.242(15) G 2
C C209 -0.3660(7) -0.0270(7) 0.8818(4) 0.061(3) Uani d . . . 1.0 . .
C C210 -0.4427(8) -0.0123(8) 0.8882(4) 0.071(4) Uani d . . . 1.0 . .
H H210 -0.469 -0.0319 0.9131 0.085 Uiso calc U . R 1.0 . .
C C211 -0.4840(9) 0.0288(10) 0.8611(5) 0.086(5) Uani d . . . 1.0 . .
H H211 -0.5383 0.0355 0.8664 0.103 Uiso calc U . R 1.0 . .
C C212 -0.4465(11) 0.0604(9) 0.8259(5) 0.092(5) Uani d . . . 1.0 . .
H H212 -0.4748 0.0904 0.8067 0.11 Uiso calc U . R 1.0 . .
C C213 -0.3700(11) 0.0498(10) 0.8180(4) 0.091(5) Uani d . . . 1.0 . .
H H213 -0.3445 0.072 0.7934 0.109 Uiso calc U . R 1.0 . .
C C214 -0.3284(8) 0.0066(8) 0.8457(4) 0.072(4) Uani d . . . 1.0 . .
H H214 -0.2741 -0.0003 0.8402 0.087 Uiso calc U . R 1.0 . .
C C215 -0.3051(8) -0.1790(7) 0.9077(4) 0.067(4) Uani d . . . 1.0 . .
C C216 -0.3622(10) -0.2037(9) 0.8898(5) 0.089(5) Uani d . . . 1.0 . .
H H216 -0.4015 -0.168 0.8802 0.107 Uiso calc U . R 1.0 . .
C C217 -0.3619(14) -0.2775(11) 0.8860(6) 0.126(7) Uani d . . . 1.0 . .
H H217 -0.3999 -0.2919 0.8733 0.151 Uiso calc U . R 1.0 . .
C C218 -0.3071(14) -0.3306(12) 0.9004(6) 0.120(7) Uani d . . . 1.0 . .
H H218 -0.3068 -0.3816 0.8977 0.144 Uiso calc U . R 1.0 . .
C C219 -0.2524(15) -0.3089(11) 0.9189(6) 0.125(8) Uani d . . . 1.0 . .
H H219 -0.2146 -0.3455 0.9293 0.149 Uiso calc U . R 1.0 . .
C C220 -0.2520(11) -0.2341(9) 0.9224(5) 0.093(5) Uani d . . . 1.0 . .
H H220 -0.2139 -0.2207 0.9354 0.112 Uiso calc U . R 1.0 . .
N N1 0.2449(9) 0.2122(8) 0.2431(4) 0.146(6) Uani d U . D 1.0 . .
C C221 0.3135(12) 0.2515(14) 0.2477(7) 0.216(14) Uani d U . D 1.0 . .
H H222 0.3268 0.2898 0.2237 0.26 Uiso calc U . R 1.0 . .
H H223 0.3578 0.2136 0.2505 0.26 Uiso calc U . R 1.0 . .
C C222 0.3016(19) 0.2900(19) 0.2817(9) 0.237(15) Uani d U . . 1.0 . .
H H224 0.3484 0.314 0.2827 0.355 Uiso calc U . R 1.0 . .
H H225 0.2587 0.3287 0.2788 0.355 Uiso calc U . R 1.0 . .
H H226 0.2898 0.2524 0.3056 0.355 Uiso calc U . R 1.0 . .
C C224 0.2167(16) 0.1614(14) 0.2811(6) 0.28(2) Uani d U . D 1.0 . .
H H231 0.214 0.1897 0.302 0.338 Uiso calc U . R 1.0 . .
H H232 0.1641 0.1479 0.2802 0.338 Uiso calc U . R 1.0 . .
C C225 0.267(2) 0.090(2) 0.2906(11) 0.290(19) Uani d U . . 1.0 . .
H H233 0.2455 0.0595 0.3154 0.435 Uiso calc U . R 1.0 . .
H H234 0.2687 0.0609 0.2703 0.435 Uiso calc U . R 1.0 . .
H H235 0.3186 0.1027 0.2921 0.435 Uiso calc U . R 1.0 . .
C C223 0.2686(11) 0.1650(15) 0.2127(7) 0.256(17) Uani d U . D 1.0 . .
H H227 0.3006 0.1198 0.2237 0.308 Uiso calc U P R 0.874(12) H 1
H H228 0.3006 0.195 0.1906 0.308 Uiso calc U P R 0.874(12) H 1
H H229 0.2507 0.1927 0.1882 0.308 Uiso calc U P R 0.126(12) H 2
H H230 0.2425 0.117 0.2209 0.308 Uiso calc U P R 0.126(12) H 2
Cl Cl3 0.1906(8) 0.1350(11) 0.1957(5) 0.371(11) Uani d . P D 0.874(12) H 1
C C527 0.3565(17) 0.146(9) 0.205(4) 0.184(12) Uani d . P D 0.126(12) H 2
H H243 0.3675 0.1155 0.1853 0.275 Uiso calc U P R 0.126(12) H 2
H H244 0.3828 0.1931 0.1963 0.275 Uiso calc U P R 0.126(12) H 2
H H245 0.3746 0.1174 0.2291 0.275 Uiso calc U P R 0.126(12) H 2
C C226 0.1815(12) 0.2705(12) 0.2306(7) 0.31(2) Uani d U . D 1.0 . .
H H236 0.1599 0.2936 0.2529 0.37 Uiso calc U P R 0.874(12) H 1
H H237 0.1401 0.2438 0.2245 0.37 Uiso calc U P R 0.874(12) H 1
H H238 0.1801 0.2758 0.2026 0.37 Uiso calc U P R 0.126(12) H 2
H H239 0.1927 0.3202 0.235 0.37 Uiso calc U P R 0.126(12) H 2
C C227 0.2036(17) 0.3350(15) 0.1957(8) 0.184(12) Uani d U P D 0.874(12) H 1
H H240 0.1581 0.3691 0.1903 0.275 Uiso calc U P R 0.874(12) H 1
H H241 0.2432 0.3634 0.2015 0.275 Uiso calc U P R 0.874(12) H 1
H H242 0.2233 0.3134 0.173 0.275 Uiso calc U P R 0.874(12) H 1
Cl Cl3B 0.0910(16) 0.246(4) 0.256(3) 0.371(11) Uani d . P D 0.126(12) H 2
Sb Sb1A 0.9961(3) 0.5836(4) 0.72954(14) 0.0807(8) Uani d . P G 0.79(2) I 1
F F1A 0.9706(7) 0.6802(6) 0.7030(3) 0.158(6) Uani d . P G 0.79(2) I 1
F F2A 0.9973(7) 0.5508(10) 0.6837(2) 0.140(6) Uani d . P G 0.79(2) I 1
F F3A 0.8920(4) 0.5680(9) 0.7426(4) 0.159(6) Uani d U P G 0.79(2) I 1
F F4A 0.9919(9) 0.6149(6) 0.7756(3) 0.131(6) Uani d . P G 0.79(2) I 1
F F5A 1.1002(3) 0.5958(8) 0.7170(5) 0.209(9) Uani d . P G 0.79(2) I 1
F F6A 1.0212(10) 0.4851(3) 0.7550(3) 0.211(8) Uani d U P G 0.79(2) I 1
Sb Sb1B 0.9869(11) 0.5994(11) 0.7329(5) 0.0807(8) Uani d . P G 0.21(2) I 2
F F1B 0.978(3) 0.7036(12) 0.7172(15) 0.158(6) Uani d . P G 0.21(2) I 2
F F2B 1.020(3) 0.595(3) 0.6814(7) 0.140(6) Uani d . P G 0.21(2) I 2
F F3B 0.8852(13) 0.596(4) 0.7255(16) 0.159(6) Uani d . P G 0.21(2) I 2
F F4B 0.951(3) 0.603(3) 0.7838(6) 0.131(6) Uani d . P G 0.21(2) I 2
F F5B 1.0883(14) 0.599(3) 0.7402(17) 0.209(9) Uani d . P G 0.21(2) I 2
F F6B 0.996(4) 0.4941(11) 0.7470(15) 0.211(8) Uani d . P G 0.21(2) I 2
Sb Sb2A 0.0277(8) 0.0624(7) 0.3378(4) 0.1098(9) Uani d . P G 0.252(9) J 1
F F7A 0.012(3) -0.0171(16) 0.3798(8) 0.201(9) Uani d . P G 0.252(9) J 1
F F8A -0.0712(13) 0.053(2) 0.3281(14) 0.269(13) Uani d . P G 0.252(9) J 1
F F9A 0.067(3) -0.0072(18) 0.3074(11) 0.193(9) Uani d . P G 0.252(9) J 1
F F10A 0.1271(13) 0.070(2) 0.3462(14) 0.239(11) Uani d U P G 0.252(9) J 1
F F11A -0.012(3) 0.1338(18) 0.3665(11) 0.306(16) Uani d . P G 0.252(9) J 1
F F12A 0.041(3) 0.1418(16) 0.2950(8) 0.246(12) Uani d U P G 0.252(9) J 1
Sb Sb2B 0.0057(3) 0.0495(2) 0.33588(13) 0.1098(9) Uani d . P G 0.748(9) J 2
F F7B -0.0279(8) -0.0440(4) 0.3364(4) 0.201(9) Uani d . P G 0.748(9) J 2
F F8B -0.0843(5) 0.0927(7) 0.3166(5) 0.269(13) Uani d . P G 0.748(9) J 2
F F9B 0.0550(8) 0.0520(9) 0.2859(2) 0.193(9) Uani d . P G 0.748(9) J 2
F F10B 0.0967(5) 0.0075(7) 0.3534(4) 0.239(11) Uani d . P G 0.748(9) J 2
F F11B -0.0430(8) 0.0505(9) 0.3852(2) 0.306(16) Uani d . P G 0.748(9) J 2
F F12B 0.0371(8) 0.1453(4) 0.3343(4) 0.246(12) Uani d . P G 0.748(9) J 2
Sb Sb3A 0.5059(11) 0.0528(12) 0.2576(8) 0.0929(7) Uani d . P G 0.097(8) K 1
F F13A 0.534(5) -0.027(3) 0.2962(17) 0.169(6) Uani d . P G 0.097(8) K 1
F F14A 0.416(3) 0.006(4) 0.260(2) 0.146(5) Uani d . P G 0.097(8) K 1
F F15A 0.555(4) -0.001(4) 0.2211(18) 0.133(5) Uani d . P G 0.097(8) K 1
F F16A 0.597(3) 0.098(5) 0.254(3) 0.194(8) Uani d . P G 0.097(8) K 1
F F17A 0.455(4) 0.108(4) 0.2927(19) 0.144(5) Uani d . P G 0.097(8) K 1
F F18A 0.475(5) 0.131(3) 0.2186(17) 0.140(5) Uani d . P G 0.097(8) K 1
Sb Sb3B 0.52046(11) 0.07270(13) 0.23791(10) 0.0929(7) Uani d . P G 0.903(8) H 2
F F13B 0.5822(4) 0.0310(5) 0.27556(19) 0.169(6) Uani d . P G 0.903(8) H 2
F F14B 0.4646(5) -0.0131(3) 0.2544(2) 0.146(5) Uani d . P G 0.903(8) H 2
F F15B 0.5863(4) 0.0252(4) 0.20336(18) 0.133(5) Uani d . P G 0.903(8) H 2
F F16B 0.5774(4) 0.1566(3) 0.2201(2) 0.194(8) Uani d . P G 0.903(8) H 2
F F17B 0.4527(3) 0.1204(4) 0.27111(19) 0.144(5) Uani d . P G 0.903(8) H 2
F F18B 0.4569(4) 0.1117(4) 0.20020(17) 0.140(5) Uani d . P G 0.903(8) H 2
Sb Sb4A 0.4415(8) 0.4669(8) 0.1746(4) 0.1127(9) Uani d . P G 0.196(9) L 1
F F19A 0.380(3) 0.390(2) 0.175(2) 0.247(11) Uani d . P G 0.196(9) L 1
F F20A 0.444(4) 0.492(4) 0.1212(5) 0.269(11) Uani d U P G 0.196(9) L 1
F F21A 0.527(2) 0.400(3) 0.170(2) 0.263(11) Uani d U P G 0.196(9) L 1
F F22A 0.443(4) 0.440(4) 0.2274(5) 0.239(10) Uani d . P G 0.196(9) L 1
F F23A 0.359(2) 0.536(3) 0.179(2) 0.304(18) Uani d . P G 0.196(9) L 1
F F24A 0.505(3) 0.545(3) 0.172(2) 0.246(11) Uani d . P G 0.196(9) L 1
Sb Sb4B 0.45701(18) 0.4362(2) 0.16886(9) 0.1127(9) Uani d . P G 0.804(9) L 2
F F19B 0.3551(3) 0.4387(9) 0.1621(4) 0.247(11) Uani d . P G 0.804(9) L 2
F F20B 0.4811(9) 0.4507(9) 0.11544(10) 0.269(11) Uani d . P G 0.804(9) L 2
F F21B 0.4638(9) 0.3317(3) 0.1732(5) 0.263(11) Uani d . P G 0.804(9) L 2
F F22B 0.4342(8) 0.4186(9) 0.22201(10) 0.239(10) Uani d . P G 0.804(9) L 2
F F23B 0.4538(9) 0.5399(3) 0.1644(5) 0.304(18) Uani d . P G 0.804(9) L 2
F F24B 0.5606(3) 0.4334(9) 0.1741(4) 0.246(11) Uani d . P G 0.804(9) L 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_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 C1 . 2.230(15) ?
Ag1 C9 . 2.352(11) ?
Ag1 C17 . 2.377(14) ?
Ag1 Ag2 . 2.9440(14) ?
Ag1 Ag3 . 3.0563(15) ?
Ag1 Ag5 . 3.1912(16) ?
Ag1 Ag4 . 3.3227(15) ?
Ag2 C1 . 2.210(15) ?
Ag2 C33 2_666 2.329(12) ?
Ag2 C25 . 2.373(13) ?
Ag2 Ag3 . 3.1119(14) ?
Ag2 Ag4 2_666 3.2166(16) ?
Ag2 Ag6 . 3.2444(16) ?
Ag3 C49 2_666 2.287(12) ?
Ag3 C1 . 2.321(13) ?
Ag3 C41 2_666 2.339(13) ?
Ag3 Ag6 2_666 3.0852(15) ?
Ag3 Ag5 2_666 3.1697(16) ?
Ag4 C9 . 2.044(16) ?
Ag4 C33 . 2.109(15) ?
Ag4 Ag8 . 2.9853(16) ?
Ag4 Ag9 . 3.1081(16) ?
Ag4 Ag2 2_666 3.2167(16) ?
Ag4 Ag6 2_666 3.2804(16) ?
Ag5 C41 . 2.068(16) ?
Ag5 C17 . 2.088(16) ?
Ag5 Ag7 . 2.9672(15) ?
Ag5 Ag8 . 3.0217(14) ?
Ag5 Ag3 2_666 3.1696(16) ?
Ag6 C25 . 2.068(15) ?
Ag6 C49 . 2.101(15) ?
Ag6 Ag9 2_666 2.9705(15) ?
Ag6 Ag7 . 3.0452(16) ?
Ag6 Ag3 2_666 3.0850(15) ?
Ag6 Ag4 2_666 3.2804(16) ?
Ag7 C17 . 2.383(13) ?
Ag7 C25 . 2.386(13) ?
Ag7 P1 . 2.406(4) ?
Ag7 C26 . 2.630(13) ?
Ag8 C41 . 2.350(12) ?
Ag8 P2 . 2.393(3) ?
Ag8 C33 . 2.407(12) ?
Ag8 C42 . 2.661(13) ?
Ag9 C49 2_666 2.347(14) ?
Ag9 C9 . 2.384(12) ?
Ag9 P3 . 2.407(3) ?
Ag9 C10 . 2.697(14) ?
Ag9 Ag6 2_666 2.9706(15) ?
Ag10 C111 . 2.285(13) ?
Ag10 C119 . 2.304(14) ?
Ag10 C127 . 2.378(14) ?
Ag10 Ag13 . 2.9371(15) ?
Ag10 Ag12 . 3.0392(15) ?
Ag10 Ag11 . 3.0927(15) ?
Ag10 Ag14 . 3.3595(17) ?
Ag11 C111 . 2.200(14) ?
Ag11 C135 . 2.358(12) ?
Ag11 C143 2_557 2.362(12) ?
Ag11 Ag12 . 2.9476(15) ?
Ag11 Ag15 . 3.1668(15) ?
Ag11 Ag13 2_557 3.3011(15) ?
Ag12 C111 . 2.270(13) ?
Ag12 C151 2_557 2.358(13) ?
Ag12 C159 2_557 2.409(11) ?
Ag12 C160 2_557 2.671(14) ?
Ag12 Ag14 2_557 3.0740(16) ?
Ag13 C143 . 2.082(14) ?
Ag13 C119 . 2.099(16) ?
Ag13 Ag18 . 2.9416(16) ?
Ag13 Ag17 . 3.1096(16) ?
Ag13 Ag11 2_557 3.3011(15) ?
Ag13 Ag15 2_557 3.3246(15) ?
Ag14 C127 . 2.049(18) ?
Ag14 C151 . 2.094(15) ?
Ag14 Ag17 . 2.9119(15) ?
Ag14 Ag16 . 3.0262(15) ?
Ag14 Ag12 2_557 3.0739(16) ?
Ag14 Ag15 . 3.3137(15) ?
Ag15 C159 . 2.057(15) ?
Ag15 C135 . 2.067(13) ?
Ag15 Ag16 . 2.9893(15) ?
Ag15 Ag18 2_557 3.0279(15) ?
Ag15 Ag13 2_557 3.3245(15) ?
Ag16 C127 . 2.326(16) ?
Ag16 C135 . 2.394(11) ?
Ag16 P4 . 2.405(4) ?
Ag17 C151 . 2.390(13) ?
Ag17 P5 . 2.405(3) ?
Ag17 C143 . 2.448(12) ?
Ag17 C144 . 2.678(12) ?
Ag18 C119 . 2.307(15) ?
Ag18 P6 . 2.414(4) ?
Ag18 C159 2_557 2.426(12) ?
Ag18 Ag15 2_557 3.0281(15) ?
P1 C69 . 1.791(13) ?
P1 C363 . 1.824(15) ?
P1 C57 . 1.826(13) ?
P1 C63 . 1.86(2) ?
P2 C75 . 1.801(13) ?
P2 C87 . 1.805(14) ?
P2 C81 . 1.831(14) ?
P3 C99 . 1.792(14) ?
P3 C93 . 1.797(15) ?
P3 C105 . 1.828(15) ?
P4 C167 . 1.802(13) ?
P4 C179 . 1.803(14) ?
P4 C173 . 1.819(15) ?
P5 C497 . 1.78(3) ?
P5 C185 . 1.812(15) ?
P5 C491 . 1.84(4) ?
P5 C197 . 1.84(3) ?
P5 C191 . 1.842(16) ?
P6 C203 . 1.794(9) ?
P6 C215 . 1.794(13) ?
P6 C209 . 1.816(13) ?
P6 C503 . 2.07(3) ?
C1 C2 . 1.210(18) ?
C2 C3 . 1.46(2) ?
C2 C303 . 1.53(3) ?
C3 C4 . 1.39 ?
C3 C8 . 1.39 ?
C4 C5 . 1.39 ?
C4 H4 . 0.95 ?
C5 C6 . 1.39 ?
C5 H5 . 0.95 ?
C6 C7 . 1.39 ?
C6 H6 . 0.95 ?
C7 C8 . 1.39 ?
C7 H7 . 0.95 ?
C8 H8 . 0.95 ?
C303 C304 . 1.39 ?
C303 C308 . 1.39 ?
C304 C305 . 1.39 ?
C304 H304 . 0.95 ?
C305 C306 . 1.39 ?
C305 H305 . 0.95 ?
C306 C307 . 1.39 ?
C306 H306 . 0.95 ?
C307 C308 . 1.39 ?
C307 H307 . 0.95 ?
C308 H308 . 0.95 ?
C9 C10 . 1.248(19) ?
C10 C311 . 1.43(5) ?
C10 C11 . 1.47(2) ?
C11 C12 . 1.39 ?
C11 C16 . 1.39 ?
C12 C13 . 1.39 ?
C12 H12 . 0.95 ?
C13 C14 . 1.39 ?
C13 H13 . 0.95 ?
C14 C15 . 1.39 ?
C14 H14 . 0.95 ?
C15 C16 . 1.39 ?
C15 H15 . 0.95 ?
C16 H16 . 0.95 ?
C311 C312 . 1.39 ?
C311 C316 . 1.39 ?
C312 C313 . 1.39 ?
C312 H312 . 0.95 ?
C313 C314 . 1.39 ?
C313 H313 . 0.95 ?
C314 C315 . 1.39 ?
C314 H314 . 0.95 ?
C315 C316 . 1.39 ?
C315 H315 . 0.95 ?
C316 H316 . 0.95 ?
C17 C18 . 1.200(19) ?
C18 C19 . 1.47(2) ?
C19 C20 . 1.37(2) ?
C19 C24 . 1.39(2) ?
C20 C21 . 1.38(2) ?
C20 H20 . 0.95 ?
C21 C22 . 1.42(3) ?
C21 H21 . 0.95 ?
C22 C23 . 1.36(3) ?
C22 H22 . 0.95 ?
C23 C24 . 1.39(2) ?
C23 H23 . 0.95 ?
C24 H24 . 0.95 ?
C25 C26 . 1.230(17) ?
C26 C27 . 1.440(18) ?
C27 C28 . 1.377(19) ?
C27 C32 . 1.40(2) ?
C28 C29 . 1.37(2) ?
C28 H28 . 0.95 ?
C29 C30 . 1.34(2) ?
C29 H29 . 0.95 ?
C30 C31 . 1.34(2) ?
C30 H30 . 0.95 ?
C31 C32 . 1.42(2) ?
C31 H31 . 0.95 ?
C32 H32 . 0.95 ?
C33 C34 . 1.200(17) ?
C33 Ag2 2_666 2.329(12) ?
C34 C35 . 1.426(19) ?
C35 C40 . 1.36(2) ?
C35 C36 . 1.38(2) ?
C36 C37 . 1.39(2) ?
C36 H36 . 0.95 ?
C37 C38 . 1.41(3) ?
C37 H37 . 0.95 ?
C38 C39 . 1.35(3) ?
C38 H38 . 0.95 ?
C39 C40 . 1.36(2) ?
C39 H39 . 0.95 ?
C40 H40 . 0.95 ?
C41 C42 . 1.235(18) ?
C41 Ag3 2_666 2.339(13) ?
C42 C43 . 1.41(2) ?
C43 C44 . 1.37(2) ?
C43 C48 . 1.40(2) ?
C44 C45 . 1.37(3) ?
C44 H44 . 0.95 ?
C45 C46 . 1.39(3) ?
C45 H45 . 0.95 ?
C46 C47 . 1.36(3) ?
C46 H46 . 0.95 ?
C47 C48 . 1.38(2) ?
C47 H47 . 0.95 ?
C48 H48 . 0.95 ?
C49 C50 . 1.204(19) ?
C49 Ag3 2_666 2.287(12) ?
C49 Ag9 2_666 2.347(14) ?
C50 C51 . 1.46(2) ?
C51 C56 . 1.36(2) ?
C51 C52 . 1.39(2) ?
C52 C53 . 1.35(3) ?
C52 H52 . 0.95 ?
C53 C54 . 1.39(3) ?
C53 H53 . 0.95 ?
C54 C55 . 1.38(3) ?
C54 H54 . 0.95 ?
C55 C56 . 1.45(2) ?
C55 H55 . 0.95 ?
C56 H56 . 0.95 ?
C57 C58 . 1.325(19) ?
C57 C62 . 1.422(19) ?
C58 C59 . 1.38(2) ?
C58 H58 . 0.95 ?
C59 C60 . 1.36(3) ?
C59 H59 . 0.95 ?
C60 C61 . 1.36(3) ?
C60 H60 . 0.95 ?
C61 C62 . 1.37(2) ?
C61 H61 . 0.95 ?
C62 H62 . 0.95 ?
C63 C64 . 1.39 ?
C63 C68 . 1.39 ?
C64 C65 . 1.39 ?
C64 H64 . 0.95 ?
C65 C66 . 1.39 ?
C65 H65 . 0.95 ?
C66 C67 . 1.39 ?
C66 H66 . 0.95 ?
C67 C68 . 1.39 ?
C67 H67 . 0.95 ?
C68 H68 . 0.95 ?
C363 C364 . 1.39 ?
C363 C368 . 1.39 ?
C364 C365 . 1.39 ?
C364 H364 . 0.95 ?
C365 C366 . 1.39 ?
C365 H365 . 0.95 ?
C366 C367 . 1.39 ?
C366 H366 . 0.95 ?
C367 C368 . 1.39 ?
C367 H367 . 0.95 ?
C368 H368 . 0.95 ?
C69 C74 . 1.371(16) ?
C69 C70 . 1.429(18) ?
C70 C71 . 1.34(2) ?
C70 H70 . 0.95 ?
C71 C72 . 1.35(2) ?
C71 H71 . 0.95 ?
C72 C73 . 1.40(2) ?
C72 H72 . 0.95 ?
C73 C74 . 1.37(2) ?
C73 H73 . 0.95 ?
C74 H74 . 0.95 ?
C75 C76 . 1.384(17) ?
C75 C80 . 1.400(17) ?
C76 C77 . 1.39(2) ?
C76 H76 . 0.95 ?
C77 C78 . 1.38(2) ?
C77 H77 . 0.95 ?
C78 C79 . 1.36(2) ?
C78 H78 . 0.95 ?
C79 C80 . 1.387(19) ?
C79 H79 . 0.95 ?
C80 H80 . 0.95 ?
C81 C86 . 1.378(19) ?
C81 C82 . 1.38(2) ?
C82 C83 . 1.37(2) ?
C82 H82 . 0.95 ?
C83 C84 . 1.38(2) ?
C83 H83 . 0.95 ?
C84 C85 . 1.36(2) ?
C84 H84 . 0.95 ?
C85 C86 . 1.384(19) ?
C85 H85 . 0.95 ?
C86 H86 . 0.95 ?
C87 C92 . 1.402(18) ?
C87 C88 . 1.419(18) ?
C88 C89 . 1.37(2) ?
C88 H88 . 0.95 ?
C89 C90 . 1.33(2) ?
C89 H89 . 0.95 ?
C90 C91 . 1.41(2) ?
C90 H90 . 0.95 ?
C91 C92 . 1.39(2) ?
C91 H91 . 0.95 ?
C92 H92 . 0.95 ?
C93 C98 . 1.34(2) ?
C93 C94 . 1.418(18) ?
C94 C95 . 1.37(2) ?
C94 H94 . 0.95 ?
C95 C96 . 1.40(2) ?
C95 H95 . 0.95 ?
C96 C97 . 1.32(3) ?
C96 H96 . 0.95 ?
C97 C98 . 1.38(3) ?
C97 H97 . 0.95 ?
C98 H98 . 0.95 ?
C99 C100 . 1.393(18) ?
C99 C104 . 1.400(19) ?
C100 C101 . 1.42(2) ?
C100 H100 . 0.95 ?
C101 C102 . 1.38(2) ?
C101 H101 . 0.95 ?
C102 C103 . 1.39(2) ?
C102 H102 . 0.95 ?
C103 C104 . 1.35(2) ?
C103 H103 . 0.95 ?
C104 H104 . 0.95 ?
C105 C110 . 1.34(2) ?
C105 C106 . 1.41(2) ?
C106 C107 . 1.41(2) ?
C106 H106 . 0.95 ?
C107 C108 . 1.34(3) ?
C107 H107 . 0.95 ?
C108 C109 . 1.32(3) ?
C108 H108 . 0.95 ?
C109 C110 . 1.43(3) ?
C109 H109 . 0.95 ?
C110 H110 . 0.95 ?
C111 C112 . 1.206(17) ?
C112 C113 . 1.45(2) ?
C113 C114 . 1.38(2) ?
C113 C118 . 1.40(2) ?
C114 C115 . 1.38(2) ?
C114 H114 . 0.95 ?
C115 C116 . 1.39(3) ?
C115 H115 . 0.95 ?
C116 C117 . 1.36(3) ?
C116 H116 . 0.95 ?
C117 C118 . 1.42(2) ?
C117 H117 . 0.95 ?
C118 H118 . 0.95 ?
C119 C120 . 1.226(18) ?
C120 C121 . 1.47(4) ?
C120 C421 . 1.48(2) ?
C121 C122 . 1.39 ?
C121 C126 . 1.39 ?
C122 C123 . 1.39 ?
C122 H122 . 0.95 ?
C123 C124 . 1.39 ?
C123 H123 . 0.95 ?
C124 C125 . 1.39 ?
C124 H124 . 0.95 ?
C125 C126 . 1.39 ?
C125 H125 . 0.95 ?
C126 H126 . 0.95 ?
C421 C422 . 1.39 ?
C421 C426 . 1.39 ?
C422 C423 . 1.39 ?
C422 H422 . 0.95 ?
C423 C424 . 1.39 ?
C423 H423 . 0.95 ?
C424 C425 . 1.39 ?
C424 H424 . 0.95 ?
C425 C426 . 1.39 ?
C425 H425 . 0.95 ?
C426 H426 . 0.95 ?
C127 C128 . 1.25(2) ?
C128 C129 . 1.42(2) ?
C129 C130 . 1.37(2) ?
C129 C134 . 1.37(2) ?
C130 C131 . 1.41(3) ?
C130 H130 . 0.95 ?
C131 C132 . 1.33(3) ?
C131 H131 . 0.95 ?
C132 C133 . 1.39(3) ?
C132 H132 . 0.95 ?
C133 C134 . 1.34(3) ?
C133 H133 . 0.95 ?
C134 H134 . 0.95 ?
C135 C136 . 1.227(17) ?
C136 C137 . 1.448(19) ?
C137 C142 . 1.359(18) ?
C137 C138 . 1.376(18) ?
C138 C139 . 1.38(2) ?
C138 H138 . 0.95 ?
C139 C140 . 1.37(2) ?
C139 H139 . 0.95 ?
C140 C141 . 1.32(2) ?
C140 H140 . 0.95 ?
C141 C142 . 1.380(19) ?
C141 H141 . 0.95 ?
C142 H142 . 0.95 ?
C143 C144 . 1.205(17) ?
C143 Ag11 2_557 2.362(12) ?
C144 C145 . 1.416(17) ?
C144 C445 . 1.59(3) ?
C145 C146 . 1.39 ?
C145 C150 . 1.39 ?
C146 C147 . 1.39 ?
C146 H146 . 0.95 ?
C147 C148 . 1.39 ?
C147 H147 . 0.95 ?
C148 C149 . 1.39 ?
C148 H148 . 0.95 ?
C149 C150 . 1.39 ?
C149 H149 . 0.95 ?
C150 H150 . 0.95 ?
C445 C446 . 1.39 ?
C445 C450 . 1.39 ?
C446 C447 . 1.39 ?
C446 H446 . 0.95 ?
C447 C448 . 1.39 ?
C447 H447 . 0.95 ?
C448 C449 . 1.39 ?
C448 H448 . 0.95 ?
C449 C450 . 1.39 ?
C449 H449 . 0.95 ?
C450 H450 . 0.95 ?
C151 C152 . 1.216(19) ?
C151 Ag12 2_557 2.358(13) ?
C152 C153 . 1.46(2) ?
C153 C154 . 1.37(2) ?
C153 C158 . 1.40(2) ?
C154 C155 . 1.36(2) ?
C154 H154 . 0.95 ?
C155 C156 . 1.42(3) ?
C155 H155 . 0.95 ?
C156 C157 . 1.31(3) ?
C156 H156 . 0.95 ?
C157 C158 . 1.43(3) ?
C157 H157 . 0.95 ?
C158 H158 . 0.95 ?
C159 C160 . 1.232(18) ?
C159 Ag12 2_557 2.409(11) ?
C159 Ag18 2_557 2.426(12) ?
C160 C161 . 1.45(2) ?
C160 Ag12 2_557 2.671(14) ?
C161 C162 . 1.38(2) ?
C161 C166 . 1.38(2) ?
C162 C163 . 1.38(2) ?
C162 H162 . 0.95 ?
C163 C164 . 1.32(3) ?
C163 H163 . 0.95 ?
C164 C165 . 1.41(3) ?
C164 H164 . 0.95 ?
C165 C166 . 1.35(2) ?
C165 H165 . 0.95 ?
C166 H166 . 0.95 ?
C167 C168 . 1.389(18) ?
C167 C172 . 1.394(18) ?
C168 C169 . 1.39(2) ?
C168 H168 . 0.95 ?
C169 C170 . 1.35(2) ?
C169 H169 . 0.95 ?
C170 C171 . 1.37(2) ?
C170 H170 . 0.95 ?
C171 C172 . 1.39(2) ?
C171 H171 . 0.95 ?
C172 H172 . 0.95 ?
C173 C174 . 1.379(19) ?
C173 C178 . 1.38(2) ?
C174 C175 . 1.45(2) ?
C174 H174 . 0.95 ?
C175 C176 . 1.30(3) ?
C175 H175 . 0.95 ?
C176 C177 . 1.30(3) ?
C176 H176 . 0.95 ?
C177 C178 . 1.39(3) ?
C177 H177 . 0.95 ?
C178 H178 . 0.95 ?
C179 C184 . 1.355(18) ?
C179 C180 . 1.386(18) ?
C180 C181 . 1.42(2) ?
C180 H180 . 0.95 ?
C181 C182 . 1.40(2) ?
C181 H181 . 0.95 ?
C182 C183 . 1.34(2) ?
C182 H182 . 0.95 ?
C183 C184 . 1.361(19) ?
C183 H183 . 0.95 ?
C184 H184 . 0.95 ?
C185 C186 . 1.35(2) ?
C185 C190 . 1.357(18) ?
C186 C187 . 1.40(2) ?
C186 H186 . 0.95 ?
C187 C188 . 1.32(2) ?
C187 H187 . 0.95 ?
C188 C189 . 1.37(2) ?
C188 H188 . 0.95 ?
C189 C190 . 1.395(19) ?
C189 H189 . 0.95 ?
C190 H190 . 0.95 ?
C191 C192 . 1.39 ?
C191 C196 . 1.39 ?
C192 C193 . 1.39 ?
C192 H192 . 0.95 ?
C193 C194 . 1.39 ?
C193 H193 . 0.95 ?
C194 C195 . 1.39 ?
C194 H194 . 0.95 ?
C195 C196 . 1.39 ?
C195 H195 . 0.95 ?
C196 H196 . 0.95 ?
C491 C492 . 1.39 ?
C491 C496 . 1.39 ?
C492 C493 . 1.39 ?
C492 H492 . 0.95 ?
C493 C494 . 1.39 ?
C493 H493 . 0.95 ?
C494 C495 . 1.39 ?
C494 H494 . 0.95 ?
C495 C496 . 1.39 ?
C495 H495 . 0.95 ?
C496 H496 . 0.95 ?
C197 C198 . 1.39 ?
C197 C202 . 1.39 ?
C198 C199 . 1.39 ?
C198 H198 . 0.95 ?
C199 C200 . 1.39 ?
C199 H199 . 0.95 ?
C200 C201 . 1.39 ?
C200 H200 . 0.95 ?
C201 C202 . 1.39 ?
C201 H201 . 0.95 ?
C202 H202 . 0.95 ?
C497 C498 . 1.39 ?
C497 C502 . 1.39 ?
C498 C499 . 1.39 ?
C498 H498 . 0.95 ?
C499 C500 . 1.39 ?
C499 H499 . 0.95 ?
C500 C501 . 1.39 ?
C500 H500 . 0.95 ?
C501 C502 . 1.39 ?
C501 H501 . 0.95 ?
C502 H502 . 0.95 ?
C203 C204 . 1.39 ?
C203 C208 . 1.39 ?
C204 C205 . 1.39 ?
C204 H204 . 0.95 ?
C205 C206 . 1.39 ?
C205 H205 . 0.95 ?
C206 C207 . 1.39 ?
C206 H206 . 0.95 ?
C207 C208 . 1.39 ?
C207 H207 . 0.95 ?
C208 H208 . 0.95 ?
C503 C504 . 1.39 ?
C503 C508 . 1.39 ?
C504 C505 . 1.39 ?
C504 H504 . 0.95 ?
C505 C506 . 1.39 ?
C505 H505 . 0.95 ?
C506 C507 . 1.39 ?
C506 H506 . 0.95 ?
C507 C508 . 1.39 ?
C507 H507 . 0.95 ?
C508 H508 . 0.95 ?
C209 C210 . 1.348(17) ?
C209 C214 . 1.401(17) ?
C210 C211 . 1.35(2) ?
C210 H210 . 0.95 ?
C211 C212 . 1.36(2) ?
C211 H211 . 0.95 ?
C212 C213 . 1.34(2) ?
C212 H212 . 0.95 ?
C213 C214 . 1.377(19) ?
C213 H213 . 0.95 ?
C214 H214 . 0.95 ?
C215 C220 . 1.37(2) ?
C215 C216 . 1.43(2) ?
C216 C217 . 1.38(2) ?
C216 H216 . 0.95 ?
C217 C218 . 1.37(3) ?
C217 H217 . 0.95 ?
C218 C219 . 1.38(3) ?
C218 H218 . 0.95 ?
C219 C220 . 1.39(2) ?
C219 H219 . 0.95 ?
C220 H220 . 0.95 ?
N1 C226 . 1.509(9) ?
N1 C224 . 1.510(9) ?
N1 C221 . 1.511(9) ?
N1 C223 . 1.514(9) ?
C221 C222 . 1.51(3) ?
C221 H222 . 0.99 ?
C221 H223 . 0.99 ?
C222 H224 . 0.98 ?
C222 H225 . 0.98 ?
C222 H226 . 0.98 ?
C224 C225 . 1.50(4) ?
C224 H231 . 0.99 ?
C224 H232 . 0.99 ?
C225 H233 . 0.98 ?
C225 H234 . 0.98 ?
C225 H235 . 0.98 ?
C223 C527 . 1.552(10) ?
C223 Cl3 . 1.762(10) ?
C223 H227 . 0.99 ?
C223 H228 . 0.99 ?
C223 H229 . 0.99 ?
C223 H230 . 0.99 ?
C527 F18B . 1.82(3) ?
C527 H243 . 0.98 ?
C527 H244 . 0.98 ?
C527 H245 . 0.98 ?
C226 C227 . 1.543(10) ?
C226 Cl3B . 1.762(10) ?
C226 H236 . 0.99 ?
C226 H237 . 0.99 ?
C226 H238 . 0.99 ?
C226 H239 . 0.99 ?
C227 H240 . 0.98 ?
C227 H241 . 0.98 ?
C227 H242 . 0.98 ?
Cl3B F1B 2_666 1.7(6) ?
Sb1A F1A . 1.8463 ?
Sb1A F4A . 1.8467 ?
Sb1A F5A . 1.8473 ?
Sb1A F3A . 1.8601 ?
Sb1A F2A . 1.8606 ?
Sb1A F6A . 1.8611 ?
Sb1B F1B . 1.8462 ?
Sb1B F4B . 1.8467 ?
Sb1B F5B . 1.8472 ?
Sb1B F3B . 1.8602 ?
Sb1B F2B . 1.8607 ?
Sb1B F6B . 1.8611 ?
F1B Cl3B 2_666 1.75(9) ?
Sb2A F7A . 1.8462 ?
Sb2A F10A . 1.8467 ?
Sb2A F11A . 1.8472 ?
Sb2A F9A . 1.8601 ?
Sb2A F8A . 1.8606 ?
Sb2A F12A . 1.8611 ?
Sb2B F7B . 1.8462 ?
Sb2B F10B . 1.8467 ?
Sb2B F11B . 1.8471 ?
Sb2B F9B . 1.8602 ?
Sb2B F8B . 1.8606 ?
Sb2B F12B . 1.8611 ?
Sb3A F13A . 1.8463 ?
Sb3A F16A . 1.8467 ?
Sb3A F17A . 1.8471 ?
Sb3A F15A . 1.8602 ?
Sb3A F14A . 1.8607 ?
Sb3A F18A . 1.8609 ?
Sb3B F13B . 1.8463 ?
Sb3B F16B . 1.8468 ?
Sb3B F17B . 1.8472 ?
Sb3B F15B . 1.8602 ?
Sb3B F14B . 1.8605 ?
Sb3B F18B . 1.861 ?
Sb4A F19A . 1.8462 ?
Sb4A F22A . 1.8467 ?
Sb4A F23A . 1.8471 ?
Sb4A F21A . 1.8602 ?
Sb4A F20A . 1.8606 ?
Sb4A F24A . 1.8611 ?
Sb4B F19B . 1.8462 ?
Sb4B F22B . 1.8467 ?
Sb4B F23B . 1.8472 ?
Sb4B F21B . 1.8601 ?
Sb4B F20B . 1.8605 ?
Sb4B F24B . 1.8612 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
C1 Ag1 C9 . . 123.2(5) ?
C1 Ag1 C17 . . 126.5(5) ?
C9 Ag1 C17 . . 102.9(5) ?
C1 Ag1 Ag2 . . 48.2(4) ?
C9 Ag1 Ag2 . . 154.2(3) ?
C17 Ag1 Ag2 . . 98.9(3) ?
C1 Ag1 Ag3 . . 49.1(3) ?
C9 Ag1 Ag3 . . 93.4(3) ?
C17 Ag1 Ag3 . . 158.9(4) ?
Ag2 Ag1 Ag3 . . 62.45(3) ?
C1 Ag1 Ag5 . . 143.1(4) ?
C9 Ag1 Ag5 . . 92.1(4) ?
C17 Ag1 Ag5 . . 40.9(4) ?
Ag2 Ag1 Ag5 . . 95.42(4) ?
Ag3 Ag1 Ag5 . . 126.42(4) ?
C1 Ag1 Ag4 . . 138.3(3) ?
C9 Ag1 Ag4 . . 37.5(4) ?
C17 Ag1 Ag4 . . 94.6(3) ?
Ag2 Ag1 Ag4 . . 127.37(4) ?
Ag3 Ag1 Ag4 . . 90.19(4) ?
Ag5 Ag1 Ag4 . . 64.41(3) ?
C1 Ag2 C33 . 2_666 124.8(5) ?
C1 Ag2 C25 . . 128.5(5) ?
C33 Ag2 C25 2_666 . 99.7(4) ?
C1 Ag2 Ag1 . . 48.8(4) ?
C33 Ag2 Ag1 2_666 . 157.9(3) ?
C25 Ag2 Ag1 . . 97.9(3) ?
C1 Ag2 Ag3 . . 48.1(3) ?
C33 Ag2 Ag3 2_666 . 98.9(3) ?
C25 Ag2 Ag3 . . 154.8(3) ?
Ag1 Ag2 Ag3 . . 60.54(3) ?
C1 Ag2 Ag4 . 2_666 140.0(3) ?
C33 Ag2 Ag4 2_666 2_666 40.9(4) ?
C25 Ag2 Ag4 . 2_666 90.1(3) ?
Ag1 Ag2 Ag4 . 2_666 126.13(4) ?
Ag3 Ag2 Ag4 . 2_666 92.86(4) ?
C1 Ag2 Ag6 . . 142.3(4) ?
C33 Ag2 Ag6 2_666 . 91.3(4) ?
C25 Ag2 Ag6 . . 39.5(4) ?
Ag1 Ag2 Ag6 . . 93.83(4) ?
Ag3 Ag2 Ag6 . . 123.36(4) ?
Ag4 Ag2 Ag6 2_666 . 61.02(4) ?
C49 Ag3 C1 2_666 . 124.9(5) ?
C49 Ag3 C41 2_666 2_666 104.8(5) ?
C1 Ag3 C41 . 2_666 120.8(5) ?
C49 Ag3 Ag1 2_666 . 101.5(4) ?
C1 Ag3 Ag1 . . 46.6(4) ?
C41 Ag3 Ag1 2_666 . 151.7(3) ?
C49 Ag3 Ag6 2_666 2_666 42.9(4) ?
C1 Ag3 Ag6 . 2_666 139.4(4) ?
C41 Ag3 Ag6 2_666 2_666 98.3(4) ?
Ag1 Ag3 Ag6 . 2_666 93.79(4) ?
C49 Ag3 Ag2 2_666 . 158.0(4) ?
C1 Ag3 Ag2 . . 45.2(4) ?
C41 Ag3 Ag2 2_666 . 95.7(3) ?
Ag1 Ag3 Ag2 . . 57.01(3) ?
Ag6 Ag3 Ag2 2_666 . 127.00(5) ?
C49 Ag3 Ag5 2_666 2_666 96.8(4) ?
C1 Ag3 Ag5 . 2_666 137.8(4) ?
C41 Ag3 Ag5 2_666 2_666 40.7(4) ?
Ag1 Ag3 Ag5 . 2_666 125.77(5) ?
Ag6 Ag3 Ag5 2_666 2_666 67.25(3) ?
Ag2 Ag3 Ag5 . 2_666 93.63(4) ?
C9 Ag4 C33 . . 170.1(5) ?
C9 Ag4 Ag8 . . 124.3(4) ?
C33 Ag4 Ag8 . . 53.1(3) ?
C9 Ag4 Ag9 . . 50.1(3) ?
C33 Ag4 Ag9 . . 127.8(3) ?
Ag8 Ag4 Ag9 . . 157.93(5) ?
C9 Ag4 Ag2 . 2_666 143.0(4) ?
C33 Ag4 Ag2 . 2_666 46.3(3) ?
Ag8 Ag4 Ag2 . 2_666 82.59(4) ?
Ag9 Ag4 Ag2 . 2_666 113.94(4) ?
C9 Ag4 Ag6 . 2_666 90.9(4) ?
C33 Ag4 Ag6 . 2_666 94.5(3) ?
Ag8 Ag4 Ag6 . 2_666 142.39(5) ?
Ag9 Ag4 Ag6 . 2_666 55.34(3) ?
Ag2 Ag4 Ag6 2_666 2_666 59.90(3) ?
C9 Ag4 Ag1 . . 44.5(3) ?
C33 Ag4 Ag1 . . 144.3(3) ?
Ag8 Ag4 Ag1 . . 109.47(4) ?
Ag9 Ag4 Ag1 . . 80.82(4) ?
Ag2 Ag4 Ag1 2_666 . 106.44(4) ?
Ag6 Ag4 Ag1 2_666 . 85.54(4) ?
C41 Ag5 C17 . . 165.4(6) ?
C41 Ag5 Ag7 . . 122.7(4) ?
C17 Ag5 Ag7 . . 52.8(3) ?
C41 Ag5 Ag8 . . 50.9(3) ?
C17 Ag5 Ag8 . . 126.2(4) ?
Ag7 Ag5 Ag8 . . 156.28(5) ?
C41 Ag5 Ag3 . 2_666 47.5(4) ?
C17 Ag5 Ag3 . 2_666 145.0(4) ?
Ag7 Ag5 Ag3 . 2_666 108.23(4) ?
Ag8 Ag5 Ag3 . 2_666 83.50(4) ?
C41 Ag5 Ag1 . . 145.5(4) ?
C17 Ag5 Ag1 . . 48.1(4) ?
Ag7 Ag5 Ag1 . . 84.60(4) ?
Ag8 Ag5 Ag1 . . 112.09(4) ?
Ag3 Ag5 Ag1 2_666 . 107.49(4) ?
C25 Ag6 C49 . . 161.8(5) ?
C25 Ag6 Ag9 . 2_666 128.9(3) ?
C49 Ag6 Ag9 . 2_666 51.7(4) ?
C25 Ag6 Ag7 . . 51.4(4) ?
C49 Ag6 Ag7 . . 118.2(4) ?
Ag9 Ag6 Ag7 2_666 . 153.12(5) ?
C25 Ag6 Ag3 . 2_666 144.8(3) ?
C49 Ag6 Ag3 . 2_666 47.8(3) ?
Ag9 Ag6 Ag3 2_666 2_666 82.87(4) ?
Ag7 Ag6 Ag3 . 2_666 108.44(4) ?
C25 Ag6 Ag2 . . 46.9(3) ?
C49 Ag6 Ag2 . . 151.3(3) ?
Ag9 Ag6 Ag2 2_666 . 117.07(5) ?
Ag7 Ag6 Ag2 . . 82.92(4) ?
Ag3 Ag6 Ag2 2_666 . 109.35(4) ?
C25 Ag6 Ag4 . 2_666 94.1(4) ?
C49 Ag6 Ag4 . 2_666 99.4(4) ?
Ag9 Ag6 Ag4 2_666 2_666 59.39(4) ?
Ag7 Ag6 Ag4 . 2_666 141.61(5) ?
Ag3 Ag6 Ag4 2_666 2_666 90.48(4) ?
Ag2 Ag6 Ag4 . 2_666 59.07(3) ?
C17 Ag7 C25 . . 99.5(5) ?
C17 Ag7 P1 . . 131.5(4) ?
C25 Ag7 P1 . . 129.0(3) ?
C17 Ag7 C26 . . 101.3(5) ?
C25 Ag7 C26 . . 27.8(4) ?
P1 Ag7 C26 . . 121.9(3) ?
C17 Ag7 Ag5 . . 44.3(4) ?
C25 Ag7 Ag5 . . 98.2(3) ?
P1 Ag7 Ag5 . . 115.87(9) ?
C26 Ag7 Ag5 . . 119.1(3) ?
C17 Ag7 Ag6 . . 99.4(4) ?
C25 Ag7 Ag6 . . 42.6(4) ?
P1 Ag7 Ag6 . . 114.23(10) ?
C26 Ag7 Ag6 . . 70.2(3) ?
Ag5 Ag7 Ag6 . . 70.36(4) ?
C41 Ag8 P2 . . 135.8(4) ?
C41 Ag8 C33 . . 102.3(4) ?
P2 Ag8 C33 . . 121.8(3) ?
C41 Ag8 C42 . . 27.7(4) ?
P2 Ag8 C42 . . 123.6(3) ?
C33 Ag8 C42 . . 106.3(4) ?
C41 Ag8 Ag4 . . 99.7(4) ?
P2 Ag8 Ag4 . . 112.76(10) ?
C33 Ag8 Ag4 . . 44.5(4) ?
C42 Ag8 Ag4 . . 122.2(3) ?
C41 Ag8 Ag5 . . 43.1(4) ?
P2 Ag8 Ag5 . . 121.65(9) ?
C33 Ag8 Ag5 . . 100.9(3) ?
C42 Ag8 Ag5 . . 70.1(3) ?
Ag4 Ag8 Ag5 . . 70.65(4) ?
C49 Ag9 C9 2_666 . 101.3(4) ?
C49 Ag9 P3 2_666 . 132.5(3) ?
C9 Ag9 P3 . . 126.3(3) ?
C49 Ag9 C10 2_666 . 106.8(4) ?
C9 Ag9 C10 . . 27.6(4) ?
P3 Ag9 C10 . . 115.5(3) ?
C49 Ag9 Ag6 2_666 2_666 44.6(4) ?
C9 Ag9 Ag6 . 2_666 92.6(3) ?
P3 Ag9 Ag6 . 2_666 123.15(11) ?
C10 Ag9 Ag6 . 2_666 115.9(3) ?
C49 Ag9 Ag4 2_666 . 98.9(4) ?
C9 Ag9 Ag4 . . 41.1(4) ?
P3 Ag9 Ag4 . . 115.85(10) ?
C10 Ag9 Ag4 . . 68.0(4) ?
Ag6 Ag9 Ag4 2_666 . 65.28(4) ?
C111 Ag10 C119 . . 125.7(5) ?
C111 Ag10 C127 . . 118.7(5) ?
C119 Ag10 C127 . . 108.6(5) ?
C111 Ag10 Ag13 . . 143.7(3) ?
C119 Ag10 Ag13 . . 45.2(4) ?
C127 Ag10 Ag13 . . 94.1(4) ?
C111 Ag10 Ag12 . . 47.9(3) ?
C119 Ag10 Ag12 . . 100.7(4) ?
C127 Ag10 Ag12 . . 147.0(4) ?
Ag13 Ag10 Ag12 . . 96.13(4) ?
C111 Ag10 Ag11 . . 45.3(3) ?
C119 Ag10 Ag11 . . 157.6(4) ?
C127 Ag10 Ag11 . . 91.4(4) ?
Ag13 Ag10 Ag11 . . 125.63(5) ?
Ag12 Ag10 Ag11 . . 57.45(3) ?
C111 Ag10 Ag14 . . 132.8(3) ?
C119 Ag10 Ag14 . . 101.0(4) ?
C127 Ag10 Ag14 . . 37.1(4) ?
Ag13 Ag10 Ag14 . . 66.03(4) ?
Ag12 Ag10 Ag14 . . 123.14(4) ?
Ag11 Ag10 Ag14 . . 88.81(4) ?
C111 Ag11 C135 . . 123.1(5) ?
C111 Ag11 C143 . 2_557 127.1(5) ?
C135 Ag11 C143 . 2_557 103.4(4) ?
C111 Ag11 Ag12 . . 49.8(3) ?
C135 Ag11 Ag12 . . 159.6(3) ?
C143 Ag11 Ag12 2_557 . 93.3(3) ?
C111 Ag11 Ag10 . . 47.5(3) ?
C135 Ag11 Ag10 . . 100.2(3) ?
C143 Ag11 Ag10 2_557 . 149.8(3) ?
Ag12 Ag11 Ag10 . . 60.36(3) ?
C111 Ag11 Ag15 . . 140.9(3) ?
C135 Ag11 Ag15 . . 40.7(3) ?
C143 Ag11 Ag15 2_557 . 90.6(3) ?
Ag12 Ag11 Ag15 . . 128.84(4) ?
Ag10 Ag11 Ag15 . . 95.15(4) ?
C111 Ag11 Ag13 . 2_557 141.5(3) ?
C135 Ag11 Ag13 . 2_557 93.7(3) ?
C143 Ag11 Ag13 2_557 2_557 38.9(4) ?
Ag12 Ag11 Ag13 . 2_557 91.85(4) ?
Ag10 Ag11 Ag13 . 2_557 121.36(4) ?
Ag15 Ag11 Ag13 . 2_557 61.82(3) ?
C111 Ag12 C151 . 2_557 129.1(5) ?
C111 Ag12 C159 . 2_557 125.7(5) ?
C151 Ag12 C159 2_557 2_557 99.3(4) ?
C111 Ag12 C160 . 2_557 110.2(5) ?
C151 Ag12 C160 2_557 2_557 99.2(4) ?
C159 Ag12 C160 2_557 2_557 27.4(4) ?
C111 Ag12 Ag11 . . 47.7(3) ?
C151 Ag12 Ag11 2_557 . 102.3(3) ?
C159 Ag12 Ag11 2_557 . 151.8(3) ?
C160 Ag12 Ag11 2_557 . 156.5(3) ?
C111 Ag12 Ag10 . . 48.3(3) ?
C151 Ag12 Ag10 2_557 . 161.8(3) ?
C159 Ag12 Ag10 2_557 . 93.0(3) ?
C160 Ag12 Ag10 2_557 . 97.8(3) ?
Ag11 Ag12 Ag10 . . 62.19(4) ?
C111 Ag12 Ag14 . 2_557 144.7(3) ?
C151 Ag12 Ag14 2_557 2_557 42.9(4) ?
C159 Ag12 Ag14 2_557 2_557 86.4(3) ?
C160 Ag12 Ag14 2_557 2_557 105.0(3) ?
Ag11 Ag12 Ag14 . 2_557 97.20(4) ?
Ag10 Ag12 Ag14 . 2_557 125.68(5) ?
C143 Ag13 C119 . . 159.6(5) ?
C143 Ag13 Ag10 . . 146.7(3) ?
C119 Ag13 Ag10 . . 51.2(4) ?
C143 Ag13 Ag18 . . 122.7(3) ?
C119 Ag13 Ag18 . . 51.2(4) ?
Ag10 Ag13 Ag18 . . 86.87(4) ?
C143 Ag13 Ag17 . . 51.8(3) ?
C119 Ag13 Ag17 . . 121.5(4) ?
Ag10 Ag13 Ag17 . . 110.45(4) ?
Ag18 Ag13 Ag17 . . 150.17(5) ?
C143 Ag13 Ag11 . 2_557 45.4(3) ?
C119 Ag13 Ag11 . 2_557 152.1(4) ?
Ag10 Ag13 Ag11 . 2_557 113.00(4) ?
Ag18 Ag13 Ag11 . 2_557 111.83(4) ?
Ag17 Ag13 Ag11 . 2_557 84.33(4) ?
C143 Ag13 Ag15 . 2_557 91.5(3) ?
C119 Ag13 Ag15 . 2_557 97.7(4) ?
Ag10 Ag13 Ag15 . 2_557 92.92(4) ?
Ag18 Ag13 Ag15 . 2_557 57.40(4) ?
Ag17 Ag13 Ag15 . 2_557 140.73(4) ?
Ag11 Ag13 Ag15 2_557 2_557 57.10(3) ?
C127 Ag14 C151 . . 162.7(5) ?
C127 Ag14 Ag17 . . 115.9(4) ?
C151 Ag14 Ag17 . . 54.1(3) ?
C127 Ag14 Ag16 . . 50.1(4) ?
C151 Ag14 Ag16 . . 129.5(3) ?
Ag17 Ag14 Ag16 . . 148.89(5) ?
C127 Ag14 Ag12 . 2_557 147.3(4) ?
C151 Ag14 Ag12 . 2_557 50.0(4) ?
Ag17 Ag14 Ag12 . 2_557 87.11(4) ?
Ag16 Ag14 Ag12 . 2_557 119.15(5) ?
C127 Ag14 Ag15 . . 90.5(4) ?
C151 Ag14 Ag15 . . 102.5(4) ?
Ag17 Ag14 Ag15 . . 152.18(5) ?
Ag16 Ag14 Ag15 . . 56.04(3) ?
Ag12 Ag14 Ag15 2_557 . 65.14(3) ?
C127 Ag14 Ag10 . . 44.4(4) ?
C151 Ag14 Ag10 . . 146.0(3) ?
Ag17 Ag14 Ag10 . . 104.54(4) ?
Ag16 Ag14 Ag10 . . 83.10(4) ?
Ag12 Ag14 Ag10 2_557 . 109.82(4) ?
Ag15 Ag14 Ag10 . . 87.64(4) ?
C159 Ag15 C135 . . 168.2(5) ?
C159 Ag15 Ag16 . . 121.6(4) ?
C135 Ag15 Ag16 . . 52.8(3) ?
C159 Ag15 Ag18 . 2_557 52.9(3) ?
C135 Ag15 Ag18 . 2_557 126.9(3) ?
Ag16 Ag15 Ag18 . 2_557 156.09(5) ?
C159 Ag15 Ag11 . . 143.6(3) ?
C135 Ag15 Ag11 . . 48.1(3) ?
Ag16 Ag15 Ag11 . . 84.15(4) ?
Ag18 Ag15 Ag11 2_557 . 113.27(4) ?
C159 Ag15 Ag14 . . 86.2(3) ?
C135 Ag15 Ag14 . . 96.8(3) ?
Ag16 Ag15 Ag14 . . 57.11(3) ?
Ag18 Ag15 Ag14 2_557 . 135.53(4) ?
Ag11 Ag15 Ag14 . . 88.39(4) ?
C159 Ag15 Ag13 . 2_557 89.7(4) ?
C135 Ag15 Ag13 . 2_557 99.0(3) ?
Ag16 Ag15 Ag13 . 2_557 145.22(5) ?
Ag18 Ag15 Ag13 2_557 2_557 54.93(3) ?
Ag11 Ag15 Ag13 . 2_557 61.08(3) ?
Ag14 Ag15 Ag13 . 2_557 116.84(4) ?
C127 Ag16 C135 . . 98.5(4) ?
C127 Ag16 P4 . . 136.7(3) ?
C135 Ag16 P4 . . 124.8(3) ?
C127 Ag16 Ag15 . . 93.9(4) ?
C135 Ag16 Ag15 . . 43.4(3) ?
P4 Ag16 Ag15 . . 117.32(11) ?
C127 Ag16 Ag14 . . 42.6(4) ?
C135 Ag16 Ag14 . . 97.9(3) ?
P4 Ag16 Ag14 . . 121.89(9) ?
Ag15 Ag16 Ag14 . . 66.85(4) ?
C151 Ag17 P5 . . 136.0(3) ?
C151 Ag17 C143 . . 95.9(4) ?
P5 Ag17 C143 . . 128.1(3) ?
C151 Ag17 C144 . . 95.5(4) ?
P5 Ag17 C144 . . 122.5(3) ?
C143 Ag17 C144 . . 26.7(4) ?
C151 Ag17 Ag14 . . 45.2(4) ?
P5 Ag17 Ag14 . . 121.58(9) ?
C143 Ag17 Ag14 . . 94.1(3) ?
C144 Ag17 Ag14 . . 112.7(3) ?
C151 Ag17 Ag13 . . 100.1(3) ?
P5 Ag17 Ag13 . . 113.36(10) ?
C143 Ag17 Ag13 . . 41.9(3) ?
C144 Ag17 Ag13 . . 68.4(3) ?
Ag14 Ag17 Ag13 . . 69.80(4) ?
C119 Ag18 P6 . . 141.1(3) ?
C119 Ag18 C159 . 2_557 99.5(4) ?
P6 Ag18 C159 . 2_557 119.0(3) ?
C119 Ag18 Ag13 . . 45.2(4) ?
P6 Ag18 Ag13 . . 122.45(10) ?
C159 Ag18 Ag13 2_557 . 92.7(3) ?
C119 Ag18 Ag15 . 2_557 101.7(4) ?
P6 Ag18 Ag15 . 2_557 103.43(10) ?
C159 Ag18 Ag15 2_557 2_557 42.6(3) ?
Ag13 Ag18 Ag15 . 2_557 67.67(4) ?
C69 P1 C363 . . 101.5(12) ?
C69 P1 C57 . . 106.9(6) ?
C363 P1 C57 . . 108.7(9) ?
C69 P1 C63 . . 107.1(17) ?
C57 P1 C63 . . 107.4(13) ?
C69 P1 Ag7 . . 114.1(4) ?
C363 P1 Ag7 . . 113.3(9) ?
C57 P1 Ag7 . . 111.7(5) ?
C63 P1 Ag7 . . 109.4(14) ?
C75 P2 C87 . . 105.0(6) ?
C75 P2 C81 . . 104.9(6) ?
C87 P2 C81 . . 106.3(6) ?
C75 P2 Ag8 . . 113.5(4) ?
C87 P2 Ag8 . . 113.0(4) ?
C81 P2 Ag8 . . 113.3(4) ?
C99 P3 C93 . . 107.6(7) ?
C99 P3 C105 . . 103.6(7) ?
C93 P3 C105 . . 106.5(7) ?
C99 P3 Ag9 . . 114.5(5) ?
C93 P3 Ag9 . . 112.7(4) ?
C105 P3 Ag9 . . 111.3(4) ?
C167 P4 C179 . . 106.0(6) ?
C167 P4 C173 . . 103.5(6) ?
C179 P4 C173 . . 104.0(7) ?
C167 P4 Ag16 . . 112.8(5) ?
C179 P4 Ag16 . . 114.1(4) ?
C173 P4 Ag16 . . 115.3(5) ?
C497 P5 C185 . . 107.6(12) ?
C497 P5 C491 . . 112.(2) ?
C185 P5 C491 . . 104.8(16) ?
C185 P5 C197 . . 107.5(11) ?
C185 P5 C191 . . 107.1(7) ?
C197 P5 C191 . . 100.9(11) ?
C497 P5 Ag17 . . 107.4(10) ?
C185 P5 Ag17 . . 114.1(4) ?
C491 P5 Ag17 . . 110.8(17) ?
C197 P5 Ag17 . . 111.6(9) ?
C191 P5 Ag17 . . 114.6(5) ?
C203 P6 C215 . . 107.3(6) ?
C203 P6 C209 . . 107.9(6) ?
C215 P6 C209 . . 104.9(7) ?
C215 P6 C503 . . 98.6(13) ?
C209 P6 C503 . . 97.7(13) ?
C203 P6 Ag18 . . 110.1(4) ?
C215 P6 Ag18 . . 112.3(5) ?
C209 P6 Ag18 . . 114.0(4) ?
C503 P6 Ag18 . . 126.4(11) ?
C2 C1 Ag2 . . 137.7(12) ?
C2 C1 Ag1 . . 137.3(12) ?
Ag2 C1 Ag1 . . 83.1(5) ?
C2 C1 Ag3 . . 105.9(11) ?
Ag2 C1 Ag3 . . 86.7(5) ?
Ag1 C1 Ag3 . . 84.3(5) ?
C1 C2 C3 . . 175.4(18) ?
C1 C2 C303 . . 163.(2) ?
C4 C3 C8 . . 120.0 ?
C4 C3 C2 . . 120.3(15) ?
C8 C3 C2 . . 119.4(15) ?
C3 C4 C5 . . 120.0 ?
C3 C4 H4 . . 120.0 ?
C5 C4 H4 . . 120.0 ?
C6 C5 C4 . . 120.0 ?
C6 C5 H5 . . 120.0 ?
C4 C5 H5 . . 120.0 ?
C5 C6 C7 . . 120.0 ?
C5 C6 H6 . . 120.0 ?
C7 C6 H6 . . 120.0 ?
C6 C7 C8 . . 120.0 ?
C6 C7 H7 . . 120.0 ?
C8 C7 H7 . . 120.0 ?
C7 C8 C3 . . 120.0 ?
C7 C8 H8 . . 120.0 ?
C3 C8 H8 . . 120.0 ?
C304 C303 C308 . . 120.0 ?
C304 C303 C2 . . 117.(2) ?
C308 C303 C2 . . 123.(3) ?
C303 C304 C305 . . 120.0 ?
C303 C304 H304 . . 120.0 ?
C305 C304 H304 . . 120.0 ?
C306 C305 C304 . . 120.0 ?
C306 C305 H305 . . 120.0 ?
C304 C305 H305 . . 120.0 ?
C307 C306 C305 . . 120.0 ?
C307 C306 H306 . . 120.0 ?
C305 C306 H306 . . 120.0 ?
C306 C307 C308 . . 120.0 ?
C306 C307 H307 . . 120.0 ?
C308 C307 H307 . . 120.0 ?
C307 C308 C303 . . 120.0 ?
C307 C308 H308 . . 120.0 ?
C303 C308 H308 . . 120.0 ?
C10 C9 Ag4 . . 164.4(12) ?
C10 C9 Ag1 . . 95.5(9) ?
Ag4 C9 Ag1 . . 98.0(5) ?
C10 C9 Ag9 . . 90.3(10) ?
Ag4 C9 Ag9 . . 88.8(5) ?
Ag1 C9 Ag9 . . 123.5(6) ?
C9 C10 C311 . . 164.(3) ?
C9 C10 C11 . . 175.3(19) ?
C9 C10 Ag9 . . 62.1(8) ?
C311 C10 Ag9 . . 122.(3) ?
C11 C10 Ag9 . . 115.8(12) ?
C12 C11 C16 . . 120.0 ?
C12 C11 C10 . . 116.2(16) ?
C16 C11 C10 . . 123.8(16) ?
C13 C12 C11 . . 120.0 ?
C13 C12 H12 . . 120.0 ?
C11 C12 H12 . . 120.0 ?
C12 C13 C14 . . 120.0 ?
C12 C13 H13 . . 120.0 ?
C14 C13 H13 . . 120.0 ?
C15 C14 C13 . . 120.0 ?
C15 C14 H14 . . 120.0 ?
C13 C14 H14 . . 120.0 ?
C14 C15 C16 . . 120.0 ?
C14 C15 H15 . . 120.0 ?
C16 C15 H15 . . 120.0 ?
C15 C16 C11 . . 120.0 ?
C15 C16 H16 . . 120.0 ?
C11 C16 H16 . . 120.0 ?
C312 C311 C316 . . 120.0 ?
C312 C311 C10 . . 132.(4) ?
C316 C311 C10 . . 108.(4) ?
C313 C312 C311 . . 120.0 ?
C313 C312 H312 . . 120.0 ?
C311 C312 H312 . . 120.0 ?
C312 C313 C314 . . 120.0 ?
C312 C313 H313 . . 120.0 ?
C314 C313 H313 . . 120.0 ?
C315 C314 C313 . . 120.0 ?
C315 C314 H314 . . 120.0 ?
C313 C314 H314 . . 120.0 ?
C314 C315 C316 . . 120.0 ?
C314 C315 H315 . . 120.0 ?
C316 C315 H315 . . 120.0 ?
C315 C316 C311 . . 120.0 ?
C315 C316 H316 . . 120.0 ?
C311 C316 H316 . . 120.0 ?
C18 C17 Ag5 . . 171.8(14) ?
C18 C17 Ag1 . . 95.5(11) ?
Ag5 C17 Ag1 . . 91.0(5) ?
C18 C17 Ag7 . . 97.9(10) ?
Ag5 C17 Ag7 . . 82.9(5) ?
Ag1 C17 Ag7 . . 121.3(6) ?
C17 C18 C19 . . 177.6(15) ?
C20 C19 C24 . . 121.6(16) ?
C20 C19 C18 . . 122.3(14) ?
C24 C19 C18 . . 116.1(17) ?
C19 C20 C21 . . 121.2(17) ?
C19 C20 H20 . . 119.4 ?
C21 C20 H20 . . 119.4 ?
C20 C21 C22 . . 116.8(19) ?
C20 C21 H21 . . 121.6 ?
C22 C21 H21 . . 121.6 ?
C23 C22 C21 . . 122.(2) ?
C23 C22 H22 . . 118.8 ?
C21 C22 H22 . . 118.8 ?
C22 C23 C24 . . 120.(2) ?
C22 C23 H23 . . 120.2 ?
C24 C23 H23 . . 120.2 ?
C23 C24 C19 . . 118.2(19) ?
C23 C24 H24 . . 120.9 ?
C19 C24 H24 . . 120.9 ?
C26 C25 Ag6 . . 167.9(12) ?
C26 C25 Ag2 . . 98.5(10) ?
Ag6 C25 Ag2 . . 93.6(5) ?
C26 C25 Ag7 . . 87.1(9) ?
Ag6 C25 Ag7 . . 85.9(5) ?
Ag2 C25 Ag7 . . 122.2(5) ?
C25 C26 C27 . . 177.0(14) ?
C25 C26 Ag7 . . 65.0(8) ?
C27 C26 Ag7 . . 112.9(9) ?
C28 C27 C32 . . 119.7(15) ?
C28 C27 C26 . . 120.1(13) ?
C32 C27 C26 . . 120.0(14) ?
C29 C28 C27 . . 118.5(15) ?
C29 C28 H28 . . 120.8 ?
C27 C28 H28 . . 120.8 ?
C30 C29 C28 . . 122.4(17) ?
C30 C29 H29 . . 118.8 ?
C28 C29 H29 . . 118.8 ?
C29 C30 C31 . . 121.5(17) ?
C29 C30 H30 . . 119.2 ?
C31 C30 H30 . . 119.2 ?
C30 C31 C32 . . 118.7(17) ?
C30 C31 H31 . . 120.6 ?
C32 C31 H31 . . 120.6 ?
C27 C32 C31 . . 119.0(16) ?
C27 C32 H32 . . 120.5 ?
C31 C32 H32 . . 120.5 ?
C34 C33 Ag4 . . 168.3(11) ?
C34 C33 Ag2 . 2_666 97.8(10) ?
Ag4 C33 Ag2 . 2_666 92.8(5) ?
C34 C33 Ag8 . . 96.6(10) ?
Ag4 C33 Ag8 . . 82.5(4) ?
Ag2 C33 Ag8 2_666 . 119.7(5) ?
C33 C34 C35 . . 179.0(14) ?
C40 C35 C36 . . 117.7(16) ?
C40 C35 C34 . . 120.7(14) ?
C36 C35 C34 . . 121.5(14) ?
C35 C36 C37 . . 119.6(18) ?
C35 C36 H36 . . 120.2 ?
C37 C36 H36 . . 120.2 ?
C36 C37 C38 . . 119.(2) ?
C36 C37 H37 . . 120.5 ?
C38 C37 H37 . . 120.5 ?
C39 C38 C37 . . 121.(2) ?
C39 C38 H38 . . 119.4 ?
C37 C38 H38 . . 119.4 ?
C38 C39 C40 . . 118.(2) ?
C38 C39 H39 . . 121.2 ?
C40 C39 H39 . . 121.2 ?
C39 C40 C35 . . 124.6(19) ?
C39 C40 H40 . . 117.7 ?
C35 C40 H40 . . 117.7 ?
C42 C41 Ag5 . . 165.2(12) ?
C42 C41 Ag3 . 2_666 102.2(10) ?
Ag5 C41 Ag3 . 2_666 91.8(5) ?
C42 C41 Ag8 . . 90.4(9) ?
Ag5 C41 Ag8 . . 86.1(5) ?
Ag3 C41 Ag8 2_666 . 123.2(6) ?
C41 C42 C43 . . 178.4(14) ?
C41 C42 Ag8 . . 62.0(8) ?
C43 C42 Ag8 . . 117.1(9) ?
C44 C43 C48 . . 115.2(16) ?
C44 C43 C42 . . 121.4(15) ?
C48 C43 C42 . . 122.9(14) ?
C45 C44 C43 . . 127.(2) ?
C45 C44 H44 . . 116.6 ?
C43 C44 H44 . . 116.6 ?
C44 C45 C46 . . 115.(2) ?
C44 C45 H45 . . 122.3 ?
C46 C45 H45 . . 122.3 ?
C47 C46 C45 . . 121.(2) ?
C47 C46 H46 . . 119.6 ?
C45 C46 H46 . . 119.6 ?
C46 C47 C48 . . 121.7(19) ?
C46 C47 H47 . . 119.1 ?
C48 C47 H47 . . 119.1 ?
C47 C48 C43 . . 120.0(16) ?
C47 C48 H48 . . 120.0 ?
C43 C48 H48 . . 120.0 ?
C50 C49 Ag6 . . 153.8(12) ?
C50 C49 Ag3 . 2_666 109.7(10) ?
Ag6 C49 Ag3 . 2_666 89.3(5) ?
C50 C49 Ag9 . 2_666 101.2(11) ?
Ag6 C49 Ag9 . 2_666 83.6(5) ?
Ag3 C49 Ag9 2_666 2_666 119.8(6) ?
C49 C50 C51 . . 173.5(17) ?
C56 C51 C52 . . 118.8(18) ?
C56 C51 C50 . . 122.6(16) ?
C52 C51 C50 . . 118.6(17) ?
C53 C52 C51 . . 124.(2) ?
C53 C52 H52 . . 118.2 ?
C51 C52 H52 . . 118.2 ?
C52 C53 C54 . . 118.(2) ?
C52 C53 H53 . . 120.9 ?
C54 C53 H53 . . 120.9 ?
C55 C54 C53 . . 121.(2) ?
C55 C54 H54 . . 119.3 ?
C53 C54 H54 . . 119.3 ?
C54 C55 C56 . . 118.(2) ?
C54 C55 H55 . . 120.8 ?
C56 C55 H55 . . 120.8 ?
C51 C56 C55 . . 119.5(19) ?
C51 C56 H56 . . 120.2 ?
C55 C56 H56 . . 120.2 ?
C58 C57 C62 . . 117.5(14) ?
C58 C57 P1 . . 120.2(11) ?
C62 C57 P1 . . 122.3(12) ?
C57 C58 C59 . . 123.6(18) ?
C57 C58 H58 . . 118.2 ?
C59 C58 H58 . . 118.2 ?
C60 C59 C58 . . 118.(2) ?
C60 C59 H59 . . 121.2 ?
C58 C59 H59 . . 121.2 ?
C59 C60 C61 . . 122.2(18) ?
C59 C60 H60 . . 118.9 ?
C61 C60 H60 . . 118.9 ?
C60 C61 C62 . . 118.8(19) ?
C60 C61 H61 . . 120.6 ?
C62 C61 H61 . . 120.6 ?
C61 C62 C57 . . 120.2(18) ?
C61 C62 H62 . . 119.9 ?
C57 C62 H62 . . 119.9 ?
C64 C63 C68 . . 120.0 ?
C64 C63 P1 . . 125.(3) ?
C68 C63 P1 . . 115.(3) ?
C63 C64 C65 . . 120.0 ?
C63 C64 H64 . . 120.0 ?
C65 C64 H64 . . 120.0 ?
C66 C65 C64 . . 120.0 ?
C66 C65 H65 . . 120.0 ?
C64 C65 H65 . . 120.0 ?
C67 C66 C65 . . 120.0 ?
C67 C66 H66 . . 120.0 ?
C65 C66 H66 . . 120.0 ?
C66 C67 C68 . . 120.0 ?
C66 C67 H67 . . 120.0 ?
C68 C67 H67 . . 120.0 ?
C67 C68 C63 . . 120.0 ?
C67 C68 H68 . . 120.0 ?
C63 C68 H68 . . 120.0 ?
C364 C363 C368 . . 120.0 ?
C364 C363 P1 . . 112.5(18) ?
C368 C363 P1 . . 127.4(18) ?
C365 C364 C363 . . 120.0 ?
C365 C364 H364 . . 120.0 ?
C363 C364 H364 . . 120.0 ?
C364 C365 C366 . . 120.0 ?
C364 C365 H365 . . 120.0 ?
C366 C365 H365 . . 120.0 ?
C367 C366 C365 . . 120.0 ?
C367 C366 H366 . . 120.0 ?
C365 C366 H366 . . 120.0 ?
C368 C367 C366 . . 120.0 ?
C368 C367 H367 . . 120.0 ?
C366 C367 H367 . . 120.0 ?
C367 C368 C363 . . 120.0 ?
C367 C368 H368 . . 120.0 ?
C363 C368 H368 . . 120.0 ?
C74 C69 C70 . . 116.8(12) ?
C74 C69 P1 . . 124.4(11) ?
C70 C69 P1 . . 118.7(10) ?
C71 C70 C69 . . 121.5(13) ?
C71 C70 H70 . . 119.3 ?
C69 C70 H70 . . 119.3 ?
C70 C71 C72 . . 120.5(15) ?
C70 C71 H71 . . 119.8 ?
C72 C71 H71 . . 119.8 ?
C71 C72 C73 . . 120.6(16) ?
C71 C72 H72 . . 119.7 ?
C73 C72 H72 . . 119.7 ?
C74 C73 C72 . . 118.9(15) ?
C74 C73 H73 . . 120.6 ?
C72 C73 H73 . . 120.6 ?
C73 C74 C69 . . 121.6(15) ?
C73 C74 H74 . . 119.2 ?
C69 C74 H74 . . 119.2 ?
C76 C75 C80 . . 118.9(12) ?
C76 C75 P2 . . 118.8(10) ?
C80 C75 P2 . . 122.3(10) ?
C75 C76 C77 . . 121.2(14) ?
C75 C76 H76 . . 119.4 ?
C77 C76 H76 . . 119.4 ?
C78 C77 C76 . . 118.7(17) ?
C78 C77 H77 . . 120.7 ?
C76 C77 H77 . . 120.7 ?
C79 C78 C77 . . 120.7(17) ?
C79 C78 H78 . . 119.7 ?
C77 C78 H78 . . 119.7 ?
C78 C79 C80 . . 121.1(16) ?
C78 C79 H79 . . 119.5 ?
C80 C79 H79 . . 119.5 ?
C79 C80 C75 . . 119.0(14) ?
C79 C80 H80 . . 120.5 ?
C75 C80 H80 . . 120.5 ?
C86 C81 C82 . . 118.7(14) ?
C86 C81 P2 . . 123.4(11) ?
C82 C81 P2 . . 117.3(11) ?
C83 C82 C81 . . 122.8(16) ?
C83 C82 H82 . . 118.6 ?
C81 C82 H82 . . 118.6 ?
C82 C83 C84 . . 117.9(18) ?
C82 C83 H83 . . 121.0 ?
C84 C83 H83 . . 121.0 ?
C85 C84 C83 . . 119.7(16) ?
C85 C84 H84 . . 120.2 ?
C83 C84 H84 . . 120.2 ?
C84 C85 C86 . . 122.4(17) ?
C84 C85 H85 . . 118.8 ?
C86 C85 H85 . . 118.8 ?
C81 C86 C85 . . 118.2(16) ?
C81 C86 H86 . . 120.9 ?
C85 C86 H86 . . 120.9 ?
C92 C87 C88 . . 118.0(13) ?
C92 C87 P2 . . 118.2(11) ?
C88 C87 P2 . . 123.6(11) ?
C89 C88 C87 . . 119.0(15) ?
C89 C88 H88 . . 120.5 ?
C87 C88 H88 . . 120.5 ?
C90 C89 C88 . . 124.2(16) ?
C90 C89 H89 . . 117.9 ?
C88 C89 H89 . . 117.9 ?
C89 C90 C91 . . 118.0(16) ?
C89 C90 H90 . . 121.0 ?
C91 C90 H90 . . 121.0 ?
C92 C91 C90 . . 120.7(16) ?
C92 C91 H91 . . 119.6 ?
C90 C91 H91 . . 119.6 ?
C91 C92 C87 . . 120.1(15) ?
C91 C92 H92 . . 120.0 ?
C87 C92 H92 . . 120.0 ?
C98 C93 C94 . . 116.9(15) ?
C98 C93 P3 . . 119.2(12) ?
C94 C93 P3 . . 123.9(11) ?
C95 C94 C93 . . 122.5(16) ?
C95 C94 H94 . . 118.8 ?
C93 C94 H94 . . 118.8 ?
C94 C95 C96 . . 117.1(17) ?
C94 C95 H95 . . 121.5 ?
C96 C95 H95 . . 121.5 ?
C97 C96 C95 . . 120.4(19) ?
C97 C96 H96 . . 119.8 ?
C95 C96 H96 . . 119.8 ?
C96 C97 C98 . . 122.(2) ?
C96 C97 H97 . . 118.9 ?
C98 C97 H97 . . 118.9 ?
C93 C98 C97 . . 120.6(17) ?
C93 C98 H98 . . 119.7 ?
C97 C98 H98 . . 119.7 ?
C100 C99 C104 . . 116.9(14) ?
C100 C99 P3 . . 121.9(11) ?
C104 C99 P3 . . 121.1(11) ?
C99 C100 C101 . . 120.5(15) ?
C99 C100 H100 . . 119.7 ?
C101 C100 H100 . . 119.7 ?
C102 C101 C100 . . 120.3(15) ?
C102 C101 H101 . . 119.8 ?
C100 C101 H101 . . 119.8 ?
C101 C102 C103 . . 118.4(16) ?
C101 C102 H102 . . 120.8 ?
C103 C102 H102 . . 120.8 ?
C104 C103 C102 . . 121.6(17) ?
C104 C103 H103 . . 119.2 ?
C102 C103 H103 . . 119.2 ?
C103 C104 C99 . . 122.2(15) ?
C103 C104 H104 . . 118.9 ?
C99 C104 H104 . . 118.9 ?
C110 C105 C106 . . 119.8(17) ?
C110 C105 P3 . . 119.0(15) ?
C106 C105 P3 . . 121.0(13) ?
C105 C106 C107 . . 120.1(19) ?
C105 C106 H106 . . 120.0 ?
C107 C106 H106 . . 120.0 ?
C108 C107 C106 . . 117.(2) ?
C108 C107 H107 . . 121.5 ?
C106 C107 H107 . . 121.5 ?
C109 C108 C107 . . 125.(3) ?
C109 C108 H108 . . 117.5 ?
C107 C108 H108 . . 117.5 ?
C108 C109 C110 . . 119.(2) ?
C108 C109 H109 . . 120.6 ?
C110 C109 H109 . . 120.6 ?
C105 C110 C109 . . 119.(2) ?
C105 C110 H110 . . 120.3 ?
C109 C110 H110 . . 120.3 ?
C112 C111 Ag11 . . 144.5(11) ?
C112 C111 Ag12 . . 128.5(12) ?
Ag11 C111 Ag12 . . 82.5(5) ?
C112 C111 Ag10 . . 110.4(11) ?
Ag11 C111 Ag10 . . 87.2(5) ?
Ag12 C111 Ag10 . . 83.7(4) ?
C111 C112 C113 . . 177.9(17) ?
C114 C113 C118 . . 120.6(16) ?
C114 C113 C112 . . 119.5(16) ?
C118 C113 C112 . . 119.9(15) ?
C115 C114 C113 . . 122.(2) ?
C115 C114 H114 . . 119.0 ?
C113 C114 H114 . . 119.0 ?
C114 C115 C116 . . 117.(2) ?
C114 C115 H115 . . 121.5 ?
C116 C115 H115 . . 121.5 ?
C117 C116 C115 . . 123.(2) ?
C117 C116 H116 . . 118.4 ?
C115 C116 H116 . . 118.4 ?
C116 C117 C118 . . 120.(2) ?
C116 C117 H117 . . 120.1 ?
C118 C117 H117 . . 120.1 ?
C113 C118 C117 . . 117.5(19) ?
C113 C118 H118 . . 121.3 ?
C117 C118 H118 . . 121.3 ?
C120 C119 Ag13 . . 151.3(12) ?
C120 C119 Ag10 . . 119.9(11) ?
Ag13 C119 Ag10 . . 83.5(5) ?
C120 C119 Ag18 . . 95.4(11) ?
Ag13 C119 Ag18 . . 83.6(5) ?
Ag10 C119 Ag18 . . 122.4(6) ?
C119 C120 C121 . . 173.(2) ?
C119 C120 C421 . . 169.2(17) ?
C122 C121 C126 . . 120.0 ?
C122 C121 C120 . . 125.(3) ?
C126 C121 C120 . . 115.(3) ?
C121 C122 C123 . . 120.0 ?
C121 C122 H122 . . 120.0 ?
C123 C122 H122 . . 120.0 ?
C122 C123 C124 . . 120.0 ?
C122 C123 H123 . . 120.0 ?
C124 C123 H123 . . 120.0 ?
C125 C124 C123 . . 120.0 ?
C125 C124 H124 . . 120.0 ?
C123 C124 H124 . . 120.0 ?
C126 C125 C124 . . 120.0 ?
C126 C125 H125 . . 120.0 ?
C124 C125 H125 . . 120.0 ?
C125 C126 C121 . . 120.0 ?
C125 C126 H126 . . 120.0 ?
C121 C126 H126 . . 120.0 ?
C422 C421 C426 . . 120.0 ?
C422 C421 C120 . . 117.8(13) ?
C426 C421 C120 . . 122.1(13) ?
C421 C422 C423 . . 120.0 ?
C421 C422 H422 . . 120.0 ?
C423 C422 H422 . . 120.0 ?
C424 C423 C422 . . 120.0 ?
C424 C423 H423 . . 120.0 ?
C422 C423 H423 . . 120.0 ?
C423 C424 C425 . . 120.0 ?
C423 C424 H424 . . 120.0 ?
C425 C424 H424 . . 120.0 ?
C426 C425 C424 . . 120.0 ?
C426 C425 H425 . . 120.0 ?
C424 C425 H425 . . 120.0 ?
C425 C426 C421 . . 120.0 ?
C425 C426 H426 . . 120.0 ?
C421 C426 H426 . . 120.0 ?
C128 C127 Ag14 . . 162.9(12) ?
C128 C127 Ag16 . . 96.2(11) ?
Ag14 C127 Ag16 . . 87.3(7) ?
C128 C127 Ag10 . . 92.4(11) ?
Ag14 C127 Ag10 . . 98.5(6) ?
Ag16 C127 Ag10 . . 128.9(6) ?
C127 C128 C129 . . 178.0(15) ?
C130 C129 C134 . . 120.2(17) ?
C130 C129 C128 . . 120.4(15) ?
C134 C129 C128 . . 118.6(16) ?
C129 C130 C131 . . 118.9(18) ?
C129 C130 H130 . . 120.6 ?
C131 C130 H130 . . 120.6 ?
C132 C131 C130 . . 120.(2) ?
C132 C131 H131 . . 120.0 ?
C130 C131 H131 . . 120.0 ?
C131 C132 C133 . . 120.(2) ?
C131 C132 H132 . . 120.0 ?
C133 C132 H132 . . 120.0 ?
C134 C133 C132 . . 121.(2) ?
C134 C133 H133 . . 119.7 ?
C132 C133 H133 . . 119.7 ?
C133 C134 C129 . . 120.(2) ?
C133 C134 H134 . . 119.9 ?
C129 C134 H134 . . 119.9 ?
C136 C135 Ag15 . . 168.9(11) ?
C136 C135 Ag11 . . 99.7(9) ?
Ag15 C135 Ag11 . . 91.2(5) ?
C136 C135 Ag16 . . 92.9(8) ?
Ag15 C135 Ag16 . . 83.8(4) ?
Ag11 C135 Ag16 . . 120.6(5) ?
C135 C136 C137 . . 176.4(13) ?
C142 C137 C138 . . 118.3(13) ?
C142 C137 C136 . . 121.9(12) ?
C138 C137 C136 . . 119.7(13) ?
C137 C138 C139 . . 119.6(15) ?
C137 C138 H138 . . 120.2 ?
C139 C138 H138 . . 120.2 ?
C140 C139 C138 . . 119.0(16) ?
C140 C139 H139 . . 120.5 ?
C138 C139 H139 . . 120.5 ?
C141 C140 C139 . . 122.3(16) ?
C141 C140 H140 . . 118.8 ?
C139 C140 H140 . . 118.8 ?
C140 C141 C142 . . 117.9(15) ?
C140 C141 H141 . . 121.0 ?
C142 C141 H141 . . 121.0 ?
C137 C142 C141 . . 122.6(14) ?
C137 C142 H142 . . 118.7 ?
C141 C142 H142 . . 118.7 ?
C144 C143 Ag13 . . 168.8(11) ?
C144 C143 Ag11 . 2_557 95.4(9) ?
Ag13 C143 Ag11 . 2_557 95.8(5) ?
C144 C143 Ag17 . . 87.4(9) ?
Ag13 C143 Ag17 . . 86.3(5) ?
Ag11 C143 Ag17 2_557 . 127.1(5) ?
C143 C144 C145 . . 175.8(14) ?
C143 C144 C445 . . 175.3(19) ?
C143 C144 Ag17 . . 65.9(8) ?
C145 C144 Ag17 . . 109.9(9) ?
C445 C144 Ag17 . . 113.6(16) ?
C146 C145 C150 . . 120.0 ?
C146 C145 C144 . . 120.7(10) ?
C150 C145 C144 . . 119.2(10) ?
C145 C146 C147 . . 120.0 ?
C145 C146 H146 . . 120.0 ?
C147 C146 H146 . . 120.0 ?
C148 C147 C146 . . 120.0 ?
C148 C147 H147 . . 120.0 ?
C146 C147 H147 . . 120.0 ?
C147 C148 C149 . . 120.0 ?
C147 C148 H148 . . 120.0 ?
C149 C148 H148 . . 120.0 ?
C150 C149 C148 . . 120.0 ?
C150 C149 H149 . . 120.0 ?
C148 C149 H149 . . 120.0 ?
C149 C150 C145 . . 120.0 ?
C149 C150 H150 . . 120.0 ?
C145 C150 H150 . . 120.0 ?
C446 C445 C450 . . 120.0 ?
C446 C445 C144 . . 121.(2) ?
C450 C445 C144 . . 119.(2) ?
C447 C446 C445 . . 120.0 ?
C447 C446 H446 . . 120.0 ?
C445 C446 H446 . . 120.0 ?
C446 C447 C448 . . 120.0 ?
C446 C447 H447 . . 120.0 ?
C448 C447 H447 . . 120.0 ?
C449 C448 C447 . . 120.0 ?
C449 C448 H448 . . 120.0 ?
C447 C448 H448 . . 120.0 ?
C448 C449 C450 . . 120.0 ?
C448 C449 H449 . . 120.0 ?
C450 C449 H449 . . 120.0 ?
C449 C450 C445 . . 120.0 ?
C449 C450 H450 . . 120.0 ?
C445 C450 H450 . . 120.0 ?
C152 C151 Ag14 . . 172.0(12) ?
C152 C151 Ag12 . 2_557 100.3(11) ?
Ag14 C151 Ag12 . 2_557 87.1(5) ?
C152 C151 Ag17 . . 97.8(10) ?
Ag14 C151 Ag17 . . 80.7(5) ?
Ag12 C151 Ag17 2_557 . 120.7(5) ?
C151 C152 C153 . . 178.5(17) ?
C154 C153 C158 . . 120.1(18) ?
C154 C153 C152 . . 121.6(15) ?
C158 C153 C152 . . 118.2(18) ?
C155 C154 C153 . . 121.(2) ?
C155 C154 H154 . . 119.7 ?
C153 C154 H154 . . 119.7 ?
C154 C155 C156 . . 118.(2) ?
C154 C155 H155 . . 121.0 ?
C156 C155 H155 . . 121.0 ?
C157 C156 C155 . . 124.(3) ?
C157 C156 H156 . . 118.1 ?
C155 C156 H156 . . 118.1 ?
C156 C157 C158 . . 117.(2) ?
C156 C157 H157 . . 121.3 ?
C158 C157 H157 . . 121.3 ?
C153 C158 C157 . . 120.(2) ?
C153 C158 H158 . . 120.2 ?
C157 C158 H158 . . 120.2 ?
C160 C159 Ag15 . . 169.9(12) ?
C160 C159 Ag12 . 2_557 88.2(9) ?
Ag15 C159 Ag12 . 2_557 100.6(5) ?
C160 C159 Ag18 . 2_557 94.8(9) ?
Ag15 C159 Ag18 . 2_557 84.5(5) ?
Ag12 C159 Ag18 2_557 2_557 123.4(5) ?
C159 C160 C161 . . 176.5(16) ?
C159 C160 Ag12 . 2_557 64.4(8) ?
C161 C160 Ag12 . 2_557 118.8(9) ?
C162 C161 C166 . . 120.1(15) ?
C162 C161 C160 . . 120.2(15) ?
C166 C161 C160 . . 119.7(15) ?
C161 C162 C163 . . 119.9(19) ?
C161 C162 H162 . . 120.1 ?
C163 C162 H162 . . 120.1 ?
C164 C163 C162 . . 120.(2) ?
C164 C163 H163 . . 119.9 ?
C162 C163 H163 . . 119.9 ?
C163 C164 C165 . . 121.(2) ?
C163 C164 H164 . . 119.7 ?
C165 C164 H164 . . 119.7 ?
C166 C165 C164 . . 120.(2) ?
C166 C165 H165 . . 119.9 ?
C164 C165 H165 . . 119.9 ?
C165 C166 C161 . . 119.1(19) ?
C165 C166 H166 . . 120.5 ?
C161 C166 H166 . . 120.5 ?
C168 C167 C172 . . 117.4(14) ?
C168 C167 P4 . . 119.0(11) ?
C172 C167 P4 . . 123.6(12) ?
C167 C168 C169 . . 122.3(16) ?
C167 C168 H168 . . 118.9 ?
C169 C168 H168 . . 118.9 ?
C170 C169 C168 . . 118.7(17) ?
C170 C169 H169 . . 120.7 ?
C168 C169 H169 . . 120.7 ?
C169 C170 C171 . . 120.8(17) ?
C169 C170 H170 . . 119.6 ?
C171 C170 H170 . . 119.6 ?
C170 C171 C172 . . 121.1(17) ?
C170 C171 H171 . . 119.4 ?
C172 C171 H171 . . 119.4 ?
C171 C172 C167 . . 119.6(17) ?
C171 C172 H172 . . 120.2 ?
C167 C172 H172 . . 120.2 ?
C174 C173 C178 . . 118.3(15) ?
C174 C173 P4 . . 122.5(12) ?
C178 C173 P4 . . 119.2(13) ?
C173 C174 C175 . . 117.2(18) ?
C173 C174 H174 . . 121.4 ?
C175 C174 H174 . . 121.4 ?
C176 C175 C174 . . 122.(2) ?
C176 C175 H175 . . 119.2 ?
C174 C175 H175 . . 119.2 ?
C177 C176 C175 . . 121.(3) ?
C177 C176 H176 . . 119.6 ?
C175 C176 H176 . . 119.6 ?
C176 C177 C178 . . 122.(3) ?
C176 C177 H177 . . 119.1 ?
C178 C177 H177 . . 119.1 ?
C173 C178 C177 . . 120.(2) ?
C173 C178 H178 . . 120.0 ?
C177 C178 H178 . . 120.0 ?
C184 C179 C180 . . 118.1(14) ?
C184 C179 P4 . . 119.0(11) ?
C180 C179 P4 . . 122.6(11) ?
C179 C180 C181 . . 119.9(13) ?
C179 C180 H180 . . 120.1 ?
C181 C180 H180 . . 120.1 ?
C182 C181 C180 . . 118.3(14) ?
C182 C181 H181 . . 120.8 ?
C180 C181 H181 . . 120.8 ?
C183 C182 C181 . . 120.1(16) ?
C183 C182 H182 . . 119.9 ?
C181 C182 H182 . . 119.9 ?
C182 C183 C184 . . 120.4(15) ?
C182 C183 H183 . . 119.8 ?
C184 C183 H183 . . 119.8 ?
C179 C184 C183 . . 123.0(15) ?
C179 C184 H184 . . 118.5 ?
C183 C184 H184 . . 118.5 ?
C186 C185 C190 . . 115.8(16) ?
C186 C185 P5 . . 124.6(13) ?
C190 C185 P5 . . 119.5(11) ?
C185 C186 C187 . . 122.8(19) ?
C185 C186 H186 . . 118.6 ?
C187 C186 H186 . . 118.6 ?
C188 C187 C186 . . 120.6(19) ?
C188 C187 H187 . . 119.7 ?
C186 C187 H187 . . 119.7 ?
C187 C188 C189 . . 118.7(18) ?
C187 C188 H188 . . 120.7 ?
C189 C188 H188 . . 120.7 ?
C188 C189 C190 . . 119.6(15) ?
C188 C189 H189 . . 120.2 ?
C190 C189 H189 . . 120.2 ?
C185 C190 C189 . . 122.2(14) ?
C185 C190 H190 . . 118.9 ?
C189 C190 H190 . . 118.9 ?
C192 C191 C196 . . 120.0 ?
C192 C191 P5 . . 123.6(10) ?
C196 C191 P5 . . 116.3(10) ?
C191 C192 C193 . . 120.0 ?
C191 C192 H192 . . 120.0 ?
C193 C192 H192 . . 120.0 ?
C192 C193 C194 . . 120.0 ?
C192 C193 H193 . . 120.0 ?
C194 C193 H193 . . 120.0 ?
C195 C194 C193 . . 120.0 ?
C195 C194 H194 . . 120.0 ?
C193 C194 H194 . . 120.0 ?
C196 C195 C194 . . 120.0 ?
C196 C195 H195 . . 120.0 ?
C194 C195 H195 . . 120.0 ?
C195 C196 C191 . . 120.0 ?
C195 C196 H196 . . 120.0 ?
C191 C196 H196 . . 120.0 ?
C492 C491 C496 . . 120.0 ?
C492 C491 P5 . . 109.(3) ?
C496 C491 P5 . . 131.(3) ?
C493 C492 C491 . . 120.0 ?
C493 C492 H492 . . 120.0 ?
C491 C492 H492 . . 120.0 ?
C492 C493 C494 . . 120.0 ?
C492 C493 H493 . . 120.0 ?
C494 C493 H493 . . 120.0 ?
C493 C494 C495 . . 120.0 ?
C493 C494 H494 . . 120.0 ?
C495 C494 H494 . . 120.0 ?
C494 C495 C496 . . 120.0 ?
C494 C495 H495 . . 120.0 ?
C496 C495 H495 . . 120.0 ?
C495 C496 C491 . . 120.0 ?
C495 C496 H496 . . 120.0 ?
C491 C496 H496 . . 120.0 ?
C198 C197 C202 . . 120.0 ?
C198 C197 P5 . . 123.7(17) ?
C202 C197 P5 . . 115.4(18) ?
C199 C198 C197 . . 120.0 ?
C199 C198 H198 . . 120.0 ?
C197 C198 H198 . . 120.0 ?
C200 C199 C198 . . 120.0 ?
C200 C199 H199 . . 120.0 ?
C198 C199 H199 . . 120.0 ?
C199 C200 C201 . . 120.0 ?
C199 C200 H200 . . 120.0 ?
C201 C200 H200 . . 120.0 ?
C202 C201 C200 . . 120.0 ?
C202 C201 H201 . . 120.0 ?
C200 C201 H201 . . 120.0 ?
C201 C202 C197 . . 120.0 ?
C201 C202 H202 . . 120.0 ?
C197 C202 H202 . . 120.0 ?
C498 C497 C502 . . 120.0 ?
C498 C497 P5 . . 117.3(19) ?
C502 C497 P5 . . 122.7(19) ?
C497 C498 C499 . . 120.0 ?
C497 C498 H498 . . 120.0 ?
C499 C498 H498 . . 120.0 ?
C500 C499 C498 . . 120.0 ?
C500 C499 H499 . . 120.0 ?
C498 C499 H499 . . 120.0 ?
C499 C500 C501 . . 120.0 ?
C499 C500 H500 . . 120.0 ?
C501 C500 H500 . . 120.0 ?
C502 C501 C500 . . 120.0 ?
C502 C501 H501 . . 120.0 ?
C500 C501 H501 . . 120.0 ?
C501 C502 C497 . . 120.0 ?
C501 C502 H502 . . 120.0 ?
C497 C502 H502 . . 120.0 ?
C204 C203 C208 . . 120.0 ?
C204 C203 P6 . . 120.1(7) ?
C208 C203 P6 . . 119.9(7) ?
C205 C204 C203 . . 120.0 ?
C205 C204 H204 . . 120.0 ?
C203 C204 H204 . . 120.0 ?
C204 C205 C206 . . 120.0 ?
C204 C205 H205 . . 120.0 ?
C206 C205 H205 . . 120.0 ?
C207 C206 C205 . . 120.0 ?
C207 C206 H206 . . 120.0 ?
C205 C206 H206 . . 120.0 ?
C208 C207 C206 . . 120.0 ?
C208 C207 H207 . . 120.0 ?
C206 C207 H207 . . 120.0 ?
C207 C208 C203 . . 120.0 ?
C207 C208 H208 . . 120.0 ?
C203 C208 H208 . . 120.0 ?
C504 C503 C508 . . 120.0 ?
C504 C503 P6 . . 110.(2) ?
C508 C503 P6 . . 130.(2) ?
C503 C504 C505 . . 120.0 ?
C503 C504 H504 . . 120.0 ?
C505 C504 H504 . . 120.0 ?
C506 C505 C504 . . 120.0 ?
C506 C505 H505 . . 120.0 ?
C504 C505 H505 . . 120.0 ?
C505 C506 C507 . . 120.0 ?
C505 C506 H506 . . 120.0 ?
C507 C506 H506 . . 120.0 ?
C506 C507 C508 . . 120.0 ?
C506 C507 H507 . . 120.0 ?
C508 C507 H507 . . 120.0 ?
C507 C508 C503 . . 120.0 ?
C507 C508 H508 . . 120.0 ?
C503 C508 H508 . . 120.0 ?
C210 C209 C214 . . 116.9(13) ?
C210 C209 P6 . . 124.8(11) ?
C214 C209 P6 . . 118.3(10) ?
C209 C210 C211 . . 123.4(15) ?
C209 C210 H210 . . 118.3 ?
C211 C210 H210 . . 118.3 ?
C210 C211 C212 . . 118.8(15) ?
C210 C211 H211 . . 120.6 ?
C212 C211 H211 . . 120.6 ?
C213 C212 C211 . . 120.7(15) ?
C213 C212 H212 . . 119.6 ?
C211 C212 H212 . . 119.6 ?
C212 C213 C214 . . 120.1(16) ?
C212 C213 H213 . . 119.9 ?
C214 C213 H213 . . 119.9 ?
C213 C214 C209 . . 120.0(14) ?
C213 C214 H214 . . 120.0 ?
C209 C214 H214 . . 120.0 ?
C220 C215 C216 . . 116.0(14) ?
C220 C215 P6 . . 120.7(12) ?
C216 C215 P6 . . 122.8(11) ?
C217 C216 C215 . . 121.9(18) ?
C217 C216 H216 . . 119.0 ?
C215 C216 H216 . . 119.0 ?
C218 C217 C216 . . 120.(2) ?
C218 C217 H217 . . 119.8 ?
C216 C217 H217 . . 119.8 ?
C217 C218 C219 . . 119.(2) ?
C217 C218 H218 . . 120.4 ?
C219 C218 H218 . . 120.4 ?
C218 C219 C220 . . 121.(2) ?
C218 C219 H219 . . 119.7 ?
C220 C219 H219 . . 119.7 ?
C215 C220 C219 . . 121.9(18) ?
C215 C220 H220 . . 119.0 ?
C219 C220 H220 . . 119.0 ?
C226 N1 C224 . . 109.5(8) ?
C226 N1 C221 . . 109.7(8) ?
C224 N1 C221 . . 109.6(8) ?
C226 N1 C223 . . 109.5(8) ?
C224 N1 C223 . . 109.5(8) ?
C221 N1 C223 . . 109.0(8) ?
N1 C221 C222 . . 114.4(19) ?
N1 C221 H222 . . 108.7 ?
C222 C221 H222 . . 108.7 ?
N1 C221 H223 . . 108.7 ?
C222 C221 H223 . . 108.7 ?
H222 C221 H223 . . 107.6 ?
C221 C222 H224 . . 109.5 ?
C221 C222 H225 . . 109.5 ?
H224 C222 H225 . . 109.5 ?
C221 C222 H226 . . 109.5 ?
H224 C222 H226 . . 109.5 ?
H225 C222 H226 . . 109.5 ?
C225 C224 N1 . . 113.(2) ?
C225 C224 H231 . . 108.9 ?
N1 C224 H231 . . 108.9 ?
C225 C224 H232 . . 108.9 ?
N1 C224 H232 . . 108.9 ?
H231 C224 H232 . . 107.7 ?
C224 C225 H233 . . 109.5 ?
C224 C225 H234 . . 109.5 ?
H233 C225 H234 . . 109.5 ?
C224 C225 H235 . . 109.5 ?
H233 C225 H235 . . 109.5 ?
H234 C225 H235 . . 109.5 ?
N1 C223 C527 . . 114.0(10) ?
N1 C223 Cl3 . . 113.8(11) ?
N1 C223 H227 . . 108.8 ?
Cl3 C223 H227 . . 108.8 ?
N1 C223 H228 . . 108.8 ?
Cl3 C223 H228 . . 108.8 ?
H227 C223 H228 . . 107.7 ?
N1 C223 H229 . . 108.8 ?
C527 C223 H229 . . 108.8 ?
N1 C223 H230 . . 108.8 ?
C527 C223 H230 . . 108.8 ?
H229 C223 H230 . . 107.7 ?
C223 C527 F18B . . 173.(10) ?
C223 C527 H243 . . 109.5 ?
F18B C527 H243 . . 69.3 ?
C223 C527 H244 . . 109.5 ?
F18B C527 H244 . . 77.6 ?
H243 C527 H244 . . 109.5 ?
C223 C527 H245 . . 109.5 ?
F18B C527 H245 . . 65.0 ?
H243 C527 H245 . . 109.5 ?
H244 C527 H245 . . 109.5 ?
N1 C226 C227 . . 116.8(18) ?
N1 C226 Cl3B . . 112.2(14) ?
N1 C226 H236 . . 108.1 ?
C227 C226 H236 . . 108.1 ?
N1 C226 H237 . . 108.1 ?
C227 C226 H237 . . 108.1 ?
H236 C226 H237 . . 107.3 ?
N1 C226 H238 . . 109.2 ?
Cl3B C226 H238 . . 109.2 ?
N1 C226 H239 . . 109.2 ?
Cl3B C226 H239 . . 109.2 ?
H238 C226 H239 . . 107.9 ?
C226 C227 H240 . . 109.5 ?
C226 C227 H241 . . 109.5 ?
H240 C227 H241 . . 109.5 ?
C226 C227 H242 . . 109.5 ?
H240 C227 H242 . . 109.5 ?
H241 C227 H242 . . 109.5 ?
F1B Cl3B C226 2_666 . 131.(10) ?
F1A Sb1A F4A . . 92.8 ?
F1A Sb1A F5A . . 92.7 ?
F4A Sb1A F5A . . 92.7 ?
F1A Sb1A F3A . . 89.1 ?
F4A Sb1A F3A . . 87.7 ?
F5A Sb1A F3A . . 178.1 ?
F1A Sb1A F2A . . 87.7 ?
F4A Sb1A F2A . . 178.2 ?
F5A Sb1A F2A . . 89.0 ?
F3A Sb1A F2A . . 90.5 ?
F1A Sb1A F6A . . 178.1 ?
F4A Sb1A F6A . . 89.0 ?
F5A Sb1A F6A . . 87.6 ?
F3A Sb1A F6A . . 90.5 ?
F2A Sb1A F6A . . 90.5 ?
F1B Sb1B F4B . . 92.8 ?
F1B Sb1B F5B . . 92.7 ?
F4B Sb1B F5B . . 92.7 ?
F1B Sb1B F3B . . 89.1 ?
F4B Sb1B F3B . . 87.7 ?
F5B Sb1B F3B . . 178.11(7) ?
F1B Sb1B F2B . . 87.7 ?
F4B Sb1B F2B . . 178.2 ?
F5B Sb1B F2B . . 89.0 ?
F3B Sb1B F2B . . 90.5 ?
F1B Sb1B F6B . . 178.1 ?
F4B Sb1B F6B . . 89.0 ?
F5B Sb1B F6B . . 87.6 ?
F3B Sb1B F6B . . 90.5 ?
F2B Sb1B F6B . . 90.5 ?
Cl3B F1B Sb1B 2_666 . 118.(3) ?
F7A Sb2A F10A . . 92.8 ?
F7A Sb2A F11A . . 92.7 ?
F10A Sb2A F11A . . 92.7 ?
F7A Sb2A F9A . . 89.1 ?
F10A Sb2A F9A . . 87.7 ?
F11A Sb2A F9A . . 178.1 ?
F7A Sb2A F8A . . 87.7 ?
F10A Sb2A F8A . . 178.2 ?
F11A Sb2A F8A . . 89.0 ?
F9A Sb2A F8A . . 90.5 ?
F7A Sb2A F12A . . 178.1 ?
F10A Sb2A F12A . . 89.0 ?
F11A Sb2A F12A . . 87.6 ?
F9A Sb2A F12A . . 90.5 ?
F8A Sb2A F12A . . 90.5 ?
F7B Sb2B F10B . . 92.8 ?
F7B Sb2B F11B . . 92.7 ?
F10B Sb2B F11B . . 92.7 ?
F7B Sb2B F9B . . 89.1 ?
F10B Sb2B F9B . . 87.7 ?
F11B Sb2B F9B . . 178.1 ?
F7B Sb2B F8B . . 87.7 ?
F10B Sb2B F8B . . 178.2 ?
F11B Sb2B F8B . . 89.0 ?
F9B Sb2B F8B . . 90.5 ?
F7B Sb2B F12B . . 178.1 ?
F10B Sb2B F12B . . 89.0 ?
F11B Sb2B F12B . . 87.6 ?
F9B Sb2B F12B . . 90.5 ?
F8B Sb2B F12B . . 90.5 ?
F13A Sb3A F16A . . 92.8 ?
F13A Sb3A F17A . . 92.7 ?
F16A Sb3A F17A . . 92.7 ?
F13A Sb3A F15A . . 89.1 ?
F16A Sb3A F15A . . 87.7 ?
F17A Sb3A F15A . . 178.1 ?
F13A Sb3A F14A . . 87.7 ?
F16A Sb3A F14A . . 178.2 ?
F17A Sb3A F14A . . 89.0 ?
F15A Sb3A F14A . . 90.5 ?
F13A Sb3A F18A . . 178.1 ?
F16A Sb3A F18A . . 89.0 ?
F17A Sb3A F18A . . 87.6 ?
F15A Sb3A F18A . . 90.5 ?
F14A Sb3A F18A . . 90.5 ?
F13B Sb3B F16B . . 92.8 ?
F13B Sb3B F17B . . 92.7 ?
F16B Sb3B F17B . . 92.7 ?
F13B Sb3B F15B . . 89.1 ?
F16B Sb3B F15B . . 87.7 ?
F17B Sb3B F15B . . 178.1 ?
F13B Sb3B F14B . . 87.7 ?
F16B Sb3B F14B . . 178.2 ?
F17B Sb3B F14B . . 89.0 ?
F15B Sb3B F14B . . 90.5 ?
F13B Sb3B F18B . . 178.1 ?
F16B Sb3B F18B . . 89.0 ?
F17B Sb3B F18B . . 87.6 ?
F15B Sb3B F18B . . 90.5 ?
F14B Sb3B F18B . . 90.5 ?
C527 F18B Sb3B . . 130.(4) ?
F19A Sb4A F22A . . 92.8 ?
F19A Sb4A F23A . . 92.8 ?
F22A Sb4A F23A . . 92.7 ?
F19A Sb4A F21A . . 89.1 ?
F22A Sb4A F21A . . 87.7 ?
F23A Sb4A F21A . . 178.11(6) ?
F19A Sb4A F20A . . 87.7 ?
F22A Sb4A F20A . . 178.2 ?
F23A Sb4A F20A . . 89.0 ?
F21A Sb4A F20A . . 90.5 ?
F19A Sb4A F24A . . 178.1 ?
F22A Sb4A F24A . . 89.0 ?
F23A Sb4A F24A . . 87.6 ?
F21A Sb4A F24A . . 90.5 ?
F20A Sb4A F24A . . 90.5 ?
F19B Sb4B F22B . . 92.8 ?
F19B Sb4B F23B . . 92.7 ?
F22B Sb4B F23B . . 92.7 ?
F19B Sb4B F21B . . 89.1 ?
F22B Sb4B F21B . . 87.7 ?
F23B Sb4B F21B . . 178.1 ?
F19B Sb4B F20B . . 87.7 ?
F22B Sb4B F20B . . 178.2 ?
F23B Sb4B F20B . . 89.0 ?
F21B Sb4B F20B . . 90.6 ?
F19B Sb4B F24B . . 178.2 ?
F22B Sb4B F24B . . 89.0 ?
F23B Sb4B F24B . . 87.6 ?
F21B Sb4B F24B . . 90.5 ?
F20B Sb4B F24B . . 90.5 ?

####################################################################### 
# 
# 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_Ag18(CCPh)14(PTol3)6Cl
_database_code_depnum_ccdc_archive 'CCDC 1563662'
_audit_update_record             
;
2017-10-01 deposited with the CCDC.
2017-10-31 downloaded from the CCDC.
;
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C238 H196 Ag18 Cl F18 P6 Sb3'
_chemical_formula_iupac          ?
_chemical_formula_weight         5926.12

_chemical_melting_point          ?

_space_group_crystal_system      triclinic
_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                   18.465(2)
_cell_length_b                   19.820(2)
_cell_length_c                   20.121(3)
_cell_angle_alpha                117.4530(10)
_cell_angle_beta                 116.6710(10)
_cell_angle_gamma                92.003(2)
_cell_volume                     5561.0(12)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    20715
_cell_measurement_theta_min      2.2394
_cell_measurement_theta_max      27.4004
_cell_measurement_temperature    173.(2)

_exptl_crystal_description       block
_exptl_crystal_colour            'clear pale orange'
_exptl_crystal_size_max          0.300
_exptl_crystal_size_mid          0.210
_exptl_crystal_size_min          0.100
_exptl_crystal_density_diffrn    1.770
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2892

_exptl_absorpt_coefficient_mu    2.022
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2014/4 (Bruker AXS Inc.)'
_exptl_absorpt_correction_T_min  0.65
_exptl_absorpt_correction_T_max  0.82

_exptl_special_details           
;
;

_diffrn_ambient_temperature      173.(2)

_diffrn_source                   'rotating-anode X-ray tube'
_diffrn_source_type              'Bruker Turbo X-ray Source'

_diffrn_radiation_type           MoKa
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  'multilayered conforcal mirror'

_diffrn_measurement_device_type  'Bruker D8 goniometer'
_diffrn_measurement_method       'omega scans'

_diffrn_detector_area_resol_mean 8.3333

_diffrn_reflns_number            30384
_diffrn_reflns_av_R_equivalents  0.0189
_diffrn_reflns_av_unetI/netI     0.0538
_diffrn_reflns_theta_min         1.98
_diffrn_reflns_theta_max         27.408
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.928
_diffrn_measured_fraction_theta_full 0.949
_diffrn_reflns_Laue_measured_fraction_max 0.928
_diffrn_reflns_Laue_measured_fraction_full 0.949
_diffrn_reflns_point_group_measured_fraction_max 0.928
_diffrn_reflns_point_group_measured_fraction_full 0.949
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       26

_refine_special_details          
;
;

_reflns_number_total             23488
_reflns_number_gt                14676
_reflns_threshold_expression     'I > 2σ(I)'

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_R_factor_all          0.0999
_refine_ls_R_factor_gt           0.0524
_refine_ls_wR_factor_gt          0.1210
_refine_ls_wR_factor_ref         0.1549
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_restrained_S_all      1.022
_refine_ls_number_reflns         23488
_refine_ls_number_parameters     1280
_refine_ls_number_restraints     137
_refine_ls_number_constraints    ?
_refine_ls_hydrogen_treatment    constr
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0557P)²+33.5071P] where P=(Fo²+2Fc²)/3'

_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap

_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_diff_density_max         1.751
_refine_diff_density_min         -1.015
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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'
Cl Cl 0.1484 0.1585 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_computing_data_collection       'APEX2(Bruker AXS)'
_computing_cell_refinement       'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_data_reduction        'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_structure_solution    'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'XSHELL V6.3.1(Bruker AXS)'
_computing_publication_material  'Generate Report (Bruker AXS)'

loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_refinement_flags_posn
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag Ag1 0.56525(4) 0.36043(4) 0.48259(4) 0.04641(15) Uani d . . . 1.0 . .
Ag Ag2 0.44032(4) 0.36109(4) 0.31966(4) 0.04525(15) Uani d . . . 1.0 . .
Ag Ag3 0.61796(4) 0.45650(4) 0.42646(4) 0.04534(15) Uani d . . . 1.0 . .
Ag Ag4 0.35278(4) 0.49264(4) 0.31464(4) 0.04711(15) Uani d . . . 1.0 . .
Ag Ag5 0.55980(4) 0.61473(4) 0.44275(4) 0.04408(14) Uani d . . . 1.0 . .
Ag Ag6 0.70164(4) 0.61852(4) 0.61364(4) 0.04406(14) Uani d . . . 1.0 . .
Ag Ag7 0.19385(3) 0.47136(4) 0.31803(4) 0.04481(15) Uani d . . . 1.0 . .
Ag Ag8 0.46389(4) 0.51957(3) 0.24908(4) 0.04226(14) Uani d . . . 1.0 . .
Ag Ag9 0.67282(3) 0.77180(3) 0.62273(4) 0.04340(14) Uani d . . . 1.0 . .
Cl Cl1 0.5 0.5 0.5 0.0393(5) Uani d . P S 1.0 . .
P P1 0.05185(12) 0.38949(12) 0.19621(13) 0.0411(4) Uani d . . . 1.0 . .
P P2 0.41336(12) 0.58908(12) 0.17426(13) 0.0415(4) Uani d . . . 1.0 . .
P P3 0.79612(12) 0.86280(12) 0.66296(13) 0.0424(5) Uani d . . . 1.0 . .
C C1 0.5609(5) 0.3247(4) 0.3557(5) 0.0424(17) Uani d . . . 1.0 . .
C C2 0.5731(5) 0.2680(5) 0.3068(5) 0.0442(18) Uani d . . . 1.0 . .
C C3 0.5833(5) 0.1995(5) 0.2450(5) 0.0474(19) Uani d . . . 1.0 . .
C C4 0.5558(6) 0.1242(6) 0.2257(7) 0.068(3) Uani d . . . 1.0 . .
H H4 0.5307 0.1162 0.2547 0.081 Uiso calc U . R 1.0 . .
C C5 0.5641(8) 0.0593(6) 0.1641(9) 0.091(4) Uani d . . . 1.0 . .
H H5 0.5447 0.0072 0.1507 0.109 Uiso calc U . R 1.0 . .
C C6 0.6010(8) 0.0714(8) 0.1223(9) 0.098(4) Uani d . . . 1.0 . .
H H6 0.6063 0.027 0.0799 0.117 Uiso calc U . R 1.0 . .
C C7 0.6302(7) 0.1474(8) 0.1415(8) 0.090(4) Uani d . . . 1.0 . .
H H7 0.6557 0.1554 0.1128 0.108 Uiso calc U . R 1.0 . .
C C8 0.6216(6) 0.2108(6) 0.2028(7) 0.067(3) Uani d . . . 1.0 . .
H H8 0.6419 0.2631 0.2169 0.08 Uiso calc U . R 1.0 . .
C C9 0.3788(5) 0.4073(5) 0.2246(6) 0.0428(17) Uani d . . . 1.0 . .
C C10 0.3773(4) 0.3580(5) 0.1596(6) 0.0456(19) Uani d . . . 1.0 . .
C C11 0.3765(5) 0.2985(5) 0.0819(6) 0.052(2) Uani d . . . 1.0 . .
C C12 0.3265(6) 0.2929(6) 0.0020(7) 0.066(3) Uani d . . . 1.0 . .
H H12 0.2933 0.328 -0.0015 0.079 Uiso calc U . R 1.0 . .
C C13 0.3252(8) 0.2351(8) -0.0735(8) 0.088(4) Uani d . . . 1.0 . .
H H13 0.2904 0.2301 -0.1285 0.106 Uiso calc U . R 1.0 . .
C C14 0.3761(9) 0.1852(7) -0.0663(9) 0.088(4) Uani d . . . 1.0 . .
H H14 0.3768 0.1469 -0.1165 0.105 Uiso calc U . R 1.0 . .
C C15 0.4243(7) 0.1910(6) 0.0112(8) 0.080(3) Uani d . . . 1.0 . .
H H15 0.4582 0.1564 0.0149 0.096 Uiso calc U . R 1.0 . .
C C16 0.4248(6) 0.2467(6) 0.0856(7) 0.063(2) Uani d . . . 1.0 . .
H H16 0.4585 0.2495 0.1395 0.076 Uiso calc U . R 1.0 . .
C C17 0.3049(5) 0.5776(5) 0.3767(5) 0.0457(19) Uani d . . . 1.0 . .
C C18 0.2729(5) 0.6301(5) 0.3995(6) 0.051(2) Uani d . . . 1.0 . .
C C19 0.2296(6) 0.6882(5) 0.4218(7) 0.056(3) Uani d . P G 0.708(9) A 1
C C20 0.1938(7) 0.7197(7) 0.3698(7) 0.079(5) Uani d . P G 0.708(9) A 1
H H20 0.1951 0.7007 0.3176 0.095 Uiso calc U P R 0.708(9) A 1
C C21 0.1562(7) 0.7789(8) 0.3940(10) 0.107(7) Uani d . P G 0.708(9) A 1
H H21 0.1317 0.8004 0.3584 0.128 Uiso calc U P R 0.708(9) A 1
C C22 0.1543(8) 0.8066(7) 0.4703(11) 0.107(6) Uani d . P G 0.708(9) A 1
H H22 0.1286 0.8471 0.4869 0.128 Uiso calc U P R 0.708(9) A 1
C C23 0.1900(9) 0.7752(8) 0.5224(8) 0.111(6) Uani d . P G 0.708(9) A 1
H H23 0.1887 0.7941 0.5745 0.133 Uiso calc U P R 0.708(9) A 1
C C24 0.2277(7) 0.7160(7) 0.4981(7) 0.090(5) Uani d . P G 0.708(9) A 1
H H24 0.2521 0.6945 0.5337 0.108 Uiso calc U P R 0.708(9) A 1
C C19B 0.2502(13) 0.7037(13) 0.4313(17) 0.056(3) Uani d . P G 0.292(9) A 2
C C20B 0.1682(12) 0.6975(14) 0.3736(18) 0.079(5) Uani d . P G 0.292(9) A 2
H H20B 0.136 0.6516 0.3156 0.095 Uiso calc U P R 0.292(9) A 2
C C21B 0.1334(12) 0.7584(19) 0.401(3) 0.107(7) Uani d . P G 0.292(9) A 2
H H21B 0.0773 0.7542 0.3612 0.128 Uiso calc U P R 0.292(9) A 2
C C22B 0.181(2) 0.8256(17) 0.485(3) 0.107(6) Uani d . P G 0.292(9) A 2
H H22B 0.1567 0.8673 0.5039 0.128 Uiso calc U P R 0.292(9) A 2
C C23B 0.262(2) 0.8318(15) 0.5431(16) 0.111(6) Uani d . P G 0.292(9) A 2
H H23B 0.2947 0.8778 0.6011 0.133 Uiso calc U P R 0.292(9) A 2
C C24B 0.2973(13) 0.7709(16) 0.5161(14) 0.090(5) Uani d . P G 0.292(9) A 2
H H24B 0.3534 0.7752 0.5555 0.108 Uiso calc U P R 0.292(9) A 2
C C25 0.5948(5) 0.5347(5) 0.3614(5) 0.0416(17) Uani d . . . 1.0 . .
C C26 0.6245(5) 0.4990(5) 0.3166(5) 0.0463(19) Uani d . . . 1.0 . .
C C27 0.6599(5) 0.4536(5) 0.2642(6) 0.051(2) Uani d . . . 1.0 . .
C C28 0.6064(6) 0.3942(5) 0.1759(6) 0.058(2) Uani d . . . 1.0 . .
H H28 0.5466 0.3841 0.1495 0.07 Uiso calc U . R 1.0 . .
C C29 0.6386(7) 0.3500(6) 0.1264(7) 0.072(3) Uani d . . . 1.0 . .
H H29 0.6011 0.3101 0.066 0.087 Uiso calc U . R 1.0 . .
C C30 0.7234(8) 0.3631(7) 0.1632(8) 0.084(3) Uani d . . . 1.0 . .
H H30 0.7451 0.3313 0.1288 0.1 Uiso calc U . R 1.0 . .
C C31 0.7780(7) 0.4213(8) 0.2489(9) 0.102(4) Uani d . . . 1.0 . .
H H31 0.8376 0.4295 0.2745 0.123 Uiso calc U . R 1.0 . .
C C32 0.7467(7) 0.4687(7) 0.2990(7) 0.088(4) Uani d . . . 1.0 . .
H H32 0.7851 0.5119 0.3576 0.105 Uiso calc U . R 1.0 . .
C C33 0.5296(4) 0.7127(5) 0.5100(5) 0.0412(17) Uani d . . . 1.0 . .
C C34 0.5141(5) 0.7767(5) 0.5339(5) 0.052(2) Uani d . . . 1.0 . .
C C35 0.5064(15) 0.8516(15) 0.5458(18) 0.055(3) Uani d U P G 0.251(9) B 1
C C36 0.5055(12) 0.8861(16) 0.4991(14) 0.099(5) Uani d U P G 0.251(9) B 1
H H36 0.5106 0.8577 0.4492 0.119 Uiso calc U P R 0.251(9) B 1
C C37 0.4971(14) 0.9622(14) 0.5254(16) 0.142(9) Uani d U P G 0.251(9) B 1
H H37 0.4965 0.9857 0.4935 0.17 Uiso calc U P R 0.251(9) B 1
C C38 0.4896(18) 1.0038(12) 0.5985(17) 0.099(6) Uani d U P G 0.251(9) B 1
H H38 0.4839 1.0558 0.6165 0.119 Uiso calc U P R 0.251(9) B 1
C C39 0.491(2) 0.969(2) 0.6452(18) 0.091(5) Uani d U P G 0.251(9) B 1
H H39 0.4855 0.9977 0.6952 0.109 Uiso calc U P R 0.251(9) B 1
C C40 0.499(2) 0.893(2) 0.619(2) 0.082(4) Uani d U P G 0.251(9) B 1
H H40 0.4996 0.8696 0.6509 0.098 Uiso calc U P R 0.251(9) B 1
C C35B 0.4882(6) 0.8500(4) 0.5633(6) 0.055(3) Uani d U P G 0.749(9) B 2
C C36B 0.5349(6) 0.9150(6) 0.5746(8) 0.099(5) Uani d U P G 0.749(9) B 2
H H36B 0.58 0.9106 0.5636 0.119 Uiso calc U P R 0.749(9) B 2
C C37B 0.5156(7) 0.9865(5) 0.6020(9) 0.142(9) Uani d U P G 0.749(9) B 2
H H37B 0.5475 1.031 0.6098 0.17 Uiso calc U P R 0.749(9) B 2
C C38B 0.4496(7) 0.9930(5) 0.6181(8) 0.099(6) Uani d U P G 0.749(9) B 2
H H38B 0.4364 1.0419 0.6368 0.119 Uiso calc U P R 0.749(9) B 2
C C39B 0.4029(6) 0.9280(6) 0.6068(7) 0.091(5) Uani d U P G 0.749(9) B 2
H H39B 0.3578 0.9324 0.6178 0.109 Uiso calc U P R 0.749(9) B 2
C C40B 0.4222(6) 0.8565(5) 0.5794(7) 0.082(4) Uani d U P G 0.749(9) B 2
H H40B 0.3903 0.812 0.5717 0.098 Uiso calc U P R 0.749(9) B 2
C C41 0.7517(4) 0.5378(5) 0.5496(5) 0.0401(17) Uani d . . . 1.0 . .
C C42 0.7934(5) 0.4987(5) 0.5263(5) 0.0482(19) Uani d . . . 1.0 . .
C C43 0.8464(9) 0.4556(5) 0.4985(7) 0.046(3) Uani d . P G 0.730(10) C 1
C C44 0.8102(6) 0.3868(5) 0.4154(5) 0.065(3) Uani d . P G 0.730(10) C 1
H H44 0.7508 0.3699 0.3745 0.078 Uiso calc U P R 0.730(10) C 1
C C45 0.8609(7) 0.3427(5) 0.3921(6) 0.078(4) Uani d . P G 0.730(10) C 1
H H45 0.8362 0.2957 0.3353 0.093 Uiso calc U P R 0.730(10) C 1
C C46 0.9478(7) 0.3674(9) 0.4520(9) 0.084(5) Uani d . P G 0.730(10) C 1
H H46 0.9825 0.3373 0.4361 0.101 Uiso calc U P R 0.730(10) C 1
C C47 0.9840(6) 0.4362(10) 0.5351(8) 0.084(5) Uani d . P G 0.730(10) C 1
H H47 1.0434 0.453 0.576 0.101 Uiso calc U P R 0.730(10) C 1
C C48 0.9333(9) 0.4802(7) 0.5584(6) 0.068(5) Uani d . P G 0.730(10) C 1
H H48 0.9581 0.5272 0.6152 0.081 Uiso calc U P R 0.730(10) C 1
C C43B 0.846(3) 0.4448(16) 0.508(2) 0.046(3) Uani d . P G 0.270(10) C 2
C C44B 0.8094(16) 0.3624(16) 0.4553(17) 0.065(3) Uani d . P G 0.270(10) C 2
H H44B 0.7524 0.3392 0.4359 0.078 Uiso calc U P R 0.270(10) C 2
C C45B 0.857(2) 0.3138(16) 0.431(2) 0.078(4) Uani d . P G 0.270(10) C 2
H H45B 0.8318 0.2575 0.3949 0.093 Uiso calc U P R 0.270(10) C 2
C C46B 0.940(2) 0.348(3) 0.459(3) 0.084(5) Uani d . P G 0.270(10) C 2
H H46B 0.9722 0.3145 0.4428 0.101 Uiso calc U P R 0.270(10) C 2
C C47B 0.9762(19) 0.430(3) 0.512(3) 0.084(5) Uani d . P G 0.270(10) C 2
H H47B 1.0332 0.4534 0.5317 0.101 Uiso calc U P R 0.270(10) C 2
C C48B 0.929(3) 0.4788(18) 0.537(3) 0.068(5) Uani d . P G 0.270(10) C 2
H H48B 0.9538 0.5351 0.5727 0.081 Uiso calc U P R 0.270(10) C 2
C C49 0.6824(4) 0.7122(5) 0.7036(5) 0.0426(18) Uani d . . . 1.0 . .
C C50 0.6920(5) 0.7664(5) 0.7710(5) 0.0436(18) Uani d . . . 1.0 . .
C C51 0.7041(4) 0.8284(4) 0.8526(5) 0.0435(18) Uani d . . . 1.0 . .
C C52 0.6643(6) 0.8862(5) 0.8575(6) 0.059(2) Uani d . . . 1.0 . .
H H52 0.6289 0.887 0.8062 0.07 Uiso calc U . R 1.0 . .
C C53 0.6760(7) 0.9437(6) 0.9381(8) 0.076(3) Uani d . . . 1.0 . .
H H53 0.649 0.9842 0.9417 0.091 Uiso calc U . R 1.0 . .
C C54 0.7257(7) 0.9424(6) 1.0116(8) 0.075(3) Uani d . . . 1.0 . .
H H54 0.7315 0.9813 1.0655 0.09 Uiso calc U . R 1.0 . .
C C55 0.7677(6) 0.8864(6) 1.0098(6) 0.062(2) Uani d . . . 1.0 . .
H H55 0.8029 0.8868 1.0619 0.074 Uiso calc U . R 1.0 . .
C C56 0.7576(5) 0.8288(5) 0.9295(6) 0.052(2) Uani d . . . 1.0 . .
H H56 0.7868 0.7899 0.9269 0.062 Uiso calc U . R 1.0 . .
C C57 0.0445(5) 0.3228(5) 0.0924(5) 0.0418(17) Uani d . . . 1.0 . .
C C58 -0.0269(5) 0.2566(5) 0.0200(6) 0.053(2) Uani d . . . 1.0 . .
H H58 -0.0741 0.2433 0.024 0.063 Uiso calc U . R 1.0 . .
C C59 -0.0279(6) 0.2111(5) -0.0573(5) 0.053(2) Uani d . . . 1.0 . .
H H59 -0.077 0.1669 -0.1058 0.063 Uiso calc U . R 1.0 . .
C C60 0.0383(6) 0.2261(6) -0.0679(6) 0.058(2) Uani d . . . 1.0 . .
C C61 0.1080(6) 0.2914(6) 0.0040(6) 0.061(2) Uani d . . . 1.0 . .
H H61 0.1547 0.3043 -0.0009 0.073 Uiso calc U . R 1.0 . .
C C62 0.1123(5) 0.3387(5) 0.0830(6) 0.051(2) Uani d . . . 1.0 . .
H H62 0.1619 0.3824 0.1312 0.061 Uiso calc U . R 1.0 . .
C C63 0.0342(8) 0.1763(6) -0.1534(7) 0.081(3) Uani d . . . 1.0 . .
H H63A 0.0471 0.1272 -0.1586 0.122 Uiso calc U . R 1.0 . .
H H63B 0.0758 0.2065 -0.1551 0.122 Uiso calc U . R 1.0 . .
H H63C -0.0231 0.1628 -0.2023 0.122 Uiso calc U . R 1.0 . .
C C64 -0.0036(5) 0.3266(4) 0.2129(5) 0.0436(18) Uani d . . . 1.0 . .
C C65 -0.0910(5) 0.2914(5) 0.1622(6) 0.056(2) Uani d . . . 1.0 . .
H H65 -0.125 0.3044 0.1204 0.067 Uiso calc U . R 1.0 . .
C C66 -0.1299(6) 0.2375(6) 0.1712(6) 0.060(2) Uani d . . . 1.0 . .
H H66 -0.1899 0.2132 0.135 0.072 Uiso calc U . R 1.0 . .
C C67 -0.0815(5) 0.2193(5) 0.2329(6) 0.055(2) Uani d . . . 1.0 . .
C C68 0.0054(5) 0.2561(5) 0.2849(6) 0.052(2) Uani d . . . 1.0 . .
H H68 0.0392 0.2451 0.3285 0.062 Uiso calc U . R 1.0 . .
C C69 0.0441(5) 0.3084(5) 0.2747(5) 0.0488(19) Uani d . . . 1.0 . .
H H69 0.1041 0.3322 0.3106 0.059 Uiso calc U . R 1.0 . .
C C70 -0.1230(6) 0.1561(6) 0.2395(7) 0.070(3) Uani d . . . 1.0 . .
H H70A -0.1166 0.1046 0.2056 0.106 Uiso calc U . R 1.0 . .
H H70B -0.1836 0.1512 0.216 0.106 Uiso calc U . R 1.0 . .
H H70C -0.0953 0.1722 0.3013 0.106 Uiso calc U . R 1.0 . .
C C71 -0.0119(5) 0.4541(5) 0.1764(5) 0.0439(18) Uani d . . . 1.0 . .
C C72 0.0101(6) 0.5303(5) 0.2479(6) 0.065(3) Uani d . . . 1.0 . .
H H72 0.0546 0.5454 0.3049 0.078 Uiso calc U . R 1.0 . .
C C73 -0.0319(6) 0.5843(6) 0.2370(7) 0.072(3) Uani d . . . 1.0 . .
H H73 -0.0158 0.6357 0.2869 0.086 Uiso calc U . R 1.0 . .
C C74 -0.0965(5) 0.5651(5) 0.1554(6) 0.052(2) Uani d . . . 1.0 . .
C C75 -0.1173(6) 0.4908(6) 0.0857(6) 0.066(3) Uani d . . . 1.0 . .
H H75 -0.1616 0.476 0.0287 0.079 Uiso calc U . R 1.0 . .
C C76 -0.0756(6) 0.4357(6) 0.0955(6) 0.062(2) Uani d . . . 1.0 . .
H H76 -0.0916 0.3846 0.0452 0.075 Uiso calc U . R 1.0 . .
C C77 -0.1386(6) 0.6265(6) 0.1444(7) 0.071(3) Uani d . . . 1.0 . .
H H77A -0.1513 0.6205 0.0888 0.106 Uiso calc U . R 1.0 . .
H H77B -0.1001 0.6802 0.1934 0.106 Uiso calc U . R 1.0 . .
H H77C -0.1915 0.6185 0.144 0.106 Uiso calc U . R 1.0 . .
C C78 0.3912(5) 0.5318(5) 0.0626(5) 0.0448(18) Uani d . . . 1.0 . .
C C79 0.4254(5) 0.4701(5) 0.0385(6) 0.051(2) Uani d . . . 1.0 . .
H H79 0.4615 0.4593 0.0815 0.062 Uiso calc U . R 1.0 . .
C C80 0.4086(6) 0.4237(6) -0.0463(6) 0.059(2) Uani d . . . 1.0 . .
H H80 0.4333 0.3819 -0.0604 0.07 Uiso calc U . R 1.0 . .
C C81 0.3566(5) 0.4374(5) -0.1109(5) 0.052(2) Uani d . . . 1.0 . .
C C82 0.3233(6) 0.5005(6) -0.0873(6) 0.060(2) Uani d . . . 1.0 . .
H H82 0.289 0.5121 -0.1302 0.072 Uiso calc U . R 1.0 . .
C C83 0.3389(5) 0.5466(5) -0.0031(5) 0.051(2) Uani d . . . 1.0 . .
H H83 0.3143 0.5886 0.0108 0.061 Uiso calc U . R 1.0 . .
C C84 0.3368(7) 0.3882(7) -0.2038(6) 0.075(3) Uani d . . . 1.0 . .
H H84A 0.3866 0.4031 -0.206 0.112 Uiso calc U . R 1.0 . .
H H84B 0.2884 0.3979 -0.242 0.112 Uiso calc U . R 1.0 . .
H H84C 0.3227 0.3314 -0.2241 0.112 Uiso calc U . R 1.0 . .
C C85 0.4898(5) 0.6842(5) 0.2270(5) 0.0467(18) Uani d . . . 1.0 . .
C C86 0.4981(5) 0.7155(5) 0.1810(6) 0.055(2) Uani d . . . 1.0 . .
H H86 0.4585 0.6898 0.1196 0.066 Uiso calc U . R 1.0 . .
C C87 0.5638(6) 0.7841(5) 0.2236(7) 0.064(3) Uani d . . . 1.0 . .
H H87 0.5674 0.8049 0.1908 0.077 Uiso calc U . R 1.0 . .
C C88 0.6238(7) 0.8228(6) 0.3122(7) 0.074(3) Uani d . . . 1.0 . .
C C89 0.6121(8) 0.7920(7) 0.3567(7) 0.092(4) Uani d U . . 1.0 . .
H H89 0.6513 0.818 0.4182 0.11 Uiso calc U . R 1.0 . .
C C90 0.5467(7) 0.7256(6) 0.3167(6) 0.074(3) Uani d . . . 1.0 . .
H H90 0.5404 0.708 0.3509 0.089 Uiso calc U . R 1.0 . .
C C91 0.6991(8) 0.8938(7) 0.3565(9) 0.108(5) Uani d . . . 1.0 . .
H H91A 0.6959 0.9054 0.3131 0.162 Uiso calc U . R 1.0 . .
H H91B 0.7521 0.8814 0.3816 0.162 Uiso calc U . R 1.0 . .
H H91C 0.698 0.9404 0.4035 0.162 Uiso calc U . R 1.0 . .
C C92 0.3130(5) 0.6057(5) 0.1609(5) 0.0442(18) Uani d . . . 1.0 . .
C C93 0.2899(5) 0.6708(5) 0.1562(5) 0.050(2) Uani d . . . 1.0 . .
H H93 0.3289 0.7103 0.1641 0.061 Uiso calc U . R 1.0 . .
C C94 0.2097(5) 0.6773(5) 0.1400(5) 0.052(2) Uani d . . . 1.0 . .
H H94 0.1939 0.7208 0.1356 0.063 Uiso calc U . R 1.0 . .
C C95 0.1520(5) 0.6207(6) 0.1302(6) 0.055(2) Uani d . . . 1.0 . .
C C96 0.1762(6) 0.5577(6) 0.1361(7) 0.065(3) Uani d . . . 1.0 . .
H H96 0.1378 0.5188 0.1298 0.078 Uiso calc U . R 1.0 . .
C C97 0.2557(5) 0.5497(5) 0.1511(6) 0.054(2) Uani d . . . 1.0 . .
H H97 0.2708 0.5057 0.1547 0.065 Uiso calc U . R 1.0 . .
C C98 0.0641(6) 0.6279(7) 0.1119(8) 0.081(3) Uani d . . . 1.0 . .
H H98A 0.0334 0.6271 0.057 0.121 Uiso calc U . R 1.0 . .
H H98B 0.0699 0.6782 0.1605 0.121 Uiso calc U . R 1.0 . .
H H98C 0.0323 0.5831 0.1063 0.121 Uiso calc U . R 1.0 . .
C C99 0.8326(5) 0.8167(5) 0.5869(5) 0.0454(18) Uani d . . . 1.0 . .
C C100 0.7888(5) 0.7408(5) 0.5168(6) 0.057(2) Uani d . . . 1.0 . .
H H100 0.7409 0.7122 0.5099 0.069 Uiso calc U . R 1.0 . .
C C101 0.8120(6) 0.7033(6) 0.4539(7) 0.071(3) Uani d . . . 1.0 . .
H H101 0.7791 0.6508 0.4042 0.085 Uiso calc U . R 1.0 . .
C C102 0.8826(6) 0.7431(6) 0.4649(6) 0.067(3) Uani d . . . 1.0 . .
C C103 0.9297(6) 0.8190(6) 0.5383(7) 0.071(3) Uani d . . . 1.0 . .
H H103 0.9796 0.8464 0.5472 0.085 Uiso calc U . R 1.0 . .
C C104 0.9058(6) 0.8557(6) 0.5985(6) 0.071(3) Uani d . . . 1.0 . .
H H104 0.9392 0.9079 0.6485 0.085 Uiso calc U . R 1.0 . .
C C105 0.9100(8) 0.7059(8) 0.3974(7) 0.093(4) Uani d . . . 1.0 . .
H H10A 0.8792 0.6487 0.3572 0.14 Uiso calc U . R 1.0 . .
H H10B 0.9713 0.7136 0.4281 0.14 Uiso calc U . R 1.0 . .
H H10C 0.8969 0.7318 0.3638 0.14 Uiso calc U . R 1.0 . .
C C106 0.7788(5) 0.9534(5) 0.6643(5) 0.051(2) Uani d . . . 1.0 . .
C C107 0.7775(8) 0.9680(6) 0.6026(7) 0.084(4) Uani d . . . 1.0 . .
H H107 0.7944 0.9353 0.5635 0.101 Uiso calc U . R 1.0 . .
C C108 0.7506(9) 1.0320(7) 0.5998(8) 0.095(4) Uani d U . . 1.0 . .
H H108 0.7491 1.042 0.5574 0.114 Uiso calc U . R 1.0 . .
C C109 0.7255(10) 1.0824(7) 0.6567(8) 0.099(4) Uani d . . . 1.0 . .
C C110 0.7379(8) 1.0708(7) 0.7219(7) 0.086(3) Uani d . . . 1.0 . .
H H110 0.7304 1.1081 0.7675 0.103 Uiso calc U . R 1.0 . .
C C111 0.7610(6) 1.0060(5) 0.7235(6) 0.060(2) Uani d . . . 1.0 . .
H H111 0.7646 0.9977 0.7676 0.072 Uiso calc U . R 1.0 . .
C C112 0.6931(11) 1.1492(8) 0.6486(9) 0.132(6) Uani d U . . 1.0 . .
H H11A 0.7415 1.1955 0.6778 0.198 Uiso calc U . R 1.0 . .
H H11B 0.6595 1.1643 0.6765 0.198 Uiso calc U . R 1.0 . .
H H11C 0.6574 1.131 0.5863 0.198 Uiso calc U . R 1.0 . .
C C113 0.8874(4) 0.8974(4) 0.7708(5) 0.0421(17) Uani d . . . 1.0 . .
C C114 0.9562(5) 0.9651(5) 0.8168(6) 0.059(2) Uani d . . . 1.0 . .
H H114 0.9544 0.9979 0.7938 0.07 Uiso calc U . R 1.0 . .
C C115 1.0268(5) 0.9845(5) 0.8957(5) 0.055(2) Uani d . . . 1.0 . .
H H115 1.0726 1.0312 0.9264 0.066 Uiso calc U . R 1.0 . .
C C116 1.0331(5) 0.9381(5) 0.9313(5) 0.0483(19) Uani d . . . 1.0 . .
C C117 0.9636(5) 0.8731(5) 0.8880(5) 0.0481(19) Uani d . . . 1.0 . .
H H117 0.9649 0.8418 0.9125 0.058 Uiso calc U . R 1.0 . .
C C118 0.8919(5) 0.8533(5) 0.8091(5) 0.0452(18) Uani d . . . 1.0 . .
H H118 0.8448 0.8085 0.7806 0.054 Uiso calc U . R 1.0 . .
C C119 1.1126(5) 0.9586(6) 1.0149(6) 0.059(2) Uani d . . . 1.0 . .
H H11D 1.1479 0.9256 1.0007 0.089 Uiso calc U . R 1.0 . .
H H11E 1.0971 0.9485 1.0508 0.089 Uiso calc U . R 1.0 . .
H H11F 1.1445 1.0151 1.0477 0.089 Uiso calc U . R 1.0 . .
Sb Sb1 0.64724(5) 0.14490(4) 0.89871(5) 0.06577(18) Uani d . . . 1.0 . .
F F1 0.6114(4) 0.1514(4) 0.7987(3) 0.0679(18) Uani d . P G 0.808(8) D 1
F F2 0.5336(3) 0.1176(5) 0.8630(5) 0.124(4) Uani d U P G 0.808(8) D 1
F F3 0.6595(6) 0.2519(3) 0.9618(4) 0.113(4) Uani d . P G 0.808(8) D 1
F F4 0.7604(3) 0.1735(5) 0.9318(5) 0.114(4) Uani d U P G 0.808(8) D 1
F F5 0.6350(5) 0.0365(2) 0.8339(4) 0.123(4) Uani d U P G 0.808(8) D 1
F F6 0.6796(4) 0.1366(4) 0.9939(4) 0.093(2) Uani d . P G 0.808(8) D 1
F F1B 0.628(2) 0.1651(17) 0.8161(16) 0.0679(18) Uani d . P G 0.192(8) D 2
F F2B 0.5655(18) 0.191(2) 0.914(2) 0.124(4) Uani d U P G 0.192(8) D 2
F F3B 0.7300(19) 0.2535(12) 0.9858(18) 0.113(4) Uani d . P G 0.192(8) D 2
F F4B 0.7431(17) 0.114(2) 0.905(2) 0.114(4) Uani d . P G 0.192(8) D 2
F F5B 0.5774(18) 0.0491(13) 0.8332(19) 0.123(4) Uani d U P G 0.192(8) D 2
F F6B 0.6768(19) 0.1386(18) 1.0009(17) 0.093(2) Uani d . P G 0.192(8) D 2
Sb Sb2 0.0360(7) 0.0594(5) 0.6114(6) 0.084(2) Uani d U P G 0.254(12) E -1
F F7 0.0465(16) 0.0339(14) 0.6920(13) 0.151(8) Uiso d . P G 0.254(12) E -1
F F8 -0.0116(15) 0.1364(11) 0.6567(15) 0.151(8) Uiso d . P G 0.254(12) E -1
F F9 -0.0710(9) -0.0164(12) 0.5310(12) 0.151(8) Uiso d . P G 0.254(12) E -1
F F10 0.0798(15) -0.0190(11) 0.5633(16) 0.151(8) Uiso d . P G 0.254(12) E -1
F F11 0.1413(10) 0.1362(12) 0.6889(13) 0.151(8) Uiso d . P G 0.254(12) E -1
F F12 0.0230(18) 0.0872(13) 0.5309(12) 0.151(8) Uiso d . P G 0.254(12) E -1
Sb Sb2B 0.0595(14) 0.0606(9) 0.6185(11) 0.137(6) Uani d . P G 0.180(12) F -2
F F7B 0.062(3) -0.0424(12) 0.560(2) 0.174(13) Uiso d . P G 0.180(12) F -2
F F8B 0.015(2) 0.029(2) 0.670(2) 0.174(13) Uiso d . P G 0.180(12) F -2
F F9B -0.0496(18) 0.031(2) 0.5244(19) 0.174(13) Uiso d . P G 0.180(12) F -2
F F10B 0.100(3) 0.092(2) 0.565(2) 0.174(13) Uiso d . P G 0.180(12) F -2
F F11B 0.1672(15) 0.093(2) 0.7143(18) 0.174(13) Uiso d . P G 0.180(12) F -2
F F12B 0.054(3) 0.1633(13) 0.679(2) 0.174(13) Uiso d . P G 0.180(12) F -2
Sb Sb2C 0.0149(11) 0.0209(11) 0.5400(15) 0.106(7) Uani d U P G 0.066(4) G -3
F F7C 0.086(5) 0.019(5) 0.498(6) 0.15(2) Uiso d . P G 0.066(4) G -3
F F8C 0.086(5) -0.017(5) 0.605(5) 0.15(2) Uiso d . P G 0.066(4) G -3
F F9C -0.049(5) -0.083(2) 0.445(4) 0.15(2) Uiso d . P G 0.066(4) G -3
F F10C -0.058(5) 0.056(5) 0.473(5) 0.15(2) Uiso d . P G 0.066(4) G -3
F F11C 0.077(5) 0.124(2) 0.636(4) 0.15(2) Uiso d . P G 0.066(4) G -3
F F12C -0.055(5) 0.020(5) 0.584(6) 0.15(2) Uiso d . P G 0.066(4) G -3


_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_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 C1 . 2.273(8) ?
Ag1 C33 2_666 2.334(7) ?
Ag1 C17 2_666 2.401(7) ?
Ag1 Ag3 . 2.9476(8) ?
Ag1 Ag2 . 3.0530(9) ?
Ag1 Ag5 2_666 3.2160(9) ?
Ag1 Ag4 2_666 3.2573(10) ?
Ag2 C1 . 2.269(8) ?
Ag2 C9 . 2.351(7) ?
Ag2 C49 2_666 2.379(7) ?
Ag2 C50 2_666 2.646(7) ?
Ag2 Ag3 . 2.9060(8) ?
Ag2 Ag4 . 3.1324(9) ?
Ag3 C1 . 2.235(7) ?
Ag3 C41 . 2.319(7) ?
Ag3 C25 . 2.391(7) ?
Ag3 Ag6 . 3.1876(9) ?
Ag3 Ag5 . 3.2710(9) ?
Ag4 C17 . 2.082(9) ?
Ag4 C9 . 2.095(9) ?
Ag4 Ag7 . 2.9856(9) ?
Ag4 Ag8 . 3.0390(9) ?
Ag4 Ag1 2_666 3.2573(10) ?
Ag5 C33 . 2.059(8) ?
Ag5 C25 . 2.059(8) ?
Ag5 Ag8 . 2.9450(9) ?
Ag5 Ag9 . 3.0867(9) ?
Ag5 Ag1 2_666 3.2160(9) ?
Ag5 Ag6 . 3.2175(9) ?
Ag6 C41 . 2.084(8) ?
Ag6 C49 . 2.092(9) ?
Ag6 Ag7 2_666 2.9842(9) ?
Ag6 Ag9 . 3.0389(9) ?
Ag7 C17 . 2.294(7) ?
Ag7 P1 . 2.4046(19) ?
Ag7 C41 2_666 2.490(7) ?
Ag7 Ag6 2_666 2.9841(9) ?
Ag8 C25 . 2.337(7) ?
Ag8 C9 . 2.389(7) ?
Ag8 P2 . 2.4035(19) ?
Ag9 C33 . 2.336(7) ?
Ag9 C49 . 2.367(7) ?
Ag9 P3 . 2.409(2) ?
Ag9 C34 . 2.697(8) ?
P1 C57 . 1.820(8) ?
P1 C64 . 1.823(8) ?
P1 C71 . 1.827(8) ?
P2 C92 . 1.814(8) ?
P2 C78 . 1.815(8) ?
P2 C85 . 1.817(8) ?
P3 C113 . 1.813(8) ?
P3 C99 . 1.819(9) ?
P3 C106 . 1.826(8) ?
C1 C2 . 1.216(10) ?
C2 C3 . 1.448(11) ?
C3 C4 . 1.368(12) ?
C3 C8 . 1.405(12) ?
C4 C5 . 1.389(14) ?
C4 H4 . 0.95 ?
C5 C6 . 1.382(17) ?
C5 H5 . 0.95 ?
C6 C7 . 1.389(17) ?
C6 H6 . 0.95 ?
C7 C8 . 1.374(14) ?
C7 H7 . 0.95 ?
C8 H8 . 0.95 ?
C9 C10 . 1.205(11) ?
C10 C11 . 1.454(13) ?
C11 C16 . 1.390(13) ?
C11 C12 . 1.394(12) ?
C12 C13 . 1.409(15) ?
C12 H12 . 0.95 ?
C13 C14 . 1.399(17) ?
C13 H13 . 0.95 ?
C14 C15 . 1.349(16) ?
C14 H14 . 0.95 ?
C15 C16 . 1.386(14) ?
C15 H15 . 0.95 ?
C16 H16 . 0.95 ?
C17 C18 . 1.220(12) ?
C17 Ag1 2_666 2.401(7) ?
C18 C19 . 1.441(13) ?
C18 C19B . 1.46(2) ?
C19 C20 . 1.39 ?
C19 C24 . 1.39 ?
C20 C21 . 1.39 ?
C20 H20 . 0.95 ?
C21 C22 . 1.39 ?
C21 H21 . 0.95 ?
C22 C23 . 1.39 ?
C22 H22 . 0.95 ?
C23 C24 . 1.39 ?
C23 H23 . 0.95 ?
C24 H24 . 0.95 ?
C19B C20B . 1.39 ?
C19B C24B . 1.39 ?
C20B C21B . 1.39 ?
C20B H20B . 0.95 ?
C21B C22B . 1.39 ?
C21B H21B . 0.95 ?
C22B C23B . 1.39 ?
C22B H22B . 0.95 ?
C23B C24B . 1.39 ?
C23B H23B . 0.95 ?
C24B H24B . 0.95 ?
C25 C26 . 1.224(11) ?
C26 C27 . 1.461(12) ?
C27 C32 . 1.383(12) ?
C27 C28 . 1.391(12) ?
C28 C29 . 1.369(13) ?
C28 H28 . 0.95 ?
C29 C30 . 1.349(14) ?
C29 H29 . 0.95 ?
C30 C31 . 1.358(16) ?
C30 H30 . 0.95 ?
C31 C32 . 1.385(15) ?
C31 H31 . 0.95 ?
C32 H32 . 0.95 ?
C33 C34 . 1.229(11) ?
C33 Ag1 2_666 2.334(7) ?
C34 C35 . 1.41(2) ?
C34 C35B . 1.483(11) ?
C35 C36 . 1.39 ?
C35 C40 . 1.39 ?
C36 C37 . 1.39 ?
C36 H36 . 0.95 ?
C37 C38 . 1.39 ?
C37 H37 . 0.95 ?
C38 C39 . 1.39 ?
C38 H38 . 0.95 ?
C39 C40 . 1.39 ?
C39 H39 . 0.95 ?
C40 H40 . 0.95 ?
C35B C36B . 1.39 ?
C35B C40B . 1.39 ?
C36B C37B . 1.39 ?
C36B H36B . 0.95 ?
C37B C38B . 1.39 ?
C37B H37B . 0.95 ?
C38B C39B . 1.39 ?
C38B H38B . 0.95 ?
C39B C40B . 1.39 ?
C39B H39B . 0.95 ?
C40B H40B . 0.95 ?
C41 C42 . 1.203(11) ?
C41 Ag7 2_666 2.490(7) ?
C42 C43 . 1.453(14) ?
C42 C43B . 1.49(3) ?
C43 C44 . 1.39 ?
C43 C48 . 1.39 ?
C44 C45 . 1.39 ?
C44 H44 . 0.95 ?
C45 C46 . 1.39 ?
C45 H45 . 0.95 ?
C46 C47 . 1.39 ?
C46 H46 . 0.95 ?
C47 C48 . 1.39 ?
C47 H47 . 0.95 ?
C48 H48 . 0.95 ?
C43B C44B . 1.39 ?
C43B C48B . 1.39 ?
C44B C45B . 1.39 ?
C44B H44B . 0.95 ?
C45B C46B . 1.39 ?
C45B H45B . 0.95 ?
C46B C47B . 1.39 ?
C46B H46B . 0.95 ?
C47B C48B . 1.39 ?
C47B H47B . 0.95 ?
C48B H48B . 0.95 ?
C49 C50 . 1.205(11) ?
C49 Ag2 2_666 2.379(7) ?
C50 C51 . 1.431(12) ?
C50 Ag2 2_666 2.646(7) ?
C51 C52 . 1.372(11) ?
C51 C56 . 1.410(11) ?
C52 C53 . 1.392(14) ?
C52 H52 . 0.95 ?
C53 C54 . 1.360(15) ?
C53 H53 . 0.95 ?
C54 C55 . 1.373(15) ?
C54 H54 . 0.95 ?
C55 C56 . 1.401(12) ?
C55 H55 . 0.95 ?
C56 H56 . 0.95 ?
C57 C62 . 1.394(11) ?
C57 C58 . 1.405(11) ?
C58 C59 . 1.383(12) ?
C58 H58 . 0.95 ?
C59 C60 . 1.376(13) ?
C59 H59 . 0.95 ?
C60 C61 . 1.383(13) ?
C60 C63 . 1.500(13) ?
C61 C62 . 1.386(12) ?
C61 H61 . 0.95 ?
C62 H62 . 0.95 ?
C63 H63A . 0.98 ?
C63 H63B . 0.98 ?
C63 H63C . 0.98 ?
C64 C69 . 1.380(11) ?
C64 C65 . 1.385(10) ?
C65 C66 . 1.390(12) ?
C65 H65 . 0.95 ?
C66 C67 . 1.383(13) ?
C66 H66 . 0.95 ?
C67 C68 . 1.381(12) ?
C67 C70 . 1.534(12) ?
C68 C69 . 1.379(11) ?
C68 H68 . 0.95 ?
C69 H69 . 0.95 ?
C70 H70A . 0.98 ?
C70 H70B . 0.98 ?
C70 H70C . 0.98 ?
C71 C76 . 1.368(11) ?
C71 C72 . 1.394(11) ?
C72 C73 . 1.384(13) ?
C72 H72 . 0.95 ?
C73 C74 . 1.377(12) ?
C73 H73 . 0.95 ?
C74 C75 . 1.362(12) ?
C74 C77 . 1.516(12) ?
C75 C76 . 1.395(12) ?
C75 H75 . 0.95 ?
C76 H76 . 0.95 ?
C77 H77A . 0.98 ?
C77 H77B . 0.98 ?
C77 H77C . 0.98 ?
C78 C79 . 1.382(11) ?
C78 C83 . 1.412(10) ?
C79 C80 . 1.384(12) ?
C79 H79 . 0.95 ?
C80 C81 . 1.380(12) ?
C80 H80 . 0.95 ?
C81 C82 . 1.392(13) ?
C81 C84 . 1.504(12) ?
C82 C83 . 1.380(12) ?
C82 H82 . 0.95 ?
C83 H83 . 0.95 ?
C84 H84A . 0.98 ?
C84 H84B . 0.98 ?
C84 H84C . 0.98 ?
C85 C90 . 1.380(12) ?
C85 C86 . 1.383(11) ?
C86 C87 . 1.389(12) ?
C86 H86 . 0.95 ?
C87 C88 . 1.378(14) ?
C87 H87 . 0.95 ?
C88 C89 . 1.374(14) ?
C88 C91 . 1.518(13) ?
C89 C90 . 1.370(13) ?
C89 H89 . 0.95 ?
C90 H90 . 0.95 ?
C91 H91A . 0.98 ?
C91 H91B . 0.98 ?
C91 H91C . 0.98 ?
C92 C97 . 1.387(10) ?
C92 C93 . 1.403(11) ?
C93 C94 . 1.391(12) ?
C93 H93 . 0.95 ?
C94 C95 . 1.398(12) ?
C94 H94 . 0.95 ?
C95 C96 . 1.381(12) ?
C95 C98 . 1.522(12) ?
C96 C97 . 1.389(12) ?
C96 H96 . 0.95 ?
C97 H97 . 0.95 ?
C98 H98A . 0.98 ?
C98 H98B . 0.98 ?
C98 H98C . 0.98 ?
C99 C100 . 1.357(11) ?
C99 C104 . 1.397(11) ?
C100 C101 . 1.408(13) ?
C100 H100 . 0.95 ?
C101 C102 . 1.370(13) ?
C101 H101 . 0.95 ?
C102 C103 . 1.382(14) ?
C102 C105 . 1.537(14) ?
C103 C104 . 1.372(13) ?
C103 H103 . 0.95 ?
C104 H104 . 0.95 ?
C105 H10A . 0.98 ?
C105 H10B . 0.98 ?
C105 H10C . 0.98 ?
C106 C111 . 1.357(12) ?
C106 C107 . 1.389(12) ?
C107 C108 . 1.394(15) ?
C107 H107 . 0.95 ?
C108 C109 . 1.406(17) ?
C108 H108 . 0.95 ?
C109 C110 . 1.357(15) ?
C109 C112 . 1.518(16) ?
C110 C111 . 1.377(13) ?
C110 H110 . 0.95 ?
C111 H111 . 0.95 ?
C112 H11A . 0.98 ?
C112 H11B . 0.98 ?
C112 H11C . 0.98 ?
C113 C118 . 1.390(10) ?
C113 C114 . 1.397(10) ?
C114 C115 . 1.383(11) ?
C114 H114 . 0.95 ?
C115 C116 . 1.383(11) ?
C115 H115 . 0.95 ?
C116 C117 . 1.383(11) ?
C116 C119 . 1.504(11) ?
C117 C118 . 1.389(10) ?
C117 H117 . 0.95 ?
C118 H118 . 0.95 ?
C119 H11D . 0.98 ?
C119 H11E . 0.98 ?
C119 H11F . 0.98 ?
Sb1 F5B . 1.732(18) ?
Sb1 F1B . 1.773(18) ?
Sb1 F6 . 1.823(4) ?
Sb1 F3 . 1.841(4) ?
Sb1 F2 . 1.850(4) ?
Sb1 F4 . 1.857(4) ?
Sb1 F2B . 1.860(19) ?
Sb1 F4B . 1.863(19) ?
Sb1 F5 . 1.866(4) ?
Sb1 F1 . 1.884(4) ?
Sb1 F6B . 1.943(19) ?
Sb1 F3B . 1.981(19) ?
Sb2 F7 . 1.8463 ?
Sb2 F10 . 1.8467 ?
Sb2 F11 . 1.8472 ?
Sb2 F9 . 1.8602 ?
Sb2 F8 . 1.8606 ?
Sb2 F12 . 1.8611 ?
Sb2B F7B . 1.8463 ?
Sb2B F10B . 1.8468 ?
Sb2B F11B . 1.8473 ?
Sb2B F9B . 1.8602 ?
Sb2B F8B . 1.8606 ?
Sb2B F12B . 1.8611 ?
Sb2C F7C . 1.8463 ?
Sb2C F10C . 1.8468 ?
Sb2C F11C . 1.8472 ?
Sb2C F9C . 1.8601 ?
Sb2C F8C . 1.8606 ?
Sb2C F12C . 1.8611 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
C1 Ag1 C33 . 2_666 123.4(3) ?
C1 Ag1 C17 . 2_666 123.4(3) ?
C33 Ag1 C17 2_666 2_666 105.4(3) ?
C1 Ag1 Ag3 . . 48.61(18) ?
C33 Ag1 Ag3 2_666 . 156.43(18) ?
C17 Ag1 Ag3 2_666 . 94.79(18) ?
C1 Ag1 Ag2 . . 47.72(19) ?
C33 Ag1 Ag2 2_666 . 99.68(18) ?
C17 Ag1 Ag2 2_666 . 150.77(19) ?
Ag3 Ag1 Ag2 . . 57.90(2) ?
C1 Ag1 Ag5 . 2_666 139.70(19) ?
C33 Ag1 Ag5 2_666 2_666 39.7(2) ?
C17 Ag1 Ag5 2_666 2_666 95.9(2) ?
Ag3 Ag1 Ag5 . 2_666 127.41(3) ?
Ag2 Ag1 Ag5 . 2_666 93.85(2) ?
C1 Ag1 Ag4 . 2_666 142.99(19) ?
C33 Ag1 Ag4 2_666 2_666 92.82(19) ?
C17 Ag1 Ag4 2_666 2_666 39.7(2) ?
Ag3 Ag1 Ag4 . 2_666 95.20(3) ?
Ag2 Ag1 Ag4 . 2_666 125.44(3) ?
Ag5 Ag1 Ag4 2_666 2_666 64.30(2) ?
C1 Ag2 C9 . . 128.8(3) ?
C1 Ag2 C49 . 2_666 120.6(3) ?
C9 Ag2 C49 . 2_666 101.5(2) ?
C1 Ag2 C50 . 2_666 108.9(3) ?
C9 Ag2 C50 . 2_666 95.2(2) ?
C49 Ag2 C50 2_666 2_666 27.1(3) ?
C1 Ag2 Ag3 . . 49.31(18) ?
C9 Ag2 Ag3 . . 102.35(17) ?
C49 Ag2 Ag3 2_666 . 152.82(19) ?
C50 Ag2 Ag3 2_666 . 157.94(17) ?
C1 Ag2 Ag1 . . 47.8(2) ?
C9 Ag2 Ag1 . . 159.47(19) ?
C49 Ag2 Ag1 2_666 . 94.86(18) ?
C50 Ag2 Ag1 2_666 . 104.99(17) ?
Ag3 Ag2 Ag1 . . 59.23(2) ?
C1 Ag2 Ag4 . . 148.74(19) ?
C9 Ag2 Ag4 . . 42.0(2) ?
C49 Ag2 Ag4 2_666 . 89.24(19) ?
C50 Ag2 Ag4 2_666 . 102.08(18) ?
Ag3 Ag2 Ag4 . . 99.92(2) ?
Ag1 Ag2 Ag4 . . 127.05(3) ?
C1 Ag3 C41 . . 129.0(3) ?
C1 Ag3 C25 . . 126.4(3) ?
C41 Ag3 C25 . . 98.1(3) ?
C1 Ag3 Ag2 . . 50.34(19) ?
C41 Ag3 Ag2 . . 160.08(19) ?
C25 Ag3 Ag2 . . 94.23(17) ?
C1 Ag3 Ag1 . . 49.7(2) ?
C41 Ag3 Ag1 . . 100.88(18) ?
C25 Ag3 Ag1 . . 153.42(18) ?
Ag2 Ag3 Ag1 . . 62.87(2) ?
C1 Ag3 Ag6 . . 143.2(2) ?
C41 Ag3 Ag6 . . 40.8(2) ?
C25 Ag3 Ag6 . . 88.28(19) ?
Ag2 Ag3 Ag6 . . 124.62(3) ?
Ag1 Ag3 Ag6 . . 94.00(3) ?
C1 Ag3 Ag5 . . 139.88(19) ?
C41 Ag3 Ag5 . . 89.9(2) ?
C25 Ag3 Ag5 . . 38.9(2) ?
Ag2 Ag3 Ag5 . . 89.91(2) ?
Ag1 Ag3 Ag5 . . 122.48(3) ?
Ag6 Ag3 Ag5 . . 59.741(19) ?
C17 Ag4 C9 . . 165.7(3) ?
C17 Ag4 Ag7 . . 50.0(2) ?
C9 Ag4 Ag7 . . 126.14(19) ?
C17 Ag4 Ag8 . . 125.0(2) ?
C9 Ag4 Ag8 . . 51.56(19) ?
Ag7 Ag4 Ag8 . . 156.55(3) ?
C17 Ag4 Ag2 . . 144.5(2) ?
C9 Ag4 Ag2 . . 48.6(2) ?
Ag7 Ag4 Ag2 . . 113.28(2) ?
Ag8 Ag4 Ag2 . . 82.75(2) ?
C17 Ag4 Ag1 . 2_666 47.4(2) ?
C9 Ag4 Ag1 . 2_666 144.9(2) ?
Ag7 Ag4 Ag1 . 2_666 84.34(2) ?
Ag8 Ag4 Ag1 . 2_666 107.97(2) ?
Ag2 Ag4 Ag1 . 2_666 107.22(2) ?
C33 Ag5 C25 . . 164.0(3) ?
C33 Ag5 Ag8 . . 120.7(2) ?
C25 Ag5 Ag8 . . 52.1(2) ?
C33 Ag5 Ag9 . . 49.18(19) ?
C25 Ag5 Ag9 . . 128.9(2) ?
Ag8 Ag5 Ag9 . . 152.71(3) ?
C33 Ag5 Ag1 . 2_666 46.40(19) ?
C25 Ag5 Ag1 . 2_666 146.7(2) ?
Ag8 Ag5 Ag1 . 2_666 111.48(3) ?
Ag9 Ag5 Ag1 . 2_666 79.92(2) ?
C33 Ag5 Ag6 . . 96.0(2) ?
C25 Ag5 Ag6 . . 93.6(2) ?
Ag8 Ag5 Ag6 . . 142.95(3) ?
Ag9 Ag5 Ag6 . . 57.59(2) ?
Ag1 Ag5 Ag6 2_666 . 89.55(2) ?
C33 Ag5 Ag3 . . 148.6(2) ?
C25 Ag5 Ag3 . . 46.79(19) ?
Ag8 Ag5 Ag3 . . 84.84(2) ?
Ag9 Ag5 Ag3 . . 115.39(2) ?
Ag1 Ag5 Ag3 2_666 . 110.04(2) ?
Ag6 Ag5 Ag3 . . 58.842(18) ?
C41 Ag6 C49 . . 165.9(3) ?
C41 Ag6 Ag7 . 2_666 55.5(2) ?
C49 Ag6 Ag7 . 2_666 115.54(19) ?
C41 Ag6 Ag9 . . 131.0(2) ?
C49 Ag6 Ag9 . . 50.95(18) ?
Ag7 Ag6 Ag9 2_666 . 152.33(3) ?
C41 Ag6 Ag3 . . 46.63(18) ?
C49 Ag6 Ag3 . . 147.3(2) ?
Ag7 Ag6 Ag3 2_666 . 84.94(2) ?
Ag9 Ag6 Ag3 . . 119.33(2) ?
C41 Ag6 Ag5 . . 95.82(19) ?
C49 Ag6 Ag5 . . 95.8(2) ?
Ag7 Ag6 Ag5 2_666 . 146.30(3) ?
Ag9 Ag6 Ag5 . . 59.041(18) ?
Ag3 Ag6 Ag5 . . 61.42(2) ?
C17 Ag7 P1 . . 144.13(19) ?
C17 Ag7 C41 . 2_666 97.1(2) ?
P1 Ag7 C41 . 2_666 117.91(16) ?
C17 Ag7 Ag6 . 2_666 97.0(2) ?
P1 Ag7 Ag6 . 2_666 113.28(5) ?
C41 Ag7 Ag6 2_666 2_666 43.61(19) ?
C17 Ag7 Ag4 . . 44.1(2) ?
P1 Ag7 Ag4 . . 128.14(6) ?
C41 Ag7 Ag4 2_666 . 100.11(17) ?
Ag6 Ag7 Ag4 2_666 . 71.03(2) ?
C25 Ag8 C9 . . 98.9(2) ?
C25 Ag8 P2 . . 135.37(18) ?
C9 Ag8 P2 . . 125.73(18) ?
C25 Ag8 Ag5 . . 44.0(2) ?
C9 Ag8 Ag5 . . 98.9(2) ?
P2 Ag8 Ag5 . . 117.62(6) ?
C25 Ag8 Ag4 . . 98.50(19) ?
C9 Ag8 Ag4 . . 43.4(2) ?
P2 Ag8 Ag4 . . 112.27(6) ?
Ag5 Ag8 Ag4 . . 70.28(2) ?
C33 Ag9 C49 . . 101.7(3) ?
C33 Ag9 P3 . . 136.86(19) ?
C49 Ag9 P3 . . 121.34(18) ?
C33 Ag9 C34 . . 27.1(3) ?
C49 Ag9 C34 . . 112.4(2) ?
P3 Ag9 C34 . . 121.82(18) ?
C33 Ag9 Ag6 . . 95.2(2) ?
C49 Ag9 Ag6 . . 43.3(2) ?
P3 Ag9 Ag6 . . 113.58(6) ?
C34 Ag9 Ag6 . . 120.43(18) ?
C33 Ag9 Ag5 . . 41.8(2) ?
C49 Ag9 Ag5 . . 93.8(2) ?
P3 Ag9 Ag5 . . 125.20(6) ?
C34 Ag9 Ag5 . . 67.88(19) ?
Ag6 Ag9 Ag5 . . 63.37(2) ?
C57 P1 C64 . . 105.8(3) ?
C57 P1 C71 . . 105.4(3) ?
C64 P1 C71 . . 106.8(4) ?
C57 P1 Ag7 . . 114.7(2) ?
C64 P1 Ag7 . . 114.6(3) ?
C71 P1 Ag7 . . 108.9(3) ?
C92 P2 C78 . . 104.0(4) ?
C92 P2 C85 . . 108.5(4) ?
C78 P2 C85 . . 105.7(4) ?
C92 P2 Ag8 . . 113.3(2) ?
C78 P2 Ag8 . . 111.6(3) ?
C85 P2 Ag8 . . 113.1(3) ?
C113 P3 C99 . . 105.4(4) ?
C113 P3 C106 . . 105.1(4) ?
C99 P3 C106 . . 105.7(4) ?
C113 P3 Ag9 . . 114.0(2) ?
C99 P3 Ag9 . . 111.6(2) ?
C106 P3 Ag9 . . 114.3(3) ?
C2 C1 Ag3 . . 132.4(6) ?
C2 C1 Ag2 . . 126.7(6) ?
Ag3 C1 Ag2 . . 80.3(2) ?
C2 C1 Ag1 . . 132.7(6) ?
Ag3 C1 Ag1 . . 81.7(3) ?
Ag2 C1 Ag1 . . 84.5(3) ?
C1 C2 C3 . . 177.2(8) ?
C4 C3 C8 . . 119.1(9) ?
C4 C3 C2 . . 122.0(8) ?
C8 C3 C2 . . 118.8(8) ?
C3 C4 C5 . . 120.6(10) ?
C3 C4 H4 . . 119.7 ?
C5 C4 H4 . . 119.7 ?
C6 C5 C4 . . 119.4(11) ?
C6 C5 H5 . . 120.3 ?
C4 C5 H5 . . 120.3 ?
C5 C6 C7 . . 121.1(11) ?
C5 C6 H6 . . 119.5 ?
C7 C6 H6 . . 119.5 ?
C8 C7 C6 . . 118.6(11) ?
C8 C7 H7 . . 120.7 ?
C6 C7 H7 . . 120.7 ?
C7 C8 C3 . . 121.1(10) ?
C7 C8 H8 . . 119.4 ?
C3 C8 H8 . . 119.4 ?
C10 C9 Ag4 . . 165.7(7) ?
C10 C9 Ag2 . . 102.2(6) ?
Ag4 C9 Ag2 . . 89.4(3) ?
C10 C9 Ag8 . . 96.3(5) ?
Ag4 C9 Ag8 . . 85.1(3) ?
Ag2 C9 Ag8 . . 118.8(3) ?
C9 C10 C11 . . 179.3(9) ?
C16 C11 C12 . . 119.0(9) ?
C16 C11 C10 . . 121.1(8) ?
C12 C11 C10 . . 119.8(9) ?
C11 C12 C13 . . 120.0(10) ?
C11 C12 H12 . . 120.0 ?
C13 C12 H12 . . 120.0 ?
C14 C13 C12 . . 118.9(11) ?
C14 C13 H13 . . 120.5 ?
C12 C13 H13 . . 120.5 ?
C15 C14 C13 . . 120.7(11) ?
C15 C14 H14 . . 119.6 ?
C13 C14 H14 . . 119.6 ?
C14 C15 C16 . . 120.8(12) ?
C14 C15 H15 . . 119.6 ?
C16 C15 H15 . . 119.6 ?
C15 C16 C11 . . 120.5(10) ?
C15 C16 H16 . . 119.8 ?
C11 C16 H16 . . 119.8 ?
C18 C17 Ag4 . . 166.7(7) ?
C18 C17 Ag7 . . 97.6(6) ?
Ag4 C17 Ag7 . . 85.9(3) ?
C18 C17 Ag1 . 2_666 95.2(6) ?
Ag4 C17 Ag1 . 2_666 92.9(3) ?
Ag7 C17 Ag1 . 2_666 126.7(3) ?
C17 C18 C19 . . 176.2(9) ?
C17 C18 C19B . . 168.2(12) ?
C20 C19 C24 . . 120.0 ?
C20 C19 C18 . . 120.0(9) ?
C24 C19 C18 . . 119.9(9) ?
C19 C20 C21 . . 120.0 ?
C19 C20 H20 . . 120.0 ?
C21 C20 H20 . . 120.0 ?
C20 C21 C22 . . 120.0 ?
C20 C21 H21 . . 120.0 ?
C22 C21 H21 . . 120.0 ?
C23 C22 C21 . . 120.0 ?
C23 C22 H22 . . 120.0 ?
C21 C22 H22 . . 120.0 ?
C22 C23 C24 . . 120.0 ?
C22 C23 H23 . . 120.0 ?
C24 C23 H23 . . 120.0 ?
C23 C24 C19 . . 120.0 ?
C23 C24 H24 . . 120.0 ?
C19 C24 H24 . . 120.0 ?
C20B C19B C24B . . 120.0 ?
C20B C19B C18 . . 113.8(17) ?
C24B C19B C18 . . 125.3(18) ?
C21B C20B C19B . . 120.0 ?
C21B C20B H20B . . 120.0 ?
C19B C20B H20B . . 120.0 ?
C20B C21B C22B . . 120.0 ?
C20B C21B H21B . . 120.0 ?
C22B C21B H21B . . 120.0 ?
C23B C22B C21B . . 120.0 ?
C23B C22B H22B . . 120.0 ?
C21B C22B H22B . . 120.0 ?
C24B C23B C22B . . 120.0 ?
C24B C23B H23B . . 120.0 ?
C22B C23B H23B . . 120.0 ?
C23B C24B C19B . . 120.0 ?
C23B C24B H24B . . 120.0 ?
C19B C24B H24B . . 120.0 ?
C26 C25 Ag5 . . 168.6(6) ?
C26 C25 Ag8 . . 98.3(6) ?
Ag5 C25 Ag8 . . 83.9(3) ?
C26 C25 Ag3 . . 93.5(5) ?
Ag5 C25 Ag3 . . 94.3(3) ?
Ag8 C25 Ag3 . . 125.3(3) ?
C25 C26 C27 . . 177.3(8) ?
C32 C27 C28 . . 117.6(9) ?
C32 C27 C26 . . 122.1(9) ?
C28 C27 C26 . . 120.3(7) ?
C29 C28 C27 . . 121.0(9) ?
C29 C28 H28 . . 119.5 ?
C27 C28 H28 . . 119.5 ?
C30 C29 C28 . . 120.2(10) ?
C30 C29 H29 . . 119.9 ?
C28 C29 H29 . . 119.9 ?
C29 C30 C31 . . 120.7(11) ?
C29 C30 H30 . . 119.6 ?
C31 C30 H30 . . 119.6 ?
C30 C31 C32 . . 119.8(10) ?
C30 C31 H31 . . 120.1 ?
C32 C31 H31 . . 120.1 ?
C27 C32 C31 . . 120.5(11) ?
C27 C32 H32 . . 119.8 ?
C31 C32 H32 . . 119.8 ?
C34 C33 Ag5 . . 160.8(7) ?
C34 C33 Ag1 . 2_666 101.5(6) ?
Ag5 C33 Ag1 . 2_666 93.9(3) ?
C34 C33 Ag9 . . 93.0(5) ?
Ag5 C33 Ag9 . . 89.0(3) ?
Ag1 C33 Ag9 2_666 . 120.2(3) ?
C33 C34 C35 . . 162.2(16) ?
C33 C34 C35B . . 173.8(9) ?
C33 C34 Ag9 . . 59.9(5) ?
C35 C34 Ag9 . . 116.5(11) ?
C35B C34 Ag9 . . 123.4(6) ?
C36 C35 C40 . . 120.0 ?
C36 C35 C34 . . 132.(2) ?
C40 C35 C34 . . 108.(2) ?
C35 C36 C37 . . 120.0 ?
C35 C36 H36 . . 120.0 ?
C37 C36 H36 . . 120.0 ?
C36 C37 C38 . . 120.0 ?
C36 C37 H37 . . 120.0 ?
C38 C37 H37 . . 120.0 ?
C39 C38 C37 . . 120.0 ?
C39 C38 H38 . . 120.0 ?
C37 C38 H38 . . 120.0 ?
C38 C39 C40 . . 120.0 ?
C38 C39 H39 . . 120.0 ?
C40 C39 H39 . . 120.0 ?
C39 C40 C35 . . 120.0 ?
C39 C40 H40 . . 120.0 ?
C35 C40 H40 . . 120.0 ?
C36B C35B C40B . . 120.0 ?
C36B C35B C34 . . 115.5(7) ?
C40B C35B C34 . . 124.5(7) ?
C37B C36B C35B . . 120.0 ?
C37B C36B H36B . . 120.0 ?
C35B C36B H36B . . 120.0 ?
C36B C37B C38B . . 120.0 ?
C36B C37B H37B . . 120.0 ?
C38B C37B H37B . . 120.0 ?
C39B C38B C37B . . 120.0 ?
C39B C38B H38B . . 120.0 ?
C37B C38B H38B . . 120.0 ?
C38B C39B C40B . . 120.0 ?
C38B C39B H39B . . 120.0 ?
C40B C39B H39B . . 120.0 ?
C39B C40B C35B . . 120.0 ?
C39B C40B H40B . . 120.0 ?
C35B C40B H40B . . 120.0 ?
C42 C41 Ag6 . . 168.8(6) ?
C42 C41 Ag3 . . 98.5(6) ?
Ag6 C41 Ag3 . . 92.6(3) ?
C42 C41 Ag7 . 2_666 91.8(5) ?
Ag6 C41 Ag7 . 2_666 80.9(3) ?
Ag3 C41 Ag7 . 2_666 120.2(3) ?
C41 C42 C43 . . 176.5(9) ?
C41 C42 C43B . . 169.3(17) ?
C44 C43 C48 . . 120.0 ?
C44 C43 C42 . . 120.6(9) ?
C48 C43 C42 . . 119.2(9) ?
C45 C44 C43 . . 120.0 ?
C45 C44 H44 . . 120.0 ?
C43 C44 H44 . . 120.0 ?
C44 C45 C46 . . 120.0 ?
C44 C45 H45 . . 120.0 ?
C46 C45 H45 . . 120.0 ?
C47 C46 C45 . . 120.0 ?
C47 C46 H46 . . 120.0 ?
C45 C46 H46 . . 120.0 ?
C46 C47 C48 . . 120.0 ?
C46 C47 H47 . . 120.0 ?
C48 C47 H47 . . 120.0 ?
C47 C48 C43 . . 120.0 ?
C47 C48 H48 . . 120.0 ?
C43 C48 H48 . . 120.0 ?
C44B C43B C48B . . 120.0 ?
C44B C43B C42 . . 121.(3) ?
C48B C43B C42 . . 119.(3) ?
C43B C44B C45B . . 120.0 ?
C43B C44B H44B . . 120.0 ?
C45B C44B H44B . . 120.0 ?
C46B C45B C44B . . 120.0 ?
C46B C45B H45B . . 120.0 ?
C44B C45B H45B . . 120.0 ?
C47B C46B C45B . . 120.0 ?
C47B C46B H46B . . 120.0 ?
C45B C46B H46B . . 120.0 ?
C46B C47B C48B . . 120.0 ?
C46B C47B H47B . . 120.0 ?
C48B C47B H47B . . 120.0 ?
C47B C48B C43B . . 120.0 ?
C47B C48B H48B . . 120.0 ?
C43B C48B H48B . . 120.0 ?
C50 C49 Ag6 . . 162.5(7) ?
C50 C49 Ag9 . . 103.5(6) ?
Ag6 C49 Ag9 . . 85.7(3) ?
C50 C49 Ag2 . 2_666 88.9(5) ?
Ag6 C49 Ag2 . 2_666 98.9(3) ?
Ag9 C49 Ag2 . 2_666 122.2(3) ?
C49 C50 C51 . . 177.4(8) ?
C49 C50 Ag2 . 2_666 64.0(5) ?
C51 C50 Ag2 . 2_666 114.9(5) ?
C52 C51 C56 . . 119.6(8) ?
C52 C51 C50 . . 121.9(8) ?
C56 C51 C50 . . 118.5(7) ?
C51 C52 C53 . . 119.7(9) ?
C51 C52 H52 . . 120.2 ?
C53 C52 H52 . . 120.2 ?
C54 C53 C52 . . 120.5(10) ?
C54 C53 H53 . . 119.8 ?
C52 C53 H53 . . 119.8 ?
C53 C54 C55 . . 121.7(10) ?
C53 C54 H54 . . 119.1 ?
C55 C54 H54 . . 119.1 ?
C54 C55 C56 . . 118.5(10) ?
C54 C55 H55 . . 120.7 ?
C56 C55 H55 . . 120.7 ?
C55 C56 C51 . . 120.0(9) ?
C55 C56 H56 . . 120.0 ?
C51 C56 H56 . . 120.0 ?
C62 C57 C58 . . 117.7(8) ?
C62 C57 P1 . . 118.7(6) ?
C58 C57 P1 . . 123.6(6) ?
C59 C58 C57 . . 119.4(8) ?
C59 C58 H58 . . 120.3 ?
C57 C58 H58 . . 120.3 ?
C60 C59 C58 . . 123.7(8) ?
C60 C59 H59 . . 118.2 ?
C58 C59 H59 . . 118.2 ?
C59 C60 C61 . . 116.2(8) ?
C59 C60 C63 . . 122.2(9) ?
C61 C60 C63 . . 121.6(9) ?
C60 C61 C62 . . 122.3(8) ?
C60 C61 H61 . . 118.8 ?
C62 C61 H61 . . 118.8 ?
C61 C62 C57 . . 120.7(8) ?
C61 C62 H62 . . 119.7 ?
C57 C62 H62 . . 119.7 ?
C60 C63 H63A . . 109.5 ?
C60 C63 H63B . . 109.5 ?
H63A C63 H63B . . 109.5 ?
C60 C63 H63C . . 109.5 ?
H63A C63 H63C . . 109.5 ?
H63B C63 H63C . . 109.5 ?
C69 C64 C65 . . 118.3(7) ?
C69 C64 P1 . . 118.5(6) ?
C65 C64 P1 . . 123.0(6) ?
C64 C65 C66 . . 121.2(8) ?
C64 C65 H65 . . 119.4 ?
C66 C65 H65 . . 119.4 ?
C67 C66 C65 . . 120.0(8) ?
C67 C66 H66 . . 120.0 ?
C65 C66 H66 . . 120.0 ?
C68 C67 C66 . . 118.5(8) ?
C68 C67 C70 . . 121.0(9) ?
C66 C67 C70 . . 120.4(8) ?
C69 C68 C67 . . 121.4(8) ?
C69 C68 H68 . . 119.3 ?
C67 C68 H68 . . 119.3 ?
C68 C69 C64 . . 120.5(8) ?
C68 C69 H69 . . 119.7 ?
C64 C69 H69 . . 119.7 ?
C67 C70 H70A . . 109.5 ?
C67 C70 H70B . . 109.5 ?
H70A C70 H70B . . 109.5 ?
C67 C70 H70C . . 109.5 ?
H70A C70 H70C . . 109.5 ?
H70B C70 H70C . . 109.5 ?
C76 C71 C72 . . 117.1(8) ?
C76 C71 P1 . . 124.8(7) ?
C72 C71 P1 . . 117.8(6) ?
C73 C72 C71 . . 121.1(8) ?
C73 C72 H72 . . 119.4 ?
C71 C72 H72 . . 119.4 ?
C74 C73 C72 . . 121.4(9) ?
C74 C73 H73 . . 119.3 ?
C72 C73 H73 . . 119.3 ?
C75 C74 C73 . . 117.4(8) ?
C75 C74 C77 . . 122.1(8) ?
C73 C74 C77 . . 120.5(9) ?
C74 C75 C76 . . 122.0(8) ?
C74 C75 H75 . . 119.0 ?
C76 C75 H75 . . 119.0 ?
C71 C76 C75 . . 121.0(8) ?
C71 C76 H76 . . 119.5 ?
C75 C76 H76 . . 119.5 ?
C74 C77 H77A . . 109.5 ?
C74 C77 H77B . . 109.5 ?
H77A C77 H77B . . 109.5 ?
C74 C77 H77C . . 109.5 ?
H77A C77 H77C . . 109.5 ?
H77B C77 H77C . . 109.5 ?
C79 C78 C83 . . 117.1(8) ?
C79 C78 P2 . . 119.9(6) ?
C83 C78 P2 . . 122.9(7) ?
C78 C79 C80 . . 121.9(8) ?
C78 C79 H79 . . 119.0 ?
C80 C79 H79 . . 119.0 ?
C81 C80 C79 . . 121.0(9) ?
C81 C80 H80 . . 119.5 ?
C79 C80 H80 . . 119.5 ?
C80 C81 C82 . . 117.8(8) ?
C80 C81 C84 . . 122.6(9) ?
C82 C81 C84 . . 119.6(8) ?
C83 C82 C81 . . 121.5(8) ?
C83 C82 H82 . . 119.2 ?
C81 C82 H82 . . 119.2 ?
C82 C83 C78 . . 120.5(8) ?
C82 C83 H83 . . 119.7 ?
C78 C83 H83 . . 119.7 ?
C81 C84 H84A . . 109.5 ?
C81 C84 H84B . . 109.5 ?
H84A C84 H84B . . 109.5 ?
C81 C84 H84C . . 109.5 ?
H84A C84 H84C . . 109.5 ?
H84B C84 H84C . . 109.5 ?
C90 C85 C86 . . 117.5(8) ?
C90 C85 P2 . . 119.2(6) ?
C86 C85 P2 . . 123.2(6) ?
C85 C86 C87 . . 120.7(8) ?
C85 C86 H86 . . 119.7 ?
C87 C86 H86 . . 119.7 ?
C88 C87 C86 . . 121.9(8) ?
C88 C87 H87 . . 119.0 ?
C86 C87 H87 . . 119.0 ?
C89 C88 C87 . . 116.0(9) ?
C89 C88 C91 . . 122.5(10) ?
C87 C88 C91 . . 121.4(10) ?
C90 C89 C88 . . 123.1(10) ?
C90 C89 H89 . . 118.4 ?
C88 C89 H89 . . 118.4 ?
C89 C90 C85 . . 120.6(9) ?
C89 C90 H90 . . 119.7 ?
C85 C90 H90 . . 119.7 ?
C88 C91 H91A . . 109.5 ?
C88 C91 H91B . . 109.5 ?
H91A C91 H91B . . 109.5 ?
C88 C91 H91C . . 109.5 ?
H91A C91 H91C . . 109.5 ?
H91B C91 H91C . . 109.5 ?
C97 C92 C93 . . 119.0(8) ?
C97 C92 P2 . . 118.2(6) ?
C93 C92 P2 . . 122.7(6) ?
C94 C93 C92 . . 119.9(8) ?
C94 C93 H93 . . 120.0 ?
C92 C93 H93 . . 120.0 ?
C93 C94 C95 . . 120.9(8) ?
C93 C94 H94 . . 119.5 ?
C95 C94 H94 . . 119.5 ?
C96 C95 C94 . . 118.4(8) ?
C96 C95 C98 . . 121.0(8) ?
C94 C95 C98 . . 120.7(8) ?
C95 C96 C97 . . 121.4(8) ?
C95 C96 H96 . . 119.3 ?
C97 C96 H96 . . 119.3 ?
C92 C97 C96 . . 120.4(8) ?
C92 C97 H97 . . 119.8 ?
C96 C97 H97 . . 119.8 ?
C95 C98 H98A . . 109.5 ?
C95 C98 H98B . . 109.5 ?
H98A C98 H98B . . 109.5 ?
C95 C98 H98C . . 109.5 ?
H98A C98 H98C . . 109.5 ?
H98B C98 H98C . . 109.5 ?
C100 C99 C104 . . 117.9(8) ?
C100 C99 P3 . . 119.4(6) ?
C104 C99 P3 . . 122.7(7) ?
C99 C100 C101 . . 121.9(8) ?
C99 C100 H100 . . 119.0 ?
C101 C100 H100 . . 119.0 ?
C102 C101 C100 . . 119.4(9) ?
C102 C101 H101 . . 120.3 ?
C100 C101 H101 . . 120.3 ?
C101 C102 C103 . . 118.9(9) ?
C101 C102 C105 . . 121.8(10) ?
C103 C102 C105 . . 119.3(9) ?
C104 C103 C102 . . 121.2(9) ?
C104 C103 H103 . . 119.4 ?
C102 C103 H103 . . 119.4 ?
C103 C104 C99 . . 120.5(9) ?
C103 C104 H104 . . 119.7 ?
C99 C104 H104 . . 119.7 ?
C102 C105 H10A . . 109.5 ?
C102 C105 H10B . . 109.5 ?
H10A C105 H10B . . 109.5 ?
C102 C105 H10C . . 109.5 ?
H10A C105 H10C . . 109.5 ?
H10B C105 H10C . . 109.5 ?
C111 C106 C107 . . 118.4(8) ?
C111 C106 P3 . . 119.4(6) ?
C107 C106 P3 . . 122.0(7) ?
C106 C107 C108 . . 118.1(11) ?
C106 C107 H107 . . 120.9 ?
C108 C107 H107 . . 120.9 ?
C107 C108 C109 . . 123.0(11) ?
C107 C108 H108 . . 118.5 ?
C109 C108 H108 . . 118.5 ?
C110 C109 C108 . . 115.8(11) ?
C110 C109 C112 . . 122.9(12) ?
C108 C109 C112 . . 121.2(11) ?
C109 C110 C111 . . 121.4(10) ?
C109 C110 H110 . . 119.3 ?
C111 C110 H110 . . 119.3 ?
C106 C111 C110 . . 122.5(9) ?
C106 C111 H111 . . 118.7 ?
C110 C111 H111 . . 118.7 ?
C109 C112 H11A . . 109.5 ?
C109 C112 H11B . . 109.5 ?
H11A C112 H11B . . 109.5 ?
C109 C112 H11C . . 109.5 ?
H11A C112 H11C . . 109.5 ?
H11B C112 H11C . . 109.5 ?
C118 C113 C114 . . 117.6(7) ?
C118 C113 P3 . . 119.2(5) ?
C114 C113 P3 . . 123.2(6) ?
C115 C114 C113 . . 120.1(8) ?
C115 C114 H114 . . 120.0 ?
C113 C114 H114 . . 120.0 ?
C116 C115 C114 . . 122.2(7) ?
C116 C115 H115 . . 118.9 ?
C114 C115 H115 . . 118.9 ?
C117 C116 C115 . . 117.7(7) ?
C117 C116 C119 . . 121.3(8) ?
C115 C116 C119 . . 120.9(7) ?
C116 C117 C118 . . 120.6(8) ?
C116 C117 H117 . . 119.7 ?
C118 C117 H117 . . 119.7 ?
C117 C118 C113 . . 121.6(7) ?
C117 C118 H118 . . 119.2 ?
C113 C118 H118 . . 119.2 ?
C116 C119 H11D . . 109.5 ?
C116 C119 H11E . . 109.5 ?
H11D C119 H11E . . 109.5 ?
C116 C119 H11F . . 109.5 ?
H11D C119 H11F . . 109.5 ?
H11E C119 H11F . . 109.5 ?
F5B Sb1 F1B . . 99.4(10) ?
F6 Sb1 F3 . . 92.4(2) ?
F6 Sb1 F2 . . 92.05(19) ?
F3 Sb1 F2 . . 91.48(18) ?
F6 Sb1 F4 . . 89.89(17) ?
F3 Sb1 F4 . . 87.95(17) ?
F2 Sb1 F4 . . 178.0(2) ?
F5B Sb1 F2B . . 92.6(9) ?
F1B Sb1 F2B . . 89.9(7) ?
F5B Sb1 F4B . . 96.0(9) ?
F1B Sb1 F4B . . 94.6(10) ?
F2B Sb1 F4B . . 169.4(12) ?
F6 Sb1 F5 . . 88.21(16) ?
F3 Sb1 F5 . . 179.4(3) ?
F2 Sb1 F5 . . 88.77(17) ?
F4 Sb1 F5 . . 91.78(18) ?
F6 Sb1 F1 . . 178.6(2) ?
F3 Sb1 F1 . . 88.50(15) ?
F2 Sb1 F1 . . 86.85(16) ?
F4 Sb1 F1 . . 91.21(19) ?
F5 Sb1 F1 . . 90.92(19) ?
F5B Sb1 F6B . . 88.4(8) ?
F1B Sb1 F6B . . 172.0(12) ?
F2B Sb1 F6B . . 88.0(9) ?
F4B Sb1 F6B . . 86.1(7) ?
F5B Sb1 F3B . . 173.1(12) ?
F1B Sb1 F3B . . 87.5(8) ?
F2B Sb1 F3B . . 86.9(8) ?
F4B Sb1 F3B . . 83.8(8) ?
F6B Sb1 F3B . . 84.7(8) ?
F7 Sb2 F10 . . 92.8 ?
F7 Sb2 F11 . . 92.7 ?
F10 Sb2 F11 . . 92.7 ?
F7 Sb2 F9 . . 89.1 ?
F10 Sb2 F9 . . 87.7 ?
F11 Sb2 F9 . . 178.1 ?
F7 Sb2 F8 . . 87.7 ?
F10 Sb2 F8 . . 178.2 ?
F11 Sb2 F8 . . 89.0 ?
F9 Sb2 F8 . . 90.5 ?
F7 Sb2 F12 . . 178.1 ?
F10 Sb2 F12 . . 89.0 ?
F11 Sb2 F12 . . 87.6 ?
F9 Sb2 F12 . . 90.5 ?
F8 Sb2 F12 . . 90.5 ?
F7B Sb2B F10B . . 92.8 ?
F7B Sb2B F11B . . 92.7 ?
F10B Sb2B F11B . . 92.7 ?
F7B Sb2B F9B . . 89.1 ?
F10B Sb2B F9B . . 87.7 ?
F11B Sb2B F9B . . 178.1 ?
F7B Sb2B F8B . . 87.7 ?
F10B Sb2B F8B . . 178.2 ?
F11B Sb2B F8B . . 89.0 ?
F9B Sb2B F8B . . 90.5 ?
F7B Sb2B F12B . . 178.2 ?
F10B Sb2B F12B . . 89.0 ?
F11B Sb2B F12B . . 87.6 ?
F9B Sb2B F12B . . 90.5 ?
F8B Sb2B F12B . . 90.5 ?
F7C Sb2C F10C . . 92.8 ?
F7C Sb2C F11C . . 92.7 ?
F10C Sb2C F11C . . 92.7 ?
F7C Sb2C F9C . . 89.1 ?
F10C Sb2C F9C . . 87.7 ?
F11C Sb2C F9C . . 178.1 ?
F7C Sb2C F8C . . 87.7 ?
F10C Sb2C F8C . . 178.16(19) ?
F11C Sb2C F8C . . 89.0 ?
F9C Sb2C F8C . . 90.5 ?
F7C Sb2C F12C . . 178.1 ?
F10C Sb2C F12C . . 89.0 ?
F11C Sb2C F12C . . 87.6 ?
F9C Sb2C F12C . . 90.53(6) ?
F8C Sb2C F12C . . 90.5 ?

