#------------------------------------------------------------------------------
#$Date: 2016-03-26 03:31:26 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180185 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/81/7108164.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_7108164
loop_
_publ_author_name
'Cai-Yan Gao'
'Xin He'
'Liang Zhao'
'Mei-Xiang Wang'
_publ_section_title
;
 Dual templated synthesis of silver acetylide cluster-encapsulated
 supramolecular boxes
;
_journal_name_full               Chem.Commun.
_journal_page_first              8368
_journal_paper_doi               10.1039/c2cc33757f
_journal_volume                  48
_journal_year                    2012
_chemical_formula_sum            'C56 H48 Ag6 F12 N16 O17 S4'
_chemical_formula_weight         2220.56
_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                 119.53(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   31.401(6)
_cell_length_b                   10.116(2)
_cell_length_c                   26.867(5)
_cell_measurement_reflns_used    9880
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.4812
_cell_measurement_theta_min      1.6424
_cell_volume                     7426(3)
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'XP in Siemens SHELXTL (Sheldrick, 1994)'
_computing_publication_material  'SHELX97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Saturn724+ CCD'
_diffrn_measurement_method       'ω scans at fixed χ = 45°'
_diffrn_radiation_monochromator  Confocal
_diffrn_radiation_source         'Rotating Anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0403
_diffrn_reflns_av_sigmaI/netI    0.0318
_diffrn_reflns_limit_h_max       37
_diffrn_reflns_limit_h_min       -37
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            24688
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.64
_exptl_absorpt_coefficient_mu    1.769
_exptl_absorpt_correction_T_max  0.7727
_exptl_absorpt_correction_T_min  0.7087
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'CrystalClear (Rigaku Inc., 2007)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.986
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             4344
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.13
_refine_diff_density_max         1.489
_refine_diff_density_min         -1.456
_refine_diff_density_rms         0.296
_refine_ls_extinction_coef       0.00047(11)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.104
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     519
_refine_ls_number_reflns         6518
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.105
_refine_ls_R_factor_all          0.0975
_refine_ls_R_factor_gt           0.0933
_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)+(0.1436P)²+102.2683P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2558
_refine_ls_wR_factor_ref         0.2601
_reflns_number_gt                6091
_reflns_number_total             6518
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2cc33757f.txt
_cod_data_source_block           y
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7108164
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 0.60174(3) 0.67704(9) 0.32462(3) 0.0571(3) Uani 1 1 d . . .
Ag2 Ag 0.58540(3) 0.63152(10) 0.18878(3) 0.0604(3) Uani 1 1 d . . .
Ag3 Ag 0.62283(9) 0.4303(3) 0.27168(14) 0.0484(16) Uani 0.46(2) 1 d P A 1
Ag3' Ag 0.6044(8) 0.4160(9) 0.2547(8) 0.165(3) Uani 0.54(2) 1 d P A 2
N1 N 0.4821(3) 0.7227(8) 0.0676(3) 0.057(2) Uani 1 1 d . . .
C1 C 0.4487(4) 0.6519(10) 0.0730(4) 0.053(2) Uani 1 1 d . . .
C2 C 0.4522(4) 0.5174(10) 0.0808(5) 0.059(3) Uani 1 1 d . . .
H2A H 0.4279 0.4698 0.0844 0.071 Uiso 1 1 calc R . .
C3 C 0.4904(4) 0.4552(11) 0.0830(5) 0.065(3) Uani 1 1 d . . .
H3A H 0.4934 0.3624 0.0892 0.079 Uiso 1 1 calc R . .
C4 C 0.5260(4) 0.5229(10) 0.0766(5) 0.064(3) Uani 1 1 d . . .
H4A H 0.5531 0.4785 0.0777 0.076 Uiso 1 1 calc R . .
C5 C 0.5199(5) 0.6575(10) 0.0686(4) 0.058(3) Uani 1 1 d . . .
N2 N 0.5529(4) 0.7347(9) 0.0597(4) 0.065(2) Uani 1 1 d . A .
C6 C 0.5334(7) 0.8510(14) 0.0223(6) 0.103(6) Uani 1 1 d . . .
H6A H 0.5600 0.8963 0.0202 0.154 Uiso 1 1 calc R . .
H6B H 0.5185 0.9115 0.0379 0.154 Uiso 1 1 calc R . .
H6C H 0.5086 0.8228 -0.0161 0.154 Uiso 1 1 calc R . .
N3 N 0.6248(3) 0.6599(7) 0.1375(4) 0.053(2) Uani 1 1 d . A .
C7 C 0.6017(5) 0.7042(10) 0.0840(5) 0.062(3) Uani 1 1 d . . .
C8 C 0.6272(6) 0.7242(12) 0.0541(6) 0.080(4) Uani 1 1 d . A .
H8A H 0.6106 0.7569 0.0160 0.096 Uiso 1 1 calc R . .
C9 C 0.6748(6) 0.6971(13) 0.0792(7) 0.084(4) Uani 1 1 d . . .
H9A H 0.6919 0.7075 0.0585 0.101 Uiso 1 1 calc R A .
C10 C 0.6999(5) 0.6536(13) 0.1360(7) 0.082(4) Uani 1 1 d . A .
H10A H 0.7341 0.6365 0.1552 0.098 Uiso 1 1 calc R . .
C11 C 0.6723(4) 0.6368(10) 0.1623(5) 0.058(3) Uani 1 1 d . . .
N4 N 0.6948(3) 0.5900(9) 0.2201(4) 0.064(2) Uani 1 1 d . A .
C12 C 0.7291(5) 0.4830(16) 0.2388(8) 0.107(5) Uani 1 1 d . . .
H12A H 0.7400 0.4635 0.2791 0.160 Uiso 1 1 calc R A .
H12B H 0.7573 0.5076 0.2346 0.160 Uiso 1 1 calc R . .
H12C H 0.7133 0.4045 0.2156 0.160 Uiso 1 1 calc R . .
N5 N 0.7056(3) 0.6053(9) 0.3118(4) 0.054(2) Uani 1 1 d . A .
C13 C 0.6917(3) 0.6660(10) 0.2617(5) 0.056(3) Uani 1 1 d . . .
C14 C 0.6757(3) 0.7951(10) 0.2528(4) 0.052(2) Uani 1 1 d . A .
H14A H 0.6664 0.8375 0.2174 0.062 Uiso 1 1 calc R . .
C15 C 0.6734(4) 0.8602(10) 0.2949(5) 0.056(2) Uani 1 1 d . . .
H15A H 0.6618 0.9487 0.2890 0.067 Uiso 1 1 calc R A .
C16 C 0.6877(3) 0.7998(10) 0.3468(4) 0.052(2) Uani 1 1 d . A .
H16A H 0.6864 0.8445 0.3771 0.062 Uiso 1 1 calc R . .
C17 C 0.7041(3) 0.6692(10) 0.3525(5) 0.057(3) Uani 1 1 d . . .
N6 N 0.7220(3) 0.6022(10) 0.4052(4) 0.065(2) Uani 1 1 d . A .
C18 C 0.7638(4) 0.5147(17) 0.4203(6) 0.092(4) Uani 1 1 d . . .
H18A H 0.7738 0.4735 0.4575 0.137 Uiso 1 1 calc R A .
H18B H 0.7911 0.5663 0.4225 0.137 Uiso 1 1 calc R . .
H18C H 0.7545 0.4460 0.3911 0.137 Uiso 1 1 calc R . .
N7 N 0.6559(3) 0.6603(8) 0.4180(3) 0.056(2) Uani 1 1 d . A .
C19 C 0.7022(4) 0.6138(10) 0.4400(5) 0.063(3) Uani 1 1 d . . .
C20 C 0.7272(4) 0.5780(13) 0.4980(5) 0.081(4) Uani 1 1 d . A .
H20A H 0.7601 0.5477 0.5145 0.097 Uiso 1 1 calc R . .
C21 C 0.7057(5) 0.5856(16) 0.5310(5) 0.095(5) Uani 1 1 d . . .
H21A H 0.7231 0.5596 0.5701 0.113 Uiso 1 1 calc R A .
C22 C 0.6600(5) 0.6301(14) 0.5079(5) 0.079(4) Uani 1 1 d . A .
H22A H 0.6442 0.6366 0.5301 0.095 Uiso 1 1 calc R . .
C23 C 0.6356(4) 0.6671(11) 0.4501(5) 0.067(3) Uani 1 1 d . . .
N8 N 0.5873(4) 0.7259(10) 0.4249(4) 0.070(3) Uani 1 1 d . . .
C24 C 0.5868(6) 0.8682(12) 0.4280(8) 0.094(5) Uani 1 1 d . . .
H24A H 0.5529 0.8992 0.4108 0.141 Uiso 1 1 calc R A .
H24B H 0.6022 0.9061 0.4073 0.141 Uiso 1 1 calc R . .
H24C H 0.6049 0.8960 0.4682 0.141 Uiso 1 1 calc R . .
C25 C 0.5569(4) 0.5635(12) 0.2418(4) 0.058(3) Uani 1 1 d . A .
C26 C 0.5211(3) 0.5659(13) 0.2476(4) 0.062(3) Uani 1 1 d . . .
S1 S 0.66176(17) 0.1867(4) 0.36408(17) 0.0926(11) Uani 1 1 d . A .
O1 O 0.6663(9) 0.3122(18) 0.3425(7) 0.192(9) Uani 1 1 d . . .
O2 O 0.7023(6) 0.1205(17) 0.3891(6) 0.159(6) Uani 1 1 d . . .
O3 O 0.6170(5) 0.1251(17) 0.3273(6) 0.144(6) Uani 1 1 d . . .
C27 C 0.6523(5) 0.2110(10) 0.4087(6) 0.071(4) Uani 1 1 d . . .
F11 F 0.6368(13) 0.341(3) 0.399(2) 0.34(2) Uani 1 1 d . A .
F12 F 0.6959(10) 0.2855(19) 0.4663(6) 0.154(10) Uani 0.60 1 d P A .
F12' F 0.609(2) 0.266(6) 0.4107(17) 0.31(5) Uani 0.40 1 d P A .
F13 F 0.6538(5) 0.1354(13) 0.4526(5) 0.146(5) Uani 1 1 d . A .
S2 S 0.6134(3) 0.1773(5) 0.1680(3) 0.129(2) Uani 1 1 d . A .
O4 O 0.5706(11) 0.157(6) 0.1474(16) 0.45(4) Uani 1 1 d . . .
O5 O 0.6448(12) 0.100(2) 0.2088(10) 0.281(17) Uani 1 1 d . . .
O6 O 0.6187(12) 0.304(2) 0.1895(14) 0.270(16) Uani 1 1 d . . .
C28 C 0.6349(7) 0.1615(19) 0.1205(12) 0.188(12) Uiso 1 1 d D . .
F21 F 0.6432(8) 0.0312(19) 0.1140(11) 0.331(19) Uani 1 1 d D A .
F22 F 0.6007(6) 0.205(2) 0.0683(6) 0.236(10) Uani 1 1 d D A .
F23 F 0.6786(4) 0.2217(14) 0.1373(5) 0.144(4) Uani 1 1 d D A .
O1W O 0.5517(3) 0.8724(9) 0.1884(4) 0.033(2) Uiso 0.70 1 d P . .
O1W' O 0.5504(8) 0.864(2) 0.1720(11) 0.037(6) Uiso 0.30 1 d P A .
O2W O 0.5575(5) 0.8918(12) 0.2823(7) 0.131(5) Uani 1 1 d . A .
O3W O 0.6824(11) 0.284(4) 0.3000(11) 0.138(10) Uani 0.50 1 d P A .
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'
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'
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
N7 Ag1 C25 145.2(4) . .
N7 Ag1 O2W 121.0(4) . .
C25 Ag1 O2W 93.2(4) . .
N7 Ag1 C26 139.6(3) . .
C25 Ag1 C26 27.7(3) . .
O2W Ag1 C26 84.8(4) . .
N7 Ag1 Ag3 103.7(3) . .
C25 Ag1 Ag3 46.6(3) . .
O2W Ag1 Ag3 132.8(4) . .
C26 Ag1 Ag3 68.4(3) . .
N7 Ag1 Ag3' 111.3(4) . .
C25 Ag1 Ag3' 37.5(5) . .
O2W Ag1 Ag3' 126.9(4) . .
C26 Ag1 Ag3' 59.0(5) . .
Ag3 Ag1 Ag3' 9.5(4) . .
C25 Ag2 N3 167.1(4) . .
C25 Ag2 O1W' 97.5(7) . .
N3 Ag2 O1W' 95.2(6) . .
C25 Ag2 Ag3' 47.8(4) . .
N3 Ag2 Ag3' 119.4(3) . .
O1W' Ag2 Ag3' 143.7(6) . .
C25 Ag2 Ag3 52.2(3) . .
N3 Ag2 Ag3 115.5(2) . .
O1W' Ag2 Ag3 141.9(6) . .
Ag3' Ag2 Ag3 11.2(5) . .
O1 Ag3 O3W 40.4(8) . .
O1 Ag3 C25 137.6(8) . .
O3W Ag3 C25 174.4(9) . .
O1 Ag3 O6 103.8(10) . .
O3W Ag3 O6 68.2(10) . .
C25 Ag3 O6 110.6(8) . .
O1 Ag3 Ag2 165.3(6) . .
O3W Ag3 Ag2 135.3(7) . .
C25 Ag3 Ag2 48.3(3) . .
O6 Ag3 Ag2 81.5(7) . .
O1 Ag3 Ag1 103.6(6) . .
O3W Ag3 Ag1 135.9(8) . .
C25 Ag3 Ag1 47.0(3) . .
O6 Ag3 Ag1 152.5(7) . .
Ag2 Ag3 Ag1 71.35(8) . .
C25 Ag3' O6 129.6(12) . .
C25 Ag3' O1 131.0(9) . .
O6 Ag3' O1 99.3(11) . .
C25 Ag3' O3W 159.7(14) . .
O6 Ag3' O3W 66.4(11) . .
O1 Ag3' O3W 34.9(8) . .
C25 Ag3' Ag2 51.7(3) . .
O6 Ag3' Ag2 87.8(8) . .
O1 Ag3' Ag2 143.3(11) . .
O3W Ag3' Ag2 126.7(9) . .
C25 Ag3' Ag1 43.4(4) . .
O6 Ag3' Ag1 154.6(8) . .
O1 Ag3' Ag1 91.5(8) . .
O3W Ag3' Ag1 116.4(11) . .
Ag2 Ag3' Ag1 70.26(19) . .
C1 N1 C5 117.9(9) . .
N1 C1 C2 122.5(10) . .
N1 C1 N8 114.7(9) . 2_655
C2 C1 N8 122.5(11) . 2_655
C3 C2 C1 118.7(11) . .
C2 C3 C4 121.5(10) . .
C5 C4 C3 116.5(11) . .
N1 C5 C4 122.7(11) . .
N1 C5 N2 116.0(9) . .
C4 C5 N2 121.2(11) . .
C7 N2 C5 122.5(9) . .
C7 N2 C6 119.7(11) . .
C5 N2 C6 117.8(12) . .
C11 N3 C7 118.9(9) . .
C11 N3 Ag2 119.2(7) . .
C7 N3 Ag2 121.9(8) . .
N3 C7 N2 118.3(9) . .
N3 C7 C8 120.6(13) . .
N2 C7 C8 121.1(12) . .
C9 C8 C7 119.7(13) . .
C8 C9 C10 120.5(11) . .
C11 C10 C9 116.2(13) . .
N3 C11 C10 124.1(12) . .
N3 C11 N4 115.8(8) . .
C10 C11 N4 120.0(12) . .
C13 N4 C12 118.2(12) . .
C13 N4 C11 119.5(9) . .
C12 N4 C11 120.9(11) . .
C17 N5 C13 119.4(9) . .
N5 C13 C14 121.1(11) . .
N5 C13 N4 115.7(9) . .
C14 C13 N4 123.2(10) . .
C15 C14 C13 119.1(10) . .
C14 C15 C16 120.6(10) . .
C15 C16 C17 116.6(10) . .
N5 C17 C16 123.1(10) . .
N5 C17 N6 116.5(10) . .
C16 C17 N6 120.3(11) . .
C19 N6 C17 123.8(9) . .
C19 N6 C18 120.9(9) . .
C17 N6 C18 115.3(11) . .
C23 N7 C19 120.0(10) . .
C23 N7 Ag1 112.9(7) . .
C19 N7 Ag1 124.9(8) . .
N7 C19 N6 119.2(9) . .
N7 C19 C20 117.8(13) . .
N6 C19 C20 123.0(11) . .
C21 C20 C19 121.6(13) . .
C22 C21 C20 118.9(11) . .
C21 C22 C23 118.8(13) . .
N7 C23 C22 122.7(12) . .
N7 C23 N8 116.9(10) . .
C22 C23 N8 120.2(13) . .
C1 N8 C24 120.3(12) 2_655 .
C1 N8 C23 116.6(9) 2_655 .
C24 N8 C23 115.0(10) . .
C26 C25 Ag3' 130.5(11) . .
C26 C25 Ag2 143.2(10) . .
Ag3' C25 Ag2 80.6(4) . .
C26 C25 Ag3 135.5(10) . .
Ag3' C25 Ag3 13.3(7) . .
Ag2 C25 Ag3 79.5(3) . .
C26 C25 Ag1 91.7(7) . .
Ag3' C25 Ag1 99.1(8) . .
Ag2 C25 Ag1 103.3(4) . .
Ag3 C25 Ag1 86.4(4) . .
C25 C26 C26 177.9(12) . 2_655
C25 C26 Ag1 60.6(6) . .
C26 C26 Ag1 121.5(8) 2_655 .
O2 S1 C27 102.5(9) . .
O2 S1 O3 121.5(11) . .
C27 S1 O3 96.8(9) . .
O2 S1 O1 113.6(14) . .
C27 S1 O1 107.4(10) . .
O3 S1 O1 111.9(11) . .
O2 S1 F11 128.5(14) . .
C27 S1 F11 38.6(12) . .
O3 S1 F11 100.0(11) . .
O1 S1 F11 70.5(14) . .
S1 O1 O3W 106(2) . .
S1 O1 Ag3 136.6(14) . .
O3W O1 Ag3 74.1(13) . .
S1 O1 Ag3' 125.8(13) . .
O3W O1 Ag3' 75.5(13) . .
Ag3 O1 Ag3' 10.9(5) . .
F11 C27 F13 123(2) . .
F11 C27 S1 102(2) . .
F13 C27 S1 134.7(10) . .
F11 C27 F12' 54(3) . .
F13 C27 F12' 79.9(19) . .
S1 C27 F12' 132.9(17) . .
F11 C27 F12 78.1(19) . .
F13 C27 F12 77.9(10) . .
S1 C27 F12 117.1(11) . .
F12' C27 F12 98(3) . .
F12' F11 C27 68(2) . .
F12' F11 S1 97(2) . .
C27 F11 S1 39.1(11) . .
F11 F12' C27 58(3) . .
O4 S2 O5 120(3) . .
O4 S2 O6 103(3) . .
O5 S2 O6 108(2) . .
O4 S2 C28 114(2) . .
O5 S2 C28 98.9(12) . .
O6 S2 C28 112.7(11) . .
S2 O6 Ag3' 138.2(15) . .
S2 O6 Ag3 142.0(17) . .
Ag3' O6 Ag3 12.4(6) . .
F22 C28 F23 111(2) . .
F22 C28 F21 106(2) . .
F23 C28 F21 104.4(19) . .
F22 C28 S2 110(2) . .
F23 C28 S2 114.5(19) . .
F21 C28 S2 111(2) . .
O1 O3W Ag3 65.5(14) . .
O1 O3W Ag3' 69.6(14) . .
Ag3 O3W Ag3' 11.1(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N7 2.239(8) .
Ag1 C25 2.273(10) .
Ag1 O2W 2.527(13) .
Ag1 C26 2.607(10) .
Ag1 Ag3 3.102(3) .
Ag1 Ag3' 3.266(12) .
Ag2 C25 2.134(10) .
Ag2 N3 2.279(8) .
Ag2 O1W' 2.54(2) .
Ag2 Ag3' 2.684(6) .
Ag2 Ag3 2.812(3) .
Ag3 O1 2.085(17) .
Ag3 O3W 2.20(3) .
Ag3 C25 2.259(12) .
Ag3 O6 2.50(2) .
Ag3' C25 2.014(15) .
Ag3' O6 2.308(18) .
Ag3' O1 2.43(2) .
Ag3' O3W 2.51(4) .
N1 C1 1.337(14) .
N1 C5 1.346(15) .
C1 C2 1.372(14) .
C1 N8 1.381(14) 2_655
C2 C3 1.327(16) .
C3 C4 1.394(17) .
C4 C5 1.377(15) .
C5 N2 1.406(15) .
N2 C7 1.375(16) .
N2 C6 1.470(15) .
N3 C11 1.321(14) .
N3 C7 1.329(14) .
C7 C8 1.399(16) .
C8 C9 1.33(2) .
C9 C10 1.40(2) .
C10 C11 1.372(15) .
C11 N4 1.434(15) .
N4 C13 1.398(15) .
N4 C12 1.431(16) .
N5 C17 1.290(15) .
N5 C13 1.342(14) .
C13 C14 1.378(14) .
C14 C15 1.342(15) .
C15 C16 1.378(14) .
C16 C17 1.399(15) .
C17 N6 1.413(13) .
N6 C19 1.360(17) .
N6 C18 1.465(16) .
N7 C23 1.301(16) .
N7 C19 1.355(15) .
C19 C20 1.405(15) .
C20 C21 1.36(2) .
C21 C22 1.33(2) .
C22 C23 1.401(17) .
C23 N8 1.448(17) .
N8 C1 1.381(14) 2_655
N8 C24 1.443(16) .
C25 C26 1.211(14) .
C26 C26 1.392(19) 2_655
S1 O2 1.296(14) .
S1 C27 1.392(14) .
S1 O3 1.404(13) .
S1 O1 1.432(16) .
S1 F11 2.16(3) .
O1 O3W 1.48(3) .
C27 F11 1.38(3) .
C27 F13 1.387(16) .
C27 F12' 1.51(4) .
C27 F12 1.66(2) .
F11 F12' 1.31(8) .
S2 O4 1.19(3) .
S2 O5 1.312(18) .
S2 O6 1.381(19) .
S2 C28 1.72(4) .
C28 F22 1.353(18) .
C28 F23 1.359(19) .
C28 F21 1.372(19) .
