#------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/01/4070186.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4070186
loop_
_publ_author_name
'Fahlbusch, Tilmann'
'Frank, Markus'
'Maas, Gerhard'
'Schatz, Jürgen'
_publ_section_title
;
 N-Heterocyclic Carbene Complexes of Mercury, Silver, Iridium, Platinum,
 Ruthenium, and Palladium Based on the Calix[4]arene Skeleton
;
_journal_issue                   21
_journal_name_full               Organometallics
_journal_page_first              6183
_journal_paper_doi               10.1021/om900642x
_journal_volume                  28
_journal_year                    2009
_chemical_formula_moiety
'(C50 H60 AG1 B1 F4 N4 O4) x 1.125 (C1 H2 Cl2) x 0.5 (C8 H10)'
_chemical_formula_sum            'C55.125 H67.25 Ag B Cl2.25 F4 N4 O4'
_chemical_formula_weight         1124.32
_chemical_name_systematic
; 
 ? 
;
_chemical_temperature_decomposition 479.15
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                105.39(3)
_cell_angle_beta                 97.43(3)
_cell_angle_gamma                93.75(3)
_cell_formula_units_Z            8
_cell_length_a                   11.021(3)
_cell_length_b                   26.011(7)
_cell_length_c                   41.515(9)
_cell_measurement_temperature    193(2)
_cell_volume                     11316(5)
_computing_cell_refinement       'IPDS software (STOE, Darmstadt)'
_computing_data_collection       'IPDS software (STOE, Darmstadt)'
_computing_data_reduction        'X-RED (STOE, Darmstadt)'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1998)'
_computing_publication_material  'SHELX-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      193(2)
_diffrn_measured_fraction_theta_full 0.949
_diffrn_measured_fraction_theta_max 0.949
_diffrn_measurement_device_type
'imaging-plate instrument (IPDS, STOE, Darmstadt)'
_diffrn_measurement_method       'phi scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0792
_diffrn_reflns_av_sigmaI/netI    0.1168
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -28
_diffrn_reflns_limit_l_max       46
_diffrn_reflns_limit_l_min       -46
_diffrn_reflns_number            67735
_diffrn_reflns_theta_full        23.26
_diffrn_reflns_theta_max         23.26
_diffrn_reflns_theta_min         2.50
_exptl_absorpt_coefficient_mu    0.522
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.320
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             4674
_exptl_crystal_size_max          0.58
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.15
_refine_diff_density_max         2.638
_refine_diff_density_min         -1.255
_refine_diff_density_rms         0.113
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           fullcycle
_refine_ls_number_parameters     2482
_refine_ls_number_reflns         30861
_refine_ls_number_restraints     15
_refine_ls_restrained_S_all      1.052
_refine_ls_R_factor_all          0.1718
_refine_ls_R_factor_gt           0.0714
_refine_ls_shift/su_max          0.643
_refine_ls_shift/su_mean         0.015
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1806
_refine_ls_wR_factor_ref         0.2240
_reflns_number_gt                13159
_reflns_number_total             30861
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om900642x_si_001.cif
_cod_data_source_block           mf045
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' tag was changed to
'_chemical_temperature_decomposition' since the value had been given
as '206 \% C (dec.)'. The value '206 \% C (dec.)' was changed to
'479.15' - it was converted from degrees Celsius(C) to Kelvins(K).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      p1bar
_cod_original_formula_sum        'C55.125 H67.25 Ag1 B1 Cl2.25 F4 N4 O4'
_cod_database_code               4070186
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.26810(6) 0.19976(3) 0.77024(2) 0.0384(2) Uani 1 1 d . . .
O1 O 0.3908(6) -0.0198(3) 0.8150(2) 0.052(2) Uani 1 1 d . . .
O2 O 0.7061(6) 0.0120(3) 0.83420(19) 0.0440(19) Uani 1 1 d . . .
O3 O 0.2886(6) -0.1053(3) 0.7436(2) 0.053(2) Uani 1 1 d . . .
O4 O 0.5888(7) -0.0595(3) 0.7555(2) 0.066(3) Uani 1 1 d . . .
N1 N 0.5383(7) 0.2279(3) 0.8046(2) 0.040(2) Uani 1 1 d . . .
N2 N 0.4266(7) 0.2846(3) 0.8308(2) 0.044(2) Uani 1 1 d . . .
N3 N 0.1318(7) 0.1105(3) 0.7096(2) 0.037(2) Uani 1 1 d . . .
N4 N 0.0021(7) 0.1619(3) 0.7307(2) 0.036(2) Uani 1 1 d . . .
C1 C 0.2070(8) -0.0217(4) 0.7505(2) 0.035(2) Uani 1 1 d . . .
C2 C 0.1481(8) -0.0281(4) 0.7812(3) 0.043(3) Uani 1 1 d . A .
H2A H 0.0577 -0.0285 0.7762 0.064 Uiso 1 1 calc R . .
H2B H 0.1662 -0.0625 0.7857 0.064 Uiso 1 1 calc R . .
C3 C 0.1991(8) 0.0182(4) 0.8122(3) 0.040(3) Uani 1 1 d . . .
C4 C 0.1319(9) 0.0595(5) 0.8255(3) 0.054(3) Uani 1 1 d . A .
H4 H 0.0474 0.0577 0.8166 0.065 Uiso 1 1 calc R . .
C5 C 0.1838(10) 0.1024(6) 0.8509(3) 0.067(4) Uani 1 1 d . . .
H5 H 0.1351 0.1298 0.8603 0.080 Uiso 1 1 calc R A .
C6 C 0.3093(11) 0.1067(5) 0.8633(3) 0.061(3) Uani 1 1 d . A .
H6 H 0.3464 0.1379 0.8803 0.073 Uiso 1 1 calc R . .
C7 C 0.3794(8) 0.0663(4) 0.8511(3) 0.039(3) Uani 1 1 d . . .
C8 C 0.5182(9) 0.0728(4) 0.8619(3) 0.047(3) Uani 1 1 d . A .
H8A H 0.5443 0.0395 0.8666 0.070 Uiso 1 1 calc R . .
H8B H 0.5408 0.1024 0.8829 0.070 Uiso 1 1 calc R . .
C9 C 0.5846(9) 0.0847(4) 0.8341(3) 0.042(3) Uani 1 1 d . . .
C10 C 0.5553(8) 0.1268(4) 0.8210(3) 0.040(3) Uani 1 1 d . A .
H10 H 0.4987 0.1499 0.8308 0.048 Uiso 1 1 calc R . .
C11 C 0.6051(8) 0.1362(4) 0.7944(3) 0.039(3) Uani 1 1 d . . .
C12 C 0.6843(8) 0.1018(4) 0.7793(3) 0.038(3) Uani 1 1 d . A .
H12 H 0.7173 0.1073 0.7603 0.046 Uiso 1 1 calc R . .
C13 C 0.7163(8) 0.0589(4) 0.7918(3) 0.035(3) Uani 1 1 d . . .
C14 C 0.7970(9) 0.0205(4) 0.7732(3) 0.043(3) Uani 1 1 d . A .
H14A H 0.8769 0.0402 0.7731 0.065 Uiso 1 1 calc R . .
H14B H 0.8132 -0.0072 0.7852 0.065 Uiso 1 1 calc R . .
C15 C 0.7387(8) -0.0062(4) 0.7375(3) 0.038(3) Uani 1 1 d . . .
C16 C 0.7797(10) 0.0088(4) 0.7112(3) 0.056(3) Uani 1 1 d . A .
H16 H 0.8537 0.0320 0.7155 0.067 Uiso 1 1 calc R . .
C17 C 0.7155(11) -0.0091(5) 0.6779(3) 0.066(3) Uani 1 1 d . . .
H17 H 0.7472 0.0001 0.6597 0.080 Uiso 1 1 calc R A .
C18 C 0.6047(9) -0.0405(4) 0.6727(3) 0.053(3) Uani 1 1 d . A .
H18 H 0.5577 -0.0513 0.6507 0.063 Uiso 1 1 calc R . .
C19 C 0.5609(8) -0.0564(4) 0.6980(3) 0.044(3) Uani 1 1 d . . .
C20 C 0.4313(8) -0.0863(4) 0.6936(3) 0.051(3) Uani 1 1 d . A .
H20A H 0.4005 -0.1021 0.6693 0.076 Uiso 1 1 calc R . .
H20B H 0.4360 -0.1157 0.7046 0.076 Uiso 1 1 calc R . .
C21 C 0.3447(8) -0.0488(4) 0.7090(3) 0.042(3) Uani 1 1 d . . .
C22 C 0.3307(8) -0.0017(4) 0.7004(3) 0.036(2) Uani 1 1 d . A .
H22 H 0.3758 0.0058 0.6839 0.044 Uiso 1 1 calc R . .
C23 C 0.2537(8) 0.0355(4) 0.7146(3) 0.036(2) Uani 1 1 d . . .
C24 C 0.1937(8) 0.0248(4) 0.7404(3) 0.036(2) Uani 1 1 d . A .
H24 H 0.1429 0.0500 0.7513 0.043 Uiso 1 1 calc R . .
C25 C 0.3235(8) 0.0216(4) 0.8267(3) 0.040(3) Uani 1 1 d . A .
C26 C 0.6689(8) 0.0525(4) 0.8201(3) 0.039(3) Uani 1 1 d . A .
C27 C 0.6286(8) -0.0415(4) 0.7297(3) 0.040(2) Uani 1 1 d . A .
C28 C 0.2775(8) -0.0579(3) 0.7341(3) 0.038(3) Uani 1 1 d . A .
C29 C 0.3817(17) -0.0603(7) 0.8314(5) 0.120(7) Uani 1 1 d . . .
H29A H 0.3839 -0.0430 0.8558 0.180 Uiso 1 1 calc R . .
H29B H 0.3001 -0.0812 0.8229 0.180 Uiso 1 1 calc R . .
C30 C 0.462(2) -0.0927(11) 0.8284(11) 0.43(4) Uani 1 1 d D . .
C31 C 0.448(3) -0.1304(10) 0.8518(10) 0.38(3) Uani 1 1 d D . .
C32 C 0.8019(10) 0.0309(4) 0.8618(3) 0.052(3) Uani 1 1 d . . .
H32A H 0.7747 0.0598 0.8794 0.078 Uiso 1 1 calc R . .
H32B H 0.8743 0.0461 0.8542 0.078 Uiso 1 1 calc R . .
C33 C 0.8370(11) -0.0136(5) 0.8764(4) 0.068(4) Uani 1 1 d . . .
H33A H 0.8914 0.0015 0.8983 0.102 Uiso 1 1 calc R . .
H33B H 0.7619 -0.0320 0.8808 0.102 Uiso 1 1 calc R . .
C34 C 0.9009(15) -0.0533(7) 0.8536(4) 0.104(6) Uani 1 1 d . . .
H34A H 0.9203 -0.0821 0.8640 0.157 Uiso 1 1 calc R . .
H34B H 0.9772 -0.0356 0.8500 0.157 Uiso 1 1 calc R . .
H34C H 0.8474 -0.0684 0.8319 0.157 Uiso 1 1 calc R . .
C35 C 0.645(2) -0.0993(10) 0.7661(6) 0.147(8) Uiso 1 1 d . . .
C36 C 0.629(2) -0.1509(10) 0.7383(8) 0.182(10) Uiso 1 1 d D . .
C37 C 0.7356(14) -0.1910(6) 0.7397(4) 0.100 Uiso 1 1 d D . .
C38A C 0.1819(17) -0.1474(8) 0.7352(5) 0.040(4) Uiso 0.50 1 d P A 1
C38B C 0.192(2) -0.1453(12) 0.7194(8) 0.071(7) Uiso 0.50 1 d P A 2
C39 C 0.212(2) -0.1895(11) 0.7068(7) 0.165(9) Uiso 1 1 d . . .
C40 C 0.1039(16) -0.2364(6) 0.6933(6) 0.178(11) Uani 1 1 d . A .
H40A H 0.1333 -0.2698 0.6964 0.267 Uiso 1 1 calc R . .
H40B H 0.0763 -0.2409 0.6692 0.267 Uiso 1 1 calc R . .
H40C H 0.0352 -0.2276 0.7059 0.267 Uiso 1 1 calc R . .
C41 C 0.5778(9) 0.1832(4) 0.7802(3) 0.046(3) Uani 1 1 d . A .
H41A H 0.6527 0.1959 0.7726 0.069 Uiso 1 1 calc R . .
H41B H 0.5127 0.1707 0.7603 0.069 Uiso 1 1 calc R . .
C42 C 0.6155(9) 0.2650(4) 0.8318(3) 0.053(3) Uani 1 1 d . . .
H42 H 0.7017 0.2651 0.8377 0.063 Uiso 1 1 calc R . .
C43 C 0.5455(9) 0.2995(4) 0.8472(3) 0.054(3) Uani 1 1 d . . .
H43 H 0.5722 0.3294 0.8663 0.065 Uiso 1 1 calc R . .
C44 C 0.4214(8) 0.2406(4) 0.8051(3) 0.038(3) Uani 1 1 d . . .
C45 C 0.3203(9) 0.3123(4) 0.8402(3) 0.047(3) Uani 1 1 d . . .
H45A H 0.3467 0.3434 0.8598 0.070 Uiso 1 1 calc R . .
H45B H 0.2606 0.2878 0.8459 0.070 Uiso 1 1 calc R . .
H45C H 0.2820 0.3243 0.8212 0.070 Uiso 1 1 calc R . .
C46 C 0.2451(8) 0.0854(4) 0.7037(3) 0.039(3) Uani 1 1 d . A .
H46A H 0.3164 0.1115 0.7160 0.058 Uiso 1 1 calc R . .
H46B H 0.2507 0.0769 0.6793 0.058 Uiso 1 1 calc R . .
C47 C 0.0203(9) 0.0910(4) 0.6898(3) 0.041(3) Uani 1 1 d . . .
H47 H 0.0036 0.0608 0.6705 0.050 Uiso 1 1 calc R . .
C48 C -0.0608(8) 0.1235(4) 0.7036(3) 0.039(3) Uani 1 1 d . . .
H48 H -0.1466 0.1203 0.6957 0.047 Uiso 1 1 calc R . .
C49 C 0.1228(8) 0.1538(4) 0.7346(3) 0.035(2) Uani 1 1 d . . .
C50 C -0.0529(8) 0.2034(4) 0.7527(3) 0.047(3) Uani 1 1 d . . .
H50A H -0.1412 0.2006 0.7446 0.071 Uiso 1 1 calc R . .
H50B H -0.0144 0.2385 0.7530 0.071 Uiso 1 1 calc R . .
H50C H -0.0404 0.1992 0.7757 0.071 Uiso 1 1 calc R . .
Ag2 Ag 0.24441(6) 0.30742(3) 0.73079(2) 0.0387(2) Uani 1 1 d . . .
O5 O 0.1203(5) 0.5248(3) 0.67953(18) 0.0454(18) Uani 1 1 d . . .
O6 O 0.2193(6) 0.6085(3) 0.75226(19) 0.051(2) Uani 1 1 d . . .
O7 O -0.0760(6) 0.5583(3) 0.73956(17) 0.0490(19) Uani 1 1 d . . .
O8 O -0.2064(6) 0.4900(3) 0.66345(18) 0.0447(19) Uani 1 1 d . . .
N5 N -0.0249(7) 0.2791(3) 0.6969(2) 0.041(2) Uani 1 1 d . . .
N6 N 0.0842(6) 0.2220(3) 0.6705(2) 0.035(2) Uani 1 1 d . . .
N7 N 0.3782(7) 0.3974(3) 0.7914(2) 0.035(2) Uani 1 1 d . . .
N8 N 0.5080(7) 0.3467(3) 0.7704(2) 0.041(2) Uani 1 1 d . . .
C51 C -0.2313(9) 0.5132(4) 0.7610(3) 0.044(3) Uani 1 1 d . . .
C52 C -0.2919(9) 0.4857(4) 0.7251(3) 0.045(3) Uani 1 1 d . . .
H52A H -0.3061 0.5129 0.7126 0.068 Uiso 1 1 calc R . .
H52B H -0.3727 0.4670 0.7253 0.068 Uiso 1 1 calc R . .
C53 C -0.2103(8) 0.4452(4) 0.7071(3) 0.036(3) Uani 1 1 d . . .
C54 C -0.1744(7) 0.4050(4) 0.7203(3) 0.036(3) Uani 1 1 d . . .
H54 H -0.2032 0.4015 0.7403 0.044 Uiso 1 1 calc R . .
C55 C -0.0969(8) 0.3694(4) 0.7054(3) 0.041(3) Uani 1 1 d . . .
C56 C -0.0482(8) 0.3772(4) 0.6781(3) 0.039(3) Uani 1 1 d . . .
H56 H 0.0081 0.3537 0.6684 0.047 Uiso 1 1 calc R . .
C57 C -0.0793(8) 0.4188(4) 0.6641(3) 0.036(3) Uani 1 1 d . . .
C58 C -0.0169(9) 0.4311(4) 0.6359(3) 0.046(3) Uani 1 1 d . . .
H58A H -0.0434 0.4023 0.6146 0.069 Uiso 1 1 calc R . .
H58B H -0.0411 0.4653 0.6321 0.069 Uiso 1 1 calc R . .
C59 C 0.1212(9) 0.4351(4) 0.6454(3) 0.041(3) Uani 1 1 d . . .
C60 C 0.1906(11) 0.3936(5) 0.6347(3) 0.058(3) Uani 1 1 d . . .
H60 H 0.1517 0.3617 0.6186 0.070 Uiso 1 1 calc R . .
C61 C 0.3125(11) 0.3963(5) 0.6461(4) 0.067(4) Uani 1 1 d . . .
H61 H 0.3594 0.3685 0.6364 0.080 Uiso 1 1 calc R . .
C62 C 0.3686(10) 0.4405(5) 0.6724(3) 0.058(3) Uani 1 1 d . . .
H62 H 0.4519 0.4408 0.6819 0.070 Uiso 1 1 calc R . .
C63 C 0.3048(9) 0.4837(4) 0.6848(3) 0.041(3) Uani 1 1 d . . .
C64 C 0.3602(8) 0.5287(4) 0.7153(3) 0.046(3) Uani 1 1 d . . .
H64A H 0.3458 0.5636 0.7110 0.069 Uiso 1 1 calc R . .
H64B H 0.4502 0.5272 0.7199 0.069 Uiso 1 1 calc R . .
C65 C 0.3014(8) 0.5234(4) 0.7461(3) 0.041(3) Uani 1 1 d . . .
C66 C 0.3135(8) 0.4780(4) 0.7575(3) 0.037(3) Uani 1 1 d . . .
H66 H 0.3634 0.4518 0.7473 0.044 Uiso 1 1 calc R . .
C67 C 0.2534(7) 0.4705(4) 0.7838(2) 0.030(2) Uani 1 1 d . . .
C68 C 0.1770(9) 0.5078(4) 0.7975(3) 0.045(3) Uani 1 1 d . . .
H68 H 0.1323 0.5017 0.8145 0.054 Uiso 1 1 calc R . .
C69 C 0.1640(9) 0.5532(4) 0.7874(3) 0.041(3) Uani 1 1 d . . .
C70 C 0.0770(9) 0.5923(4) 0.8024(3) 0.054(3) Uani 1 1 d . . .
H70A H 0.0736 0.6211 0.7909 0.080 Uiso 1 1 calc R . .
H70B H 0.1082 0.6090 0.8267 0.080 Uiso 1 1 calc R . .
C71 C -0.0511(9) 0.5644(4) 0.7987(3) 0.046(3) Uani 1 1 d . . .
C72 C -0.0996(11) 0.5526(5) 0.8252(3) 0.058(3) Uani 1 1 d . . .
H72 H -0.0542 0.5653 0.8474 0.070 Uiso 1 1 calc R . .
C73 C -0.2107(11) 0.5232(5) 0.8206(3) 0.061(3) Uani 1 1 d . . .
H73 H -0.2431 0.5167 0.8394 0.073 Uiso 1 1 calc R . .
C74 C -0.2754(10) 0.5033(4) 0.7887(3) 0.053(3) Uani 1 1 d . . .
H74 H -0.3519 0.4822 0.7855 0.064 Uiso 1 1 calc R . .
C75 C -0.1656(8) 0.4510(4) 0.6780(3) 0.038(3) Uani 1 1 d . . .
C76 C 0.1836(8) 0.4824(4) 0.6700(2) 0.035(2) Uani 1 1 d . . .
C77 C 0.2279(9) 0.5623(4) 0.7619(3) 0.044(3) Uani 1 1 d . . .
C78 C -0.1204(9) 0.5464(4) 0.7660(3) 0.040(2) Uani 1 1 d . . .
C79 C -0.3049(10) 0.4679(5) 0.6352(3) 0.054(3) Uani 1 1 d . . .
H79A H -0.3740 0.4503 0.6428 0.081 Uiso 1 1 calc R . .
H79B H -0.2747 0.4407 0.6173 0.081 Uiso 1 1 calc R . .
C80 C -0.3479(11) 0.5129(5) 0.6216(4) 0.067(4) Uani 1 1 d . . .
H80A H -0.2759 0.5332 0.6172 0.101 Uiso 1 1 calc R . .
H80B H -0.4031 0.4975 0.5999 0.101 Uiso 1 1 calc R . .
C81 C -0.4146(13) 0.5503(6) 0.6454(4) 0.079(4) Uani 1 1 d . . .
H81A H -0.4399 0.5790 0.6355 0.119 Uiso 1 1 calc R . .
H81B H -0.3601 0.5660 0.6669 0.119 Uiso 1 1 calc R . .
H81C H -0.4875 0.5306 0.6493 0.119 Uiso 1 1 calc R . .
C82 C 0.1583(11) 0.5694(5) 0.6644(3) 0.070(4) Uani 1 1 d . . .
H82A H 0.1403 0.6041 0.6789 0.105 Uiso 1 1 calc R . .
H82B H 0.2481 0.5713 0.6641 0.105 Uiso 1 1 calc R . .
C83 C 0.0954(11) 0.5612(5) 0.6308(3) 0.077(4) Uani 1 1 d . . .
H83A H 0.0061 0.5630 0.6312 0.116 Uiso 1 1 calc R . .
H83B H 0.1077 0.5255 0.6166 0.116 Uiso 1 1 calc R . .
C84 C 0.1476(14) 0.6057(7) 0.6162(4) 0.112(6) Uani 1 1 d . . .
H84A H 0.1046 0.6009 0.5932 0.169 Uiso 1 1 calc R . .
H84B H 0.2357 0.6033 0.6155 0.169 Uiso 1 1 calc R . .
H84C H 0.1355 0.6410 0.6305 0.169 Uiso 1 1 calc R . .
C85 C 0.3101(12) 0.6504(4) 0.7712(4) 0.079(5) Uani 1 1 d . . .
H85A H 0.3924 0.6410 0.7660 0.119 Uiso 1 1 calc R . .
H85B H 0.3098 0.6553 0.7956 0.119 Uiso 1 1 calc R . .
C86 C 0.2851(13) 0.7006(5) 0.7628(4) 0.095(5) Uani 1 1 d . . .
H86A H 0.2052 0.7111 0.7694 0.142 Uiso 1 1 calc R . .
H86B H 0.2789 0.6947 0.7380 0.142 Uiso 1 1 calc R . .
C87 C 0.384(2) 0.7448(8) 0.7803(8) 0.221(15) Uani 1 1 d . . .
H87A H 0.3632 0.7778 0.7745 0.331 Uiso 1 1 calc R . .
H87B H 0.4622 0.7352 0.7730 0.331 Uiso 1 1 calc R . .
H87C H 0.3902 0.7507 0.8048 0.331 Uiso 1 1 calc R . .
C88 C -0.1307(14) 0.6018(7) 0.7311(5) 0.115(7) Uani 1 1 d . . .
H88A H -0.2088 0.5863 0.7159 0.173 Uiso 1 1 calc R . .
H88B H -0.1535 0.6243 0.7523 0.173 Uiso 1 1 calc R . .
C89 C -0.0835(18) 0.6307(12) 0.7189(13) 0.39(3) Uani 1 1 d . . .
H89A H -0.0549 0.6081 0.6986 0.579 Uiso 1 1 calc R . .
H89B H -0.0086 0.6483 0.7349 0.579 Uiso 1 1 calc R . .
C90 C -0.1463(18) 0.6758(7) 0.7075(7) 0.167(10) Uani 1 1 d . . .
H90A H -0.1048 0.6851 0.6900 0.251 Uiso 1 1 calc R . .
H90B H -0.1412 0.7074 0.7269 0.251 Uiso 1 1 calc R . .
H90C H -0.2329 0.6634 0.6983 0.251 Uiso 1 1 calc R . .
C91 C -0.0623(9) 0.3249(4) 0.7208(3) 0.047(3) Uani 1 1 d . . .
H91A H 0.0060 0.3393 0.7398 0.070 Uiso 1 1 calc R . .
H91B H -0.1335 0.3127 0.7301 0.070 Uiso 1 1 calc R . .
C92 C -0.1021(9) 0.2428(4) 0.6708(3) 0.044(3) Uani 1 1 d . . .
H92 H -0.1885 0.2430 0.6655 0.053 Uiso 1 1 calc R . .
C93 C -0.0331(9) 0.2073(4) 0.6544(3) 0.047(3) Uani 1 1 d . . .
H93 H -0.0608 0.1776 0.6353 0.056 Uiso 1 1 calc R . .
C94 C 0.0930(8) 0.2664(4) 0.6969(3) 0.036(2) Uani 1 1 d . . .
C95 C 0.1891(9) 0.1940(4) 0.6600(3) 0.045(3) Uani 1 1 d . . .
H95A H 0.1605 0.1627 0.6407 0.068 Uiso 1 1 calc R . .
H95B H 0.2304 0.1823 0.6788 0.068 Uiso 1 1 calc R . .
H95C H 0.2469 0.2183 0.6535 0.068 Uiso 1 1 calc R . .
C96 C 0.2637(8) 0.4217(4) 0.7967(3) 0.044(3) Uani 1 1 d . . .
H96A H 0.2587 0.4320 0.8212 0.066 Uiso 1 1 calc R . .
H96B H 0.1931 0.3947 0.7852 0.066 Uiso 1 1 calc R . .
C97 C 0.4914(9) 0.4174(4) 0.8110(3) 0.044(3) Uani 1 1 d . . .
H97 H 0.5075 0.4480 0.8300 0.053 Uiso 1 1 calc R . .
C98 C 0.5730(9) 0.3858(4) 0.7981(3) 0.047(3) Uani 1 1 d . . .
H98 H 0.6586 0.3892 0.8062 0.056 Uiso 1 1 calc R . .
C99 C 0.3881(8) 0.3532(4) 0.7661(3) 0.039(3) Uani 1 1 d . . .
C100 C 0.5658(9) 0.3050(4) 0.7485(3) 0.053(3) Uani 1 1 d . . .
H10A H 0.6541 0.3085 0.7569 0.079 Uiso 1 1 calc R . .
H10B H 0.5537 0.3088 0.7255 0.079 Uiso 1 1 calc R . .
H10C H 0.5286 0.2697 0.7484 0.079 Uiso 1 1 calc R . .
Ag3 Ag 0.03079(7) 0.45031(3) 0.02475(2) 0.0440(2) Uani 1 1 d . . .
O9 O -0.1700(6) 0.1753(3) 0.0136(2) 0.065(2) Uani 1 1 d . . .
O10 O 0.0519(6) 0.1591(2) -0.0302(2) 0.0500(19) Uani 1 1 d . . .
O11 O 0.1149(6) 0.2301(2) 0.0509(2) 0.0525(19) Uani 1 1 d . . .
O12 O -0.1083(7) 0.2222(3) 0.0977(2) 0.061(2) Uani 1 1 d . . .
N9 N 0.0370(8) 0.3923(3) -0.0509(2) 0.045(2) Uani 1 1 d . . .
N10 N 0.1958(8) 0.4473(4) -0.0312(3) 0.053(3) Uani 1 1 d . . .
N11 N -0.1402(7) 0.4579(3) 0.0796(2) 0.037(2) Uani 1 1 d . . .
N12 N 0.0199(7) 0.5132(3) 0.0991(2) 0.039(2) Uani 1 1 d . . .
C101 C -0.0457(8) 0.3113(4) 0.0951(3) 0.041(3) Uani 1 1 d . . .
C102 C -0.0743(9) 0.3570(4) 0.0855(3) 0.042(3) Uani 1 1 d . . .
H102 H -0.0143 0.3871 0.0905 0.051 Uiso 1 1 calc R . .
C103 C -0.1880(8) 0.3585(4) 0.0690(3) 0.037(3) Uani 1 1 d . . .
C104 C -0.2731(8) 0.3149(4) 0.0610(3) 0.044(3) Uani 1 1 d . . .
H104 H -0.3520 0.3166 0.0492 0.052 Uiso 1 1 calc R . .
C105 C -0.2488(8) 0.2686(4) 0.0694(3) 0.045(3) Uani 1 1 d . . .
C106 C -0.3423(9) 0.2181(4) 0.0574(4) 0.066(4) Uani 1 1 d . . .
H10D H -0.3079 0.1886 0.0653 0.099 Uiso 1 1 calc R . .
H10E H -0.4189 0.2257 0.0670 0.099 Uiso 1 1 calc R . .
C107 C -0.3706(9) 0.2015(4) 0.0185(3) 0.058(3) Uani 1 1 d . . .
C108 C -0.4859(10) 0.2072(4) 0.0028(4) 0.078(4) Uani 1 1 d . . .
H108 H -0.5503 0.2169 0.0156 0.093 Uiso 1 1 calc R . .
C109 C -0.5058(10) 0.1985(5) -0.0321(4) 0.095(6) Uani 1 1 d . . .
H109 H -0.5850 0.2025 -0.0427 0.114 Uiso 1 1 calc R . .
C110 C -0.4121(10) 0.1838(5) -0.0528(4) 0.085(5) Uani 1 1 d . . .
H110 H -0.4278 0.1797 -0.0765 0.102 Uiso 1 1 calc R . .
C111 C -0.2995(9) 0.1759(4) -0.0377(4) 0.066(4) Uani 1 1 d . . .
C112 C -0.1967(10) 0.1631(4) -0.0573(3) 0.062(3) Uani 1 1 d . . .
H11A H -0.2290 0.1526 -0.0818 0.094 Uiso 1 1 calc R . .
H11B H -0.1583 0.1325 -0.0519 0.094 Uiso 1 1 calc R . .
C113 C -0.1009(8) 0.2110(4) -0.0491(3) 0.050(3) Uani 1 1 d . . .
C114 C -0.1278(8) 0.2594(4) -0.0548(3) 0.049(3) Uani 1 1 d . . .
H114 H -0.2071 0.2621 -0.0659 0.059 Uiso 1 1 calc R . .
C115 C -0.0404(9) 0.3042(4) -0.0444(3) 0.048(3) Uani 1 1 d . . .
C116 C 0.0706(8) 0.3013(4) -0.0280(2) 0.038(2) Uani 1 1 d . . .
H116 H 0.1275 0.3327 -0.0202 0.045 Uiso 1 1 calc R . .
C117 C 0.1055(7) 0.2531(4) -0.0220(2) 0.036(2) Uani 1 1 d . . .
C118 C 0.2300(8) 0.2516(4) -0.0020(3) 0.042(2) Uani 1 1 d . . .
H11C H 0.2378 0.2150 0.0004 0.063 Uiso 1 1 calc R . .
H11D H 0.2961 0.2607 -0.0142 0.063 Uiso 1 1 calc R . .
C119 C 0.2435(8) 0.2909(4) 0.0323(3) 0.045(3) Uani 1 1 d . . .
C120 C 0.3082(9) 0.3410(4) 0.0394(3) 0.055(3) Uani 1 1 d . . .
H120 H 0.3527 0.3498 0.0232 0.066 Uiso 1 1 calc R . .
C121 C 0.3084(10) 0.3785(5) 0.0702(3) 0.065(4) Uani 1 1 d . . .
H121 H 0.3555 0.4123 0.0751 0.078 Uiso 1 1 calc R . .
C122 C 0.2403(9) 0.3672(4) 0.0939(3) 0.051(3) Uani 1 1 d . . .
H122 H 0.2392 0.3937 0.1146 0.061 Uiso 1 1 calc R . .
C123 C 0.0843(10) 0.3085(4) 0.1110(3) 0.054(3) Uani 1 1 d . . .
H12A H 0.0916 0.2728 0.1149 0.080 Uiso 1 1 calc R . .
H12B H 0.1041 0.3359 0.1331 0.080 Uiso 1 1 calc R . .
C124 C 0.1751(8) 0.3182(4) 0.0877(3) 0.047(3) Uani 1 1 d . . .
C125 C -0.1370(9) 0.2679(4) 0.0872(3) 0.050(3) Uani 1 1 d . . .
C126 C -0.2830(8) 0.1828(4) -0.0030(4) 0.059(4) Uani 1 1 d . . .
C127 C 0.0169(9) 0.2075(4) -0.0342(3) 0.050(3) Uani 1 1 d . . .
C128 C 0.1795(8) 0.2795(4) 0.0581(3) 0.040(2) Uani 1 1 d . . .
C129 C -0.1275(15) 0.2276(6) 0.1321(4) 0.091(5) Uani 1 1 d . . .
H12C H -0.2156 0.2298 0.1341 0.137 Uiso 1 1 calc R . .
H12D H -0.0796 0.2604 0.1475 0.137 Uiso 1 1 calc R . .
C130 C -0.085(2) 0.1787(8) 0.1409(5) 0.155(10) Uani 1 1 d . . .
H13A H -0.0043 0.1716 0.1333 0.233 Uiso 1 1 calc R . .
H13B H -0.1447 0.1471 0.1293 0.233 Uiso 1 1 calc R . .
C131 C -0.072(3) 0.1887(10) 0.1807(10) 0.254(19) Uani 1 1 d . . .
H13C H -0.0468 0.1566 0.1867 0.381 Uiso 1 1 calc R . .
H13D H -0.1515 0.1966 0.1881 0.381 Uiso 1 1 calc R . .
H13E H -0.0101 0.2191 0.1920 0.381 Uiso 1 1 calc R . .
C132 C -0.1663(12) 0.1254(5) 0.0225(4) 0.085(4) Uani 1 1 d . . .
H13F H -0.0965 0.1300 0.0409 0.127 Uiso 1 1 calc R . .
H13G H -0.2425 0.1191 0.0317 0.127 Uiso 1 1 calc R . .
C133 C -0.1547(15) 0.0788(5) -0.0031(5) 0.122(7) Uani 1 1 d D . .
H13H H -0.0810 0.0839 -0.0137 0.183 Uiso 1 1 calc R . .
H13I H -0.2281 0.0702 -0.0208 0.183 Uiso 1 1 calc R . .
C134 C -0.1423(18) 0.0321(7) 0.0146(7) 0.211(15) Uani 1 1 d D . .
H13J H -0.1355 -0.0015 -0.0024 0.316 Uiso 1 1 calc R . .
H13K H -0.2150 0.0280 0.0253 0.316 Uiso 1 1 calc R . .
H13L H -0.0685 0.0408 0.0317 0.316 Uiso 1 1 calc R . .
C135 C 0.1051(11) 0.1289(4) -0.0578(4) 0.073(4) Uani 1 1 d . . .
H13M H 0.1745 0.1509 -0.0622 0.109 Uiso 1 1 calc R . .
H13N H 0.0430 0.1177 -0.0785 0.109 Uiso 1 1 calc R . .
C136 C 0.1500(16) 0.0803(5) -0.0488(5) 0.104(6) Uani 1 1 d . . .
H13O H 0.2056 0.0921 -0.0269 0.156 Uiso 1 1 calc R . .
H13P H 0.0787 0.0576 -0.0460 0.156 Uiso 1 1 calc R . .
C137 C 0.216(2) 0.0482(8) -0.0745(6) 0.170(11) Uani 1 1 d . . .
H13Q H 0.2434 0.0174 -0.0673 0.255 Uiso 1 1 calc R . .
H13R H 0.2870 0.0703 -0.0772 0.255 Uiso 1 1 calc R . .
H13S H 0.1604 0.0354 -0.0961 0.255 Uiso 1 1 calc R . .
C138 C 0.1840(19) 0.1900(7) 0.0552(6) 0.149(9) Uani 1 1 d D . .
C139 C 0.192(3) 0.1695(11) 0.0833(9) 0.36(3) Uani 1 1 d D . .
C140 C 0.244(2) 0.1150(9) 0.0761(7) 0.199(13) Uani 1 1 d D . .
C141 C -0.0736(9) 0.3559(4) -0.0521(3) 0.052(3) Uani 1 1 d . . .
H14C H -0.1232 0.3473 -0.0749 0.077 Uiso 1 1 calc R . .
H14D H -0.1245 0.3744 -0.0355 0.077 Uiso 1 1 calc R . .
C142 C 0.1055(11) 0.3887(5) -0.0764(3) 0.059(3) Uani 1 1 d . . .
H142 H 0.0853 0.3655 -0.0986 0.071 Uiso 1 1 calc R . .
C143 C 0.2041(11) 0.4229(4) -0.0647(3) 0.054(3) Uani 1 1 d . . .
H143 H 0.2682 0.4296 -0.0767 0.065 Uiso 1 1 calc R . .
C144 C 0.0898(9) 0.4281(4) -0.0218(3) 0.041(3) Uani 1 1 d . . .
C145 C 0.2867(11) 0.4880(5) -0.0076(3) 0.068(4) Uani 1 1 d . . .
H14E H 0.3540 0.4961 -0.0194 0.102 Uiso 1 1 calc R . .
H14F H 0.3193 0.4745 0.0113 0.102 Uiso 1 1 calc R . .
H14G H 0.2477 0.5207 0.0009 0.102 Uiso 1 1 calc R . .
C146 C -0.2227(9) 0.4107(4) 0.0590(3) 0.043(3) Uani 1 1 d . . .
H14H H -0.2170 0.4060 0.0348 0.064 Uiso 1 1 calc R . .
H14I H -0.3087 0.4164 0.0622 0.064 Uiso 1 1 calc R . .
C147 C -0.1528(9) 0.4859(4) 0.1127(3) 0.040(3) Uani 1 1 d . . .
H147 H -0.2194 0.4810 0.1243 0.048 Uiso 1 1 calc R . .
C148 C -0.0524(9) 0.5209(4) 0.1245(3) 0.040(3) Uani 1 1 d . . .
H148 H -0.0342 0.5462 0.1461 0.048 Uiso 1 1 calc R . .
C149 C -0.0338(9) 0.4743(4) 0.0712(3) 0.040(3) Uani 1 1 d . . .
C150 C 0.1430(9) 0.5413(4) 0.1021(3) 0.055(3) Uani 1 1 d . . .
H15A H 0.1634 0.5675 0.1244 0.082 Uiso 1 1 calc R . .
H15B H 0.1436 0.5599 0.0844 0.082 Uiso 1 1 calc R . .
H15C H 0.2040 0.5153 0.0996 0.082 Uiso 1 1 calc R . .
Ag4 Ag 0.46791(7) 0.04823(3) 0.47544(2) 0.0437(2) Uani 1 1 d . . .
O13 O 0.3438(6) 0.2587(3) 0.44081(19) 0.0493(18) Uani 1 1 d . . .
O14 O 0.4109(6) 0.3399(2) 0.52218(18) 0.0473(18) Uani 1 1 d . . .
O15 O 0.5683(6) 0.2651(3) 0.39536(18) 0.0491(18) Uani 1 1 d . . .
O16 O 0.6346(6) 0.3226(3) 0.4779(2) 0.0505(19) Uani 1 1 d . . .
N13 N 0.6409(7) 0.0387(3) 0.4211(2) 0.041(2) Uani 1 1 d . . .
N14 N 0.4838(7) -0.0192(3) 0.4028(2) 0.043(2) Uani 1 1 d . . .
N15 N 0.4563(7) 0.1120(3) 0.5489(2) 0.042(2) Uani 1 1 d . . .
N16 N 0.2987(7) 0.0542(3) 0.5302(2) 0.044(2) Uani 1 1 d . . .
C151 C 0.3668(8) 0.2462(4) 0.5174(3) 0.039(2) Uani 1 1 d . . .
C152 C 0.2415(8) 0.2444(4) 0.4982(3) 0.048(3) Uani 1 1 d . . .
H15D H 0.2297 0.2796 0.4941 0.073 Uiso 1 1 calc R . .
H15E H 0.1781 0.2363 0.5115 0.073 Uiso 1 1 calc R . .
C153 C 0.2283(8) 0.2008(4) 0.4644(3) 0.040(2) Uani 1 1 d . . .
C154 C 0.1684(9) 0.1504(4) 0.4608(3) 0.051(3) Uani 1 1 d . . .
H154 H 0.1230 0.1446 0.4777 0.061 Uiso 1 1 calc R . .
C155 C 0.1754(10) 0.1088(4) 0.4326(3) 0.055(3) Uani 1 1 d . . .
H155 H 0.1328 0.0746 0.4298 0.066 Uiso 1 1 calc R . .
C156 C 0.2434(9) 0.1167(4) 0.4086(3) 0.052(3) Uani 1 1 d . . .
H156 H 0.2510 0.0873 0.3899 0.062 Uiso 1 1 calc R . .
C157 C 0.3016(8) 0.1671(4) 0.4110(3) 0.038(2) Uani 1 1 d . . .
C158 C 0.3870(8) 0.1756(4) 0.3861(3) 0.045(3) Uani 1 1 d . . .
H15F H 0.3690 0.1457 0.3650 0.067 Uiso 1 1 calc R . .
H15G H 0.3729 0.2094 0.3802 0.067 Uiso 1 1 calc R . .
C159 C 0.5178(8) 0.1780(4) 0.4017(2) 0.038(2) Uani 1 1 d . . .
C160 C 0.5563(8) 0.1351(4) 0.4124(2) 0.038(3) Uani 1 1 d . . .
H160 H 0.4990 0.1044 0.4088 0.046 Uiso 1 1 calc R . .
C161 C 0.6775(8) 0.1346(3) 0.4287(3) 0.036(2) Uani 1 1 d . . .
C162 C 0.7565(9) 0.1819(4) 0.4357(3) 0.044(3) Uani 1 1 d . . .
H162 H 0.8369 0.1841 0.4477 0.052 Uiso 1 1 calc R . .
C163 C 0.7187(8) 0.2263(3) 0.4251(3) 0.039(2) Uani 1 1 d . . .
C164 C 0.8073(8) 0.2775(4) 0.4360(3) 0.048(3) Uani 1 1 d . . .
H16A H 0.8844 0.2704 0.4265 0.072 Uiso 1 1 calc R . .
H16B H 0.7701 0.3054 0.4270 0.072 Uiso 1 1 calc R . .
C165 C 0.8362(9) 0.2974(4) 0.4732(3) 0.050(3) Uani 1 1 d . . .
C166 C 0.9536(9) 0.2934(4) 0.4896(3) 0.056(3) Uani 1 1 d . . .
H166 H 1.0163 0.2812 0.4767 0.067 Uiso 1 1 calc R . .
C167 C 0.9779(9) 0.3071(4) 0.5244(3) 0.068(4) Uani 1 1 d . . .
H167 H 1.0582 0.3054 0.5353 0.081 Uiso 1 1 calc R . .
C168 C 0.8825(10) 0.3240(4) 0.5443(3) 0.063(3) Uani 1 1 d . . .
H168 H 0.8997 0.3325 0.5683 0.075 Uiso 1 1 calc R . .
C169 C 0.7700(8) 0.3277(4) 0.5293(3) 0.046(3) Uani 1 1 d . . .
C170 C 0.6655(9) 0.3413(4) 0.5495(3) 0.060(3) Uani 1 1 d . . .
H17A H 0.6253 0.3710 0.5434 0.090 Uiso 1 1 calc R . .
H17B H 0.6985 0.3532 0.5739 0.090 Uiso 1 1 calc R . .
C171 C 0.5707(8) 0.2922(4) 0.5423(3) 0.042(2) Uani 1 1 d . . .
C172 C 0.6036(8) 0.2455(4) 0.5486(3) 0.044(3) Uani 1 1 d . . .
H172 H 0.6856 0.2444 0.5585 0.052 Uiso 1 1 calc R . .
C173 C 0.5220(8) 0.2000(4) 0.5409(3) 0.042(3) Uani 1 1 d . . .
C174 C 0.4043(8) 0.2012(4) 0.5245(3) 0.039(2) Uani 1 1 d . . .
H174 H 0.3485 0.1696 0.5180 0.047 Uiso 1 1 calc R . .
C175 C 0.2903(8) 0.2082(4) 0.4379(2) 0.037(2) Uani 1 1 d . . .
C176 C 0.6021(8) 0.2225(3) 0.4074(2) 0.034(2) Uani 1 1 d . . .
C177 C 0.7486(8) 0.3175(4) 0.4932(3) 0.043(3) Uani 1 1 d . . .
C178 C 0.4515(8) 0.2926(4) 0.5276(2) 0.039(2) Uani 1 1 d . . .
C179 C 0.2555(15) 0.2959(7) 0.4328(4) 0.109(5) Uiso 1 1 d D . .
H17C H 0.1758 0.2862 0.4394 0.164 Uiso 1 1 calc R . .
H17D H 0.2861 0.3326 0.4468 0.164 Uiso 1 1 calc R . .
C180 C 0.234(3) 0.2964(12) 0.3977(7) 0.33(3) Uani 1 1 d D . .
H18A H 0.1833 0.2634 0.3834 0.489 Uiso 1 1 calc R . .
H18B H 0.3122 0.3001 0.3889 0.489 Uiso 1 1 calc R . .
C181 C 0.162(2) 0.3479(9) 0.3996(5) 0.186(12) Uani 1 1 d D . .
H18C H 0.1506 0.3548 0.3773 0.279 Uiso 1 1 calc R . .
H18D H 0.2092 0.3789 0.4163 0.279 Uiso 1 1 calc R . .
H18E H 0.0812 0.3416 0.4062 0.279 Uiso 1 1 calc R . .
C182 C 0.5866(11) 0.2600(5) 0.3612(3) 0.059(3) Uani 1 1 d . . .
H18F H 0.5456 0.2253 0.3464 0.089 Uiso 1 1 calc R . .
H18G H 0.6756 0.2612 0.3597 0.089 Uiso 1 1 calc R . .
C183 C 0.5329(12) 0.3057(5) 0.3501(3) 0.070(4) Uani 1 1 d . . .
H18H H 0.4431 0.3024 0.3505 0.105 Uiso 1 1 calc R . .
H18I H 0.5686 0.3399 0.3667 0.105 Uiso 1 1 calc R . .
C184 C 0.5550(13) 0.3079(6) 0.3155(3) 0.086(5) Uani 1 1 d . . .
H18J H 0.5183 0.3386 0.3103 0.129 Uiso 1 1 calc R . .
H18K H 0.5174 0.2748 0.2987 0.129 Uiso 1 1 calc R . .
H18L H 0.6437 0.3119 0.3150 0.129 Uiso 1 1 calc R . .
C185 C 0.6235(15) 0.3732(6) 0.4720(6) 0.141(9) Uani 1 1 d . . .
H18M H 0.6347 0.3989 0.4948 0.211 Uiso 1 1 calc R . .
H18N H 0.6977 0.3805 0.4622 0.211 Uiso 1 1 calc R . .
C186 C 0.548(4) 0.3871(12) 0.4572(10) 0.33(2) Uani 1 1 d . . .
H18O H 0.4725 0.3757 0.4652 0.499 Uiso 1 1 calc R . .
H18P H 0.5438 0.3642 0.4338 0.499 Uiso 1 1 calc R . .
C187 C 0.5290(18) 0.4421(8) 0.4534(6) 0.140(7) Uiso 1 1 d . . .
H18Q H 0.4504 0.4405 0.4389 0.210 Uiso 1 1 calc R . .
H18R H 0.5962 0.4545 0.4431 0.210 Uiso 1 1 calc R . .
H18S H 0.5281 0.4670 0.4757 0.210 Uiso 1 1 calc R . .
C188 C 0.3578(10) 0.3710(4) 0.5497(3) 0.053(3) Uani 1 1 d . . .
H18T H 0.4212 0.3849 0.5699 0.080 Uiso 1 1 calc R . .
H18U H 0.2919 0.3487 0.5553 0.080 Uiso 1 1 calc R . .
C189 C 0.3055(14) 0.4169(5) 0.5383(4) 0.084(4) Uani 1 1 d . . .
H18V H 0.3724 0.4387 0.5327 0.125 Uiso 1 1 calc R . .
H18W H 0.2442 0.4023 0.5177 0.125 Uiso 1 1 calc R . .
C190 C 0.2453(14) 0.4519(5) 0.5655(4) 0.095(5) Uani 1 1 d . . .
H19A H 0.2112 0.4808 0.5574 0.142 Uiso 1 1 calc R . .
H19B H 0.3064 0.4673 0.5857 0.142 Uiso 1 1 calc R . .
H19C H 0.1789 0.4303 0.5710 0.142 Uiso 1 1 calc R . .
C191 C 0.7153(9) 0.0889(4) 0.4398(3) 0.043(3) Uani 1 1 d . . .
H19D H 0.7093 0.0957 0.4642 0.065 Uiso 1 1 calc R . .
H19E H 0.8025 0.0852 0.4372 0.065 Uiso 1 1 calc R . .
C192 C 0.6558(10) 0.0093(4) 0.3888(3) 0.046(3) Uani 1 1 d . . .
H192 H 0.7216 0.0144 0.3769 0.055 Uiso 1 1 calc R . .
C193 C 0.5573(10) -0.0279(4) 0.3779(3) 0.051(3) Uani 1 1 d . . .
H193 H 0.5417 -0.0550 0.3570 0.061 Uiso 1 1 calc R . .
C194 C 0.5346(8) 0.0214(4) 0.4302(3) 0.037(3) Uani 1 1 d . . .
C195 C 0.3659(9) -0.0496(4) 0.3995(3) 0.054(3) Uani 1 1 d . . .
H19F H 0.3497 -0.0768 0.3776 0.081 Uiso 1 1 calc R . .
H19G H 0.3010 -0.0254 0.4011 0.081 Uiso 1 1 calc R . .
H19H H 0.3671 -0.0672 0.4177 0.081 Uiso 1 1 calc R . .
C196 C 0.5608(9) 0.1502(4) 0.5494(3) 0.051(3) Uani 1 1 d . . .
H19I H 0.6133 0.1325 0.5330 0.076 Uiso 1 1 calc R . .
H19J H 0.6108 0.1605 0.5722 0.076 Uiso 1 1 calc R . .
C197 C 0.3851(10) 0.1185(4) 0.5753(3) 0.053(3) Uani 1 1 d . . .
H197 H 0.4020 0.1435 0.5971 0.064 Uiso 1 1 calc R . .
C198 C 0.2870(10) 0.0808(5) 0.5627(3) 0.053(3) Uani 1 1 d . . .
H198 H 0.2215 0.0742 0.5743 0.064 Uiso 1 1 calc R . .
C199 C 0.4032(9) 0.0737(4) 0.5214(3) 0.039(3) Uani 1 1 d . . .
C200 C 0.2122(10) 0.0115(5) 0.5078(3) 0.060(4) Uani 1 1 d . . .
H20C H 0.2419 -0.0011 0.4861 0.090 Uiso 1 1 calc R . .
H20D H 0.1319 0.0248 0.5042 0.090 Uiso 1 1 calc R . .
H20E H 0.2040 -0.0182 0.5180 0.090 Uiso 1 1 calc R . .
B1 B -0.0778(12) 0.3384(5) 0.8167(4) 0.055(4) Uani 1 1 d . . .
F1 F -0.1140(7) 0.3838(3) 0.8119(2) 0.090(3) Uani 1 1 d . . .
F2 F -0.1562(6) 0.2958(3) 0.79515(19) 0.072(2) Uani 1 1 d . . .
F3 F 0.0378(6) 0.3306(3) 0.8091(2) 0.096(3) Uani 1 1 d . . .
F4 F -0.0846(9) 0.3372(3) 0.8494(2) 0.100(3) Uani 1 1 d . . .
B2 B 0.5826(12) 0.1687(5) 0.6844(4) 0.058(4) Uani 1 1 d . . .
F5 F 0.4708(6) 0.1758(4) 0.6935(3) 0.114(4) Uani 1 1 d . . .
F6 F 0.6216(9) 0.1222(3) 0.6874(3) 0.116(4) Uani 1 1 d . . .
F7 F 0.5825(10) 0.1686(4) 0.6510(2) 0.119(4) Uani 1 1 d . . .
F8 F 0.6611(6) 0.2103(3) 0.7038(2) 0.078(2) Uani 1 1 d . . .
B3 B 0.4902(14) 0.5309(6) 0.0953(4) 0.063(4) Uani 1 1 d . . .
F9 F 0.4229(11) 0.5697(6) 0.0900(4) 0.200(8) Uani 1 1 d . . .
F10 F 0.4267(6) 0.5041(3) 0.11329(18) 0.074(2) Uani 1 1 d . . .
F11 F 0.5141(10) 0.4991(5) 0.0658(3) 0.147(5) Uani 1 1 d . . .
F12 F 0.5994(7) 0.5576(4) 0.1138(2) 0.126(4) Uani 1 1 d . . .
B4 B 0.0073(12) -0.0381(7) 0.4043(4) 0.064(4) Uani 1 1 d . . .
F13 F -0.0150(11) -0.0081(4) 0.4322(2) 0.153(6) Uani 1 1 d . . .
F14 F 0.0724(6) -0.0120(3) 0.38495(18) 0.072(2) Uani 1 1 d . . .
F15 F -0.0899(8) -0.0684(4) 0.3863(2) 0.144(5) Uani 1 1 d . . .
F16 F 0.0856(11) -0.0766(7) 0.4097(5) 0.229(9) Uani 1 1 d . . .
Cl1 Cl 0.3955(3) 0.26291(13) 0.61114(9) 0.0718(10) Uani 1 1 d . . .
Cl2 Cl 0.6042(4) 0.32726(17) 0.65547(17) 0.143(2) Uani 1 1 d . . .
C201 C 0.4712(15) 0.2827(6) 0.6535(4) 0.110(7) Uani 1 1 d . . .
Cl3 Cl 0.1156(3) 0.24127(14) 0.88844(9) 0.0772(11) Uani 1 1 d D . .
Cl4 Cl -0.0942(3) 0.17753(16) 0.84362(13) 0.1087(16) Uani 1 1 d D . .
C202 C 0.0395(15) 0.2239(7) 0.8472(4) 0.119(7) Uani 1 1 d D . .
Cl5 Cl 0.8993(4) 0.1164(2) 0.36899(13) 0.1201(16) Uani 1 1 d . . .
Cl6 Cl 1.0870(4) 0.1202(2) 0.32556(12) 0.1121(15) Uani 1 1 d . . .
C203 C 0.9813(9) 0.0778(4) 0.3388(3) 0.051(3) Uani 1 1 d . . .
Cl7 Cl 0.0943(4) 0.2053(3) 0.57180(14) 0.172(3) Uani 1 1 d D . .
Cl8 Cl -0.1083(6) 0.1585(3) 0.52067(15) 0.208(4) Uani 1 1 d D . .
C204 C -0.0168(18) 0.1523(8) 0.5555(5) 0.165(9) Uiso 1 1 d D . .
Cl9 Cl 0.3929(5) 0.3128(2) 0.93256(16) 0.0585(14) Uiso 0.50 1 d PD . .
Cl10 Cl 0.6148(7) 0.3423(3) 0.9775(2) 0.092(2) Uiso 0.50 1 d PD . .
C213 C 0.498(2) 0.3673(8) 0.9597(8) 0.110(10) Uiso 0.50 1 d PD . .
C205 C 0.9271(11) 0.4939(5) 0.5245(3) 0.069(4) Uani 1 1 d . . .
C206 C 1.0374(11) 0.4551(5) 0.4798(4) 0.072(4) Uani 1 1 d . . .
H206 H 1.0607 0.4238 0.4653 0.087 Uiso 1 1 calc R . .
C207 C 0.9697(11) 0.4501(5) 0.5048(3) 0.065(4) Uani 1 1 d . . .
H207 H 0.9527 0.4159 0.5084 0.078 Uiso 1 1 calc R . .
C208 C 0.8468(13) 0.4889(6) 0.5507(4) 0.096(5) Uani 1 1 d . . .
H20F H 0.7614 0.4928 0.5424 0.145 Uiso 1 1 calc R . .
H20G H 0.8756 0.5170 0.5718 0.145 Uiso 1 1 calc R . .
H20H H 0.8512 0.4537 0.5549 0.145 Uiso 1 1 calc R . .
C209 C 0.5066(12) 0.0483(6) 0.9945(5) 0.086(5) Uani 1 1 d . . .
H209 H 0.5112 0.0829 0.9910 0.104 Uiso 1 1 calc R . .
C210 C 0.5220(13) 0.0051(7) 0.9691(4) 0.092(5) Uani 1 1 d . . .
C211 C 0.4851(12) 0.0427(6) 1.0244(4) 0.083(4) Uani 1 1 d . . .
H211 H 0.4745 0.0737 1.0416 0.099 Uiso 1 1 calc R . .
C212 C 0.555(3) 0.0103(11) 0.9344(7) 0.228(15) Uani 1 1 d . . .
H21A H 0.6367 0.0297 0.9379 0.342 Uiso 1 1 calc R . .
H21B H 0.4938 0.0298 0.9246 0.342 Uiso 1 1 calc R . .
H21C H 0.5540 -0.0256 0.9190 0.342 Uiso 1 1 calc R . .
C214 C 0.5048(8) 0.3100(4) 0.1357(2) 0.062(3) Uiso 1 1 d G . .
C215 C 0.5148(8) 0.3655(3) 0.1478(3) 0.095(4) Uiso 1 1 d GD . .
C216 C 0.4451(10) 0.3898(3) 0.1721(3) 0.102(5) Uiso 1 1 d G . .
C217 C 0.3654(10) 0.3585(5) 0.1843(3) 0.109(5) Uiso 1 1 d G . .
C218 C 0.3554(10) 0.3029(5) 0.1722(3) 0.151(8) Uiso 1 1 d GD . .
C219 C 0.4251(10) 0.2787(3) 0.1479(3) 0.134(7) Uiso 1 1 d G . .
C220 C 0.2493(11) 0.2784(6) 0.1880(4) 0.082(4) Uiso 1 1 d D . .
C221 C 0.6038(13) 0.3936(6) 0.1333(4) 0.089(4) Uiso 1 1 d D . .
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C49 Ag1 C44 175.5(4) . .
C25 O1 C29 113.4(11) . .
C26 O2 C32 112.3(7) . .
C28 O3 C38A 120.2(10) . .
C28 O3 C38B 104.6(12) . .
C38A O3 C38B 26.9(11) . .
C35 O4 C27 120.0(13) . .
C44 N1 C42 108.7(9) . .
C44 N1 C41 125.5(8) . .
C42 N1 C41 125.7(8) . .
C44 N2 C43 110.5(9) . .
C44 N2 C45 124.2(8) . .
C43 N2 C45 125.3(9) . .
C49 N3 C47 111.7(8) . .
C49 N3 C46 125.2(8) . .
C47 N3 C46 123.0(9) . .
C49 N4 C48 109.9(9) . .
C49 N4 C50 125.2(8) . .
C48 N4 C50 124.8(8) . .
C28 C1 C24 118.2(9) . .
C28 C1 C2 123.0(9) . .
C24 C1 C2 118.6(9) . .
C3 C2 C1 109.8(7) . .
C4 C3 C25 117.7(10) . .
C4 C3 C2 123.0(9) . .
C25 C3 C2 119.0(10) . .
C5 C4 C3 121.4(10) . .
C4 C5 C6 119.9(13) . .
C7 C6 C5 120.7(11) . .
C25 C7 C6 118.5(9) . .
C25 C7 C8 120.2(10) . .
C6 C7 C8 121.1(9) . .
C7 C8 C9 110.6(8) . .
C26 C9 C10 118.1(10) . .
C26 C9 C8 121.4(10) . .
C10 C9 C8 120.3(10) . .
C11 C10 C9 122.3(10) . .
C10 C11 C12 119.1(10) . .
C10 C11 C41 123.3(10) . .
C12 C11 C41 117.6(9) . .
C11 C12 C13 120.3(10) . .
C26 C13 C12 118.7(10) . .
C26 C13 C14 122.9(9) . .
C12 C13 C14 118.3(9) . .
C15 C14 C13 111.8(8) . .
C16 C15 C27 116.8(10) . .
C16 C15 C14 120.5(8) . .
C27 C15 C14 122.0(9) . .
C15 C16 C17 122.2(10) . .
C18 C17 C16 117.7(11) . .
C19 C18 C17 122.0(11) . .
C18 C19 C27 119.4(9) . .
C18 C19 C20 122.7(10) . .
C27 C19 C20 117.6(10) . .
C21 C20 C19 110.6(8) . .
C22 C21 C28 116.5(10) . .
C22 C21 C20 120.9(10) . .
C28 C21 C20 122.6(9) . .
C21 C22 C23 123.4(10) . .
C22 C23 C24 116.9(9) . .
C22 C23 C46 119.4(9) . .
C24 C23 C46 123.6(9) . .
C1 C24 C23 121.7(10) . .
O1 C25 C7 119.4(9) . .
O1 C25 C3 119.0(9) . .
C7 C25 C3 121.5(10) . .
C9 C26 C13 121.3(10) . .
C9 C26 O2 119.4(10) . .
C13 C26 O2 119.3(9) . .
C19 C27 O4 120.4(8) . .
C19 C27 C15 121.6(9) . .
O4 C27 C15 118.0(9) . .
C1 C28 O3 118.4(9) . .
C1 C28 C21 123.0(9) . .
O3 C28 C21 118.5(9) . .
C30 C29 O1 117(2) . .
C29 C30 C31 110(3) . .
O2 C32 C33 110.3(9) . .
C34 C33 C32 112.5(12) . .
O4 C35 C36 111(2) . .
C35 C36 C37 116(2) . .
C39 C38A O3 104.6(16) . .
C39 C38B O3 122(3) . .
C38B C39 C38A 27.7(16) . .
C38B C39 C40 121(3) . .
C38A C39 C40 111.3(19) . .
N1 C41 C11 113.2(9) . .
C43 C42 N1 106.9(9) . .
C42 C43 N2 107.9(10) . .
N2 C44 N1 105.9(8) . .
N2 C44 Ag1 128.6(7) . .
N1 C44 Ag1 125.5(8) . .
N3 C46 C23 114.0(8) . .
C48 C47 N3 105.5(9) . .
C47 C48 N4 107.9(8) . .
N3 C49 N4 104.9(8) . .
N3 C49 Ag1 126.1(7) . .
N4 C49 Ag1 128.9(8) . .
C94 Ag2 C99 175.7(4) . .
C76 O5 C82 111.5(8) . .
C77 O6 C85 112.9(8) . .
C78 O7 C88 111.7(10) . .
C75 O8 C79 111.5(7) . .
C94 N5 C92 110.1(9) . .
C94 N5 C91 124.4(8) . .
C92 N5 C91 125.5(8) . .
C94 N6 C93 112.1(9) . .
C94 N6 C95 123.9(8) . .
C93 N6 C95 124.0(9) . .
C99 N7 C97 111.1(9) . .
C99 N7 C96 124.6(8) . .
C97 N7 C96 124.3(9) . .
C99 N8 C98 111.7(9) . .
C99 N8 C100 124.8(9) . .
C98 N8 C100 123.5(8) . .
C74 C51 C78 119.1(10) . .
C74 C51 C52 122.2(9) . .
C78 C51 C52 118.4(9) . .
C51 C52 C53 110.5(8) . .
C54 C53 C75 119.1(10) . .
C54 C53 C52 120.3(10) . .
C75 C53 C52 120.5(9) . .
C53 C54 C55 121.5(10) . .
C56 C55 C54 118.9(9) . .
C56 C55 C91 121.8(10) . .
C54 C55 C91 119.2(10) . .
C55 C56 C57 121.8(10) . .
C75 C57 C56 117.4(9) . .
C75 C57 C58 120.4(9) . .
C56 C57 C58 122.1(10) . .
C59 C58 C57 109.6(8) . .
C60 C59 C76 116.9(10) . .
C60 C59 C58 123.6(10) . .
C76 C59 C58 119.2(10) . .
C61 C60 C59 122.6(11) . .
C60 C61 C62 119.5(12) . .
C63 C62 C61 121.1(11) . .
C62 C63 C76 118.0(10) . .
C62 C63 C64 121.3(10) . .
C76 C63 C64 120.4(10) . .
C63 C64 C65 109.5(7) . .
C66 C65 C77 118.6(9) . .
C66 C65 C64 119.8(10) . .
C77 C65 C64 121.4(9) . .
C65 C66 C67 120.8(10) . .
C68 C67 C66 119.1(9) . .
C68 C67 C96 118.4(9) . .
C66 C67 C96 122.4(9) . .
C69 C68 C67 121.8(10) . .
C68 C69 C77 119.6(11) . .
C68 C69 C70 120.2(10) . .
C77 C69 C70 120.1(9) . .
C69 C70 C71 111.0(8) . .
C72 C71 C78 118.7(10) . .
C72 C71 C70 123.2(10) . .
C78 C71 C70 118.0(10) . .
C73 C72 C71 122.0(11) . .
C72 C73 C74 119.6(11) . .
C73 C74 C51 121.2(10) . .
O8 C75 C57 119.6(9) . .
O8 C75 C53 119.4(10) . .
C57 C75 C53 121.0(9) . .
O5 C76 C63 120.4(9) . .
O5 C76 C59 118.3(8) . .
C63 C76 C59 121.2(10) . .
O6 C77 C69 120.4(10) . .
O6 C77 C65 119.8(10) . .
C69 C77 C65 119.9(9) . .
O7 C78 C51 120.9(9) . .
O7 C78 C71 119.9(9) . .
C51 C78 C71 119.1(9) . .
O8 C79 C80 108.5(9) . .
C81 C80 C79 112.7(12) . .
C83 C82 O5 111.8(9) . .
C82 C83 C84 108.5(10) . .
O6 C85 C86 109.9(10) . .
C85 C86 C87 111.6(14) . .
C89 C88 O7 124.1(18) . .
C88 C89 C90 124(2) . .
N5 C91 C55 113.5(9) . .
C93 C92 N5 107.4(8) . .
C92 C93 N6 106.6(9) . .
N6 C94 N5 103.9(8) . .
N6 C94 Ag2 130.3(7) . .
N5 C94 Ag2 125.9(8) . .
N7 C96 C67 113.0(8) . .
C98 C97 N7 107.1(9) . .
C97 C98 N8 106.3(9) . .
N8 C99 N7 103.9(8) . .
N8 C99 Ag2 130.2(8) . .
N7 C99 Ag2 125.9(7) . .
C144 Ag3 C149 177.9(4) . .
C126 O9 C132 115.3(8) . .
C127 O10 C135 113.5(9) . .
C128 O11 C138 114.8(10) . .
C125 O12 C129 111.9(9) . .
C144 N9 C142 112.8(9) . .
C144 N9 C141 121.2(9) . .
C142 N9 C141 125.3(10) . .
C144 N10 C143 111.7(9) . .
C144 N10 C145 122.7(11) . .
C143 N10 C145 125.6(10) . .
C149 N11 C147 111.4(8) . .
C149 N11 C146 123.9(9) . .
C147 N11 C146 124.0(8) . .
C149 N12 C148 111.6(8) . .
C149 N12 C150 123.5(9) . .
C148 N12 C150 124.8(8) . .
C102 C101 C125 118.1(9) . .
C102 C101 C123 119.2(8) . .
C125 C101 C123 122.4(9) . .
C103 C102 C101 119.8(8) . .
C102 C103 C104 120.2(9) . .
C102 C103 C146 120.3(8) . .
C104 C103 C146 119.6(8) . .
C103 C104 C105 122.2(9) . .
C125 C105 C104 117.7(8) . .
C125 C105 C106 120.9(9) . .
C104 C105 C106 121.3(9) . .
C107 C106 C105 109.2(9) . .
C108 C107 C126 116.5(12) . .
C108 C107 C106 119.4(11) . .
C126 C107 C106 123.9(10) . .
C107 C108 C109 119.0(12) . .
C108 C109 C110 123.0(12) . .
C111 C110 C109 118.5(14) . .
C110 C111 C126 117.5(11) . .
C110 C111 C112 121.3(13) . .
C126 C111 C112 121.0(10) . .
C111 C112 C113 110.8(9) . .
C114 C113 C127 118.2(8) . .
C114 C113 C112 122.3(9) . .
C127 C113 C112 119.5(10) . .
C113 C114 C115 121.1(9) . .
C116 C115 C114 120.2(9) . .
C116 C115 C141 120.8(9) . .
C114 C115 C141 119.0(9) . .
C115 C116 C117 121.8(8) . .
C116 C117 C127 116.8(8) . .
C116 C117 C118 120.6(7) . .
C127 C117 C118 122.6(8) . .
C119 C118 C117 110.0(8) . .
C120 C119 C128 117.5(10) . .
C120 C119 C118 121.6(10) . .
C128 C119 C118 120.6(8) . .
C121 C120 C119 120.4(11) . .
C120 C121 C122 120.7(10) . .
C124 C122 C121 120.4(11) . .
C101 C123 C124 109.9(8) . .
C122 C124 C128 119.6(10) . .
C122 C124 C123 120.5(11) . .
C128 C124 C123 119.4(9) . .
C105 C125 C101 121.8(9) . .
C105 C125 O12 120.4(8) . .
C101 C125 O12 117.8(9) . .
C111 C126 O9 119.7(10) . .
C111 C126 C107 125.1(10) . .
O9 C126 C107 115.0(12) . .
C113 C127 O10 120.7(8) . .
C113 C127 C117 121.7(9) . .
O10 C127 C117 117.6(9) . .
O11 C128 C124 121.3(9) . .
O11 C128 C119 117.3(9) . .
C124 C128 C119 121.2(9) . .
O12 C129 C130 106.4(12) . .
C129 C130 C131 108.8(17) . .
C133 C132 O9 118.0(14) . .
C132 C133 C134 106.6(16) . .
O10 C135 C136 108.1(12) . .
C137 C136 C135 112.9(14) . .
O11 C138 C139 125(2) . .
C138 C139 C140 112(2) . .
N9 C141 C115 112.0(8) . .
C143 C142 N9 108.0(11) . .
C142 C143 N10 106.0(11) . .
N9 C144 N10 101.5(10) . .
N9 C144 Ag3 130.4(8) . .
N10 C144 Ag3 128.1(8) . .
N11 C146 C103 111.0(7) . .
C148 C147 N11 106.2(9) . .
C147 C148 N12 106.7(9) . .
N11 C149 N12 104.1(9) . .
N11 C149 Ag3 128.6(7) . .
N12 C149 Ag3 127.1(7) . .
C194 Ag4 C199 178.5(4) . .
C175 O13 C179 114.0(8) . .
C178 O14 C188 113.4(8) . .
C176 O15 C182 114.1(8) . .
C177 O16 C185 113.7(9) . .
C194 N13 C192 111.8(8) . .
C194 N13 C191 123.2(10) . .
C192 N13 C191 123.8(9) . .
C194 N14 C193 112.0(8) . .
C194 N14 C195 124.7(9) . .
C193 N14 C195 123.3(9) . .
C199 N15 C197 111.7(8) . .
C199 N15 C196 124.1(9) . .
C197 N15 C196 123.0(9) . .
C199 N16 C198 110.7(9) . .
C199 N16 C200 124.0(10) . .
C198 N16 C200 125.3(9) . .
C174 C151 C178 117.5(8) . .
C174 C151 C152 119.6(8) . .
C178 C151 C152 122.8(9) . .
C151 C152 C153 109.0(9) . .
C154 C153 C175 118.2(10) . .
C154 C153 C152 120.2(9) . .
C175 C153 C152 121.1(8) . .
C155 C154 C153 119.7(10) . .
C156 C155 C154 120.3(9) . .
C155 C156 C157 121.3(11) . .
C175 C157 C156 118.2(10) . .
C175 C157 C158 119.7(8) . .
C156 C157 C158 121.8(10) . .
C159 C158 C157 109.6(8) . .
C160 C159 C176 117.8(8) . .
C160 C159 C158 119.1(8) . .
C176 C159 C158 123.0(8) . .
C159 C160 C161 123.0(8) . .
C162 C161 C160 116.6(9) . .
C162 C161 C191 121.3(9) . .
C160 C161 C191 121.9(8) . .
C161 C162 C163 121.1(9) . .
C176 C163 C162 118.9(7) . .
C176 C163 C164 123.5(9) . .
C162 C163 C164 117.4(8) . .
C165 C164 C163 111.3(8) . .
C177 C165 C166 117.9(10) . .
C177 C165 C164 122.3(9) . .
C166 C165 C164 119.7(10) . .
C167 C166 C165 120.2(11) . .
C166 C167 C168 120.5(10) . .
C169 C168 C167 120.3(11) . .
C168 C169 C177 118.6(10) . .
C168 C169 C170 121.3(10) . .
C177 C169 C170 120.1(9) . .
C169 C170 C171 110.4(9) . .
C172 C171 C178 117.7(8) . .
C172 C171 C170 121.0(9) . .
C178 C171 C170 121.2(9) . .
C171 C172 C173 122.4(9) . .
C172 C173 C174 118.0(9) . .
C172 C173 C196 120.6(8) . .
C174 C173 C196 121.4(8) . .
C151 C174 C173 122.1(8) . .
C157 C175 O13 120.0(9) . .
C157 C175 C153 122.1(8) . .
O13 C175 C153 117.9(9) . .
C163 C176 C159 122.3(8) . .
C163 C176 O15 118.5(7) . .
C159 C176 O15 119.2(8) . .
O16 C177 C165 119.1(9) . .
O16 C177 C169 118.6(9) . .
C165 C177 C169 122.0(9) . .
C171 C178 O14 120.3(7) . .
C171 C178 C151 122.0(9) . .
O14 C178 C151 117.7(8) . .
C180 C179 O13 115.5(15) . .
C179 C180 C181 102.2(18) . .
O15 C182 C183 108.5(10) . .
C184 C183 C182 114.3(12) . .
C186 C185 O16 130(2) . .
C185 C186 C187 131(4) . .
O14 C188 C189 106.9(10) . .
C190 C189 C188 111.2(12) . .
C161 C191 N13 112.9(8) . .
C193 C192 N13 105.8(9) . .
C192 C193 N14 107.1(10) . .
N14 C194 N13 103.4(9) . .
N14 C194 Ag4 127.9(7) . .
N13 C194 Ag4 128.7(7) . .
N15 C196 C173 112.8(8) . .
C198 C197 N15 104.5(10) . .
C197 C198 N16 108.2(10) . .
N15 C199 N16 105.0(10) . .
N15 C199 Ag4 127.6(7) . .
N16 C199 Ag4 127.4(8) . .
F1 B1 F3 112.2(11) . .
F1 B1 F4 110.3(13) . .
F3 B1 F4 111.0(10) . .
F1 B1 F2 108.8(10) . .
F3 B1 F2 106.6(12) . .
F4 B1 F2 107.8(10) . .
F6 B2 F8 110.7(11) . .
F6 B2 F5 112.6(12) . .
F8 B2 F5 107.8(13) . .
F6 B2 F7 106.7(13) . .
F8 B2 F7 107.8(11) . .
F5 B2 F7 111.2(11) . .
F9 B3 F11 111.2(14) . .
F9 B3 F10 106.6(13) . .
F11 B3 F10 113.7(11) . .
F9 B3 F12 104.7(13) . .
F11 B3 F12 108.4(13) . .
F10 B3 F12 112.0(12) . .
F13 B4 F15 112.7(12) . .
F13 B4 F16 111.3(16) . .
F15 B4 F16 101.6(15) . .
F13 B4 F14 115.5(12) . .
F15 B4 F14 112.2(13) . .
F16 B4 F14 102.1(12) . .
Cl1 C201 Cl2 107.5(9) . .
Cl3 C202 Cl4 109.0(8) . .
Cl5 C203 Cl6 110.7(6) . .
Cl8 C204 Cl7 112.0(10) . .
Cl10 C213 Cl9 108.5(12) . .
C207 C205 C206 117.8(12) . 2_766
C207 C205 C208 121.4(12) . .
C206 C205 C208 120.8(13) 2_766 .
C207 C206 C205 121.5(12) . 2_766
C205 C207 C206 120.5(12) . .
C211 C209 C210 121.0(13) . .
C211 C210 C209 116.8(14) 2_657 .
C211 C210 C212 120.5(19) 2_657 .
C209 C210 C212 122.6(18) . .
C209 C211 C210 122.2(15) . 2_657
C215 C214 C219 120.0 . .
C214 C215 C216 120.0 . .
C214 C215 C221 114.4(10) . .
C216 C215 C221 125.6(10) . .
C215 C216 C217 120.0 . .
C218 C217 C216 120.0 . .
C217 C218 C219 120.0 . .
C217 C218 C220 108.6(10) . .
C219 C218 C220 131.1(10) . .
C218 C219 C214 120.0 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 C49 2.093(9) .
Ag1 C44 2.095(9) .
O1 C25 1.364(13) .
O1 C29 1.405(16) .
O2 C26 1.393(12) .
O2 C32 1.411(12) .
O3 C28 1.398(11) .
O3 C38A 1.493(19) .
O3 C38B 1.50(3) .
O4 C35 1.38(2) .
O4 C27 1.384(12) .
N1 C44 1.352(12) .
N1 C42 1.411(13) .
N1 C41 1.458(14) .
N2 C44 1.335(14) .
N2 C43 1.376(12) .
N2 C45 1.457(13) .
N3 C49 1.334(13) .
N3 C47 1.371(11) .
N3 C46 1.465(12) .
N4 C49 1.356(11) .
N4 C48 1.362(12) .
N4 C50 1.440(13) .
C1 C28 1.359(14) .
C1 C24 1.390(13) .
C1 C2 1.544(14) .
C2 C3 1.525(14) .
C3 C4 1.379(16) .
C3 C25 1.411(13) .
C4 C5 1.349(17) .
C5 C6 1.399(15) .
C6 C7 1.371(16) .
C7 C25 1.371(14) .
C7 C8 1.522(13) .
C8 C9 1.529(15) .
C9 C26 1.373(15) .
C9 C10 1.385(14) .
C10 C11 1.367(14) .
C11 C12 1.380(14) .
C11 C41 1.520(13) .
C12 C13 1.396(13) .
C13 C26 1.391(14) .
C13 C14 1.508(15) .
C14 C15 1.495(14) .
C15 C16 1.373(15) .
C15 C27 1.419(12) .
C16 C17 1.411(16) .
C17 C18 1.383(15) .
C18 C19 1.359(15) .
C19 C27 1.371(14) .
C19 C20 1.545(13) .
C20 C21 1.490(14) .
C21 C22 1.376(13) .
C21 C28 1.414(15) .
C22 C23 1.392(14) .
C23 C24 1.408(13) .
C23 C46 1.489(13) .
C29 C30 1.26(3) .
C30 C31 1.567(19) .
C32 C33 1.492(15) .
C33 C34 1.48(2) .
C35 C36 1.50(3) .
C36 C37 1.631(17) .
C38A C39 1.47(4) .
C38B C39 1.18(4) .
C39 C40 1.58(3) .
C42 C43 1.311(16) .
C47 C48 1.347(14) .
Ag2 C94 2.067(9) .
Ag2 C99 2.074(10) .
O5 C76 1.342(12) .
O5 C82 1.519(13) .
O6 C77 1.370(11) .
O6 C85 1.417(11) .
O7 C78 1.356(12) .
O7 C88 1.418(15) .
O8 C75 1.384(11) .
O8 C79 1.455(11) .
N5 C94 1.360(12) .
N5 C92 1.379(12) .
N5 C91 1.455(14) .
N6 C94 1.352(13) .
N6 C93 1.356(11) .
N6 C95 1.458(13) .
N7 C99 1.356(13) .
N7 C97 1.384(11) .
N7 C96 1.465(13) .
N8 C99 1.339(12) .
N8 C98 1.394(13) .
N8 C100 1.458(14) .
C51 C74 1.383(15) .
C51 C78 1.408(13) .
C51 C52 1.516(15) .
C52 C53 1.536(14) .
C53 C54 1.361(13) .
C53 C75 1.399(14) .
C54 C55 1.382(14) .
C55 C56 1.371(14) .
C55 C91 1.509(13) .
C56 C57 1.400(13) .
C57 C75 1.389(14) .
C57 C58 1.524(14) .
C58 C59 1.512(14) .
C59 C60 1.376(16) .
C59 C76 1.438(14) .
C60 C61 1.356(16) .
C61 C62 1.400(17) .
C62 C63 1.382(16) .
C63 C76 1.389(13) .
C63 C64 1.507(15) .
C64 C65 1.538(14) .
C65 C66 1.392(13) .
C65 C77 1.414(15) .
C66 C67 1.398(13) .
C67 C68 1.383(14) .
C67 C96 1.510(13) .
C68 C69 1.363(14) .
C69 C77 1.407(15) .
C69 C70 1.513(15) .
C70 C71 1.514(14) .
C71 C72 1.379(15) .
C71 C78 1.412(14) .
C72 C73 1.364(15) .
C73 C74 1.369(16) .
C79 C80 1.505(15) .
C80 C81 1.494(19) .
C82 C83 1.430(16) .
C83 C84 1.555(17) .
C85 C86 1.472(16) .
C86 C87 1.490(19) .
C88 C89 1.15(2) .
C89 C90 1.55(2) .
C92 C93 1.336(15) .
C97 C98 1.325(15) .
Ag3 C144 2.069(12) .
Ag3 C149 2.096(11) .
O9 C126 1.395(12) .
O9 C132 1.441(14) .
O10 C127 1.386(12) .
O10 C135 1.425(14) .
O11 C128 1.367(10) .
O11 C138 1.368(19) .
O12 C125 1.412(12) .
O12 C129 1.442(15) .
N9 C144 1.346(13) .
N9 C142 1.363(14) .
N9 C141 1.480(12) .
N10 C144 1.381(13) .
N10 C143 1.386(15) .
N10 C145 1.461(14) .
N11 C149 1.341(12) .
N11 C147 1.402(13) .
N11 C146 1.471(11) .
N12 C149 1.353(13) .
N12 C148 1.385(13) .
N12 C150 1.473(11) .
C101 C102 1.394(13) .
C101 C125 1.402(13) .
C101 C123 1.513(13) .
C102 C103 1.356(13) .
C103 C104 1.362(12) .
C103 C146 1.578(13) .
C104 C105 1.371(13) .
C105 C125 1.357(14) .
C105 C106 1.542(13) .
C106 C107 1.540(17) .
C107 C108 1.388(16) .
C107 C126 1.420(16) .
C108 C109 1.39(2) .
C109 C110 1.435(19) .
C110 C111 1.370(16) .
C111 C126 1.392(18) .
C111 C112 1.483(16) .
C112 C113 1.515(13) .
C113 C114 1.382(14) .
C113 C127 1.383(14) .
C114 C115 1.397(13) .
C115 C116 1.338(13) .
C115 C141 1.520(13) .
C116 C117 1.410(13) .
C117 C127 1.420(12) .
C117 C118 1.518(12) .
C118 C119 1.501(15) .
C119 C120 1.384(13) .
C119 C128 1.437(14) .
C120 C121 1.384(17) .
C121 C122 1.393(16) .
C122 C124 1.364(13) .
C123 C124 1.534(15) .
C124 C128 1.375(15) .
C129 C130 1.500(18) .
C130 C131 1.59(4) .
C132 C133 1.41(2) .
C133 C134 1.582(15) .
C135 C136 1.505(17) .
C136 C137 1.47(2) .
C138 C139 1.398(19) .
C139 C140 1.535(18) .
C142 C143 1.309(15) .
C147 C148 1.336(12) .
Ag4 C194 2.069(11) .
Ag4 C199 2.081(11) .
O13 C175 1.374(10) .
O13 C179 1.483(18) .
O14 C178 1.399(11) .
O14 C188 1.429(13) .
O15 C176 1.386(11) .
O15 C182 1.429(13) .
O16 C177 1.364(11) .
O16 C185 1.412(15) .
N13 C194 1.363(12) .
N13 C192 1.391(14) .
N13 C191 1.463(11) .
N14 C194 1.357(13) .
N14 C193 1.375(14) .
N14 C195 1.449(11) .
N15 C199 1.337(13) .
N15 C197 1.411(14) .
N15 C196 1.465(11) .
N16 C199 1.359(12) .
N16 C198 1.371(15) .
N16 C200 1.446(13) .
C151 C174 1.357(13) .
C151 C178 1.409(12) .
C151 C152 1.493(13) .
C152 C153 1.535(15) .
C153 C154 1.392(12) .
C153 C175 1.414(14) .
C154 C155 1.383(16) .
C155 C156 1.371(16) .
C156 C157 1.395(12) .
C157 C175 1.352(14) .
C157 C158 1.534(14) .
C158 C159 1.493(12) .
C159 C160 1.379(13) .
C159 C176 1.384(12) .
C160 C161 1.419(13) .
C161 C162 1.401(12) .
C161 C191 1.450(14) .
C162 C163 1.409(14) .
C163 C176 1.378(12) .
C163 C164 1.527(11) .
C164 C165 1.476(15) .
C165 C177 1.391(14) .
C165 C166 1.406(14) .
C166 C167 1.378(17) .
C167 C168 1.441(17) .
C168 C169 1.335(15) .
C169 C177 1.436(15) .
C169 C170 1.517(15) .
C170 C171 1.534(12) .
C171 C172 1.369(13) .
C171 C178 1.377(13) .
C172 C173 1.378(12) .
C173 C174 1.392(12) .
C173 C196 1.503(14) .
C179 C180 1.448(18) .
C180 C181 1.591(17) .
C182 C183 1.511(16) .
C183 C184 1.504(16) .
C185 C186 1.11(3) .
C186 C187 1.50(3) .
C188 C189 1.516(16) .
C189 C190 1.506(19) .
C192 C193 1.351(13) .
C197 C198 1.359(14) .
B1 F1 1.325(15) .
B1 F3 1.367(16) .
B1 F4 1.377(17) .
B1 F2 1.387(13) .
B2 F6 1.341(15) .
B2 F8 1.342(13) .
B2 F5 1.344(17) .
B2 F7 1.385(18) .
B3 F9 1.336(19) .
B3 F11 1.352(19) .
B3 F10 1.372(15) .
B3 F12 1.374(14) .
B4 F13 1.278(18) .
B4 F15 1.303(14) .
B4 F16 1.41(2) .
B4 F14 1.412(15) .
Cl1 C201 1.773(15) .
Cl2 C201 1.787(14) .
Cl3 C202 1.734(13) .
Cl4 C202 1.806(12) .
Cl5 C203 1.771(12) .
Cl6 C203 1.788(11) .
Cl7 C204 1.710(15) .
Cl8 C204 1.705(16) .
Cl9 C213 1.793(18) .
Cl10 C213 1.661(18) .
C205 C207 1.365(17) .
C205 C206 1.422(16) 2_766
C205 C208 1.515(17) .
C206 C207 1.382(17) .
C206 C205 1.422(16) 2_766
C209 C211 1.33(2) .
C209 C210 1.36(2) .
C210 C211 1.342(19) 2_657
C210 C212 1.57(2) .
C211 C210 1.342(19) 2_657
C214 C215 1.3900 .
C214 C219 1.3900 .
C215 C216 1.3900 .
C215 C221 1.466(13) .
C216 C217 1.3900 .
C217 C218 1.3900 .
C218 C219 1.3900 .
C218 C220 1.591(12) .
