#------------------------------------------------------------------------------
#$Date: 2016-03-22 23:54:16 +0200 (Tue, 22 Mar 2016) $
#$Revision: 179083 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/45/4304520.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_4304520
loop_
_publ_author_name
'Mei-Li Chen'
'Xue-Fei Xu'
'Ze-Xing Cao'
'Quan-Ming Wang'
_publ_section_title
;
Ligand- and Anion-Controlled Formation of Silver Alkynyl Oligomers from
Soluble Precursors
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1877
_journal_page_last               1879
_journal_paper_doi               10.1021/ic702023e
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'C56 H54 Ag5 F9 N8 O10 S3'
_chemical_formula_weight         1805.60
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 100.523(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.9036(12)
_cell_length_b                   16.7075(6)
_cell_length_c                   21.7841(18)
_cell_measurement_temperature    293(2)
_cell_volume                     6406.6(7)
_computing_cell_refinement       'CrysAlis RED, Oxford Diffraction Ltd.'
_computing_data_collection       'CrysAlis CCD, Oxford Diffraction Ltd.'
_computing_data_reduction        'CrysAlis RED, Oxford Diffraction Ltd.'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.867
_diffrn_measurement_device_type  'Oxford Gemini S Ultra'
_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  0.0560
_diffrn_reflns_av_sigmaI/netI    0.1304
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            21554
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         30.69
_diffrn_reflns_theta_min         2.31
_exptl_absorpt_coefficient_mu    1.687
_exptl_absorpt_correction_T_max  0.7511
_exptl_absorpt_correction_T_min  0.7079
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May  8 2007,13:10:02)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.872
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block-like
_exptl_crystal_F_000             3560
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.18
_refine_diff_density_max         1.405
_refine_diff_density_min         -0.977
_refine_diff_density_rms         0.115
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.858
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     400
_refine_ls_number_reflns         8625
_refine_ls_number_restraints     67
_refine_ls_restrained_S_all      0.867
_refine_ls_R_factor_all          0.1050
_refine_ls_R_factor_gt           0.0427
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0484P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0940
_refine_ls_wR_factor_ref         0.1064
_reflns_number_gt                4003
_reflns_number_total             8625
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic702023e-file003_2.cif
_cod_data_source_block           2
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4304520
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
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 0.0000 0.5000 0.0000 0.03506(14) Uani 1 2 d S . .
Ag2 Ag -0.15454(2) 0.55845(2) -0.048879(18) 0.04456(12) Uani 1 1 d . . .
Ag3 Ag 0.06586(2) 0.64413(2) -0.037936(18) 0.04600(13) Uani 1 1 d . . .
N1 N -0.2167(2) 0.6605(2) -0.10664(18) 0.0378(9) Uani 1 1 d . . .
N2 N -0.1230(2) 0.6781(2) 0.00612(18) 0.0395(10) Uani 1 1 d . . .
N3 N -0.0196(2) 0.6538(3) -0.13230(18) 0.0412(10) Uani 1 1 d . . .
N4 N 0.0415(2) 0.7786(2) -0.05873(17) 0.0380(10) Uani 1 1 d . . .
C1 C -0.0965(3) 0.4378(3) -0.0438(2) 0.0328(10) Uani 1 1 d . . .
C2 C -0.1495(3) 0.4131(3) -0.0788(2) 0.0405(12) Uani 1 1 d D . .
C3 C -0.2127(3) 0.3732(3) -0.1250(3) 0.0639(18) Uani 1 1 d D . .
C4 C -0.2823(6) 0.3640(11) -0.0922(7) 0.154(9) Uiso 0.50 1 d PD . .
C5 C -0.1800(6) 0.2862(5) -0.1391(5) 0.062(4) Uiso 0.50 1 d PD . .
C6 C -0.2291(8) 0.4214(8) -0.1860(5) 0.096(6) Uiso 0.50 1 d PD . .
C4' C -0.2016(7) 0.2826(5) -0.1204(6) 0.075(5) Uiso 0.50 1 d PD . .
C5' C -0.2911(4) 0.4026(7) -0.1105(5) 0.051(3) Uiso 0.50 1 d PD . .
C6' C -0.2065(6) 0.4065(6) -0.1931(3) 0.045(3) Uiso 0.50 1 d PD . .
C7 C -0.2625(3) 0.6511(3) -0.1618(2) 0.0413(12) Uani 1 1 d . . .
H7A H -0.2678 0.6002 -0.1791 0.050 Uiso 1 1 calc R . .
C8 C -0.3021(3) 0.7125(4) -0.1940(2) 0.0511(14) Uani 1 1 d . . .
H8A H -0.3320 0.7040 -0.2330 0.061 Uiso 1 1 calc R . .
C9 C -0.2965(3) 0.7874(3) -0.1672(3) 0.0537(15) Uani 1 1 d . . .
H9A H -0.3244 0.8299 -0.1873 0.064 Uiso 1 1 calc R . .
C10 C -0.2495(3) 0.7990(3) -0.1109(2) 0.0425(12) Uani 1 1 d . . .
H10A H -0.2453 0.8494 -0.0926 0.051 Uiso 1 1 calc R . .
C11 C -0.2083(3) 0.7351(3) -0.0811(2) 0.0335(11) Uani 1 1 d . . .
C12 C -0.1561(3) 0.7453(3) -0.0218(2) 0.0352(11) Uani 1 1 d . . .
C13 C -0.1406(3) 0.8201(3) 0.0059(3) 0.0527(14) Uani 1 1 d . . .
H13A H -0.1639 0.8656 -0.0135 0.063 Uiso 1 1 calc R . .
C14 C -0.0908(3) 0.8268(4) 0.0618(3) 0.0581(16) Uani 1 1 d . . .
H14A H -0.0799 0.8764 0.0806 0.070 Uiso 1 1 calc R . .
C15 C -0.0573(3) 0.7576(4) 0.0893(2) 0.0613(17) Uani 1 1 d . . .
H15A H -0.0234 0.7599 0.1271 0.074 Uiso 1 1 calc R . .
C16 C -0.0749(3) 0.6861(4) 0.0600(2) 0.0489(14) Uani 1 1 d . . .
H16A H -0.0519 0.6402 0.0789 0.059 Uiso 1 1 calc R . .
C17 C -0.0432(3) 0.5920(3) -0.1696(2) 0.0492(13) Uani 1 1 d . . .
H17A H -0.0303 0.5405 -0.1552 0.059 Uiso 1 1 calc R . .
C18 C -0.0863(3) 0.6012(4) -0.2290(3) 0.0524(14) Uani 1 1 d . . .
H18A H -0.1014 0.5570 -0.2541 0.063 Uiso 1 1 calc R . .
C19 C -0.1058(3) 0.6763(4) -0.2495(3) 0.0517(14) Uani 1 1 d . . .
H19A H -0.1351 0.6840 -0.2889 0.062 Uiso 1 1 calc R . .
C20 C -0.0818(3) 0.7424(3) -0.2112(2) 0.0465(13) Uani 1 1 d . . .
H20A H -0.0945 0.7942 -0.2250 0.056 Uiso 1 1 calc R . .
C21 C -0.0391(3) 0.7290(3) -0.1528(2) 0.0357(11) Uani 1 1 d . . .
C22 C -0.0094(3) 0.7970(3) -0.1100(2) 0.0333(11) Uani 1 1 d . . .
C23 C -0.0335(3) 0.8757(3) -0.1228(2) 0.0455(13) Uani 1 1 d . . .
H23A H -0.0708 0.8865 -0.1575 0.055 Uiso 1 1 calc R . .
C24 C -0.0030(3) 0.9374(3) -0.0846(2) 0.0510(14) Uani 1 1 d . . .
H24A H -0.0181 0.9900 -0.0936 0.061 Uiso 1 1 calc R . .
C25 C 0.0508(3) 0.9193(3) -0.0324(2) 0.0524(14) Uani 1 1 d . . .
H25A H 0.0733 0.9594 -0.0056 0.063 Uiso 1 1 calc R . .
C26 C 0.0704(3) 0.8395(3) -0.0212(2) 0.0459(13) Uani 1 1 d . . .
H26A H 0.1056 0.8274 0.0145 0.055 Uiso 1 1 calc R . .
S1 S 0.20479(7) 0.53417(8) -0.09287(6) 0.0418(3) Uani 1 1 d . . .
O1 O 0.1878(2) 0.6174(2) -0.08237(19) 0.0647(12) Uani 1 1 d . . .
O2 O 0.2414(2) 0.4903(2) -0.03909(15) 0.0519(10) Uani 1 1 d . . .
O3 O 0.1454(2) 0.4894(3) -0.13238(18) 0.0645(11) Uani 1 1 d . . .
C27 C 0.2787(3) 0.5425(3) -0.1401(2) 0.0362(11) Uani 1 1 d . . .
F1 F 0.30173(19) 0.46946(18) -0.15531(15) 0.0606(9) Uani 1 1 d . . .
F2 F 0.34020(17) 0.5809(2) -0.10969(13) 0.0613(9) Uani 1 1 d . . .
F3 F 0.25585(16) 0.5834(2) -0.19233(12) 0.0535(8) Uani 1 1 d . . .
S2 S -0.02694(13) 0.91628(16) 0.24813(13) 0.0497(7) Uiso 0.50 1 d PD . .
O4 O 0.0000 0.8361(4) 0.2500 0.119(3) Uiso 1 2 d SD . .
O5 O -0.0696(5) 0.9303(6) 0.2965(4) 0.107(3) Uiso 0.50 1 d PD . .
O6 O -0.0582(5) 0.9405(6) 0.1858(3) 0.094(3) Uiso 0.50 1 d PD . .
C28 C 0.0560(4) 0.9792(4) 0.2701(3) 0.053(3) Uiso 0.50 1 d PD . .
F4 F 0.0372(4) 1.0574(3) 0.2668(3) 0.075(2) Uiso 0.50 1 d PD . .
F5 F 0.0915(4) 0.9669(5) 0.3277(3) 0.074(2) Uiso 0.50 1 d PD . .
F6 F 0.1049(3) 0.9708(4) 0.2332(3) 0.0683(19) Uiso 0.50 1 d PD . .
C1S C 0.0000 0.6212(8) 0.2500 0.103(4) Uiso 1 2 d S . .
O1S O 0.0379(6) 0.6815(7) 0.2291(5) 0.105(3) Uiso 0.50 1 d P . .
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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Ag1 C1 180.0 . 5_565 ?
C1 Ag1 Ag3 129.39(12) . . ?
C1 Ag1 Ag3 50.61(12) 5_565 . ?
C1 Ag1 Ag3 50.61(12) . 5_565 ?
C1 Ag1 Ag3 129.39(12) 5_565 5_565 ?
Ag3 Ag1 Ag3 180.0 . 5_565 ?
C1 Ag1 Ag2 49.92(12) . . ?
C1 Ag1 Ag2 130.08(12) 5_565 . ?
Ag3 Ag1 Ag2 91.489(11) . . ?
Ag3 Ag1 Ag2 88.511(11) 5_565 . ?
C1 Ag1 Ag2 130.08(12) . 5_565 ?
C1 Ag1 Ag2 49.92(12) 5_565 5_565 ?
Ag3 Ag1 Ag2 88.511(11) . 5_565 ?
Ag3 Ag1 Ag2 91.489(11) 5_565 5_565 ?
Ag2 Ag1 Ag2 180.000(14) . 5_565 ?
C1 Ag2 N1 149.96(15) . . ?
C1 Ag2 N2 132.01(15) . . ?
N1 Ag2 N2 72.11(14) . . ?
C1 Ag2 C2 27.86(15) . . ?
N1 Ag2 C2 127.84(15) . . ?
N2 Ag2 C2 159.50(15) . . ?
C1 Ag2 Ag1 45.05(12) . . ?
N1 Ag2 Ag1 141.08(10) . . ?
N2 Ag2 Ag1 88.59(10) . . ?
C2 Ag2 Ag1 72.44(12) . . ?
C1 Ag3 N4 139.47(15) 5_565 . ?
C1 Ag3 N3 140.46(16) 5_565 . ?
N4 Ag3 N3 71.98(14) . . ?
C1 Ag3 O1 95.23(15) 5_565 . ?
N4 Ag3 O1 103.67(13) . . ?
N3 Ag3 O1 98.33(14) . . ?
C1 Ag3 Ag1 46.37(12) 5_565 . ?
N4 Ag3 Ag1 142.90(10) . . ?
N3 Ag3 Ag1 94.27(10) . . ?
O1 Ag3 Ag1 112.49(9) . . ?
C7 N1 C11 118.6(4) . . ?
C7 N1 Ag2 124.5(3) . . ?
C11 N1 Ag2 116.8(3) . . ?
C16 N2 C12 118.1(5) . . ?
C16 N2 Ag2 126.4(4) . . ?
C12 N2 Ag2 115.5(3) . . ?
C17 N3 C21 118.8(4) . . ?
C17 N3 Ag3 124.5(3) . . ?
C21 N3 Ag3 116.2(3) . . ?
C22 N4 C26 117.3(4) . . ?
C22 N4 Ag3 117.4(3) . . ?
C26 N4 Ag3 125.2(3) . . ?
C2 C1 Ag1 165.9(4) . . ?
C2 C1 Ag3 110.7(4) . 5_565 ?
Ag1 C1 Ag3 83.03(16) . 5_565 ?
C2 C1 Ag2 88.4(3) . . ?
Ag1 C1 Ag2 85.02(16) . . ?
Ag3 C1 Ag2 129.0(2) 5_565 . ?
C1 C2 C3 173.7(5) . . ?
C1 C2 Ag2 63.8(3) . . ?
C3 C2 Ag2 122.3(3) . . ?
C2 C3 C4' 108.5(6) . . ?
C2 C3 C6 110.1(6) . . ?
C4' C3 C6 125.4(8) . . ?
C2 C3 C4 107.5(6) . . ?
C4' C3 C4 88.6(9) . . ?
C6 C3 C4 114.0(8) . . ?
C2 C3 C5' 108.2(5) . . ?
C4' C3 C5' 113.9(7) . . ?
C6 C3 C5' 88.5(7) . . ?
C4 C3 C5' 28.1(8) . . ?
C2 C3 C6' 106.9(5) . . ?
C4' C3 C6' 111.9(6) . . ?
C6 C3 C6' 19.0(7) . . ?
C4 C3 C6' 131.0(8) . . ?
C5' C3 C6' 107.1(6) . . ?
C2 C3 C5 105.5(5) . . ?
C4' C3 C5 22.3(6) . . ?
C6 C3 C5 109.1(7) . . ?
C4 C3 C5 110.3(8) . . ?
C5' C3 C5 133.3(6) . . ?
C6' C3 C5 92.7(6) . . ?
C5' C4 C3 77.4(10) . . ?
C4' C5 C3 70.6(11) . . ?
C6' C6 C3 88.3(15) . . ?
C5 C4' C3 87.0(12) . . ?
C4 C5' C3 74.5(9) . . ?
C6 C6' C3 72.7(13) . . ?
N1 C7 C8 123.4(5) . . ?
C7 C8 C9 118.3(5) . . ?
C10 C9 C8 119.5(5) . . ?
C9 C10 C11 119.9(5) . . ?
N1 C11 C10 120.1(4) . . ?
N1 C11 C12 118.3(4) . . ?
C10 C11 C12 121.6(4) . . ?
N2 C12 C13 120.7(5) . . ?
N2 C12 C11 117.2(4) . . ?
C13 C12 C11 122.1(5) . . ?
C14 C13 C12 120.0(6) . . ?
C13 C14 C15 118.4(6) . . ?
C16 C15 C14 118.9(5) . . ?
N2 C16 C15 123.9(6) . . ?
N3 C17 C18 122.8(5) . . ?
C19 C18 C17 118.4(6) . . ?
C18 C19 C20 120.0(5) . . ?
C21 C20 C19 118.6(5) . . ?
N3 C21 C20 121.3(5) . . ?
N3 C21 C22 117.1(4) . . ?
C20 C21 C22 121.6(5) . . ?
N4 C22 C23 121.3(5) . . ?
N4 C22 C21 116.9(4) . . ?
C23 C22 C21 121.8(4) . . ?
C24 C23 C22 120.8(5) . . ?
C23 C24 C25 118.3(5) . . ?
C24 C25 C26 118.0(5) . . ?
N4 C26 C25 124.2(5) . . ?
O2 S1 O3 113.5(2) . . ?
O2 S1 O1 116.0(2) . . ?
O3 S1 O1 115.9(3) . . ?
O2 S1 C27 103.2(2) . . ?
O3 S1 C27 103.5(2) . . ?
O1 S1 C27 102.1(2) . . ?
S1 O1 Ag3 116.1(2) . . ?
F3 C27 F2 106.0(4) . . ?
F3 C27 F1 108.5(4) . . ?
F2 C27 F1 107.1(4) . . ?
F3 C27 S1 112.4(3) . . ?
F2 C27 S1 111.8(3) . . ?
F1 C27 S1 110.8(3) . . ?
S2 S2 C28 113.4(4) 2 2 ?
S2 S2 O4 70.41(13) 2 . ?
C28 S2 O4 162.4(4) 2 . ?
S2 S2 O6 107.2(5) 2 . ?
C28 S2 O6 51.0(5) 2 . ?
O4 S2 O6 111.5(4) . . ?
S2 S2 O5 127.3(5) 2 . ?
C28 S2 O5 81.0(6) 2 . ?
O4 S2 O5 111.0(5) . . ?
O6 S2 O5 119.0(6) . . ?
S2 S2 F6 143.8(3) 2 2 ?
C28 S2 F6 47.1(4) 2 2 ?
O4 S2 F6 138.9(3) . 2 ?
O6 S2 F6 83.4(5) . 2 ?
O5 S2 F6 36.7(4) . 2 ?
S2 S2 C28 37.7(3) 2 . ?
C28 S2 C28 82.2(6) 2 . ?
O4 S2 C28 106.4(3) . . ?
O6 S2 C28 104.3(4) . . ?
O5 S2 C28 103.5(4) . . ?
F6 S2 C28 106.4(4) 2 . ?
S2 S2 O6 44.8(4) 2 2 ?
C28 S2 O6 107.2(5) 2 2 ?
O4 S2 O6 87.6(3) . 2 ?
O6 S2 O6 139.9(5) . 2 ?
O5 S2 O6 82.6(5) . 2 ?
F6 S2 O6 105.5(4) 2 2 ?
C28 S2 O6 35.6(4) . 2 ?
S2 S2 F5 119.3(4) 2 2 ?
C28 S2 F5 38.6(4) 2 2 ?
O4 S2 F5 124.0(3) . 2 ?
O6 S2 F5 16.0(5) . 2 ?
O5 S2 F5 103.3(5) . 2 ?
F6 S2 F5 67.4(3) 2 2 ?
C28 S2 F5 107.0(3) . 2 ?
O6 S2 F5 140.8(3) 2 2 ?
S2 S2 O5 32.0(4) 2 2 ?
C28 S2 O5 95.2(4) 2 2 ?
O4 S2 O5 79.6(3) . 2 ?
O6 S2 O5 75.3(5) . 2 ?
O5 S2 O5 154.1(5) . 2 ?
F6 S2 O5 141.3(4) 2 2 ?
C28 S2 O5 50.7(4) . 2 ?
O6 S2 O5 74.0(4) 2 2 ?
F5 S2 O5 88.4(4) 2 2 ?
S2 O4 S2 39.2(2) 2 . ?
F6 O5 S2 89.6(7) 2 . ?
F6 O5 C28 49.0(5) 2 2 ?
S2 O5 C28 43.9(3) . 2 ?
F6 O5 S2 103.5(6) 2 2 ?
S2 O5 S2 20.7(2) . 2 ?
C28 O5 S2 54.5(3) 2 2 ?
F5 O6 C28 84.3(11) 2 2 ?
F5 O6 S2 132.6(12) 2 . ?
C28 O6 S2 54.5(5) 2 . ?
F5 O6 S2 150.1(12) 2 2 ?
C28 O6 S2 66.1(5) 2 2 ?
S2 O6 S2 28.0(2) . 2 ?
O6 C28 S2 74.5(6) 2 2 ?
O6 C28 F6 122.1(9) 2 . ?
S2 C28 F6 90.0(6) 2 . ?
O6 C28 F5 35.0(6) 2 . ?
S2 C28 F5 106.4(6) 2 . ?
F6 C28 F5 108.1(7) . . ?
O6 C28 F4 123.9(8) 2 . ?
S2 C28 F4 137.6(7) 2 . ?
F6 C28 F4 105.2(6) . . ?
F5 C28 F4 105.9(6) . . ?
O6 C28 O5 116.7(8) 2 2 ?
S2 C28 O5 55.2(4) 2 2 ?
F6 C28 O5 38.0(4) . 2 ?
F5 C28 O5 127.8(7) . 2 ?
F4 C28 O5 119.2(6) . 2 ?
O6 C28 S2 78.2(6) 2 . ?
S2 C28 S2 28.9(2) 2 . ?
F6 C28 S2 112.7(5) . . ?
F5 C28 S2 113.1(5) . . ?
F4 C28 S2 111.4(5) . . ?
O5 C28 S2 74.8(4) 2 . ?
O6 C28 C28 103.8(7) 2 2 ?
S2 C28 C28 61.8(4) 2 2 ?
F6 C28 C28 117.1(7) . 2 ?
F5 C28 C28 132.6(7) . 2 ?
F4 C28 C28 76.2(4) . 2 ?
O5 C28 C28 85.3(5) 2 2 ?
S2 C28 C28 36.0(2) . 2 ?
C28 F4 F4 103.4(4) . 2 ?
O6 F5 C28 60.8(9) 2 . ?
O6 F5 S2 31.4(8) 2 2 ?
C28 F5 S2 35.0(3) . 2 ?
O5 F6 C28 93.0(6) 2 . ?
O5 F6 S2 53.7(5) 2 2 ?
C28 F6 S2 42.9(3) . 2 ?
O1S C1S O1S 82.5(12) 2 . ?
C1S O1S O1S 48.7(6) . 2 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 C1 2.092(5) . ?
Ag1 C1 2.092(5) 5_565 ?
Ag1 Ag3 2.8685(4) . ?
Ag1 Ag3 2.8685(4) 5_565 ?
Ag1 Ag2 2.9440(4) . ?
Ag1 Ag2 2.9440(4) 5_565 ?
Ag2 C1 2.261(5) . ?
Ag2 N1 2.284(4) . ?
Ag2 N2 2.346(4) . ?
Ag2 C2 2.520(5) . ?
Ag3 C1 2.233(4) 5_565 ?
Ag3 N4 2.317(4) . ?
Ag3 N3 2.333(4) . ?
Ag3 O1 2.584(3) . ?
N1 C7 1.334(6) . ?
N1 C11 1.363(6) . ?
N2 C16 1.330(6) . ?
N2 C12 1.359(6) . ?
N3 C17 1.335(6) . ?
N3 C21 1.357(6) . ?
N4 C22 1.342(6) . ?
N4 C26 1.349(6) . ?
C1 C2 1.178(6) . ?
C1 Ag3 2.233(4) 5_565 ?
C2 C3 1.524(7) . ?
C3 C4' 1.528(10) . ?
C3 C6 1.534(10) . ?
C3 C4 1.553(11) . ?
C3 C5' 1.572(9) . ?
C3 C6' 1.606(9) . ?
C3 C5 1.618(10) . ?
C4 C5' 0.76(2) . ?
C5 C4' 0.615(16) . ?
C6 C6' 0.52(2) . ?
C7 C8 1.366(7) . ?
C8 C9 1.376(8) . ?
C9 C10 1.369(7) . ?
C10 C11 1.389(7) . ?
C11 C12 1.459(7) . ?
C12 C13 1.394(7) . ?
C13 C14 1.376(8) . ?
C14 C15 1.387(8) . ?
C15 C16 1.363(8) . ?
C17 C18 1.388(7) . ?
C18 C19 1.356(8) . ?
C19 C20 1.403(7) . ?
C20 C21 1.378(7) . ?
C21 C22 1.502(7) . ?
C22 C23 1.396(7) . ?
C23 C24 1.374(7) . ?
C24 C25 1.383(7) . ?
C25 C26 1.388(7) . ?
S1 O2 1.435(3) . ?
S1 O3 1.448(4) . ?
S1 O1 1.450(4) . ?
S1 C27 1.825(5) . ?
C27 F3 1.325(5) . ?
C27 F2 1.340(5) . ?
C27 F1 1.348(5) . ?
S2 S2 0.953(5) 2 ?
S2 C28 1.207(6) 2 ?
S2 O4 1.422(6) . ?
S2 O6 1.430(7) . ?
S2 O5 1.430(7) . ?
S2 F6 1.775(6) 2 ?
S2 C28 1.811(6) . ?
S2 O6 1.938(8) 2 ?
S2 F5 2.021(7) 2 ?
S2 O5 2.146(8) 2 ?
O4 S2 1.422(6) 2 ?
O5 F6 1.060(11) 2 ?
O5 C28 1.721(12) 2 ?
O5 S2 2.146(8) 2 ?
O6 F5 0.758(10) 2 ?
O6 C28 1.153(11) 2 ?
O6 S2 1.938(8) 2 ?
C28 O6 1.153(11) 2 ?
C28 S2 1.207(6) 2 ?
C28 F6 1.301(7) . ?
C28 F5 1.315(7) . ?
C28 F4 1.348(7) . ?
C28 O5 1.721(12) 2 ?
C28 C28 2.036(13) 2 ?
F4 F4 1.400(13) 2 ?
F5 O6 0.758(10) 2 ?
F5 S2 2.021(7) 2 ?
F6 O5 1.060(11) 2 ?
F6 S2 1.775(6) 2 ?
C1S O1S 1.340(13) 2 ?
C1S O1S 1.340(13) . ?
O1S O1S 1.77(2) 2 ?
