#------------------------------------------------------------------------------
#$Date: 2019-11-25 00:34:17 +0200 (Mon, 25 Nov 2019) $
#$Revision: 239771 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/35/01/4350188.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_4350188
loop_
_publ_author_name
'Dong, Yu-Bin'
'Xu, Hong-Xia'
'Ma, Jian-Ping'
'Huang, Ru-Qi'
_publ_section_title
;
 Silver(I) coordination polymers based on a nano-sized bent
 bis(3-acetylenylphenyl-(4-cyanophenyl))oxadiazole ligand: the role of
 ligand isomerism and the templating effect of polyatomic anions and
 solvent intermediates.
;
_journal_issue                   8
_journal_name_full               'Inorganic chemistry'
_journal_page_first              3325
_journal_page_last               3343
_journal_paper_doi               10.1021/ic052158w
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'C42 H30 Ag F6 N4 O2 Sb'
_chemical_formula_weight         966.32
_space_group_IT_number           1
_space_group_name_Hall           'P 1'
_space_group_name_H-M_alt        'P 1'
_symmetry_cell_setting           triclinic
_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                111.4810(10)
_cell_angle_beta                 105.9500(10)
_cell_angle_gamma                93.8490(10)
_cell_formula_units_Z            2
_cell_length_a                   10.7908(7)
_cell_length_b                   12.5144(8)
_cell_length_c                   16.8103(11)
_cell_measurement_reflns_used    3635
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      2.723
_cell_measurement_theta_min      2.414
_cell_volume                     1995.0(2)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.0000
_diffrn_reflns_av_sigmaI/netI    0.0409
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            8494
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.76
_exptl_absorpt_coefficient_mu    1.236
_exptl_absorpt_correction_T_max  0.7990
_exptl_absorpt_correction_T_min  0.7474
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.609
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             956
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.21
_refine_diff_density_max         0.684
_refine_diff_density_min         -0.373
_refine_diff_density_rms         '0.075 End ===='
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.00
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1009
_refine_ls_number_reflns         8494
_refine_ls_number_restraints     42
_refine_ls_restrained_S_all      1.018
_refine_ls_R_factor_all          0.0589
_refine_ls_R_factor_gt           0.0429
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0654P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0998
_refine_ls_wR_factor_ref         0.1085
_reflns_number_gt                6764
_reflns_number_total             8494
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic052158wsi20051219_053724.cif
_cod_data_source_block           4
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Triclinic' was changed to
'triclinic' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/ACS/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      P1
_cod_database_code               4350188
loop_
_symmetry_equiv_pos_as_xyz
'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
Ag1 Ag 0.65960(6) 0.46685(7) 0.50742(5) 0.0719(2) Uani 1 1 d .
Ag2 Ag 0.65874(6) 0.59038(7) 0.74432(5) 0.0727(2) Uani 1 1 d .
N1 N 0.8528(7) 0.5593(6) 0.7118(4) 0.0523(17) Uani 1 1 d .
N2 N 0.8576(7) 0.5118(6) 0.6231(4) 0.0535(18) Uani 1 1 d .
N3 N 0.6850(10) -0.2257(8) -0.1488(7) 0.083(3) Uani 1 1 d .
N4 N 0.6782(11) 0.5426(9) 1.4074(7) 0.088(3) Uani 1 1 d .
N5 N 0.4664(7) 0.5056(6) 0.6281(4) 0.0469(16) Uani 1 1 d .
N6 N 0.4685(7) 0.4580(6) 0.5397(4) 0.0471(17) Uani 1 1 d .
N7 N 0.6466(10) 0.5113(9) -0.1425(7) 0.083(3) Uani 1 1 d .
N8 N 0.6569(9) 1.2727(8) 1.3900(7) 0.077(2) Uani 1 1 d .
C1 C 0.3584(8) 0.3863(7) 0.4913(5) 0.0447(19) Uani 1 1 d .
C2 C 0.3162(8) 0.3113(8) 0.3954(6) 0.0459(19) Uani 1 1 d .
C3 C 0.2510(9) 0.1988(8) 0.3637(6) 0.056(2) Uani 1 1 d .
H3 H 0.2284 0.1701 0.4026 0.068 Uiso 1 1 calc R
C4 C 0.2194(9) 0.1288(8) 0.2729(6) 0.065(3) Uani 1 1 d .
H4 H 0.1720 0.0532 0.2502 0.078 Uiso 1 1 calc R
C5 C 0.2578(10) 0.1698(8) 0.2144(6) 0.063(2) Uani 1 1 d .
H5 H 0.2373 0.1218 0.1535 0.076 Uiso 1 1 calc R
C6 C 0.3257(9) 0.2815(8) 0.2484(6) 0.054(2) Uani 1 1 d .
C7 C 0.3543(8) 0.3538(8) 0.3371(5) 0.048(2) Uani 1 1 d .
H7 H 0.3984 0.4303 0.3589 0.058 Uiso 1 1 calc R
C8 C 0.3677(10) 0.3220(9) 0.1885(6) 0.059(2) Uani 1 1 d .
C9 C 0.4089(11) 0.3494(9) 0.1380(7) 0.066(3) Uani 1 1 d .
C10 C 0.4602(10) 0.3859(9) 0.0791(6) 0.060(2) Uani 1 1 d .
C11 C 0.4843(10) 0.5017(10) 0.0944(7) 0.065(3) Uani 1 1 d .
H11 H 0.4674 0.5577 0.1427 0.078 Uiso 1 1 calc R
C12 C 0.5349(10) 0.5355(9) 0.0366(7) 0.065(3) Uani 1 1 d .
H12 H 0.5531 0.6140 0.0467 0.078 Uiso 1 1 calc R
C13 C 0.5576(10) 0.4484(9) -0.0367(7) 0.063(3) Uani 1 1 d .
C14 C 0.6075(9) 0.4842(10) -0.0958(7) 0.067(3) Uani 1 1 d .
C15 C 0.5400(12) 0.3353(9) -0.0475(7) 0.074(3) Uani 1 1 d .
H15 H 0.5644 0.2800 -0.0922 0.089 Uiso 1 1 calc R
C16 C 0.4866(12) 0.3008(9) 0.0069(7) 0.077(3) Uani 1 1 d .
H16 H 0.4682 0.2221 -0.0041 0.093 Uiso 1 1 calc R
C17 C 0.3544(8) 0.4583(7) 0.6264(5) 0.0450(19) Uani 1 1 d .
C18 C 0.3050(8) 0.4754(8) 0.7014(6) 0.048(2) Uani 1 1 d .
C19 C 0.2173(10) 0.3891(8) 0.7003(7) 0.069(3) Uani 1 1 d .
H19 H 0.1836 0.3198 0.6491 0.083 Uiso 1 1 calc R
C20 C 0.1792(13) 0.4060(11) 0.7764(9) 0.090(4) Uani 1 1 d .
H20 H 0.1176 0.3492 0.7751 0.109 Uiso 1 1 calc R
C21 C 0.2330(11) 0.5069(9) 0.8532(7) 0.066(3) Uani 1 1 d .
H21 H 0.2121 0.5154 0.9051 0.080 Uiso 1 1 calc R
C22 C 0.3169(9) 0.5951(9) 0.8544(6) 0.055(2) Uani 1 1 d .
C23 C 0.3519(8) 0.5785(7) 0.7775(5) 0.0439(19) Uani 1 1 d .
H23 H 0.4081 0.6381 0.7774 0.053 Uiso 1 1 calc R
C24 C 0.3715(10) 0.7036(9) 0.9338(7) 0.060(2) Uani 1 1 d .
C25 C 0.4141(10) 0.7905(9) 1.0003(7) 0.060(2) Uani 1 1 d .
C26 C 0.4681(10) 0.8914(8) 1.0820(7) 0.058(2) Uani 1 1 d .
C27 C 0.4977(10) 1.0002(9) 1.0820(6) 0.064(3) Uani 1 1 d .
H27 H 0.4829 1.0064 1.0268 0.077 Uiso 1 1 calc R
C28 C 0.5481(10) 1.0998(9) 1.1596(7) 0.062(2) Uani 1 1 d .
H28 H 0.5683 1.1721 1.1578 0.075 Uiso 1 1 calc R
C29 C 0.5678(9) 1.0884(8) 1.2410(6) 0.057(2) Uani 1 1 d .
C30 C 0.6187(10) 1.1932(10) 1.3250(8) 0.066(3) Uani 1 1 d .
C31 C 0.5402(11) 0.9813(9) 1.2442(7) 0.068(3) Uani 1 1 d .
H31 H 0.5567 0.9755 1.2996 0.081 Uiso 1 1 calc R
C32 C 0.4898(12) 0.8859(10) 1.1675(7) 0.073(3) Uani 1 1 d .
H32 H 0.4684 0.8143 1.1702 0.088 Uiso 1 1 calc R
C33 C 0.9634(8) 0.6308(8) 0.7611(5) 0.047(2) Uani 1 1 d .
C34 C 1.0091(8) 0.7039(8) 0.8571(5) 0.047(2) Uani 1 1 d .
C35 C 1.0895(8) 0.8131(9) 0.8895(6) 0.055(2) Uani 1 1 d .
H35 H 1.1164 0.8375 0.8498 0.066 Uiso 1 1 calc R
C36 C 1.1287(10) 0.8845(9) 0.9798(7) 0.069(3) Uani 1 1 d .
H36 H 1.1838 0.9565 1.0018 0.083 Uiso 1 1 calc R
C37 C 1.0856(10) 0.8486(10) 1.0377(7) 0.075(3) Uani 1 1 d .
H37 H 1.1119 0.8971 1.0988 0.090 Uiso 1 1 calc R
C38 C 1.0025(9) 0.7399(9) 1.0058(6) 0.054(2) Uani 1 1 d .
C39 C 0.9641(8) 0.6695(8) 0.9153(6) 0.048(2) Uani 1 1 d .
H39 H 0.9075 0.5983 0.8929 0.058 Uiso 1 1 calc R
C40 C 0.9532(10) 0.7084(9) 1.0664(6) 0.062(2) Uani 1 1 d .
C41 C 0.9093(10) 0.6829(9) 1.1162(7) 0.065(3) Uani 1 1 d .
C42 C 0.8554(10) 0.6525(10) 1.1757(7) 0.064(3) Uani 1 1 d .
C43 C 0.8484(11) 0.5429(10) 1.1758(8) 0.072(3) Uani 1 1 d .
H43 H 0.8795 0.4867 1.1360 0.086 Uiso 1 1 calc R
C44 C 0.7986(11) 0.5141(11) 1.2309(8) 0.074(3) Uani 1 1 d .
H44 H 0.7923 0.4382 1.2280 0.089 Uiso 1 1 calc R
C45 C 0.7562(10) 0.5979(10) 1.2925(7) 0.065(3) Uani 1 1 d .
C46 C 0.7087(12) 0.5694(10) 1.3592(8) 0.077(3) Uani 1 1 d .
C47 C 0.7662(15) 0.7103(12) 1.2985(10) 0.099(5) Uani 1 1 d .
H47 H 0.7429 0.7679 1.3425 0.119 Uiso 1 1 calc R
C48 C 0.8124(13) 0.7361(11) 1.2362(8) 0.085(3) Uani 1 1 d .
H48 H 0.8140 0.8103 1.2359 0.102 Uiso 1 1 calc R
C49 C 0.9698(8) 0.5590(7) 0.6256(5) 0.0470(19) Uani 1 1 d .
C50 C 1.0224(8) 0.5457(7) 0.5520(6) 0.047(2) Uani 1 1 d .
C51 C 1.1188(10) 0.6335(9) 0.5612(7) 0.061(3) Uani 1 1 d .
H51 H 1.1534 0.6992 0.6152 0.074 Uiso 1 1 calc R
C52 C 1.1615(11) 0.6214(9) 0.4894(7) 0.071(3) Uani 1 1 d .
H52 H 1.2251 0.6801 0.4950 0.086 Uiso 1 1 calc R
C53 C 1.1132(10) 0.5252(9) 0.4098(7) 0.065(3) Uani 1 1 d .
H53 H 1.1438 0.5194 0.3621 0.078 Uiso 1 1 calc R
C54 C 1.0186(8) 0.4361(8) 0.3996(6) 0.048(2) Uani 1 1 d .
C55 C 0.9746(8) 0.4473(7) 0.4725(6) 0.047(2) Uani 1 1 d .
H55 H 0.9125 0.3879 0.4673 0.056 Uiso 1 1 calc R
C56 C 0.9703(9) 0.3349(8) 0.3173(6) 0.050(2) Uani 1 1 d .
C57 C 0.9287(10) 0.2519(9) 0.2467(7) 0.061(2) Uani 1 1 d .
C58 C 0.8762(9) 0.1517(8) 0.1629(6) 0.056(2) Uani 1 1 d .
C59 C 0.8503(10) 0.0388(9) 0.1594(7) 0.065(3) Uani 1 1 d .
H59 H 0.8693 0.0277 0.2129 0.079 Uiso 1 1 calc R
C60 C 0.7979(10) -0.0552(8) 0.0790(7) 0.068(3) Uani 1 1 d .
H60 H 0.7783 -0.1292 0.0780 0.082 Uiso 1 1 calc R
C61 C 0.7746(11) -0.0410(9) 0.0013(7) 0.068(3) Uani 1 1 d .
C62 C 0.7982(13) 0.0690(10) 0.0010(7) 0.088(4) Uani 1 1 d .
H62 H 0.7810 0.0781 -0.0533 0.105 Uiso 1 1 calc R
C63 C 0.8478(14) 0.1654(10) 0.0825(7) 0.091(4) Uani 1 1 d .
H63 H 0.8621 0.2398 0.0830 0.109 Uiso 1 1 calc R
C64 C 0.7224(11) -0.1412(10) -0.0837(8) 0.079(3) Uani 1 1 d .
C65 C 0.982(4) 0.388(2) 0.968(2) 0.201(13) Uani 1 1 d .
H65 H 0.9701 0.4624 0.9996 0.242 Uiso 1 1 calc R
C66 C 1.083(3) 0.343(3) 0.996(2) 0.213(12) Uani 1 1 d .
H66 H 1.1435 0.3865 1.0528 0.256 Uiso 1 1 calc R
C67 C 1.1032(19) 0.237(2) 0.946(2) 0.172(9) Uani 1 1 d .
H67 H 1.1807 0.2124 0.9664 0.206 Uiso 1 1 calc R
C68 C 1.010(3) 0.1656(19) 0.8656(17) 0.154(7) Uani 1 1 d .
H68 H 1.0238 0.0924 0.8318 0.185 Uiso 1 1 calc R
C69 C 0.909(2) 0.1999(19) 0.8384(13) 0.156(7) Uani 1 1 d .
H69 H 0.8423 0.1501 0.7862 0.187 Uiso 1 1 calc R
C70 C 0.893(2) 0.308(3) 0.884(2) 0.177(9) Uani 1 1 d .
H70 H 0.8190 0.3330 0.8582 0.213 Uiso 1 1 calc R
C71 C 0.971(2) 0.091(2) 0.5636(16) 0.253(15) Uani 1 1 d DU
H71 H 0.9519 0.1202 0.6174 0.303 Uiso 1 1 calc R
C72 C 0.933(2) 0.1335(19) 0.5039(18) 0.227(15) Uani 1 1 d DU
H72 H 0.8856 0.1940 0.5146 0.272 Uiso 1 1 calc R
C73 C 0.9591(18) 0.093(2) 0.4295(16) 0.195(11) Uani 1 1 d DU
H73 H 0.9315 0.1238 0.3866 0.234 Uiso 1 1 calc R
C74 C 1.024(2) 0.0089(19) 0.4148(18) 0.210(13) Uani 1 1 d DU
H74 H 1.0425 -0.0206 0.3608 0.252 Uiso 1 1 calc R
C75 C 1.063(2) -0.035(2) 0.474(2) 0.29(2) Uani 1 1 d DU
H75 H 1.1109 -0.0948 0.4626 0.353 Uiso 1 1 calc R
C76 C 1.036(2) 0.006(3) 0.5484(18) 0.264(19) Uani 1 1 d DU
H76 H 1.0639 -0.0247 0.5913 0.317 Uiso 1 1 calc R
C77 C 0.8009(16) 0.7914(14) 0.6470(16) 0.151(8) Uani 1 1 d D
H77A H 0.8486 0.7560 0.6059 0.182 Uiso 1 1 calc R
H77B H 0.8586 0.8150 0.7085 0.182 Uiso 1 1 calc R
C78 C 0.755(2) 0.891(2) 0.633(3) 0.27(2) Uani 1 1 d D
H78A H 0.7781 0.9577 0.6906 0.329 Uiso 1 1 calc R
H78B H 0.7952 0.9110 0.5944 0.329 Uiso 1 1 calc R
C79 C 0.615(3) 0.861(2) 0.592(2) 0.236(15) Uani 1 1 d D
H79A H 0.5909 0.8494 0.5293 0.283 Uiso 1 1 calc R
H79B H 0.5737 0.9217 0.6232 0.283 Uiso 1 1 calc R
C80 C 0.5760(16) 0.7536(15) 0.5997(14) 0.141(6) Uani 1 1 d D
H80A H 0.5271 0.7674 0.6419 0.169 Uiso 1 1 calc R
H80B H 0.5204 0.6960 0.5414 0.169 Uiso 1 1 calc R
C81 C 0.481(5) 0.183(3) 0.650(3) 0.33(3) Uani 1 1 d .
H81A H 0.5075 0.1210 0.6686 0.392 Uiso 1 1 calc R
H81B H 0.4166 0.2165 0.6766 0.392 Uiso 1 1 calc R
C82 C 0.594(5) 0.272(3) 0.6684(18) 0.30(3) Uani 1 1 d .
H82A H 0.5679 0.3467 0.6771 0.359 Uiso 1 1 calc R
H82B H 0.6632 0.2800 0.7224 0.359 Uiso 1 1 calc R
C83 C 0.639(3) 0.230(3) 0.590(3) 0.208(12) Uani 1 1 d .
H83A H 0.6502 0.2927 0.5702 0.250 Uiso 1 1 calc R
H83B H 0.7219 0.2057 0.6057 0.250 Uiso 1 1 calc R
C84 C 0.546(3) 0.139(3) 0.5237(15) 0.188(10) Uani 1 1 d .
H84A H 0.5759 0.0653 0.5144 0.226 Uiso 1 1 calc R
H84B H 0.5212 0.1489 0.4672 0.226 Uiso 1 1 calc R
O1 O 0.2810(5) 0.3818(5) 0.5421(3) 0.0476(13) Uani 1 1 d .
O2 O 1.0428(5) 0.6355(5) 0.7111(3) 0.0495(13) Uani 1 1 d .
O3 O 0.6899(11) 0.7131(10) 0.6303(7) 0.126(3) Uani 1 1 d .
O4 O 0.439(2) 0.146(5) 0.561(2) 0.46(3) Uani 1 1 d .
F1 F 0.3259(14) 0.8013(15) 0.4266(9) 0.225(8) Uani 1 1 d .
F2 F 0.1478(11) 0.6720(17) 0.2844(11) 0.257(9) Uani 1 1 d .
F3 F 0.2604(15) 0.8595(13) 0.2811(12) 0.223(8) Uani 1 1 d .
F4 F 0.4823(12) 0.7888(18) 0.3249(13) 0.265(10) Uani 1 1 d .
F5 F 0.3632(16) 0.6213(14) 0.3403(15) 0.260(9) Uani 1 1 d .
F6 F 0.2914(18) 0.6703(15) 0.1867(10) 0.236(7) Uani 1 1 d .
F7 F 0.3367(9) 0.9216(8) 0.6623(5) 0.128(3) Uani 1 1 d .
F8 F 0.2973(10) 1.1184(7) 0.7751(6) 0.123(3) Uani 1 1 d .
F9 F 0.1524(8) 0.9143(7) 0.7337(5) 0.115(2) Uani 1 1 d .
F10 F 0.3154(9) 1.0288(7) 0.8953(5) 0.119(3) Uani 1 1 d .
F11 F 0.3549(12) 0.8343(8) 0.7820(7) 0.153(4) Uani 1 1 d .
F12 F 0.5080(8) 1.0355(9) 0.8259(8) 0.154(4) Uani 1 1 d .
Sb1 Sb 0.33016(7) 0.97594(6) 0.77899(5) 0.0767(2) Uani 1 1 d .
Sb2 Sb 0.31138(8) 0.73755(7) 0.30743(6) 0.0866(3) Uani 1 1 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'
F F 0.0171 0.0103 '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'
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
N4 Ag1 N6 119.6(3) 1_554 .
N4 Ag1 N2 111.2(3) 1_554 .
N6 Ag1 N2 119.0(2) . .
N4 Ag1 N8 86.6(3) 1_554 1_544
N6 Ag1 N8 108.3(3) . 1_544
N2 Ag1 N8 106.0(3) . 1_544
N5 Ag2 N3 121.0(3) . 1_566
N5 Ag2 N1 117.4(2) . .
N3 Ag2 N1 110.7(3) 1_566 .
N5 Ag2 N7 105.4(3) . 1_556
N3 Ag2 N7 88.9(3) 1_566 1_556
N1 Ag2 N7 108.6(3) . 1_556
C33 N1 N2 106.4(6) . .
C33 N1 Ag2 122.0(6) . .
N2 N1 Ag2 122.8(5) . .
C49 N2 N1 106.7(6) . .
C49 N2 Ag1 126.0(5) . .
N1 N2 Ag1 116.5(5) . .
C64 N3 Ag2 163.9(10) . 1_544
C46 N4 Ag1 165.9(10) . 1_556
C17 N5 N6 106.1(6) . .
C17 N5 Ag2 130.5(5) . .
N6 N5 Ag2 119.6(5) . .
C1 N6 N5 107.0(6) . .
C1 N6 Ag1 128.6(5) . .
N5 N6 Ag1 121.5(5) . .
C14 N7 Ag2 160.4(9) . 1_554
C30 N8 Ag1 157.9(9) . 1_566
N6 C1 O1 111.6(7) . .
N6 C1 C2 128.0(7) . .
O1 C1 C2 120.4(7) . .
C3 C2 C7 120.6(8) . .
C3 C2 C1 120.8(7) . .
C7 C2 C1 118.3(8) . .
C2 C3 C4 118.8(8) . .
C2 C3 H3 120.6 . .
C4 C3 H3 120.6 . .
C3 C4 C5 121.0(9) . .
C3 C4 H4 119.5 . .
C5 C4 H4 119.5 . .
C6 C5 C4 118.8(8) . .
C6 C5 H5 120.6 . .
C4 C5 H5 120.6 . .
C7 C6 C5 121.3(8) . .
C7 C6 C8 120.2(9) . .
C5 C6 C8 118.5(8) . .
C6 C7 C2 119.3(8) . .
C6 C7 H7 120.3 . .
C2 C7 H7 120.3 . .
C9 C8 C6 174.9(10) . .
C8 C9 C10 178.3(12) . .
C11 C10 C16 120.7(9) . .
C11 C10 C9 120.4(9) . .
C16 C10 C9 119.0(9) . .
C10 C11 C12 119.5(9) . .
C10 C11 H11 120.2 . .
C12 C11 H11 120.2 . .
C11 C12 C13 118.8(9) . .
C11 C12 H12 120.6 . .
C13 C12 H12 120.6 . .
C15 C13 C12 120.4(8) . .
C15 C13 C14 121.4(10) . .
C12 C13 C14 118.1(9) . .
N7 C14 C13 179.4(12) . .
C13 C15 C16 121.0(10) . .
C13 C15 H15 119.5 . .
C16 C15 H15 119.5 . .
C15 C16 C10 119.3(9) . .
C15 C16 H16 120.4 . .
C10 C16 H16 120.4 . .
N5 C17 O1 112.1(6) . .
N5 C17 C18 128.3(7) . .
O1 C17 C18 119.6(7) . .
C19 C18 C23 119.2(7) . .
C19 C18 C17 121.7(8) . .
C23 C18 C17 119.1(7) . .
C18 C19 C20 119.9(9) . .
C18 C19 H19 120.1 . .
C20 C19 H19 120.1 . .
C21 C20 C19 119.8(9) . .
C21 C20 H20 120.1 . .
C19 C20 H20 120.1 . .
C22 C21 C20 121.0(8) . .
C22 C21 H21 119.5 . .
C20 C21 H21 119.5 . .
C21 C22 C23 118.6(9) . .
C21 C22 C24 121.8(8) . .
C23 C22 C24 119.5(9) . .
C18 C23 C22 121.4(8) . .
C18 C23 H23 119.3 . .
C22 C23 H23 119.3 . .
C25 C24 C22 177.6(11) . .
C24 C25 C26 177.3(11) . .
C27 C26 C25 121.4(9) . .
C27 C26 C32 116.8(9) . .
C25 C26 C32 121.7(9) . .
C28 C27 C26 122.9(9) . .
C28 C27 H27 118.5 . .
C26 C27 H27 118.5 . .
C27 C28 C29 117.4(9) . .
C27 C28 H28 121.3 . .
C29 C28 H28 121.3 . .
C31 C29 C28 121.6(9) . .
C31 C29 C30 119.6(9) . .
C28 C29 C30 118.8(9) . .
N8 C30 C29 179.1(12) . .
C32 C31 C29 119.8(9) . .
C32 C31 H31 120.1 . .
C29 C31 H31 120.1 . .
C31 C32 C26 121.4(9) . .
C31 C32 H32 119.3 . .
C26 C32 H32 119.3 . .
N1 C33 O2 111.8(7) . .
N1 C33 C34 129.4(7) . .
O2 C33 C34 118.8(7) . .
C39 C34 C35 120.2(8) . .
C39 C34 C33 119.8(8) . .
C35 C34 C33 119.8(7) . .
C36 C35 C34 120.0(8) . .
C36 C35 H35 120.0 . .
C34 C35 H35 120.0 . .
C35 C36 C37 119.5(10) . .
C35 C36 H36 120.3 . .
C37 C36 H36 120.3 . .
C36 C37 C38 121.1(9) . .
C36 C37 H37 119.4 . .
C38 C37 H37 119.4 . .
C39 C38 C37 118.8(8) . .
C39 C38 C40 121.4(9) . .
C37 C38 C40 119.7(9) . .
C38 C39 C34 120.4(9) . .
C38 C39 H39 119.8 . .
C34 C39 H39 119.8 . .
C41 C40 C38 178.4(11) . .
C40 C41 C42 179.5(11) . .
C43 C42 C48 118.6(9) . .
C43 C42 C41 121.9(9) . .
C48 C42 C41 119.4(10) . .
C44 C43 C42 122.2(10) . .
C44 C43 H43 118.9 . .
C42 C43 H43 118.9 . .
C43 C44 C45 119.5(10) . .
C43 C44 H44 120.2 . .
C45 C44 H44 120.2 . .
C47 C45 C44 121.1(9) . .
C47 C45 C46 118.6(10) . .
C44 C45 C46 120.2(9) . .
N4 C46 C45 175.4(12) . .
C45 C47 C48 117.9(11) . .
C45 C47 H47 121.0 . .
C48 C47 H47 121.0 . .
C42 C48 C47 120.5(11) . .
C42 C48 H48 119.7 . .
C47 C48 H48 119.7 . .
N2 C49 O2 111.8(6) . .
N2 C49 C50 129.6(7) . .
O2 C49 C50 118.5(7) . .
C55 C50 C51 120.0(7) . .
C55 C50 C49 119.9(7) . .
C51 C50 C49 120.1(8) . .
C52 C51 C50 118.9(9) . .
C52 C51 H51 120.6 . .
C50 C51 H51 120.6 . .
C53 C52 C51 121.6(9) . .
C53 C52 H52 119.2 . .
C51 C52 H52 119.2 . .
C52 C53 C54 120.4(8) . .
C52 C53 H53 119.8 . .
C54 C53 H53 119.8 . .
C53 C54 C55 118.4(8) . .
C53 C54 C56 120.4(8) . .
C55 C54 C56 121.1(8) . .
C50 C55 C54 120.6(8) . .
C50 C55 H55 119.7 . .
C54 C55 H55 119.7 . .
C57 C56 C54 178.0(10) . .
C56 C57 C58 178.5(11) . .
C63 C58 C59 118.1(9) . .
C63 C58 C57 119.8(9) . .
C59 C58 C57 122.1(9) . .
C60 C59 C58 121.2(10) . .
C60 C59 H59 119.4 . .
C58 C59 H59 119.4 . .
C61 C60 C59 120.1(10) . .
C61 C60 H60 120.0 . .
C59 C60 H60 120.0 . .
C60 C61 C62 121.0(9) . .
C60 C61 C64 119.9(10) . .
C62 C61 C64 119.0(10) . .
C63 C62 C61 119.1(11) . .
C63 C62 H62 120.4 . .
C61 C62 H62 120.4 . .
C58 C63 C62 120.4(11) . .
C58 C63 H63 119.8 . .
C62 C63 H63 119.8 . .
N3 C64 C61 175.3(13) . .
C66 C65 C70 112(2) . .
C66 C65 H65 124.0 . .
C70 C65 H65 124.0 . .
C65 C66 C67 123(3) . .
C65 C66 H66 118.4 . .
C67 C66 H66 118.4 . .
C66 C67 C68 120(2) . .
C66 C67 H67 119.8 . .
C68 C67 H67 119.8 . .
C69 C68 C67 119(2) . .
C69 C68 H68 120.4 . .
C67 C68 H68 120.4 . .
C68 C69 C70 120(2) . .
C68 C69 H69 119.8 . .
C70 C69 H69 119.8 . .
C69 C70 C65 125(2) . .
C69 C70 H70 117.7 . .
C65 C70 H70 117.7 . .
C72 C71 C76 120(2) . .
C72 C71 H71 120.1 . .
C76 C71 H71 120.1 . .
C73 C72 C71 120(2) . .
C73 C72 H72 119.9 . .
C71 C72 H72 119.9 . .
C72 C73 C74 120(2) . .
C72 C73 H73 120.1 . .
C74 C73 H73 120.1 . .
C75 C74 C73 121(2) . .
C75 C74 H74 119.5 . .
C73 C74 H74 119.5 . .
C74 C75 C76 119(2) . .
C74 C75 H75 120.5 . .
C76 C75 H75 120.5 . .
C71 C76 C75 120(2) . .
C71 C76 H76 119.9 . .
C75 C76 H76 119.9 . .
O3 C77 C78 106.3(14) . .
O3 C77 H77A 110.5 . .
C78 C77 H77A 110.5 . .
O3 C77 H77B 110.5 . .
C78 C77 H77B 110.5 . .
H77A C77 H77B 108.7 . .
C79 C78 C77 108.1(17) . .
C79 C78 H78A 110.1 . .
C77 C78 H78A 110.1 . .
C79 C78 H78B 110.1 . .
C77 C78 H78B 110.1 . .
H78A C78 H78B 108.4 . .
C78 C79 C80 105.9(18) . .
C78 C79 H79A 110.6 . .
C80 C79 H79A 110.6 . .
C78 C79 H79B 110.6 . .
C80 C79 H79B 110.6 . .
H79A C79 H79B 108.7 . .
O3 C80 C79 107.7(15) . .
O3 C80 H80A 110.2 . .
C79 C80 H80A 110.2 . .
O3 C80 H80B 110.2 . .
C79 C80 H80B 110.2 . .
H80A C80 H80B 108.5 . .
O4 C81 C82 98(2) . .
O4 C81 H81A 112.2 . .
C82 C81 H81A 112.2 . .
O4 C81 H81B 112.2 . .
C82 C81 H81B 112.2 . .
H81A C81 H81B 109.8 . .
C83 C82 C81 106(2) . .
C83 C82 H82A 110.5 . .
C81 C82 H82A 110.5 . .
C83 C82 H82B 110.5 . .
C81 C82 H82B 110.5 . .
H82A C82 H82B 108.7 . .
C84 C83 C82 108(3) . .
C84 C83 H83A 110.1 . .
C82 C83 H83A 110.1 . .
C84 C83 H83B 110.1 . .
C82 C83 H83B 110.1 . .
H83A C83 H83B 108.4 . .
C83 C84 O4 101(3) . .
C83 C84 H84A 111.6 . .
O4 C84 H84A 111.6 . .
C83 C84 H84B 111.6 . .
O4 C84 H84B 111.6 . .
H84A C84 H84B 109.4 . .
C17 O1 C1 103.2(6) . .
C33 O2 C49 103.2(6) . .
C77 O3 C80 110.6(11) . .
C81 O4 C84 112(3) . .
F11 Sb1 F12 92.4(5) . .
F11 Sb1 F9 86.5(5) . .
F12 Sb1 F9 178.6(5) . .
F11 Sb1 F7 89.6(5) . .
F12 Sb1 F7 91.4(5) . .
F9 Sb1 F7 89.4(4) . .
F11 Sb1 F8 177.5(5) . .
F12 Sb1 F8 90.0(5) . .
F9 Sb1 F8 91.1(4) . .
F7 Sb1 F8 91.0(4) . .
F11 Sb1 F10 90.5(4) . .
F12 Sb1 F10 91.1(4) . .
F9 Sb1 F10 88.0(4) . .
F7 Sb1 F10 177.4(4) . .
F8 Sb1 F10 88.9(4) . .
F2 Sb2 F5 87.5(7) . .
F2 Sb2 F3 92.6(7) . .
F5 Sb2 F3 176.7(9) . .
F2 Sb2 F4 173.7(10) . .
F5 Sb2 F4 87.9(7) . .
F3 Sb2 F4 92.1(6) . .
F2 Sb2 F1 88.3(7) . .
F5 Sb2 F1 79.6(8) . .
F3 Sb2 F1 97.1(8) . .
F4 Sb2 F1 95.2(8) . .
F2 Sb2 F6 89.8(8) . .
F5 Sb2 F6 100.0(9) . .
F3 Sb2 F6 83.3(8) . .
F4 Sb2 F6 86.6(8) . .
F1 Sb2 F6 178.1(8) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N4 2.257(9) 1_554
Ag1 N6 2.278(6) .
Ag1 N2 2.327(7) .
Ag1 N8 2.499(10) 1_544
Ag2 N5 2.282(7) .
Ag2 N3 2.282(9) 1_566
Ag2 N1 2.328(7) .
Ag2 N7 2.473(9) 1_556
N1 C33 1.297(11) .
N1 N2 1.406(9) .
N2 C49 1.294(10) .
N3 C64 1.154(13) .
N3 Ag2 2.282(9) 1_544
N4 C46 1.100(12) .
N4 Ag1 2.257(9) 1_556
N5 C17 1.298(10) .
N5 N6 1.391(9) .
N6 C1 1.292(10) .
N7 C14 1.126(12) .
N7 Ag2 2.473(9) 1_554
N8 C30 1.120(13) .
N8 Ag1 2.499(10) 1_566
C1 O1 1.362(9) .
C1 C2 1.455(11) .
C2 C3 1.368(12) .
C2 C7 1.408(11) .
C3 C4 1.382(13) .
C3 H3 0.9300 .
C4 C5 1.403(13) .
C4 H4 0.9300 .
C5 C6 1.365(13) .
C5 H5 0.9300 .
C6 C7 1.363(12) .
C6 C8 1.440(12) .
C7 H7 0.9300 .
C8 C9 1.197(12) .
C9 C10 1.448(13) .
C10 C11 1.369(14) .
C10 C16 1.404(14) .
C11 C12 1.408(13) .
C11 H11 0.9300 .
C12 C13 1.410(14) .
C12 H12 0.9300 .
C13 C15 1.352(14) .
C13 C14 1.436(14) .
C15 C16 1.378(13) .
C15 H15 0.9300 .
C16 H16 0.9300 .
C17 O1 1.356(10) .
C17 C18 1.451(11) .
C18 C19 1.379(12) .
C18 C23 1.381(12) .
C19 C20 1.397(14) .
C19 H19 0.9300 .
C20 C21 1.377(16) .
C20 H20 0.9300 .
C21 C22 1.370(13) .
C21 H21 0.9300 .
C22 C23 1.392(11) .
C22 C24 1.451(14) .
C23 H23 0.9300 .
C24 C25 1.185(14) .
C25 C26 1.418(14) .
C26 C27 1.378(13) .
C26 C32 1.420(13) .
C27 C28 1.371(14) .
C27 H27 0.9300 .
C28 C29 1.388(13) .
C28 H28 0.9300 .
C29 C31 1.376(13) .
C29 C30 1.461(15) .
C31 C32 1.336(15) .
C31 H31 0.9300 .
C32 H32 0.9300 .
C33 O2 1.368(9) .
C33 C34 1.451(11) .
C34 C39 1.385(11) .
C34 C35 1.398(12) .
C35 C36 1.373(13) .
C35 H35 0.9300 .
C36 C37 1.380(14) .
C36 H36 0.9300 .
C37 C38 1.406(15) .
C37 H37 0.9300 .
C38 C39 1.373(12) .
C38 C40 1.430(12) .
C39 H39 0.9300 .
C40 C41 1.191(13) .
C41 C42 1.433(13) .
C42 C43 1.369(14) .
C42 C48 1.376(15) .
C43 C44 1.330(13) .
C43 H43 0.9300 .
C44 C45 1.382(15) .
C44 H44 0.9300 .
C45 C47 1.368(15) .
C45 C46 1.492(14) .
C47 C48 1.400(15) .
C47 H47 0.9300 .
C48 H48 0.9300 .
C49 O2 1.368(10) .
C49 C50 1.458(11) .
C50 C55 1.378(12) .
C50 C51 1.396(12) .
C51 C52 1.369(13) .
C51 H51 0.9300 .
C52 C53 1.365(15) .
C52 H52 0.9300 .
C53 C54 1.388(13) .
C53 H53 0.9300 .
C54 C55 1.396(11) .
C54 C56 1.422(12) .
C55 H55 0.9300 .
C56 C57 1.196(13) .
C57 C58 1.432(13) .
C58 C63 1.378(14) .
C58 C59 1.397(14) .
C59 C60 1.363(14) .
C59 H59 0.9300 .
C60 C61 1.339(14) .
C60 H60 0.9300 .
C61 C62 1.386(15) .
C61 C64 1.443(15) .
C62 C63 1.386(15) .
C62 H62 0.9300 .
C63 H63 0.9300 .
C65 C66 1.30(4) .
C65 C70 1.42(4) .
C65 H65 0.9300 .
C66 C67 1.36(4) .
C66 H66 0.9300 .
C67 C68 1.37(3) .
C67 H67 0.9300 .
C68 C69 1.24(2) .
C68 H68 0.9300 .
C69 C70 1.34(3) .
C69 H69 0.9300 .
C70 H70 0.9300 .
C71 C72 1.289(15) .
C71 C76 1.294(15) .
C71 H71 0.9300 .
C72 C73 1.286(14) .
C72 H72 0.9300 .
C73 C74 1.287(15) .
C73 H73 0.9300 .
C74 C75 1.285(15) .
C74 H74 0.9300 .
C75 C76 1.297(15) .
C75 H75 0.9300 .
C76 H76 0.9300 .
C77 O3 1.389(17) .
C77 C78 1.441(10) .
C77 H77A 0.9700 .
C77 H77B 0.9700 .
C78 C79 1.433(10) .
C78 H78A 0.9700 .
C78 H78B 0.9700 .
C79 C80 1.437(10) .
C79 H79A 0.9700 .
C79 H79B 0.9700 .
C80 O3 1.399(16) .
C80 H80A 0.9700 .
C80 H80B 0.9700 .
C81 O4 1.31(5) .
C81 C82 1.47(5) .
C81 H81A 0.9700 .
C81 H81B 0.9700 .
C82 C83 1.45(4) .
C82 H82A 0.9700 .
C82 H82B 0.9700 .
C83 C84 1.36(3) .
C83 H83A 0.9700 .
C83 H83B 0.9700 .
C84 O4 1.46(3) .
C84 H84A 0.9700 .
C84 H84B 0.9700 .
F1 Sb2 1.821(12) .
F2 Sb2 1.771(11) .
F3 Sb2 1.817(10) .
F4 Sb2 1.818(11) .
F5 Sb2 1.807(13) .
F6 Sb2 1.832(14) .
F7 Sb1 1.850(7) .
F8 Sb1 1.861(7) .
F9 Sb1 1.850(8) .
F10 Sb1 1.877(7) .
F11 Sb1 1.827(9) .
F12 Sb1 1.845(9) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
N5 Ag2 N1 C33 156.2(6) .
N3 Ag2 N1 C33 11.6(7) 1_566
N7 Ag2 N1 C33 -84.5(7) 1_556
N5 Ag2 N1 N2 13.0(7) .
N3 Ag2 N1 N2 -131.6(6) 1_566
N7 Ag2 N1 N2 132.3(6) 1_556
C33 N1 N2 C49 -0.6(9) .
Ag2 N1 N2 C49 147.5(6) .
C33 N1 N2 Ag1 -147.2(6) .
Ag2 N1 N2 Ag1 0.8(8) .
N4 Ag1 N2 C49 -9.3(8) 1_554
N6 Ag1 N2 C49 -154.4(6) .
N8 Ag1 N2 C49 83.3(7) 1_544
N4 Ag1 N2 N1 130.1(6) 1_554
N6 Ag1 N2 N1 -15.0(6) .
N8 Ag1 N2 N1 -137.3(5) 1_544
N3 Ag2 N5 C17 -76.7(8) 1_566
N1 Ag2 N5 C17 142.5(7) .
N7 Ag2 N5 C17 21.4(7) 1_556
N3 Ag2 N5 N6 128.4(6) 1_566
N1 Ag2 N5 N6 -12.4(6) .
N7 Ag2 N5 N6 -133.4(5) 1_556
C17 N5 N6 C1 0.2(8) .
Ag2 N5 N6 C1 160.6(5) .
C17 N5 N6 Ag1 -162.0(5) .
Ag2 N5 N6 Ag1 -1.7(7) .
N4 Ag1 N6 C1 75.6(8) 1_554
N2 Ag1 N6 C1 -142.2(7) .
N8 Ag1 N6 C1 -21.1(8) 1_544
N4 Ag1 N6 N5 -126.3(6) 1_554
N2 Ag1 N6 N5 15.9(6) .
N8 Ag1 N6 N5 137.0(6) 1_544
N5 N6 C1 O1 -0.3(9) .
Ag1 N6 C1 O1 160.3(5) .
N5 N6 C1 C2 -177.1(8) .
Ag1 N6 C1 C2 -16.4(12) .
N6 C1 C2 C3 138.4(9) .
O1 C1 C2 C3 -38.1(12) .
N6 C1 C2 C7 -36.1(13) .
O1 C1 C2 C7 147.4(7) .
C7 C2 C3 C4 -2.0(14) .
C1 C2 C3 C4 -176.4(9) .
C2 C3 C4 C5 2.6(15) .
C3 C4 C5 C6 -0.9(15) .
C4 C5 C6 C7 -1.3(15) .
C4 C5 C6 C8 178.4(9) .
C5 C6 C7 C2 1.8(14) .
C8 C6 C7 C2 -177.8(8) .
C3 C2 C7 C6 -0.1(13) .
C1 C2 C7 C6 174.3(8) .
C7 C6 C8 C9 114(13) .
C5 C6 C8 C9 -65(13) .
C6 C8 C9 C10 -117(37) .
C8 C9 C10 C11 -25(40) .
C8 C9 C10 C16 154(39) .
C16 C10 C11 C12 0.6(16) .
C9 C10 C11 C12 179.7(9) .
C10 C11 C12 C13 1.0(15) .
C11 C12 C13 C15 -4.8(16) .
C11 C12 C13 C14 179.1(9) .
Ag2 N7 C14 C13 114(100) 1_554
C15 C13 C14 N7 5(100) .
C12 C13 C14 N7 -179(100) .
C12 C13 C15 C16 7.0(18) .
C14 C13 C15 C16 -177.0(11) .
C13 C15 C16 C10 -5.3(19) .
C11 C10 C16 C15 1.5(17) .
C9 C10 C16 C15 -177.6(11) .
N6 N5 C17 O1 -0.1(9) .
Ag2 N5 C17 O1 -157.5(5) .
N6 N5 C17 C18 178.0(8) .
Ag2 N5 C17 C18 20.6(12) .
N5 C17 C18 C19 -151.2(9) .
O1 C17 C18 C19 26.7(13) .
N5 C17 C18 C23 25.6(13) .
O1 C17 C18 C23 -156.5(8) .
C23 C18 C19 C20 -1.3(15) .
C17 C18 C19 C20 175.5(10) .
C18 C19 C20 C21 -2.3(18) .
C19 C20 C21 C22 4.5(18) .
C20 C21 C22 C23 -3.0(15) .
C20 C21 C22 C24 178.1(10) .
C19 C18 C23 C22 2.8(13) .
C17 C18 C23 C22 -174.1(8) .
C21 C22 C23 C18 -0.7(13) .
C24 C22 C23 C18 178.2(8) .
C21 C22 C24 C25 6(25) .
C23 C22 C24 C25 -173(25) .
C22 C24 C25 C26 59(39) .
C24 C25 C26 C27 148(23) .
C24 C25 C26 C32 -34(23) .
C25 C26 C27 C28 178.9(9) .
C32 C26 C27 C28 1.2(15) .
C26 C27 C28 C29 -0.8(15) .
C27 C28 C29 C31 1.1(14) .
C27 C28 C29 C30 -178.7(9) .
Ag1 N8 C30 C29 -91(81) 1_566
C31 C29 C30 N8 -25(81) .
C28 C29 C30 N8 155(81) .
C28 C29 C31 C32 -1.9(16) .
C30 C29 C31 C32 177.9(10) .
C29 C31 C32 C26 2.3(18) .
C27 C26 C32 C31 -2.0(16) .
C25 C26 C32 C31 -179.7(11) .
N2 N1 C33 O2 0.5(9) .
Ag2 N1 C33 O2 -147.9(5) .
N2 N1 C33 C34 179.2(8) .
Ag2 N1 C33 C34 30.8(12) .
N1 C33 C34 C39 28.7(13) .
O2 C33 C34 C39 -152.7(7) .
N1 C33 C34 C35 -145.9(9) .
O2 C33 C34 C35 32.7(12) .
C39 C34 C35 C36 2.9(14) .
C33 C34 C35 C36 177.4(9) .
C34 C35 C36 C37 -1.5(15) .
C35 C36 C37 C38 0.2(16) .
C36 C37 C38 C39 -0.3(15) .
C36 C37 C38 C40 -176.2(9) .
C37 C38 C39 C34 1.6(13) .
C40 C38 C39 C34 177.4(8) .
C35 C34 C39 C38 -2.9(13) .
C33 C34 C39 C38 -177.5(8) .
C39 C38 C40 C41 -77(43) .
C37 C38 C40 C41 99(43) .
C38 C40 C41 C42 5(100) .
C40 C41 C42 C43 120(100) .
C40 C41 C42 C48 -62(100) .
C48 C42 C43 C44 1.7(18) .
C41 C42 C43 C44 179.9(11) .
C42 C43 C44 C45 -2.3(18) .
C43 C44 C45 C47 -0.8(18) .
C43 C44 C45 C46 -175.7(11) .
Ag1 N4 C46 C45 21(21) 1_556
C47 C45 C46 N4 -154(17) .
C44 C45 C46 N4 21(18) .
C44 C45 C47 C48 4(2) .
C46 C45 C47 C48 179.2(12) .
C43 C42 C48 C47 1.9(19) .
C41 C42 C48 C47 -176.4(13) .
C45 C47 C48 C42 -5(2) .
N1 N2 C49 O2 0.4(9) .
Ag1 N2 C49 O2 143.0(6) .
N1 N2 C49 C50 -176.4(8) .
Ag1 N2 C49 C50 -33.8(12) .
N2 C49 C50 C55 -23.3(14) .
O2 C49 C50 C55 160.1(8) .
N2 C49 C50 C51 155.2(9) .
O2 C49 C50 C51 -21.4(12) .
C55 C50 C51 C52 1.8(14) .
C49 C50 C51 C52 -176.7(9) .
C50 C51 C52 C53 -0.7(17) .
C51 C52 C53 C54 -0.2(17) .
C52 C53 C54 C55 0.0(14) .
C52 C53 C54 C56 -178.7(10) .
C51 C50 C55 C54 -2.1(13) .
C49 C50 C55 C54 176.4(8) .
C53 C54 C55 C50 1.2(12) .
C56 C54 C55 C50 179.8(8) .
C53 C54 C56 C57 -53(26) .
C55 C54 C56 C57 128(26) .
C54 C56 C57 C58 -113(43) .
C56 C57 C58 C63 124(42) .
C56 C57 C58 C59 -55(43) .
C63 C58 C59 C60 -0.4(15) .
C57 C58 C59 C60 178.7(10) .
C58 C59 C60 C61 2.4(16) .
C59 C60 C61 C62 -2.5(17) .
C59 C60 C61 C64 178.3(10) .
C60 C61 C62 C63 0.6(19) .
C64 C61 C62 C63 179.7(12) .
C59 C58 C63 C62 -1.6(18) .
C57 C58 C63 C62 179.3(12) .
C61 C62 C63 C58 2(2) .
Ag2 N3 C64 C61 -18(19) 1_544
C60 C61 C64 N3 -30(17) .
C62 C61 C64 N3 151(16) .
C70 C65 C66 C67 5(5) .
C65 C66 C67 C68 -6(5) .
C66 C67 C68 C69 1(4) .
C67 C68 C69 C70 5(4) .
C68 C69 C70 C65 -6(4) .
C66 C65 C70 C69 1(4) .
C76 C71 C72 C73 -0.1(4) .
C71 C72 C73 C74 0.1(4) .
C72 C73 C74 C75 -0.4(9) .
C73 C74 C75 C76 0.5(11) .
C72 C71 C76 C75 0.2(8) .
C74 C75 C76 C71 -0.4(11) .
O3 C77 C78 C79 -11(4) .
C77 C78 C79 C80 12(4) .
C78 C79 C80 O3 -9(3) .
O4 C81 C82 C83 -30(4) .
C81 C82 C83 C84 11(4) .
C82 C83 C84 O4 11(4) .
N5 C17 O1 C1 -0.1(8) .
C18 C17 O1 C1 -178.3(7) .
N6 C1 O1 C17 0.3(8) .
C2 C1 O1 C17 177.3(7) .
N1 C33 O2 C49 -0.2(9) .
C34 C33 O2 C49 -179.1(7) .
N2 C49 O2 C33 -0.1(9) .
C50 C49 O2 C33 177.0(7) .
C78 C77 O3 C80 5(3) .
C79 C80 O3 C77 3(2) .
C82 C81 O4 C84 40(4) .
C83 C84 O4 C81 -34(5) .
