#------------------------------------------------------------------------------
#$Date: 2016-03-26 00:35:06 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180086 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/32/7053204.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_7053204
loop_
_publ_author_name
'Pilar Carranza, M.'
'Manzano, Blanca R.'
'Jalón, Félix A.'
'Rodríguez, Ana M.'
'Santos, Lucía'
'Moreno, Miquel'
_publ_section_title
;
 Experimental and theoretical evidence of unsupported Ag--Ag interactions
 in complexes with triazine-based ligands. Subtle effects of the symmetry
 of the triazine substituents
;
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              3183
_journal_paper_doi               10.1039/c3nj00738c
_journal_volume                  37
_journal_year                    2013
_chemical_formula_moiety         '(C18 H24 Ag F3 N8 O3 S)2'
_chemical_formula_sum            'C36 H48 Ag2 F6 N16 O6 S2'
_chemical_formula_weight         1194.76
_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                91.920(4)
_cell_angle_beta                 103.279(3)
_cell_angle_gamma                99.284(3)
_cell_formula_units_Z            2
_cell_length_a                   9.4378(19)
_cell_length_b                   13.969(3)
_cell_length_c                   17.639(4)
_cell_measurement_temperature    100(2)
_cell_volume                     2227.6(8)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      100(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       'omega and 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  0.0000
_diffrn_reflns_av_sigmaI/netI    0.0446
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            10998
_diffrn_reflns_theta_full        28.35
_diffrn_reflns_theta_max         28.35
_diffrn_reflns_theta_min         2.25
_exptl_absorpt_coefficient_mu    1.064
_exptl_absorpt_correction_T_max  0.8399
_exptl_absorpt_correction_T_min  0.6636
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.781
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1208
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.17
_refine_diff_density_max         0.787
_refine_diff_density_min         -0.535
_refine_diff_density_rms         0.097
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     625
_refine_ls_number_reflns         10998
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.033
_refine_ls_R_factor_all          0.0492
_refine_ls_R_factor_gt           0.0320
_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)+(0.0378P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0727
_refine_ls_wR_factor_ref         0.0778
_reflns_number_gt                8247
_reflns_number_total             10998
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3nj00738c.txt
_cod_data_source_block           2b
_cod_original_cell_volume        2227.5(8)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7053204
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
Ag1 Ag 0.01888(2) 0.388534(14) 1.003579(11) 0.01839(6) Uani 1 1 d .
Ag2 Ag 0.99161(2) 0.115104(13) 0.512035(10) 0.01798(6) Uani 1 1 d .
N1 N 0.0391(2) 0.39649(14) 0.86809(11) 0.0146(4) Uani 1 1 d .
N2 N 0.1448(2) 0.46869(14) 0.85246(11) 0.0130(4) Uani 1 1 d .
N3 N 0.2163(2) 0.50993(14) 0.98486(11) 0.0136(4) Uani 1 1 d .
N4 N 0.3625(2) 0.57827(14) 0.90095(11) 0.0134(4) Uani 1 1 d .
N5 N 0.4496(2) 0.60761(14) 1.04064(11) 0.0134(4) Uani 1 1 d .
N6 N 0.1919(2) 0.45403(14) 1.12263(11) 0.0134(4) Uani 1 1 d .
N7 N 0.3069(2) 0.52640(14) 1.11820(11) 0.0126(4) Uani 1 1 d .
N8 N 0.5742(2) 0.68868(14) 0.95673(11) 0.0136(4) Uani 1 1 d .
N9 N 0.9765(2) 0.07716(14) 0.64289(11) 0.0137(4) Uani 1 1 d .
N10 N 0.8683(2) 0.00188(14) 0.65076(11) 0.0129(4) Uani 1 1 d .
N11 N 0.7887(2) -0.01028(14) 0.51649(11) 0.0137(4) Uani 1 1 d .
N12 N 0.6426(2) -0.09623(14) 0.59407(11) 0.0132(4) Uani 1 1 d .
N13 N 0.5491(2) -0.09629(14) 0.45477(11) 0.0131(4) Uani 1 1 d .
N14 N 0.8098(2) 0.07674(14) 0.38935(11) 0.0140(4) Uani 1 1 d .
N15 N 0.6911(2) 0.00222(14) 0.38600(11) 0.0125(4) Uani 1 1 d .
N16 N 0.4255(2) -0.19582(14) 0.52936(11) 0.0141(4) Uani 1 1 d .
C1 C 0.1356(3) 0.46951(18) 0.77280(13) 0.0147(5) Uani 1 1 d .
C2 C 0.0211(3) 0.39684(18) 0.73850(14) 0.0186(5) Uani 1 1 d .
H2 H -0.0138 0.3786 0.6842 0.022 Uiso 1 1 calc R
C3 C -0.0352(3) 0.35419(18) 0.79931(14) 0.0159(5) Uani 1 1 d .
C4 C 0.2318(3) 0.53841(19) 0.73533(14) 0.0197(5) Uani 1 1 d .
H4A H 0.1966 0.5284 0.6784 0.030 Uiso 1 1 calc R
H4B H 0.3338 0.5267 0.7508 0.030 Uiso 1 1 calc R
H4C H 0.2284 0.6054 0.7522 0.030 Uiso 1 1 calc R
C5 C -0.1592(3) 0.27109(18) 0.79388(15) 0.0208(5) Uani 1 1 d .
H5A H -0.1330 0.2119 0.7736 0.031 Uiso 1 1 calc R
H5B H -0.2487 0.2853 0.7586 0.031 Uiso 1 1 calc R
H5C H -0.1773 0.2615 0.8459 0.031 Uiso 1 1 calc R
C7 C 0.3269(2) 0.55066(17) 1.04427(13) 0.0119(5) Uani 1 1 d .
C8 C 0.4588(2) 0.62501(17) 0.96606(14) 0.0138(5) Uani 1 1 d .
C9 C 0.2077(3) 0.44170(17) 1.19814(14) 0.0142(5) Uani 1 1 d .
C10 C 0.3328(3) 0.50602(17) 1.24264(13) 0.0155(5) Uani 1 1 d .
H10 H 0.3672 0.5110 1.2979 0.019 Uiso 1 1 calc R
C11 C 0.3948(3) 0.55934(17) 1.19164(13) 0.0141(5) Uani 1 1 d .
C12 C 0.1048(3) 0.36626(18) 1.22555(14) 0.0191(5) Uani 1 1 d .
H12A H 0.0156 0.3453 1.1836 0.029 Uiso 1 1 calc R
H12B H 0.0775 0.3933 1.2711 0.029 Uiso 1 1 calc R
H12C H 0.1533 0.3103 1.2400 0.029 Uiso 1 1 calc R
C13 C 0.5243(3) 0.63933(18) 1.20744(14) 0.0184(5) Uani 1 1 d .
H13A H 0.5642 0.6516 1.2640 0.028 Uiso 1 1 calc R
H13B H 0.4937 0.6984 1.1856 0.028 Uiso 1 1 calc R
H13C H 0.6005 0.6208 1.1832 0.028 Uiso 1 1 calc R
C14 C 0.5908(3) 0.71002(18) 0.87813(14) 0.0164(5) Uani 1 1 d .
H14A H 0.5586 0.6493 0.8436 0.020 Uiso 1 1 calc R
H14B H 0.6966 0.7333 0.8804 0.020 Uiso 1 1 calc R
C15 C 0.5019(3) 0.78604(19) 0.84332(14) 0.0209(6) Uani 1 1 d .
H15A H 0.3982 0.7659 0.8447 0.031 Uiso 1 1 calc R
H15B H 0.5088 0.7928 0.7891 0.031 Uiso 1 1 calc R
H15C H 0.5414 0.8486 0.8737 0.031 Uiso 1 1 calc R
C16 C 0.6745(3) 0.74767(18) 1.02432(14) 0.0188(5) Uani 1 1 d .
H16A H 0.7667 0.7763 1.0097 0.023 Uiso 1 1 calc R
H16B H 0.7010 0.7051 1.0673 0.023 Uiso 1 1 calc R
C17 C 0.6061(3) 0.82892(18) 1.05309(15) 0.0230(6) Uani 1 1 d .
H17A H 0.5772 0.8702 1.0104 0.034 Uiso 1 1 calc R
H17B H 0.6783 0.8681 1.0964 0.034 Uiso 1 1 calc R
H17C H 0.5186 0.8008 1.0711 0.034 Uiso 1 1 calc R
C18 C -0.1868(3) 0.07768(19) 0.97228(16) 0.0232(6) Uani 1 1 d .
C20 C 0.8847(3) -0.01989(18) 0.72836(13) 0.0153(5) Uani 1 1 d .
C21 C 1.0069(3) 0.04239(18) 0.76879(14) 0.0167(5) Uani 1 1 d .
H21 H 1.0486 0.0455 0.8234 0.020 Uiso 1 1 calc R
C22 C 1.0603(3) 0.10160(17) 0.71427(14) 0.0143(5) Uani 1 1 d .
C23 C 0.7862(3) -0.09658(18) 0.75740(14) 0.0200(5) Uani 1 1 d .
H23A H 0.8323 -0.1072 0.8115 0.030 Uiso 1 1 calc R
H23B H 0.7704 -0.1572 0.7246 0.030 Uiso 1 1 calc R
H23C H 0.6911 -0.0759 0.7552 0.030 Uiso 1 1 calc R
C24 C 1.1882(3) 0.18275(18) 0.72884(15) 0.0202(5) Uani 1 1 d .
H24A H 1.2106 0.2004 0.6790 0.030 Uiso 1 1 calc R
H24B H 1.2744 0.1623 0.7625 0.030 Uiso 1 1 calc R
H24C H 1.1639 0.2391 0.7546 0.030 Uiso 1 1 calc R
C25 C 0.7594(2) -0.03863(17) 0.58426(13) 0.0119(5) Uani 1 1 d .
C26 C 0.6734(2) -0.03820(16) 0.45575(13) 0.0116(5) Uani 1 1 d .
C27 C 0.5418(2) -0.12946(17) 0.52565(13) 0.0125(5) Uani 1 1 d .
C28 C 0.6056(3) -0.01795(18) 0.31064(13) 0.0153(5) Uani 1 1 d .
C29 C 0.6728(3) 0.04535(17) 0.26617(13) 0.0154(5) Uani 1 1 d .
H29 H 0.6413 0.0499 0.2114 0.018 Uiso 1 1 calc R
C30 C 0.7973(3) 0.10218(17) 0.31728(13) 0.0144(5) Uani 1 1 d .
C31 C 0.4717(3) -0.09411(19) 0.28644(14) 0.0192(5) Uani 1 1 d .
H31A H 0.4371 -0.0990 0.2294 0.029 Uiso 1 1 calc R
H31B H 0.3939 -0.0769 0.3100 0.029 Uiso 1 1 calc R
H31C H 0.4955 -0.1567 0.3039 0.029 Uiso 1 1 calc R
C32 C 0.9028(3) 0.18451(18) 0.29954(14) 0.0183(5) Uani 1 1 d .
H32A H 0.8584 0.2435 0.2965 0.028 Uiso 1 1 calc R
H32B H 0.9253 0.1691 0.2495 0.028 Uiso 1 1 calc R
H32C H 0.9941 0.1952 0.3409 0.028 Uiso 1 1 calc R
C33 C 0.3150(3) -0.23735(18) 0.45774(14) 0.0176(5) Uani 1 1 d .
H33A H 0.2951 -0.1848 0.4226 0.021 Uiso 1 1 calc R
H33B H 0.2214 -0.2644 0.4716 0.021 Uiso 1 1 calc R
C34 C 0.3642(3) -0.31638(18) 0.41490(15) 0.0233(6) Uani 1 1 d .
H34A H 0.4505 -0.2885 0.3958 0.035 Uiso 1 1 calc R
H34B H 0.2837 -0.3454 0.3706 0.035 Uiso 1 1 calc R
H34C H 0.3905 -0.3666 0.4505 0.035 Uiso 1 1 calc R
C35 C 0.4139(3) -0.23688(18) 0.60387(14) 0.0176(5) Uani 1 1 d .
H35A H 0.3088 -0.2629 0.6012 0.021 Uiso 1 1 calc R
H35B H 0.4477 -0.1841 0.6462 0.021 Uiso 1 1 calc R
C36 C 0.5035(3) -0.31717(19) 0.62408(15) 0.0223(6) Uani 1 1 d .
H36A H 0.4616 -0.3736 0.5865 0.033 Uiso 1 1 calc R
H36B H 0.5007 -0.3360 0.6768 0.033 Uiso 1 1 calc R
H36C H 0.6061 -0.2939 0.6220 0.033 Uiso 1 1 calc R
C37 C 1.1664(3) 0.4223(2) 0.47212(15) 0.0238(6) Uani 1 1 d .
S1 S -0.13171(7) 0.18044(5) 1.04463(4) 0.01763(13) Uani 1 1 d .
O1 O -0.1810(2) 0.26022(13) 1.00080(11) 0.0261(4) Uani 1 1 d .
O2 O 0.02678(19) 0.18960(14) 1.06755(12) 0.0331(5) Uani 1 1 d .
O3 O -0.2096(2) 0.15135(15) 1.10256(11) 0.0370(5) Uani 1 1 d .
F1 F -0.15474(18) -0.00393(11) 1.00351(10) 0.0335(4) Uani 1 1 d .
F2 F -0.1181(2) 0.09050(13) 0.91488(10) 0.0469(5) Uani 1 1 d .
F3 F -0.33193(19) 0.06204(13) 0.94078(11) 0.0507(5) Uani 1 1 d .
S2 S 1.17683(7) 0.32560(5) 0.53888(4) 0.01725(13) Uani 1 1 d .
C6 C 0.2474(2) 0.52293(17) 0.91516(13) 0.0128(5) Uani 1 1 d .
O4 O 1.1879(2) 0.24195(13) 0.49112(11) 0.0280(4) Uani 1 1 d .
O5 O 1.03767(19) 0.31579(14) 0.56126(11) 0.0282(4) Uani 1 1 d .
O6 O 1.3055(2) 0.36241(15) 0.59949(11) 0.0313(5) Uani 1 1 d .
F4 F 1.0449(2) 0.40169(13) 0.41409(9) 0.0398(4) Uani 1 1 d .
F5 F 1.2819(2) 0.43538(12) 0.44015(11) 0.0449(5) Uani 1 1 d .
F6 F 1.16310(18) 0.50634(11) 0.50909(10) 0.0309(4) 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_3
O1 Ag1 N6 122.08(7) .
O1 Ag1 N3 170.82(6) .
N6 Ag1 N3 66.45(6) .
O1 Ag1 N1 105.27(7) .
N6 Ag1 N1 130.41(6) .
N3 Ag1 N1 65.63(6) .
O1 Ag1 Ag1 122.91(5) 2_567
N6 Ag1 Ag1 80.68(5) 2_567
N3 Ag1 Ag1 59.52(5) 2_567
N1 Ag1 Ag1 85.96(5) 2_567
N11 Ag2 N14 65.94(6) .
N11 Ag2 N9 66.23(6) .
N14 Ag2 N9 130.41(6) .
N11 Ag2 O4 173.39(6) .
N14 Ag2 O4 107.53(6) .
N9 Ag2 O4 120.36(6) .
N11 Ag2 Ag2 58.02(5) 2_756
N14 Ag2 Ag2 81.51(5) 2_756
N9 Ag2 Ag2 84.29(5) 2_756
O4 Ag2 Ag2 121.27(5) 2_756
C3 N1 N2 105.35(19) .
C3 N1 Ag1 136.93(16) .
N2 N1 Ag1 117.38(13) .
N1 N2 C1 111.05(19) .
N1 N2 C6 118.59(18) .
C1 N2 C6 130.2(2) .
C7 N3 C6 112.93(19) .
C7 N3 Ag1 121.76(15) .
C6 N3 Ag1 122.91(15) .
C6 N4 C8 113.82(19) .
C7 N5 C8 113.3(2) .
C9 N6 N7 105.41(18) .
C9 N6 Ag1 136.62(16) .
N7 N6 Ag1 117.93(13) .
N6 N7 C11 111.44(18) .
N6 N7 C7 118.81(18) .
C11 N7 C7 129.5(2) .
C8 N8 C14 120.2(2) .
C8 N8 C16 120.42(19) .
C14 N8 C16 118.87(18) .
C22 N9 N10 105.53(18) .
C22 N9 Ag2 136.12(16) .
N10 N9 Ag2 117.60(13) .
N9 N10 C20 111.21(18) .
N9 N10 C25 118.89(18) .
C20 N10 C25 129.87(19) .
C26 N11 C25 112.27(19) .
C26 N11 Ag2 122.98(15) .
C25 N11 Ag2 122.21(15) .
C25 N12 C27 113.44(19) .
C26 N13 C27 113.43(19) .
C30 N14 N15 105.59(18) .
C30 N14 Ag2 136.18(16) .
N15 N14 Ag2 117.82(13) .
C28 N15 N14 111.06(18) .
C28 N15 C26 130.5(2) .
N14 N15 C26 118.42(18) .
C27 N16 C35 120.47(19) .
C27 N16 C33 120.62(19) .
C35 N16 C33 118.55(18) .
C2 C1 N2 105.6(2) .
C2 C1 C4 129.0(2) .
N2 C1 C4 125.4(2) .
C1 C2 C3 106.8(2) .
N1 C3 C2 111.2(2) .
N1 C3 C5 120.1(2) .
C2 C3 C5 128.6(2) .
N5 C7 N3 127.5(2) .
N5 C7 N7 118.2(2) .
N3 C7 N7 114.3(2) .
N8 C8 N4 118.0(2) .
N8 C8 N5 117.6(2) .
N4 C8 N5 124.3(2) .
N6 C9 C10 110.4(2) .
N6 C9 C12 120.8(2) .
C10 C9 C12 128.7(2) .
C11 C10 C9 107.3(2) .
C10 C11 N7 105.4(2) .
C10 C11 C13 129.5(2) .
N7 C11 C13 125.0(2) .
N8 C14 C15 112.76(19) .
N8 C16 C17 112.3(2) .
F2 C18 F1 106.8(2) .
F2 C18 F3 107.9(2) .
F1 C18 F3 107.0(2) .
F2 C18 S1 111.78(19) .
F1 C18 S1 111.45(19) .
F3 C18 S1 111.71(18) .
C21 C20 N10 105.5(2) .
C21 C20 C23 129.3(2) .
N10 C20 C23 125.2(2) .
C20 C21 C22 107.2(2) .
N9 C22 C21 110.6(2) .
N9 C22 C24 120.8(2) .
C21 C22 C24 128.6(2) .
N12 C25 N11 127.6(2) .
N12 C25 N10 118.3(2) .
N11 C25 N10 114.12(19) .
N13 C26 N11 127.8(2) .
N13 C26 N15 118.2(2) .
N11 C26 N15 114.02(19) .
N16 C27 N13 118.0(2) .
N16 C27 N12 117.6(2) .
N13 C27 N12 124.4(2) .
C29 C28 N15 105.4(2) .
C29 C28 C31 129.5(2) .
N15 C28 C31 125.0(2) .
C28 C29 C30 106.9(2) .
N14 C30 C29 111.0(2) .
N14 C30 C32 120.4(2) .
C29 C30 C32 128.6(2) .
N16 C33 C34 112.8(2) .
N16 C35 C36 113.48(19) .
F5 C37 F6 107.8(2) .
F5 C37 F4 107.5(2) .
F6 C37 F4 107.8(2) .
F5 C37 S2 111.41(19) .
F6 C37 S2 111.01(17) .
F4 C37 S2 111.14(18) .
O3 S1 O2 116.25(13) .
O3 S1 O1 114.82(12) .
O2 S1 O1 113.29(12) .
O3 S1 C18 103.55(13) .
O2 S1 C18 103.46(12) .
O1 S1 C18 103.23(12) .
S1 O1 Ag1 111.43(10) .
O6 S2 O5 115.74(12) .
O6 S2 O4 115.37(12) .
O5 S2 O4 112.71(12) .
O6 S2 C37 103.67(13) .
O5 S2 C37 103.32(12) .
O4 S2 C37 103.96(12) .
N4 C6 N3 127.1(2) .
N4 C6 N2 118.3(2) .
N3 C6 N2 114.6(2) .
S2 O4 Ag2 103.72(10) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 O1 2.3738(18) .
Ag1 N6 2.393(2) .
Ag1 N3 2.3995(19) .
Ag1 N1 2.445(2) .
Ag1 Ag1 3.1943(7) 2_567
Ag2 N11 2.3953(19) .
Ag2 N14 2.416(2) .
Ag2 N9 2.416(2) .
Ag2 O4 2.4511(19) .
Ag2 Ag2 3.2634(8) 2_756
N1 C3 1.319(3) .
N1 N2 1.382(3) .
N2 C1 1.388(3) .
N2 C6 1.396(3) .
N3 C7 1.333(3) .
N3 C6 1.339(3) .
N4 C6 1.307(3) .
N4 C8 1.360(3) .
N5 C7 1.311(3) .
N5 C8 1.365(3) .
N6 C9 1.326(3) .
N6 N7 1.377(2) .
N7 C11 1.386(3) .
N7 C7 1.404(3) .
N8 C8 1.335(3) .
N8 C14 1.466(3) .
N8 C16 1.470(3) .
N9 C22 1.324(3) .
N9 N10 1.377(2) .
N10 C20 1.391(3) .
N10 C25 1.402(3) .
N11 C26 1.335(3) .
N11 C25 1.345(3) .
N12 C25 1.305(3) .
N12 C27 1.367(3) .
N13 C26 1.310(3) .
N13 C27 1.360(3) .
N14 C30 1.316(3) .
N14 N15 1.389(2) .
N15 C28 1.381(3) .
N15 C26 1.404(3) .
N16 C27 1.333(3) .
N16 C35 1.471(3) .
N16 C33 1.473(3) .
C1 C2 1.367(3) .
C1 C4 1.491(3) .
C2 C3 1.411(3) .
C3 C5 1.493(3) .
C9 C10 1.415(3) .
C9 C12 1.486(3) .
C10 C11 1.361(3) .
C11 C13 1.484(3) .
C14 C15 1.517(3) .
C16 C17 1.521(3) .
C18 F2 1.324(3) .
C18 F1 1.331(3) .
C18 F3 1.334(3) .
C18 S1 1.814(3) .
C20 C21 1.361(3) .
C20 C23 1.486(3) .
C21 C22 1.416(3) .
C22 C24 1.485(3) .
C28 C29 1.376(3) .
C28 C31 1.483(3) .
C29 C30 1.410(3) .
C30 C32 1.486(3) .
C33 C34 1.509(3) .
C35 C36 1.515(3) .
C37 F5 1.328(3) .
C37 F6 1.332(3) .
C37 F4 1.334(3) .
C37 S2 1.822(3) .
S1 O3 1.4234(19) .
S1 O2 1.4402(19) .
S1 O1 1.4547(19) .
S2 O6 1.4306(18) .
S2 O5 1.4434(18) .
S2 O4 1.449(2) .
