#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:40:34 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179122 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/84/4308470.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_4308470
loop_
_publ_author_name
'Bratislav Djordjevic'
'Oliver Schuster'
'Hubert Schmidbaur'
_publ_section_title
;
A Cyclic Hexamer of Silver Trifluoroacetate Supported by Four
Triphenylphosphine Sulfide Template Molecules
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              673
_journal_page_last               676
_journal_paper_doi               10.1021/ic048795o
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'C22 H18 Ag2 F6 N2 O8 S2'
_chemical_formula_weight         832.24
_chemical_name_systematic
;
?
;
_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                104.2352(18)
_cell_angle_beta                 96.633(2)
_cell_angle_gamma                118.9642(12)
_cell_formula_units_Z            2
_cell_length_a                   10.9501(3)
_cell_length_b                   11.2398(4)
_cell_length_c                   13.8195(4)
_cell_measurement_reflns_used    39342
_cell_measurement_temperature    143(2)
_cell_volume                     1386.14(8)
_computing_cell_refinement       DENZO
_computing_data_collection       XPRESS
_computing_data_reduction        SCALEPACK
_computing_molecular_graphics    SHELXTL-PLUS
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      143(2)
_diffrn_measured_fraction_theta_full 0.934
_diffrn_measured_fraction_theta_max 0.934
_diffrn_measurement_device_type  'NONIUS DIP 2020'
_diffrn_measurement_method       phi-rotation
_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  0.043
_diffrn_reflns_av_sigmaI/netI    0.0399
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            39342
_diffrn_reflns_theta_full        25.37
_diffrn_reflns_theta_max         25.37
_diffrn_reflns_theta_min         2.34
_exptl_absorpt_coefficient_mu    1.653
_exptl_absorpt_correction_T_max  0.885
_exptl_absorpt_correction_T_min  0.614
_exptl_absorpt_correction_type   refdelf
_exptl_absorpt_process_details
;
Platon Delabs (See: Walker, N. & Stuart, D. (1983) Acta Cryst. A39, 158-166)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.994
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             816
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.427
_refine_diff_density_min         -0.331
_refine_diff_density_rms         0.076
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.060
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     380
_refine_ls_number_reflns         4763
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.0353
_refine_ls_R_factor_gt           0.0297
_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)+(0.0079P)²+2.0580P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0634
_refine_ls_wR_factor_ref         0.0656
_reflns_number_gt                4279
_reflns_number_total             4763
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic048795osi20041014_114852_3.cif
_cod_data_source_block           14p1cos
_cod_original_cell_volume        1386.14(7)
_cod_database_code               4308470
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 0.82501(3) 0.43912(3) 0.29590(2) 0.02726(8) Uani 1 1 d . . .
S1 S 1.41273(9) 0.77798(9) 0.47208(7) 0.02565(18) Uani 1 1 d . . .
N1 N 1.1364(3) 0.7046(3) 0.4423(2) 0.0241(6) Uani 1 1 d . . .
C1 C 0.8074(4) 0.0202(4) 0.2792(3) 0.0335(8) Uani 1 1 d . . .
Ag2 Ag 0.96910(3) 0.37190(3) 0.13525(2) 0.02916(8) Uani 1 1 d . . .
S2 S 1.15982(9) 0.92436(9) 0.22855(7) 0.02540(18) Uani 1 1 d . . .
N2 N 1.2005(3) 0.7067(3) 0.1732(2) 0.0256(6) Uani 1 1 d . . .
C2 C 0.8325(4) 0.1548(4) 0.2538(3) 0.0264(7) Uani 1 1 d . . .
C3 C 0.4815(4) 0.1698(4) -0.0044(3) 0.0320(8) Uani 1 1 d . . .
C4 C 0.6349(4) 0.2595(3) 0.0720(3) 0.0253(7) Uani 1 1 d . . .
O11 O 0.6435(3) 0.3416(3) 0.15534(18) 0.0319(6) Uani 1 1 d . . .
F11 F 0.8335(3) -0.0637(3) 0.2113(2) 0.0663(8) Uani 1 1 d . . .
C11 C 1.2272(5) 0.2186(4) 0.5527(3) 0.0414(9) Uani 1 1 d . . .
H11A H 1.1388 0.1906 0.5757 0.062 Uiso 1 1 calc R . .
H11B H 1.3036 0.2325 0.6070 0.062 Uiso 1 1 calc R . .
H11C H 1.2067 0.1421 0.4890 0.062 Uiso 1 1 calc R . .
O12 O 0.7613(3) 0.2057(3) 0.28807(19) 0.0304(6) Uani 1 1 d . . .
F12 F 0.8935(3) 0.0628(3) 0.3736(2) 0.0557(7) Uani 1 1 d . . .
C12 C 1.2768(4) 0.3580(4) 0.5317(3) 0.0281(8) Uani 1 1 d . . .
F13 F 0.6719(2) -0.0636(2) 0.28287(17) 0.0382(5) Uani 1 1 d . . .
O13 O 1.4026(3) 0.7526(3) 0.36399(19) 0.0320(6) Uani 1 1 d . . .
C13 C 1.3685(4) 0.4918(4) 0.6115(3) 0.0281(8) Uani 1 1 d . . .
H027 H 1.4017 0.4941 0.6790 0.034 Uiso 1 1 calc R . .
O14 O 1.5443(3) 0.8949(3) 0.5494(2) 0.0343(6) Uani 1 1 d . . .
C14 C 1.4121(4) 0.6211(4) 0.5946(3) 0.0273(7) Uani 1 1 d . . .
H032 H 1.4754 0.7113 0.6493 0.033 Uiso 1 1 calc R . .
C15 C 1.3615(4) 0.6163(4) 0.4961(3) 0.0243(7) Uani 1 1 d . . .
C16 C 1.2703(4) 0.4844(4) 0.4144(3) 0.0291(8) Uani 1 1 d . . .
H038 H 1.2364 0.4823 0.3472 0.035 Uiso 1 1 calc R . .
C17 C 1.2303(4) 0.3564(4) 0.4330(3) 0.0307(8) Uani 1 1 d . . .
H035 H 1.1702 0.2663 0.3776 0.037 Uiso 1 1 calc R . .
C18 C 1.2795(4) 0.8195(4) 0.5020(3) 0.0262(7) Uani 1 1 d . . .
H02A H 1.2858 0.8381 0.5768 0.031 Uiso 1 1 calc R . .
H02B H 1.3006 0.9089 0.4881 0.031 Uiso 1 1 calc R . .
C19 C 1.0219(4) 0.6129(4) 0.3929(3) 0.0279(7) Uani 1 1 d . . .
O21 O 0.9248(3) 0.1995(3) 0.2060(2) 0.0398(6) Uani 1 1 d . . .
C21 C 0.6301(4) 0.5633(5) -0.1429(3) 0.0402(9) Uani 1 1 d . . .
H04A H 0.6494 0.6054 -0.1977 0.060 Uiso 1 1 calc R . .
H04B H 0.5473 0.5632 -0.1223 0.060 Uiso 1 1 calc R . .
H04C H 0.6076 0.4636 -0.1688 0.060 Uiso 1 1 calc R . .
O22 O 0.7282(3) 0.2430(3) 0.04017(19) 0.0302(5) Uani 1 1 d . . .
C22 C 0.7621(4) 0.6520(4) -0.0504(3) 0.0289(8) Uani 1 1 d . . .
O23 O 1.1178(3) 0.8882(3) 0.31671(18) 0.0315(6) Uani 1 1 d . . .
C23 C 0.7638(4) 0.6160(4) 0.0387(3) 0.0296(8) Uani 1 1 d . . .
H029 H 0.6800 0.5334 0.0411 0.036 Uiso 1 1 calc R . .
O24 O 1.2365(3) 1.0722(3) 0.2336(2) 0.0346(6) Uani 1 1 d . . .
C24 C 0.8845(4) 0.6971(4) 0.1238(3) 0.0270(7) Uani 1 1 d . . .
H036 H 0.8840 0.6712 0.1843 0.032 Uiso 1 1 calc R . .
C25 C 1.0067(4) 0.8175(3) 0.1194(3) 0.0233(7) Uani 1 1 d . . .
C26 C 1.0093(4) 0.8556(4) 0.0310(3) 0.0260(7) Uani 1 1 d . . .
H025 H 1.0940 0.9372 0.0284 0.031 Uiso 1 1 calc R . .
C27 C 0.8870(4) 0.7735(4) -0.0530(3) 0.0286(8) Uani 1 1 d . . .
H031 H 0.8876 0.7997 -0.1134 0.034 Uiso 1 1 calc R . .
C28 C 1.2781(4) 0.8597(3) 0.1963(3) 0.0253(7) Uani 1 1 d . . .
H02C H 1.3095 0.8827 0.1354 0.030 Uiso 1 1 calc R . .
H02D H 1.3657 0.9079 0.2555 0.030 Uiso 1 1 calc R . .
C29 C 1.1248(4) 0.5851(4) 0.1559(3) 0.0269(7) Uani 1 1 d . . .
F31 F 0.4591(3) 0.2542(3) -0.04808(19) 0.0520(6) Uani 1 1 d . . .
F32 F 0.4609(2) 0.0579(2) -0.08167(16) 0.0369(5) Uani 1 1 d . . .
F33 F 0.3772(2) 0.1168(3) 0.0422(2) 0.0539(7) 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'
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
C19 Ag1 O11 149.73(12) . . ?
C19 Ag1 O12 118.93(11) . . ?
O11 Ag1 O12 88.72(9) . . ?
C19 Ag1 Ag2 91.18(10) . . ?
O11 Ag1 Ag2 81.38(6) . . ?
O12 Ag1 Ag2 79.72(6) . . ?
O13 S1 O14 120.44(15) . . ?
O13 S1 C15 109.23(16) . . ?
O14 S1 C15 109.29(15) . . ?
O13 S1 C18 108.42(15) . . ?
O14 S1 C18 103.19(16) . . ?
C15 S1 C18 105.10(16) . . ?
C19 N1 C18 178.9(3) . . ?
F11 C1 F13 106.5(3) . . ?
F11 C1 F12 108.8(3) . . ?
F13 C1 F12 106.1(3) . . ?
F11 C1 C2 113.1(3) . . ?
F13 C1 C2 113.0(3) . . ?
F12 C1 C2 109.2(3) . . ?
C29 Ag2 O21 141.07(12) . . ?
C29 Ag2 O22 126.58(11) . . ?
O21 Ag2 O22 90.73(9) . . ?
C29 Ag2 Ag1 97.19(9) . . ?
O21 Ag2 Ag1 78.57(7) . . ?
O22 Ag2 Ag1 77.76(6) . . ?
O24 S2 O23 120.68(16) . . ?
O24 S2 C25 110.30(15) . . ?
O23 S2 C25 108.74(15) . . ?
O24 S2 C28 104.98(16) . . ?
O23 S2 C28 107.54(15) . . ?
C25 S2 C28 103.08(15) . . ?
C29 N2 C28 172.2(3) . . ?
O21 C2 O12 129.7(3) . . ?
O21 C2 C1 115.2(3) . . ?
O12 C2 C1 115.0(3) . . ?
F33 C3 F32 107.1(3) . . ?
F33 C3 F31 106.9(3) . . ?
F32 C3 F31 107.0(3) . . ?
F33 C3 C4 112.5(3) . . ?
F32 C3 C4 113.4(3) . . ?
F31 C3 C4 109.6(3) . . ?
O22 C4 O11 131.0(3) . . ?
O22 C4 C3 116.0(3) . . ?
O11 C4 C3 112.9(3) . . ?
C4 O11 Ag1 122.0(2) . . ?
C12 C11 H11A 109.5 . . ?
C12 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C12 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C2 O12 Ag1 120.1(2) . . ?
C17 C12 C13 118.5(3) . . ?
C17 C12 C11 120.8(3) . . ?
C13 C12 C11 120.6(3) . . ?
C14 C13 C12 121.5(3) . . ?
C14 C13 H027 119.2 . . ?
C12 C13 H027 119.2 . . ?
C13 C14 C15 118.7(3) . . ?
C13 C14 H032 120.6 . . ?
C15 C14 H032 120.6 . . ?
C14 C15 C16 121.2(3) . . ?
C14 C15 S1 120.0(3) . . ?
C16 C15 S1 118.8(3) . . ?
C17 C16 C15 118.9(3) . . ?
C17 C16 H038 120.6 . . ?
C15 C16 H038 120.6 . . ?
C16 C17 C12 121.1(3) . . ?
C16 C17 H035 119.5 . . ?
C12 C17 H035 119.5 . . ?
N1 C18 S1 111.7(2) . . ?
N1 C18 H02A 109.3 . . ?
S1 C18 H02A 109.3 . . ?
N1 C18 H02B 109.3 . . ?
S1 C18 H02B 109.3 . . ?
H02A C18 H02B 107.9 . . ?
N1 C19 Ag1 174.5(3) . . ?
C2 O21 Ag2 125.7(2) . . ?
C22 C21 H04A 109.5 . . ?
C22 C21 H04B 109.5 . . ?
H04A C21 H04B 109.5 . . ?
C22 C21 H04C 109.5 . . ?
H04A C21 H04C 109.5 . . ?
H04B C21 H04C 109.5 . . ?
C4 O22 Ag2 123.3(2) . . ?
C23 C22 C27 118.4(3) . . ?
C23 C22 C21 121.4(3) . . ?
C27 C22 C21 120.2(3) . . ?
C24 C23 C22 121.6(3) . . ?
C24 C23 H029 119.2 . . ?
C22 C23 H029 119.2 . . ?
C23 C24 C25 118.7(3) . . ?
C23 C24 H036 120.6 . . ?
C25 C24 H036 120.6 . . ?
C26 C25 C24 121.1(3) . . ?
C26 C25 S2 119.7(3) . . ?
C24 C25 S2 119.2(3) . . ?
C27 C26 C25 119.1(3) . . ?
C27 C26 H025 120.4 . . ?
C25 C26 H025 120.4 . . ?
C26 C27 C22 120.9(3) . . ?
C26 C27 H031 119.6 . . ?
C22 C27 H031 119.6 . . ?
N2 C28 S2 108.7(2) . . ?
N2 C28 H02C 110.0 . . ?
S2 C28 H02C 110.0 . . ?
N2 C28 H02D 110.0 . . ?
S2 C28 H02D 110.0 . . ?
H02C C28 H02D 108.3 . . ?
N2 C29 Ag2 171.9(3) . . ?
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 C19 2.056(4) . ?
Ag1 O11 2.208(2) . ?
Ag1 O12 2.335(2) . ?
Ag1 Ag2 3.0213(4) . ?
S1 O13 1.431(3) . ?
S1 O14 1.437(3) . ?
S1 C15 1.755(3) . ?
S1 C18 1.795(3) . ?
N1 C19 1.142(4) . ?
N1 C18 1.422(4) . ?
C1 F11 1.319(4) . ?
C1 F13 1.333(4) . ?
C1 F12 1.339(4) . ?
C1 C2 1.538(5) . ?
Ag2 C29 2.080(4) . ?
Ag2 O21 2.253(3) . ?
Ag2 O22 2.312(2) . ?
S2 O24 1.431(2) . ?
S2 O23 1.433(2) . ?
S2 C25 1.762(3) . ?
S2 C28 1.814(3) . ?
N2 C29 1.143(4) . ?
N2 C28 1.426(4) . ?
C2 O21 1.240(4) . ?
C2 O12 1.243(4) . ?
C3 F33 1.332(4) . ?
C3 F32 1.335(4) . ?
C3 F31 1.340(4) . ?
C3 C4 1.543(5) . ?
C4 O22 1.233(4) . ?
C4 O11 1.246(4) . ?
C11 C12 1.506(5) . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 C17 1.392(5) . ?
C12 C13 1.398(5) . ?
C13 C14 1.384(5) . ?
C13 H027 0.9500 . ?
C14 C15 1.387(5) . ?
C14 H032 0.9500 . ?
C15 C16 1.397(5) . ?
C16 C17 1.387(5) . ?
C16 H038 0.9500 . ?
C17 H035 0.9500 . ?
C18 H02A 0.9900 . ?
C18 H02B 0.9900 . ?
C21 C22 1.506(5) . ?
C21 H04A 0.9800 . ?
C21 H04B 0.9800 . ?
C21 H04C 0.9800 . ?
C22 C23 1.389(5) . ?
C22 C27 1.401(5) . ?
C23 C24 1.381(5) . ?
C23 H029 0.9500 . ?
C24 C25 1.389(5) . ?
C24 H036 0.9500 . ?
C25 C26 1.389(5) . ?
C26 C27 1.382(5) . ?
C26 H025 0.9500 . ?
C27 H031 0.9500 . ?
C28 H02C 0.9900 . ?
C28 H02D 0.9900 . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C19 Ag1 Ag2 C29 -37.32(13) . . . . ?
O11 Ag1 Ag2 C29 113.21(11) . . . . ?
O12 Ag1 Ag2 C29 -156.53(11) . . . . ?
C19 Ag1 Ag2 O21 103.44(12) . . . . ?
O11 Ag1 Ag2 O21 -106.04(10) . . . . ?
O12 Ag1 Ag2 O21 -15.77(10) . . . . ?
C19 Ag1 Ag2 O22 -163.29(11) . . . . ?
O11 Ag1 Ag2 O22 -12.76(9) . . . . ?
O12 Ag1 Ag2 O22 77.50(9) . . . . ?
F11 C1 C2 O21 -28.7(5) . . . . ?
F13 C1 C2 O21 -149.7(3) . . . . ?
F12 C1 C2 O21 92.6(4) . . . . ?
F11 C1 C2 O12 154.1(3) . . . . ?
F13 C1 C2 O12 33.1(4) . . . . ?
F12 C1 C2 O12 -84.7(4) . . . . ?
F33 C3 C4 O22 139.8(3) . . . . ?
F32 C3 C4 O22 18.1(4) . . . . ?
F31 C3 C4 O22 -101.3(4) . . . . ?
F33 C3 C4 O11 -42.8(4) . . . . ?
F32 C3 C4 O11 -164.5(3) . . . . ?
F31 C3 C4 O11 76.1(4) . . . . ?
O22 C4 O11 Ag1 -20.0(5) . . . . ?
C3 C4 O11 Ag1 163.1(2) . . . . ?
C19 Ag1 O11 C4 98.5(3) . . . . ?
O12 Ag1 O11 C4 -58.7(3) . . . . ?
Ag2 Ag1 O11 C4 21.1(2) . . . . ?
O21 C2 O12 Ag1 -12.4(5) . . . . ?
C1 C2 O12 Ag1 164.3(2) . . . . ?
C19 Ag1 O12 C2 -64.8(3) . . . . ?
O11 Ag1 O12 C2 102.3(3) . . . . ?
Ag2 Ag1 O12 C2 20.8(2) . . . . ?
C17 C12 C13 C14 0.6(5) . . . . ?
C11 C12 C13 C14 -178.2(3) . . . . ?
C12 C13 C14 C15 0.8(5) . . . . ?
C13 C14 C15 C16 -1.1(5) . . . . ?
C13 C14 C15 S1 179.2(3) . . . . ?
O13 S1 C15 C14 155.4(3) . . . . ?
O14 S1 C15 C14 21.8(3) . . . . ?
C18 S1 C15 C14 -88.4(3) . . . . ?
O13 S1 C15 C16 -24.2(3) . . . . ?
O14 S1 C15 C16 -157.9(3) . . . . ?
C18 S1 C15 C16 92.0(3) . . . . ?
C14 C15 C16 C17 0.1(5) . . . . ?
S1 C15 C16 C17 179.7(3) . . . . ?
C15 C16 C17 C12 1.4(5) . . . . ?
C13 C12 C17 C16 -1.8(5) . . . . ?
C11 C12 C17 C16 177.0(3) . . . . ?
C19 N1 C18 S1 -76(18) . . . . ?
O13 S1 C18 N1 59.4(3) . . . . ?
O14 S1 C18 N1 -171.8(2) . . . . ?
C15 S1 C18 N1 -57.3(3) . . . . ?
C18 N1 C19 Ag1 66(19) . . . . ?
O11 Ag1 C19 N1 -93(3) . . . . ?
O12 Ag1 C19 N1 60(3) . . . . ?
Ag2 Ag1 C19 N1 -19(3) . . . . ?
O12 C2 O21 Ag2 -12.6(6) . . . . ?
C1 C2 O21 Ag2 170.7(2) . . . . ?
C29 Ag2 O21 C2 109.2(3) . . . . ?
O22 Ag2 O21 C2 -55.5(3) . . . . ?
Ag1 Ag2 O21 C2 21.9(3) . . . . ?
O11 C4 O22 Ag2 0.0(5) . . . . ?
C3 C4 O22 Ag2 176.9(2) . . . . ?
C29 Ag2 O22 C4 -77.5(3) . . . . ?
O21 Ag2 O22 C4 90.6(3) . . . . ?
Ag1 Ag2 O22 C4 12.5(2) . . . . ?
C27 C22 C23 C24 0.4(5) . . . . ?
C21 C22 C23 C24 -179.9(3) . . . . ?
C22 C23 C24 C25 -0.1(5) . . . . ?
C23 C24 C25 C26 -0.6(5) . . . . ?
C23 C24 C25 S2 178.5(2) . . . . ?
O24 S2 C25 C26 29.9(3) . . . . ?
O23 S2 C25 C26 164.3(3) . . . . ?
C28 S2 C25 C26 -81.8(3) . . . . ?
O24 S2 C25 C24 -149.3(3) . . . . ?
O23 S2 C25 C24 -14.9(3) . . . . ?
C28 S2 C25 C24 99.1(3) . . . . ?
C24 C25 C26 C27 1.1(5) . . . . ?
S2 C25 C26 C27 -178.1(2) . . . . ?
C25 C26 C27 C22 -0.8(5) . . . . ?
C23 C22 C27 C26 0.0(5) . . . . ?
C21 C22 C27 C26 -179.7(3) . . . . ?
C29 N2 C28 S2 5(3) . . . . ?
O24 S2 C28 N2 -170.8(2) . . . . ?
O23 S2 C28 N2 59.6(3) . . . . ?
C25 S2 C28 N2 -55.2(3) . . . . ?
C28 N2 C29 Ag2 -22(4) . . . . ?
O21 Ag2 C29 N2 -97(2) . . . . ?
O22 Ag2 C29 N2 64(2) . . . . ?
Ag1 Ag2 C29 N2 -16(2) . . . . ?
