#------------------------------------------------------------------------------
#$Date: 2016-03-26 03:01:50 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180165 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/61/7106177.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_7106177
loop_
_publ_author_name
'Jie-Peng Zhang'
'Xiao-Lin Qi'
'Chun-Ting He'
'Xiao-Ming Chen'
_publ_section_title
;
 Interweaving isomerism and isomerization of molecular chains
;
_journal_name_full               Chem.Commun.
_journal_page_first              4156
_journal_paper_doi               10.1039/c1cc10365b
_journal_volume                  47
_journal_year                    2011
_chemical_formula_sum            'C72 H108 Ag12 N24'
_chemical_formula_weight         2604.26
_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                108.5320(10)
_cell_angle_beta                 96.5300(10)
_cell_angle_gamma                104.6880(10)
_cell_formula_units_Z            2
_cell_length_a                   12.1005(8)
_cell_length_b                   18.0915(12)
_cell_length_c                   24.1686(16)
_cell_measurement_temperature    293(2)
_cell_volume                     4742.5(5)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  CCD
_diffrn_measurement_method       '/w scan'
_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  0.0306
_diffrn_reflns_av_sigmaI/netI    0.0544
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            37044
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         1.79
_exptl_absorpt_coefficient_mu    2.466
_exptl_absorpt_correction_T_max  0.7086
_exptl_absorpt_correction_T_min  0.5776
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.824
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             2544
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.996
_refine_diff_density_min         -0.574
_refine_diff_density_rms         0.111
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.047
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     973
_refine_ls_number_reflns         18409
_refine_ls_number_restraints     114
_refine_ls_restrained_S_all      1.067
_refine_ls_R_factor_all          0.0884
_refine_ls_R_factor_gt           0.0547
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0444P)²+5.4060P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1067
_refine_ls_wR_factor_ref         0.1228
_reflns_number_gt                12430
_reflns_number_total             18409
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1cc10365b.txt
_cod_data_source_block           2
_cod_original_cell_volume        4742.4(5)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7106177
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 -1.86952(7) -0.00323(4) 0.09038(4) 0.0896(3) Uani 1 1 d . . .
Ag2 Ag -1.59576(5) -0.24069(4) 0.11974(3) 0.06041(17) Uani 1 1 d . . .
Ag3 Ag -1.14538(5) -0.34307(4) 0.15346(3) 0.05970(17) Uani 1 1 d . . .
Ag4 Ag -0.61796(5) -0.29331(4) 0.23229(3) 0.06174(17) Uani 1 1 d . . .
Ag5 Ag -0.15010(6) -0.05869(4) 0.40031(3) 0.0749(2) Uani 1 1 d . . .
Ag6 Ag 0.32710(5) 0.20883(4) 0.52964(3) 0.0703(2) Uani 1 1 d . . .
Ag7 Ag 0.86864(5) 0.33510(4) 0.56857(3) 0.06945(19) Uani 1 1 d . . .
Ag8 Ag 1.35347(6) 0.37309(4) 0.49687(3) 0.0737(2) Uani 1 1 d . . .
Ag9 Ag 1.69563(6) 0.42903(4) 0.33107(3) 0.0700(2) Uani 1 1 d . . .
Ag10 Ag 2.00186(5) 0.41762(4) 0.14111(3) 0.05623(16) Uani 1 1 d . . .
Ag11 Ag 2.44967(5) 0.37018(4) 0.04974(3) 0.06028(17) Uani 1 1 d . . .
Ag12 Ag 2.87787(5) 0.24004(4) 0.04453(3) 0.06358(18) Uani 1 1 d . . .
N1 N -1.8202(6) -0.0966(4) 0.1083(3) 0.074(2) Uani 1 1 d . . .
N2 N -1.7202(6) -0.1798(4) 0.1177(3) 0.0577(17) Uani 1 1 d . . .
N3 N -1.4774(5) -0.3075(4) 0.1203(3) 0.0529(15) Uani 1 1 d . . .
N4 N -1.3152(5) -0.3408(4) 0.1339(3) 0.0504(15) Uani 1 1 d . . .
N5 N -0.9807(5) -0.3581(4) 0.1620(3) 0.0499(15) Uani 1 1 d . . .
N6 N -0.7926(5) -0.3416(4) 0.1880(3) 0.0537(16) Uani 1 1 d . . .
N7 N -0.4452(5) -0.2459(4) 0.2795(3) 0.0593(17) Uani 1 1 d . . .
N8 N -0.2811(5) -0.1638(4) 0.3431(3) 0.0654(18) Uani 1 1 d . . .
N9 N -0.0233(6) 0.0509(4) 0.4538(3) 0.0694(19) Uani 1 1 d . . .
N10 N 0.1504(5) 0.1422(4) 0.4995(3) 0.0629(17) Uani 1 1 d . . .
N11 N 0.5035(5) 0.2717(4) 0.5643(3) 0.0637(18) Uani 1 1 d . . .
N12 N 0.6969(5) 0.3139(4) 0.5794(3) 0.0673(19) Uani 1 1 d . . .
N13 N 1.0459(5) 0.3607(4) 0.5676(3) 0.0595(17) Uani 1 1 d . . .
N14 N 1.2152(6) 0.3629(4) 0.5410(3) 0.0615(17) Uani 1 1 d . . .
N15 N 1.5002(6) 0.3908(4) 0.4594(3) 0.0658(19) Uani 1 1 d . . .
N16 N 1.6243(6) 0.4122(4) 0.4019(3) 0.0646(18) Uani 1 1 d . . .
N17 N 1.7638(5) 0.4418(4) 0.2589(3) 0.0570(16) Uani 1 1 d . . .
N18 N 1.8786(5) 0.4403(4) 0.1927(3) 0.0513(15) Uani 1 1 d . . .
N19 N 2.1241(5) 0.3960(3) 0.0878(3) 0.0471(14) Uani 1 1 d . . .
N20 N 2.2895(5) 0.3888(3) 0.0585(3) 0.0495(15) Uani 1 1 d . . .
N21 N 2.6095(5) 0.3529(4) 0.0384(3) 0.0532(15) Uani 1 1 d . . .
N22 N 2.7632(5) 0.3074(4) 0.0363(3) 0.0520(15) Uani 1 1 d . . .
N23 N 2.9958(5) 0.1754(4) 0.0545(3) 0.0642(18) Uani 1 1 d . . .
N24 N 3.0875(6) 0.0899(4) 0.0695(4) 0.076(2) Uani 1 1 d . . .
C1 C -1.8963(7) -0.1713(5) 0.0953(4) 0.064(2) Uani 1 1 d . . .
H1A H -1.9772 -0.1852 0.0848 0.077 Uiso 1 1 calc R . .
C2 C -1.8359(7) -0.2220(5) 0.1001(4) 0.058(2) Uani 1 1 d . . .
H2A H -1.8680 -0.2776 0.0925 0.070 Uiso 1 1 calc R . .
C3 C -1.7147(8) -0.1041(5) 0.1219(4) 0.072(2) Uani 1 1 d . . .
C4 C -1.5991(12) -0.0343(8) 0.1451(7) 0.127(5) Uani 1 1 d . . .
H4A H -1.5362 -0.0575 0.1520 0.152 Uiso 1 1 calc R . .
C5 C -1.5766(15) 0.0026(11) 0.1004(8) 0.207(7) Uani 1 1 d U . .
H5A H -1.5734 -0.0383 0.0643 0.269 Uiso 1 1 calc R . .
H5B H -1.5034 0.0457 0.1151 0.269 Uiso 1 1 calc R . .
H5C H -1.6383 0.0247 0.0924 0.269 Uiso 1 1 calc R . .
C6 C -1.6015(15) 0.0276(11) 0.2043(8) 0.200(7) Uani 1 1 d U . .
H6A H -1.5289 0.0713 0.2186 0.260 Uiso 1 1 calc R . .
H6B H -1.6125 0.0012 0.2329 0.260 Uiso 1 1 calc R . .
H6C H -1.6647 0.0494 0.1988 0.260 Uiso 1 1 calc R . .
C7 C -1.5082(6) -0.3879(5) 0.1108(3) 0.0533(19) Uani 1 1 d . . .
H7A H -1.5843 -0.4231 0.1003 0.064 Uiso 1 1 calc R . .
C8 C -1.4091(6) -0.4090(5) 0.1190(3) 0.0542(19) Uani 1 1 d . . .
H8A H -1.4059 -0.4612 0.1151 0.065 Uiso 1 1 calc R . .
C9 C -1.3602(7) -0.2805(5) 0.1349(3) 0.0504(18) Uani 1 1 d . . .
C10 C -1.2914(8) -0.1945(6) 0.1459(5) 0.082(3) Uani 1 1 d . . .
H10A H -1.3522 -0.1676 0.1514 0.098 Uiso 1 1 calc R . .
C11 C -1.2601(13) -0.1815(7) 0.0935(5) 0.151(6) Uani 1 1 d . . .
H11A H -1.2161 -0.1251 0.1037 0.196 Uiso 1 1 calc R . .
H11B H -1.3297 -0.1951 0.0641 0.196 Uiso 1 1 calc R . .
H11C H -1.2135 -0.2156 0.0776 0.196 Uiso 1 1 calc R . .
C12 C -1.2125(13) -0.1505(8) 0.1997(6) 0.167(6) Uani 1 1 d U . .
H12A H -1.1743 -0.0965 0.2008 0.217 Uiso 1 1 calc R . .
H12B H -1.1552 -0.1778 0.2037 0.217 Uiso 1 1 calc R . .
H12C H -1.2530 -0.1468 0.2319 0.217 Uiso 1 1 calc R . .
C13 C -0.9513(6) -0.4140(4) 0.1176(3) 0.0511(18) Uani 1 1 d . . .
H13A H -1.0020 -0.4519 0.0824 0.061 Uiso 1 1 calc R . .
C14 C -0.8364(6) -0.4047(4) 0.1333(4) 0.0520(19) Uani 1 1 d . . .
H14A H -0.7944 -0.4353 0.1113 0.062 Uiso 1 1 calc R . .
C15 C -0.8828(6) -0.3162(5) 0.2033(3) 0.0528(19) Uani 1 1 d . . .
C16 C -0.8724(9) -0.2490(7) 0.2606(4) 0.092(3) Uani 1 1 d . . .
H16A H -0.7911 -0.2383 0.2797 0.111 Uiso 1 1 calc R . .
C17 C -0.9309(14) -0.2757(10) 0.3008(6) 0.182(6) Uani 1 1 d U . .
H17A H -0.9201 -0.2298 0.3367 0.237 Uiso 1 1 calc R . .
H17B H -0.8999 -0.3152 0.3101 0.237 Uiso 1 1 calc R . .
H17C H -1.0127 -0.3004 0.2831 0.237 Uiso 1 1 calc R . .
C18 C -0.8664(14) -0.1728(9) 0.2557(6) 0.162(6) Uani 1 1 d U . .
H18A H -0.8585 -0.1331 0.2945 0.211 Uiso 1 1 calc R . .
H18B H -0.9365 -0.1778 0.2299 0.211 Uiso 1 1 calc R . .
H18C H -0.8001 -0.1556 0.2393 0.211 Uiso 1 1 calc R . .
C19 C -0.3680(7) -0.2884(5) 0.2791(3) 0.058(2) Uani 1 1 d . . .
H19A H -0.3824 -0.3433 0.2563 0.070 Uiso 1 1 calc R . .
C20 C -0.2682(7) -0.2391(5) 0.3167(3) 0.060(2) Uani 1 1 d . . .
H20A H -0.2009 -0.2535 0.3239 0.072 Uiso 1 1 calc R . .
C21 C -0.3889(7) -0.1712(5) 0.3186(4) 0.065(2) Uani 1 1 d . . .
C22 C -0.4425(10) -0.1024(7) 0.3347(6) 0.109(4) Uani 1 1 d . . .
H22A H -0.5135 -0.1316 0.3033 0.130 Uiso 1 1 calc R . .
C23 C -0.4987(15) -0.0998(10) 0.3810(8) 0.181(6) Uani 1 1 d U . .
H23A H -0.5311 -0.0552 0.3890 0.236 Uiso 1 1 calc R . .
H23B H -0.4441 -0.0921 0.4159 0.236 Uiso 1 1 calc R . .
H23C H -0.5604 -0.1504 0.3705 0.236 Uiso 1 1 calc R . .
C24 C -0.4034(16) -0.0399(10) 0.3132(8) 0.198(7) Uani 1 1 d U . .
H24A H -0.4433 0.0001 0.3259 0.257 Uiso 1 1 calc R . .
H24B H -0.4191 -0.0623 0.2703 0.257 Uiso 1 1 calc R . .
H24C H -0.3208 -0.0145 0.3284 0.257 Uiso 1 1 calc R . .
C25 C -0.0347(7) 0.1083(5) 0.5033(4) 0.066(2) Uani 1 1 d . . .
H25A H -0.1045 0.1093 0.5157 0.080 Uiso 1 1 calc R . .
C26 C 0.0693(7) 0.1625(5) 0.5312(4) 0.065(2) Uani 1 1 d . . .
H26A H 0.0845 0.2071 0.5665 0.078 Uiso 1 1 calc R . .
C27 C 0.0890(7) 0.0739(5) 0.4529(4) 0.068(2) Uani 1 1 d . . .
C28 C 0.1400(10) 0.0282(7) 0.4034(5) 0.102(3) Uani 1 1 d . . .
H28A H 0.0834 -0.0268 0.3854 0.122 Uiso 1 1 calc R . .
C29 C 0.2507(10) 0.0151(8) 0.4232(7) 0.163(6) Uani 1 1 d . . .
H29A H 0.2760 -0.0145 0.3890 0.212 Uiso 1 1 calc R . .
H29B H 0.2393 -0.0160 0.4488 0.212 Uiso 1 1 calc R . .
H29C H 0.3091 0.0670 0.4445 0.212 Uiso 1 1 calc R . .
C30 C 0.1416(15) 0.0616(10) 0.3548(7) 0.186(7) Uani 1 1 d U . .
H30A H 0.0665 0.0675 0.3436 0.241 Uiso 1 1 calc R . .
H30B H 0.1591 0.0249 0.3209 0.241 Uiso 1 1 calc R . .
H30C H 0.2002 0.1142 0.3684 0.241 Uiso 1 1 calc R . .
C31 C 0.5462(7) 0.3357(6) 0.6164(4) 0.071(2) Uani 1 1 d . . .
H31A H 0.5011 0.3578 0.6417 0.085 Uiso 1 1 calc R . .
C32 C 0.6628(7) 0.3627(6) 0.6264(4) 0.077(3) Uani 1 1 d . . .
H32A H 0.7120 0.4065 0.6593 0.092 Uiso 1 1 calc R . .
C33 C 0.5985(7) 0.2617(5) 0.5435(4) 0.064(2) Uani 1 1 d . . .
C34 C 0.5892(9) 0.1910(7) 0.4872(5) 0.098(3) Uani 1 1 d . . .
H34A H 0.5075 0.1569 0.4780 0.118 Uiso 1 1 calc R . .
C35 C 0.6546(14) 0.1366(8) 0.4936(6) 0.175(7) Uani 1 1 d . . .
H35A H 0.6429 0.0938 0.4557 0.227 Uiso 1 1 calc R . .
H35B H 0.6283 0.1129 0.5220 0.227 Uiso 1 1 calc R . .
H35C H 0.7363 0.1668 0.5075 0.227 Uiso 1 1 calc R . .
C36 C 0.5996(14) 0.2132(9) 0.4370(6) 0.163(6) Uani 1 1 d U . .
H36A H 0.5919 0.1654 0.4029 0.212 Uiso 1 1 calc R . .
H36B H 0.6748 0.2526 0.4442 0.212 Uiso 1 1 calc R . .
H36C H 0.5394 0.2366 0.4294 0.212 Uiso 1 1 calc R . .
C37 C 1.1276(7) 0.3786(5) 0.6168(4) 0.058(2) Uani 1 1 d . . .
H37A H 1.1148 0.3882 0.6554 0.070 Uiso 1 1 calc R . .
C38 C 1.2316(7) 0.3804(5) 0.6005(4) 0.062(2) Uani 1 1 d . . .
H38A H 1.3023 0.3916 0.6260 0.074 Uiso 1 1 calc R . .
C39 C 1.1019(7) 0.3514(5) 0.5226(4) 0.061(2) Uani 1 1 d . . .
C40 C 1.0434(12) 0.3315(8) 0.4587(5) 0.114(4) Uani 1 1 d . . .
H40A H 1.1154 0.3545 0.4469 0.137 Uiso 1 1 calc R . .
C41 C 0.9880(13) 0.3849(9) 0.4474(7) 0.174(6) Uani 1 1 d U . .
H41A H 0.9545 0.3657 0.4055 0.226 Uiso 1 1 calc R . .
H41B H 1.0437 0.4384 0.4592 0.226 Uiso 1 1 calc R . .
H41C H 0.9273 0.3879 0.4696 0.226 Uiso 1 1 calc R . .
C42 C 1.0241(14) 0.2556(10) 0.4213(7) 0.176(6) Uani 1 1 d U . .
H42A H 0.9868 0.2499 0.3823 0.228 Uiso 1 1 calc R . .
H42B H 0.9744 0.2179 0.4351 0.228 Uiso 1 1 calc R . .
H42C H 1.0971 0.2442 0.4195 0.228 Uiso 1 1 calc R . .
C43 C 1.6086(8) 0.4244(5) 0.4935(4) 0.069(2) Uani 1 1 d . . .
H43A H 1.6275 0.4362 0.5344 0.083 Uiso 1 1 calc R . .
C44 C 1.6859(8) 0.4384(5) 0.4589(4) 0.071(2) Uani 1 1 d . . .
H44A H 1.7665 0.4617 0.4718 0.085 Uiso 1 1 calc R . .
C45 C 1.5135(7) 0.3849(5) 0.4051(4) 0.067(2) Uani 1 1 d . . .
C46 C 1.4159(9) 0.3510(8) 0.3510(5) 0.100(3) Uani 1 1 d U . .
H46A H 1.4580 0.3588 0.3200 0.120 Uiso 1 1 calc R . .
C47 C 1.3643(14) 0.2654(10) 0.3290(7) 0.185(6) Uani 1 1 d U . .
H47A H 1.3034 0.2496 0.2945 0.240 Uiso 1 1 calc R . .
H47B H 1.3316 0.2492 0.3593 0.240 Uiso 1 1 calc R . .
H47C H 1.4225 0.2392 0.3183 0.240 Uiso 1 1 calc R . .
C48 C 1.3387(14) 0.4003(11) 0.3507(6) 0.197(8) Uani 1 1 d . . .
H48A H 1.2790 0.3741 0.3148 0.256 Uiso 1 1 calc R . .
H48B H 1.3827 0.4534 0.3523 0.256 Uiso 1 1 calc R . .
H48C H 1.3031 0.4059 0.3847 0.256 Uiso 1 1 calc R . .
C49 C 1.7217(6) 0.4714(5) 0.2186(4) 0.060(2) Uani 1 1 d . . .
H49A H 1.6560 0.4892 0.2187 0.073 Uiso 1 1 calc R . .
C50 C 1.7918(6) 0.4708(5) 0.1783(3) 0.0543(19) Uani 1 1 d . . .
H50A H 1.7820 0.4883 0.1463 0.065 Uiso 1 1 calc R . .
C51 C 1.8588(6) 0.4245(5) 0.2419(3) 0.0548(19) Uani 1 1 d . . .
C52 C 1.9387(9) 0.3978(7) 0.2772(5) 0.093(3) Uani 1 1 d . . .
H52A H 1.9004 0.3996 0.3110 0.112 Uiso 1 1 calc R . .
C53 C 1.9251(15) 0.3170(11) 0.2546(8) 0.203(8) Uani 1 1 d U . .
H53A H 1.9787 0.3039 0.2796 0.264 Uiso 1 1 calc R . .
H53B H 1.9403 0.3027 0.2150 0.264 Uiso 1 1 calc R . .
H53C H 1.8464 0.2867 0.2530 0.264 Uiso 1 1 calc R . .
C54 C 2.0520(12) 0.4594(9) 0.3089(6) 0.155(6) Uani 1 1 d . . .
H54A H 2.0976 0.4368 0.3302 0.201 Uiso 1 1 calc R . .
H54B H 2.0397 0.5065 0.3367 0.201 Uiso 1 1 calc R . .
H54C H 2.0928 0.4753 0.2807 0.201 Uiso 1 1 calc R . .
C55 C 2.1118(6) 0.3919(4) 0.0299(3) 0.0484(18) Uani 1 1 d . . .
H55A H 2.0451 0.3917 0.0065 0.058 Uiso 1 1 calc R . .
C56 C 2.2126(6) 0.3882(4) 0.0126(3) 0.0488(18) Uani 1 1 d . . .
H56A H 2.2274 0.3856 -0.0247 0.059 Uiso 1 1 calc R . .
C57 C 2.2338(6) 0.3940(4) 0.1034(3) 0.0456(17) Uani 1 1 d . . .
C58 C 2.2852(9) 0.3985(6) 0.1639(4) 0.085(3) Uani 1 1 d U . .
H58A H 2.2126 0.3992 0.1781 0.102 Uiso 1 1 calc R . .
C59 C 2.3483(12) 0.4804(7) 0.2055(5) 0.144(6) Uani 1 1 d . . .
H59A H 2.3775 0.4780 0.2433 0.188 Uiso 1 1 calc R . .
H59B H 2.2968 0.5135 0.2106 0.188 Uiso 1 1 calc R . .
H59C H 2.4126 0.5041 0.1903 0.188 Uiso 1 1 calc R . .
C60 C 2.2860(14) 0.3297(9) 0.1732(7) 0.187(6) Uani 1 1 d U . .
H60A H 2.3199 0.3427 0.2143 0.243 Uiso 1 1 calc R . .
H60B H 2.3313 0.3030 0.1482 0.243 Uiso 1 1 calc R . .
H60C H 2.2073 0.2939 0.1637 0.243 Uiso 1 1 calc R . .
C61 C 2.6924(6) 0.4016(5) 0.0196(3) 0.0509(18) Uani 1 1 d . . .
H61A H 2.6856 0.4459 0.0094 0.061 Uiso 1 1 calc R . .
C62 C 2.7844(6) 0.3735(4) 0.0188(3) 0.0505(18) Uani 1 1 d . . .
H62A H 2.8529 0.3957 0.0079 0.061 Uiso 1 1 calc R . .
C63 C 2.6566(6) 0.2975(4) 0.0478(3) 0.0516(18) Uani 1 1 d . . .
C64 C 2.5973(8) 0.2313(6) 0.0687(5) 0.085(3) Uani 1 1 d . . .
H64A H 2.6520 0.1994 0.0612 0.102 Uiso 1 1 calc R . .
C65 C 2.6135(12) 0.2501(8) 0.1304(6) 0.151(5) Uani 1 1 d U . .
H65A H 2.5714 0.2032 0.1383 0.196 Uiso 1 1 calc R . .
H65B H 2.5849 0.2952 0.1479 0.196 Uiso 1 1 calc R . .
H65C H 2.6952 0.2647 0.1473 0.196 Uiso 1 1 calc R . .
C66 C 2.4985(15) 0.1716(10) 0.0294(7) 0.189(7) Uani 1 1 d U . .
H66A H 2.4674 0.1322 0.0469 0.246 Uiso 1 1 calc R . .
H66B H 2.5191 0.1447 -0.0073 0.246 Uiso 1 1 calc R . .
H66C H 2.4406 0.1968 0.0213 0.246 Uiso 1 1 calc R . .
C67 C 3.0937(6) 0.1846(5) 0.0312(4) 0.061(2) Uani 1 1 d . . .
H67A H 3.1181 0.2209 0.0119 0.073 Uiso 1 1 calc R . .
C68 C 3.1489(7) 0.1332(5) 0.0407(4) 0.073(3) Uani 1 1 d . . .
H68A H 3.2183 0.1281 0.0293 0.088 Uiso 1 1 calc R . .
C69 C 2.9941(8) 0.1174(6) 0.0769(5) 0.085(3) Uani 1 1 d . . .
C70 C 2.8960(13) 0.0850(10) 0.1072(7) 0.144(5) Uani 1 1 d U . .
H70A H 2.8803 0.1378 0.1187 0.172 Uiso 1 1 calc R . .
C71 C 2.7801(13) 0.0447(8) 0.0675(8) 0.173(7) Uani 1 1 d . . .
H71A H 2.7245 0.0263 0.0893 0.225 Uiso 1 1 calc R . .
H71B H 2.7829 -0.0014 0.0348 0.225 Uiso 1 1 calc R . .
H71C H 2.7571 0.0828 0.0523 0.225 Uiso 1 1 calc R . .
C72 C 2.9451(16) 0.1014(10) 0.1701(7) 0.180(7) Uani 1 1 d . . .
H72A H 2.8839 0.0814 0.1886 0.234 Uiso 1 1 calc R . .
H72B H 2.9804 0.1593 0.1908 0.234 Uiso 1 1 calc R . .
H72C H 3.0032 0.0741 0.1720 0.234 Uiso 1 1 calc R . .
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'
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
N24 Ag1 N1 177.0(3) 1_055 . ?
N2 Ag2 N3 177.1(2) . . ?
N2 Ag2 Ag4 103.74(17) . 1_455 ?
N3 Ag2 Ag4 75.43(16) . 1_455 ?
N4 Ag3 N5 172.3(3) . . ?
N6 Ag4 N7 177.8(2) . . ?
N6 Ag4 Ag2 81.02(16) . 1_655 ?
N7 Ag4 Ag2 101.18(17) . 1_655 ?
N9 Ag5 N8 175.9(3) . . ?
N11 Ag6 N10 176.0(3) . . ?
N11 Ag6 Ag8 78.43(19) . 1_455 ?
N10 Ag6 Ag8 105.03(18) . 1_455 ?
N12 Ag7 N13 173.9(3) . . ?
N15 Ag8 N14 175.2(3) . . ?
N15 Ag8 Ag6 107.12(18) . 1_655 ?
N14 Ag8 Ag6 73.83(18) . 1_655 ?
N17 Ag9 N16 178.1(3) . . ?
N18 Ag10 N19 178.6(2) . . ?
N18 Ag10 Ag12 104.53(17) . 1_455 ?
N19 Ag10 Ag12 75.44(16) . 1_455 ?
N21 Ag11 N20 178.0(2) . . ?
N22 Ag12 N23 178.5(3) . . ?
N22 Ag12 Ag10 74.82(17) . 1_655 ?
N23 Ag12 Ag10 103.67(19) . 1_655 ?
C3 N1 C1 105.6(6) . . ?
C3 N1 Ag1 130.8(6) . . ?
C1 N1 Ag1 122.3(5) . . ?
C3 N2 C2 104.7(6) . . ?
C3 N2 Ag2 133.8(6) . . ?
C2 N2 Ag2 120.7(5) . . ?
C7 N3 C9 106.2(6) . . ?
C7 N3 Ag2 124.4(5) . . ?
C9 N3 Ag2 129.1(5) . . ?
C9 N4 C8 105.2(6) . . ?
C9 N4 Ag3 132.6(5) . . ?
C8 N4 Ag3 122.1(5) . . ?
C15 N5 C13 105.9(6) . . ?
C15 N5 Ag3 131.9(5) . . ?
C13 N5 Ag3 121.9(5) . . ?
C15 N6 C14 105.9(6) . . ?
C15 N6 Ag4 128.6(5) . . ?
C14 N6 Ag4 125.4(5) . . ?
C21 N7 C19 104.9(6) . . ?
C21 N7 Ag4 129.0(6) . . ?
C19 N7 Ag4 125.9(6) . . ?
C21 N8 C20 104.6(7) . . ?
C21 N8 Ag5 128.8(6) . . ?
C20 N8 Ag5 126.1(5) . . ?
C27 N9 C25 104.8(7) . . ?
C27 N9 Ag5 127.8(6) . . ?
C25 N9 Ag5 126.6(6) . . ?
C27 N10 C26 104.4(7) . . ?
C27 N10 Ag6 134.2(6) . . ?
C26 N10 Ag6 121.4(5) . . ?
C33 N11 C31 104.1(7) . . ?
C33 N11 Ag6 131.4(6) . . ?
C31 N11 Ag6 124.4(5) . . ?
C33 N12 C32 104.8(7) . . ?
C33 N12 Ag7 131.0(6) . . ?
C32 N12 Ag7 123.7(6) . . ?
C39 N13 C37 105.6(6) . . ?
C39 N13 Ag7 131.5(6) . . ?
C37 N13 Ag7 122.1(5) . . ?
C39 N14 C38 105.6(6) . . ?
C39 N14 Ag8 131.2(5) . . ?
C38 N14 Ag8 122.5(5) . . ?
C45 N15 C43 105.3(7) . . ?
C45 N15 Ag8 132.8(6) . . ?
C43 N15 Ag8 121.4(5) . . ?
C45 N16 C44 104.9(7) . . ?
C45 N16 Ag9 130.1(6) . . ?
C44 N16 Ag9 124.5(5) . . ?
C51 N17 C49 105.0(6) . . ?
C51 N17 Ag9 128.3(5) . . ?
C49 N17 Ag9 126.7(5) . . ?
C51 N18 C50 104.8(6) . . ?
C51 N18 Ag10 130.9(5) . . ?
C50 N18 Ag10 124.1(5) . . ?
C57 N19 C55 105.3(5) . . ?
C57 N19 Ag10 129.4(5) . . ?
C55 N19 Ag10 124.7(4) . . ?
C57 N20 C56 105.7(5) . . ?
C57 N20 Ag11 130.9(5) . . ?
C56 N20 Ag11 123.0(4) . . ?
C63 N21 C61 105.5(5) . . ?
C63 N21 Ag11 130.4(5) . . ?
C61 N21 Ag11 124.1(5) . . ?
C63 N22 C62 104.7(5) . . ?
C63 N22 Ag12 128.8(5) . . ?
C62 N22 Ag12 126.5(4) . . ?
C69 N23 C67 105.4(6) . . ?
C69 N23 Ag12 133.1(6) . . ?
C67 N23 Ag12 121.4(5) . . ?
C68 N24 C69 105.4(6) . . ?
C68 N24 Ag1 124.2(5) . 1_:55 ?
C69 N24 Ag1 130.3(6) . 1_:55 ?
C2 C1 N1 108.3(7) . . ?
C2 C1 H1A 125.8 . . ?
N1 C1 H1A 125.8 . . ?
C1 C2 N2 109.3(7) . . ?
C1 C2 H2A 125.4 . . ?
N2 C2 H2A 125.4 . . ?
N2 C3 N1 112.1(7) . . ?
N2 C3 C4 121.8(8) . . ?
N1 C3 C4 125.9(8) . . ?
C5 C4 C6 112.4(13) . . ?
C5 C4 C3 110.0(12) . . ?
C6 C4 C3 109.8(12) . . ?
C5 C4 H4A 108.1 . . ?
C6 C4 H4A 108.1 . . ?
C3 C4 H4A 108.1 . . ?
C4 C5 H5A 109.5 . . ?
C4 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
C4 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
C4 C6 H6A 109.5 . . ?
C4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
N3 C7 C8 108.2(7) . . ?
N3 C7 H7A 125.9 . . ?
C8 C7 H7A 125.9 . . ?
C7 C8 N4 108.6(7) . . ?
C7 C8 H8A 125.7 . . ?
N4 C8 H8A 125.7 . . ?
N4 C9 N3 111.8(6) . . ?
N4 C9 C10 125.3(7) . . ?
N3 C9 C10 122.8(7) . . ?
C12 C10 C11 117.8(10) . . ?
C12 C10 C9 118.2(9) . . ?
C11 C10 C9 113.8(9) . . ?
C12 C10 H10A 100.7 . . ?
C11 C10 H10A 100.7 . . ?
C9 C10 H10A 100.7 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C13 N5 108.6(7) . . ?
C14 C13 H13A 125.7 . . ?
N5 C13 H13A 125.7 . . ?
C13 C14 N6 107.7(7) . . ?
C13 C14 H14A 126.2 . . ?
N6 C14 H14A 126.2 . . ?
N5 C15 N6 112.0(7) . . ?
N5 C15 C16 125.2(7) . . ?
N6 C15 C16 122.8(7) . . ?
C17 C16 C18 121.9(12) . . ?
C17 C16 C15 113.6(10) . . ?
C18 C16 C15 114.9(10) . . ?
C17 C16 H16A 100.4 . . ?
C18 C16 H16A 100.4 . . ?
C15 C16 H16A 100.4 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 N7 109.1(7) . . ?
C20 C19 H19A 125.5 . . ?
N7 C19 H19A 125.4 . . ?
C19 C20 N8 108.6(7) . . ?
C19 C20 H20A 125.7 . . ?
N8 C20 H20A 125.7 . . ?
N8 C21 N7 112.8(7) . . ?
N8 C21 C22 123.5(9) . . ?
N7 C21 C22 123.8(8) . . ?
C23 C22 C24 127.5(14) . . ?
C23 C22 C21 113.4(11) . . ?
C24 C22 C21 116.6(12) . . ?
C23 C22 H22A 95.2 . . ?
C24 C22 H22A 95.2 . . ?
C21 C22 H22A 95.2 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C26 C25 N9 109.3(8) . . ?
C26 C25 H25A 125.3 . . ?
N9 C25 H25A 125.3 . . ?
C25 C26 N10 108.8(8) . . ?
C25 C26 H26A 125.6 . . ?
N10 C26 H26A 125.6 . . ?
N9 C27 N10 112.7(8) . . ?
N9 C27 C28 122.6(9) . . ?
N10 C27 C28 124.7(8) . . ?
C29 C28 C30 113.9(12) . . ?
C29 C28 C27 115.4(10) . . ?
C30 C28 C27 111.8(10) . . ?
C29 C28 H28A 104.8 . . ?
C30 C28 H28A 104.8 . . ?
C27 C28 H28A 104.8 . . ?
C28 C29 H29A 109.5 . . ?
C28 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C28 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C28 C30 H30A 109.5 . . ?
C28 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C28 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C32 C31 N11 110.2(8) . . ?
C32 C31 H31A 124.9 . . ?
N11 C31 H31A 124.9 . . ?
C31 C32 N12 107.5(8) . . ?
C31 C32 H32A 126.2 . . ?
N12 C32 H32A 126.2 . . ?
N12 C33 N11 113.2(8) . . ?
N12 C33 C34 125.4(8) . . ?
N11 C33 C34 121.1(8) . . ?
C36 C34 C35 114.0(11) . . ?
C36 C34 C33 114.0(10) . . ?
C35 C34 C33 115.8(10) . . ?
C36 C34 H34A 103.7 . . ?
C35 C34 H34A 103.7 . . ?
C33 C34 H34A 103.7 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
N13 C37 C38 108.4(7) . . ?
N13 C37 H37A 125.8 . . ?
C38 C37 H37A 125.8 . . ?
N14 C38 C37 108.5(7) . . ?
N14 C38 H38A 125.8 . . ?
C37 C38 H38A 125.8 . . ?
N14 C39 N13 111.9(7) . . ?
N14 C39 C40 124.5(8) . . ?
N13 C39 C40 123.6(8) . . ?
C42 C40 C41 123.7(13) . . ?
C42 C40 C39 116.5(11) . . ?
C41 C40 C39 117.5(11) . . ?
C42 C40 H40A 95.0 . . ?
C41 C40 H40A 95.0 . . ?
C39 C40 H40A 95.0 . . ?
C40 C41 H41A 109.5 . . ?
C40 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
C40 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C40 C42 H42A 109.5 . . ?
C40 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
C40 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
N15 C43 C44 109.1(8) . . ?
N15 C43 H43A 125.4 . . ?
C44 C43 H43A 125.4 . . ?
C43 C44 N16 107.6(8) . . ?
C43 C44 H44A 126.2 . . ?
N16 C44 H44A 126.2 . . ?
N15 C45 N16 113.2(8) . . ?
N15 C45 C46 125.0(8) . . ?
N16 C45 C46 121.8(8) . . ?
C47 C46 C48 117.1(13) . . ?
C47 C46 C45 115.6(11) . . ?
C48 C46 C45 115.0(11) . . ?
C47 C46 H46A 101.9 . . ?
C48 C46 H46A 101.9 . . ?
C45 C46 H46A 101.9 . . ?
C46 C47 H47A 109.5 . . ?
C46 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C46 C47 H47C 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
C46 C48 H48A 109.5 . . ?
C46 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C46 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
N17 C49 C50 108.7(6) . . ?
N17 C49 H49A 125.6 . . ?
C50 C49 H49A 125.6 . . ?
C49 C50 N18 108.6(6) . . ?
C49 C50 H50A 125.7 . . ?
N18 C50 H50A 125.7 . . ?
N17 C51 N18 112.8(6) . . ?
N17 C51 C52 123.0(7) . . ?
N18 C51 C52 124.0(7) . . ?
C53 C52 C54 122.8(12) . . ?
C53 C52 C51 113.8(12) . . ?
C54 C52 C51 115.3(9) . . ?
C53 C52 H52A 99.5 . . ?
C54 C52 H52A 99.5 . . ?
C51 C52 H52A 99.5 . . ?
C52 C53 H53A 109.5 . . ?
C52 C53 H53B 109.5 . . ?
H53A C53 H53B 109.5 . . ?
C52 C53 H53C 109.5 . . ?
H53A C53 H53C 109.5 . . ?
H53B C53 H53C 109.5 . . ?
C52 C54 H54A 109.5 . . ?
C52 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C52 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
C56 C55 N19 108.3(6) . . ?
C56 C55 H55A 125.9 . . ?
N19 C55 H55A 125.9 . . ?
C55 C56 N20 109.1(6) . . ?
C55 C56 H56A 125.4 . . ?
N20 C56 H56A 125.4 . . ?
N20 C57 N19 111.6(6) . . ?
N20 C57 C58 124.9(7) . . ?
N19 C57 C58 123.5(7) . . ?
C60 C58 C59 124.8(11) . . ?
C60 C58 C57 119.6(11) . . ?
C59 C58 C57 114.8(8) . . ?
C60 C58 H58A 93.0 . . ?
C59 C58 H58A 93.0 . . ?
C57 C58 H58A 93.0 . . ?
C58 C59 H59A 109.5 . . ?
C58 C59 H59B 109.5 . . ?
H59A C59 H59B 109.5 . . ?
C58 C59 H59C 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C58 C60 H60A 109.5 . . ?
C58 C60 H60B 109.5 . . ?
H60A C60 H60B 109.5 . . ?
C58 C60 H60C 109.5 . . ?
H60A C60 H60C 109.5 . . ?
H60B C60 H60C 109.5 . . ?
C62 C61 N21 107.4(6) . . ?
C62 C61 H61A 126.3 . . ?
N21 C61 H61A 126.3 . . ?
C61 C62 N22 110.0(6) . . ?
C61 C62 H62A 125.0 . . ?
N22 C62 H62A 125.0 . . ?
N22 C63 N21 112.4(6) . . ?
N22 C63 C64 123.1(7) . . ?
N21 C63 C64 124.4(7) . . ?
C66 C64 C65 121.7(11) . . ?
C66 C64 C63 116.1(10) . . ?
C65 C64 C63 117.1(9) . . ?
C66 C64 H64A 97.5 . . ?
C65 C64 H64A 97.5 . . ?
C63 C64 H64A 97.5 . . ?
C64 C65 H65A 109.5 . . ?
C64 C65 H65B 109.5 . . ?
H65A C65 H65B 109.5 . . ?
C64 C65 H65C 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
C64 C66 H66A 109.5 . . ?
C64 C66 H66B 109.5 . . ?
H66A C66 H66B 109.5 . . ?
C64 C66 H66C 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
C68 C67 N23 109.0(7) . . ?
C68 C67 H67A 125.5 . . ?
N23 C67 H67A 125.5 . . ?
C67 C68 N24 108.7(7) . . ?
C67 C68 H68A 125.6 . . ?
N24 C68 H68A 125.6 . . ?
N23 C69 N24 111.5(8) . . ?
N23 C69 C70 123.7(9) . . ?
N24 C69 C70 124.9(9) . . ?
C71 C70 C72 135.6(14) . . ?
C71 C70 C69 114.4(12) . . ?
C72 C70 C69 110.0(13) . . ?
C71 C70 H70A 90.5 . . ?
C72 C70 H70A 90.5 . . ?
C69 C70 H70A 90.5 . . ?
C70 C71 H71A 109.5 . . ?
C70 C71 H71B 109.5 . . ?
H71A C71 H71B 109.5 . . ?
C70 C71 H71C 109.5 . . ?
H71A C71 H71C 109.5 . . ?
H71B C71 H71C 109.5 . . ?
C70 C72 H72A 109.5 . . ?
C70 C72 H72B 109.5 . . ?
H72A C72 H72B 109.5 . . ?
C70 C72 H72C 109.5 . . ?
H72A C72 H72C 109.5 . . ?
H72B C72 H72C 109.5 . . ?
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 N24 2.071(6) 1_055 ?
Ag1 N1 2.078(6) . ?
Ag2 N2 2.084(6) . ?
Ag2 N3 2.098(6) . ?
Ag2 Ag4 3.1719(9) 1_455 ?
Ag3 N4 2.069(5) . ?
Ag3 N5 2.075(5) . ?
Ag4 N6 2.080(6) . ?
Ag4 N7 2.081(6) . ?
Ag4 Ag2 3.1719(9) 1_655 ?
Ag5 N9 2.082(7) . ?
Ag5 N8 2.084(6) . ?
Ag6 N11 2.076(6) . ?
Ag6 N10 2.083(6) . ?
Ag6 Ag8 3.2608(10) 1_455 ?
Ag7 N12 2.078(6) . ?
Ag7 N13 2.081(6) . ?
Ag8 N15 2.083(6) . ?
Ag8 N14 2.084(6) . ?
Ag8 Ag6 3.2608(10) 1_655 ?
Ag9 N17 2.065(5) . ?
Ag9 N16 2.074(6) . ?
Ag10 N18 2.087(5) . ?
Ag10 N19 2.099(5) . ?
Ag10 Ag12 3.1643(9) 1_455 ?
Ag11 N21 2.070(5) . ?
Ag11 N20 2.073(5) . ?
Ag12 N22 2.097(5) . ?
Ag12 N23 2.100(6) . ?
Ag12 Ag10 3.1643(9) 1_655 ?
N1 C3 1.333(10) . ?
N1 C1 1.343(9) . ?
N2 C3 1.324(9) . ?
N2 C2 1.356(9) . ?
N3 C7 1.341(9) . ?
N3 C9 1.341(9) . ?
N4 C9 1.333(8) . ?
N4 C8 1.362(9) . ?
N5 C15 1.330(8) . ?
N5 C13 1.371(9) . ?
N6 C15 1.333(8) . ?
N6 C14 1.380(9) . ?
N7 C21 1.326(10) . ?
N7 C19 1.351(9) . ?
N8 C21 1.324(9) . ?
N8 C20 1.364(9) . ?
N9 C27 1.321(10) . ?
N9 C25 1.360(10) . ?
N10 C27 1.343(10) . ?
N10 C26 1.364(10) . ?
N11 C33 1.336(9) . ?
N11 C31 1.347(10) . ?
N12 C33 1.319(9) . ?
N12 C32 1.376(10) . ?
N13 C39 1.335(9) . ?
N13 C37 1.350(9) . ?
N14 C39 1.333(9) . ?
N14 C38 1.351(9) . ?
N15 C45 1.313(9) . ?
N15 C43 1.342(10) . ?
N16 C45 1.327(9) . ?
N16 C44 1.361(10) . ?
N17 C51 1.339(9) . ?
N17 C49 1.360(9) . ?
N18 C51 1.341(8) . ?
N18 C50 1.365(9) . ?
N19 C57 1.351(8) . ?
N19 C55 1.366(8) . ?
N20 C57 1.331(8) . ?
N20 C56 1.360(8) . ?
N21 C63 1.336(8) . ?
N21 C61 1.378(8) . ?
N22 C63 1.329(8) . ?
N22 C62 1.366(8) . ?
N23 C69 1.324(9) . ?
N23 C67 1.363(9) . ?
N24 C68 1.350(10) . ?
N24 C69 1.353(10) . ?
N24 Ag1 2.071(6) 1_:55 ?
C1 C2 1.334(10) . ?
C1 H1A 0.9300 . ?
C2 H2A 0.9300 . ?
C3 C4 1.530(14) . ?
C4 C5 1.456(18) . ?
C4 C6 1.520(18) . ?
C4 H4A 0.9800 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C7 C8 1.360(9) . ?
C7 H7A 0.9300 . ?
C8 H8A 0.9300 . ?
C9 C10 1.488(11) . ?
C10 C12 1.382(14) . ?
C10 C11 1.435(13) . ?
C10 H10A 0.9800 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C14 1.352(9) . ?
C13 H13A 0.9300 . ?
C14 H14A 0.9300 . ?
C15 C16 1.492(12) . ?
C16 C17 1.399(14) . ?
C16 C18 1.405(15) . ?
C16 H16A 0.9800 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C19 C20 1.330(10) . ?
C19 H19A 0.9300 . ?
C20 H20A 0.9300 . ?
C21 C22 1.511(13) . ?
C22 C23 1.368(16) . ?
C22 C24 1.389(17) . ?
C22 H22A 0.9800 . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C25 C26 1.327(10) . ?
C25 H25A 0.9300 . ?
C26 H26A 0.9300 . ?
C27 C28 1.514(12) . ?
C28 C29 1.473(15) . ?
C28 C30 1.483(16) . ?
C28 H28A 0.9800 . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
C31 C32 1.336(10) . ?
C31 H31A 0.9300 . ?
C32 H32A 0.9300 . ?
C33 C34 1.512(13) . ?
C34 C36 1.402(15) . ?
C34 C35 1.444(14) . ?
C34 H34A 0.9800 . ?
C35 H35A 0.9600 . ?
C35 H35B 0.9600 . ?
C35 H35C 0.9600 . ?
C36 H36A 0.9600 . ?
C36 H36B 0.9600 . ?
C36 H36C 0.9600 . ?
C37 C38 1.357(9) . ?
C37 H37A 0.9300 . ?
C38 H38A 0.9300 . ?
C39 C40 1.512(12) . ?
C40 C42 1.326(16) . ?
C40 C41 1.383(15) . ?
C40 H40A 0.9800 . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
C42 H42A 0.9600 . ?
C42 H42B 0.9600 . ?
C42 H42C 0.9600 . ?
C43 C44 1.353(10) . ?
C43 H43A 0.9300 . ?
C44 H44A 0.9300 . ?
C45 C46 1.500(13) . ?
C46 C47 1.407(16) . ?
C46 C48 1.446(15) . ?
C46 H46A 0.9800 . ?
C47 H47A 0.9600 . ?
C47 H47B 0.9600 . ?
C47 H47C 0.9600 . ?
C48 H48A 0.9600 . ?
C48 H48B 0.9600 . ?
C48 H48C 0.9600 . ?
C49 C50 1.362(9) . ?
C49 H49A 0.9300 . ?
C50 H50A 0.9300 . ?
C51 C52 1.487(11) . ?
C52 C53 1.346(17) . ?
C52 C54 1.467(15) . ?
C52 H52A 0.9800 . ?
C53 H53A 0.9600 . ?
C53 H53B 0.9600 . ?
C53 H53C 0.9600 . ?
C54 H54A 0.9600 . ?
C54 H54B 0.9600 . ?
C54 H54C 0.9600 . ?
C55 C56 1.344(9) . ?
C55 H55A 0.9300 . ?
C56 H56A 0.9300 . ?
C57 C58 1.492(10) . ?
C58 C60 1.336(15) . ?
C58 C59 1.447(13) . ?
C58 H58A 0.9800 . ?
C59 H59A 0.9600 . ?
C59 H59B 0.9600 . ?
C59 H59C 0.9600 . ?
C60 H60A 0.9600 . ?
C60 H60B 0.9600 . ?
C60 H60C 0.9600 . ?
C61 C62 1.335(9) . ?
C61 H61A 0.9300 . ?
C62 H62A 0.9300 . ?
C63 C64 1.494(11) . ?
C64 C66 1.391(16) . ?
C64 C65 1.399(14) . ?
C64 H64A 0.9800 . ?
C65 H65A 0.9600 . ?
C65 H65B 0.9600 . ?
C65 H65C 0.9600 . ?
C66 H66A 0.9600 . ?
C66 H66B 0.9600 . ?
C66 H66C 0.9600 . ?
C67 C68 1.333(10) . ?
C67 H67A 0.9300 . ?
C68 H68A 0.9300 . ?
C69 C70 1.551(15) . ?
C70 C71 1.467(19) . ?
C70 C72 1.473(19) . ?
C70 H70A 0.9800 . ?
C71 H71A 0.9600 . ?
C71 H71B 0.9600 . ?
C71 H71C 0.9600 . ?
C72 H72A 0.9600 . ?
C72 H72B 0.9600 . ?
C72 H72C 0.9600 . ?
