#------------------------------------------------------------------------------
#$Date: 2016-03-26 21:59:59 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180487 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/56/7215680.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_7215680
loop_
_publ_author_name
'Shi, Hua-Yu'
'Dong, Yun-Bo'
'Liu, Ying-Ying'
'Ma, Jian-Fang'
_publ_section_title
;
 Multinuclear coordination polymers based on Ag⋯Ag interaction:
 syntheses, structures, and luminescence properties
;
_journal_issue                   23
_journal_name_full               CrystEngComm
_journal_page_first              5110
_journal_paper_doi               10.1039/c4ce00236a
_journal_volume                  16
_journal_year                    2014
_chemical_formula_moiety         'C46 H34 Ag5 N10 O12'
_chemical_formula_sum            'C46 H34 Ag5 N10 O12'
_chemical_formula_weight         1458.18
_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                106.736(4)
_cell_angle_beta                 99.655(4)
_cell_angle_gamma                115.188(4)
_cell_formula_units_Z            2
_cell_length_a                   12.6750(5)
_cell_length_b                   14.3120(7)
_cell_length_c                   15.2200(7)
_cell_measurement_reflns_used    5913
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.1959
_cell_measurement_theta_min      2.8280
_cell_volume                     2254.4(2)
_computing_cell_refinement       CrysAlis
_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_data_reduction        CrysAlis
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 10.2375
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.842
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω 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  0.0297
_diffrn_reflns_av_sigmaI/netI    0.0547
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            16828
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         29.26
_diffrn_reflns_theta_min         2.83
_exptl_absorpt_coefficient_mu    2.212
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.91987
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
; 
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.148
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1422
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.17
_refine_diff_density_max         1.421
_refine_diff_density_min         -1.375
_refine_diff_density_rms         0.120
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.015
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     676
_refine_ls_number_reflns         10342
_refine_ls_number_restraints     38
_refine_ls_restrained_S_all      1.026
_refine_ls_R_factor_all          0.0796
_refine_ls_R_factor_gt           0.0498
_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)+(0.0458P)²+5.2957P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1068
_refine_ls_wR_factor_ref         0.1245
_reflns_number_gt                7279
_reflns_number_total             10342
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            c4ce00236a2.cif
_cod_data_source_block           crystal5
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 7215675--7215683.cif.
;
_cod_original_cell_volume        2254.41(18)
_cod_original_sg_symbol_H-M      p-1
_cod_database_code               7215680
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 0.50616(5) 0.23738(4) 0.09149(3) 0.05043(14) Uani 1 1 d .
Ag2 Ag 0.76742(4) 0.32655(4) 0.10760(3) 0.05061(14) Uani 1 1 d .
Ag3 Ag 0.92459(5) 0.38128(4) -0.05728(4) 0.05076(14) Uani 1 1 d .
Ag4 Ag 0.03587(5) 0.01358(5) -0.58795(4) 0.05822(16) Uani 1 1 d .
Ag5 Ag 0.87962(5) -0.07004(4) 0.19088(3) 0.04776(13) Uani 1 1 d .
C1 C 0.4741(5) 0.0011(4) 0.0858(4) 0.0359(12) Uani 1 1 d .
C2 C 0.3790(5) -0.0353(4) 0.0015(4) 0.0364(12) Uani 1 1 d .
C3 C 0.5946(5) 0.0342(4) 0.0836(4) 0.0379(13) Uani 1 1 d .
C4 C 0.4470(6) -0.0023(5) 0.1780(4) 0.0443(14) Uani 1 1 d .
H4A H 0.3716 -0.0724 0.1616 0.053 Uiso 1 1 calc R
H4B H 0.5137 -0.0020 0.2202 0.053 Uiso 1 1 calc R
C5 C 0.2489(5) -0.0761(5) 0.0028(5) 0.0419(13) Uani 1 1 d .
H5A H 0.1917 -0.1311 -0.0618 0.050 Uiso 1 1 calc R
H5B H 0.2365 -0.1138 0.0470 0.050 Uiso 1 1 calc R
C6 C 0.6957(6) 0.0651(5) 0.1731(4) 0.0463(14) Uani 1 1 d .
H6A H 0.6668 0.0060 0.1971 0.056 Uiso 1 1 calc R
H6B H 0.7668 0.0688 0.1552 0.056 Uiso 1 1 calc R
C7 C 0.3857(7) 0.0972(6) 0.3036(5) 0.0607(19) Uani 1 1 d .
H7 H 0.3484 0.0395 0.3239 0.073 Uiso 1 1 calc R
C8 C 0.4028(8) 0.2036(6) 0.3421(5) 0.067(2) Uani 1 1 d .
H8 H 0.3804 0.2334 0.3938 0.080 Uiso 1 1 calc R
C9 C 0.4608(6) 0.2574(5) 0.2875(4) 0.0425(14) Uani 1 1 d .
C10 C 0.5028(6) 0.3724(5) 0.2947(4) 0.0455(14) Uani 1 1 d .
C11 C 0.5088(10) 0.4536(7) 0.3741(6) 0.090(3) Uani 1 1 d .
C12 C 0.577(3) 0.570(2) 0.378(2) 0.066(8) Uani 0.50 1 d P
C12' C 0.519(3) 0.550(3) 0.372(3) 0.081(10) Uani 0.50 1 d P
C13 C 0.5867(10) 0.5848(7) 0.3023(8) 0.088(3) Uani 1 1 d .
C14 C 0.5743(8) 0.4983(6) 0.2269(7) 0.078(2) Uani 1 1 d .
H14 H 0.5964 0.5131 0.1751 0.094 Uiso 1 1 calc R
C15 C 0.1586(7) 0.0296(6) 0.0928(5) 0.0558(17) Uani 1 1 d .
H15 H 0.1249 -0.0156 0.1252 0.067 Uiso 1 1 calc R
C16 C 0.1541(7) 0.1246(6) 0.0977(5) 0.0612(19) Uani 1 1 d .
H16 H 0.1179 0.1577 0.1343 0.073 Uiso 1 1 calc R
C17 C 0.2145(5) 0.1606(5) 0.0370(4) 0.0375(12) Uani 1 1 d .
C18 C 0.2368(5) 0.2579(5) 0.0141(4) 0.0414(13) Uani 1 1 d .
C19 C 0.2674(7) 0.3594(5) 0.0842(5) 0.0559(17) Uani 1 1 d .
H19 H 0.2716 0.3666 0.1476 0.067 Uiso 1 1 calc R
C20 C 0.2916(8) 0.4498(6) 0.0604(6) 0.071(2) Uani 1 1 d .
H20 H 0.3114 0.5186 0.1071 0.086 Uiso 1 1 calc R
C21 C 0.2864(9) 0.4380(6) -0.0316(7) 0.083(3) Uani 1 1 d .
H21 H 0.3046 0.4988 -0.0491 0.099 Uiso 1 1 calc R
C22 C 0.2532(8) 0.3331(6) -0.0996(6) 0.071(2) Uani 1 1 d .
H22 H 0.2493 0.3248 -0.1632 0.085 Uiso 1 1 calc R
C23 C 0.7486(8) 0.1924(6) 0.3452(5) 0.073(2) Uani 1 1 d .
H23 H 0.7292 0.1396 0.3727 0.088 Uiso 1 1 calc R
C24 C 0.7976(8) 0.3058(7) 0.3927(5) 0.076(2) Uani 1 1 d .
H24 H 0.8190 0.3463 0.4590 0.091 Uiso 1 1 calc R
C25 C 0.8085(6) 0.3478(5) 0.3218(4) 0.0510(16) Uani 1 1 d .
C26 C 0.8560(6) 0.4660(5) 0.3316(5) 0.0539(17) Uani 1 1 d .
C27 C 0.9007(9) 0.5522(7) 0.4207(6) 0.087(3) Uani 1 1 d .
H27 H 0.9015 0.5373 0.4764 0.105 Uiso 1 1 calc R
C28 C 0.9441(10) 0.6603(7) 0.4279(7) 0.097(3) Uani 1 1 d .
H28 H 0.9722 0.7196 0.4878 0.116 Uiso 1 1 calc R
C29 C 0.9453(9) 0.6788(6) 0.3460(6) 0.081(3) Uani 1 1 d .
H29 H 0.9752 0.7515 0.3484 0.098 Uiso 1 1 calc R
C30 C 0.9020(7) 0.5896(6) 0.2598(5) 0.0638(19) Uani 1 1 d .
H30 H 0.9040 0.6034 0.2038 0.077 Uiso 1 1 calc R
C31 C 1.0620(5) 0.4533(5) 0.1556(4) 0.0386(13) Uani 1 1 d .
C32 C 1.0554(6) 0.1860(5) 0.3111(4) 0.0407(13) Uani 1 1 d .
C33 C 1.1087(5) 0.4318(5) 0.2399(4) 0.0370(12) Uani 1 1 d .
C34 C 1.0615(5) 0.3235(5) 0.2375(4) 0.0364(12) Uani 1 1 d .
H34 H 0.9970 0.2629 0.1828 0.044 Uiso 1 1 calc R
C35 C 1.1081(5) 0.3042(5) 0.3143(4) 0.0390(13) Uani 1 1 d .
C36 C 1.2048(7) 0.3935(6) 0.3937(5) 0.066(2) Uani 1 1 d .
H36 H 1.2386 0.3812 0.4454 0.080 Uiso 1 1 calc R
C37 C 1.2523(8) 0.5012(6) 0.3971(5) 0.083(3) Uani 1 1 d .
H37 H 1.3178 0.5613 0.4514 0.100 Uiso 1 1 calc R
C38 C 1.2035(7) 0.5208(5) 0.3207(5) 0.0608(19) Uani 1 1 d .
H38 H 1.2349 0.5940 0.3240 0.073 Uiso 1 1 calc R
C39 C 0.2329(7) 0.0925(6) -0.3893(6) 0.0604(16) Uani 1 1 d U
C40 C 0.5868(5) 0.2563(4) -0.0871(4) 0.0333(12) Uani 1 1 d .
C41 C 0.3673(6) 0.1386(5) -0.3401(4) 0.0424(13) Uani 1 1 d .
C42 C 0.4168(5) 0.1820(4) -0.2404(4) 0.0363(12) Uani 1 1 d .
H42 H 0.3659 0.1836 -0.2033 0.044 Uiso 1 1 calc R
C43 C 0.5408(5) 0.2234(4) -0.1942(4) 0.0323(11) Uani 1 1 d .
C44 C 0.6165(6) 0.2247(5) -0.2496(4) 0.0458(14) Uani 1 1 d .
H44 H 0.7004 0.2539 -0.2195 0.055 Uiso 1 1 calc R
C45 C 0.5686(6) 0.1832(6) -0.3484(5) 0.0600(19) Uani 1 1 d .
H45 H 0.6205 0.1850 -0.3852 0.072 Uiso 1 1 calc R
C46 C 0.4443(6) 0.1387(6) -0.3943(4) 0.0566(17) Uani 1 1 d .
H46 H 0.4123 0.1087 -0.4619 0.068 Uiso 1 1 calc R
O1 O 0.1940(5) 0.0393(5) -0.4795(4) 0.0835(15) Uani 1 1 d U
O2 O 0.1692(4) 0.1075(5) -0.3405(4) 0.0715(15) Uani 1 1 d .
O3 O 0.5142(4) 0.2556(5) -0.0429(3) 0.0650(14) Uani 1 1 d .
O4 O 0.6943(4) 0.2793(4) -0.0490(3) 0.0466(10) Uani 1 1 d .
O5 O 0.9676(4) 0.1105(3) 0.2360(3) 0.0491(10) Uani 1 1 d .
O6 O 1.1044(5) 0.1751(4) 0.3817(3) 0.0647(13) Uani 1 1 d .
O7 O 0.9736(4) 0.3676(3) 0.0830(3) 0.0459(10) Uani 1 1 d .
O8 O 1.1127(4) 0.5503(3) 0.1610(3) 0.0575(12) Uani 1 1 d .
O9 O 0.0424(12) -0.2191(10) 0.1210(9) 0.079(3) Uani 0.50 1 d PU
O9' O 0.1451(15) -0.1736(13) 0.1639(12) 0.111(4) Uani 0.50 1 d PU
O10 O 0.0730(7) -0.0939(6) 0.2535(5) 0.102(2) Uani 1 1 d .
O11 O 0.1611(10) -0.1855(9) 0.2521(8) 0.164(3) Uani 1 1 d U
O1W O 0.7563(19) 0.1316(19) -0.4518(16) 0.356(11) Uani 1 1 d .
N1 N 0.4327(5) 0.0919(4) 0.2312(3) 0.0406(11) Uani 1 1 d .
N2 N 0.4805(4) 0.1890(4) 0.2207(3) 0.0381(11) Uani 1 1 d .
N3 N 0.5333(6) 0.3947(4) 0.2215(4) 0.0566(15) Uani 1 1 d .
N4 N 0.2205(4) 0.0141(4) 0.0326(3) 0.0401(11) Uani 1 1 d .
N5 N 0.2562(4) 0.0935(4) -0.0031(3) 0.0410(11) Uani 1 1 d .
N6 N 0.2269(5) 0.2442(4) -0.0781(4) 0.0481(13) Uani 1 1 d .
N7 N 0.7340(5) 0.1719(4) 0.2508(4) 0.0474(12) Uani 1 1 d .
N8 N 0.7689(4) 0.2653(4) 0.2344(3) 0.0403(11) Uani 1 1 d .
N9 N 0.8567(5) 0.4834(4) 0.2515(4) 0.0475(12) Uani 1 1 d .
N10 N 0.0866(9) -0.1651(6) 0.2087(7) 0.100(2) Uani 1 1 d U
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'
O O 0.0106 0.0060 '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'
N N 0.0061 0.0033 '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
O3 Ag1 N2 171.29(18) . .
O3 Ag1 N3 116.7(2) . .
N2 Ag1 N3 71.31(17) . .
O3 Ag1 Ag2 75.20(12) . .
N2 Ag1 Ag2 108.01(12) . .
N3 Ag1 Ag2 97.10(14) . .
O4 Ag2 N9 139.26(18) . .
O4 Ag2 N8 146.77(16) . .
N9 Ag2 N8 72.50(18) . .
O4 Ag2 O7 86.15(14) . .
N9 Ag2 O7 93.34(16) . .
N8 Ag2 O7 104.48(15) . .
O4 Ag2 Ag1 83.06(11) . .
N9 Ag2 Ag1 99.77(13) . .
N8 Ag2 Ag1 80.96(12) . .
O7 Ag2 Ag1 166.82(9) . .
O8 Ag3 O7 160.21(16) 2_765 .
O8 Ag3 O9 115.6(3) 2_765 2_655
O7 Ag3 O9 83.6(3) . 2_655
O8 Ag3 O9' 104.5(4) 2_765 2_655
O7 Ag3 O9' 95.0(4) . 2_655
O9 Ag3 O9' 25.7(4) 2_655 2_655
O8 Ag3 Ag3 78.33(11) 2_765 2_765
O7 Ag3 Ag3 84.10(10) . 2_765
O9 Ag3 Ag3 137.0(3) 2_655 2_765
O9' Ag3 Ag3 161.8(4) 2_655 2_765
O1 Ag4 O2 139.3(2) . 2_554
O1 Ag4 O6 106.2(2) . 1_454
O2 Ag4 O6 113.90(19) 2_554 1_454
O1 Ag4 Ag4 70.89(16) . 2_554
O2 Ag4 Ag4 79.62(13) 2_554 2_554
O6 Ag4 Ag4 126.44(12) 1_454 2_554
O1 Ag4 Ag5 150.05(15) . 1_454
O2 Ag4 Ag5 53.91(13) 2_554 1_454
O6 Ag4 Ag5 75.21(11) 1_454 1_454
Ag4 Ag4 Ag5 133.12(3) 2_554 1_454
O5 Ag5 N6 152.05(18) . 2_655
O5 Ag5 O2 105.71(17) . 2_655
N6 Ag5 O2 99.99(18) 2_655 2_655
O5 Ag5 Ag4 79.35(11) . 1_656
N6 Ag5 Ag4 127.83(14) 2_655 1_656
O2 Ag5 Ag4 44.48(10) 2_655 1_656
C2 C1 C3 119.9(5) . .
C2 C1 C4 120.3(5) . .
C3 C1 C4 119.7(5) . .
C1 C2 C3 119.5(5) . 2_655
C1 C2 C5 119.8(5) . .
C3 C2 C5 120.7(5) 2_655 .
C2 C3 C1 120.6(5) 2_655 .
C2 C3 C6 119.6(5) 2_655 .
C1 C3 C6 119.7(5) . .
N1 C4 C1 113.6(5) . .
N1 C4 H4A 108.9 . .
C1 C4 H4A 108.9 . .
N1 C4 H4B 108.9 . .
C1 C4 H4B 108.9 . .
H4A C4 H4B 107.7 . .
N4 C5 C2 113.2(5) . .
N4 C5 H5A 108.9 . .
C2 C5 H5A 108.9 . .
N4 C5 H5B 108.9 . .
C2 C5 H5B 108.9 . .
H5A C5 H5B 107.8 . .
N7 C6 C3 113.3(5) . .
N7 C6 H6A 108.9 . .
C3 C6 H6A 108.9 . .
N7 C6 H6B 108.9 . .
C3 C6 H6B 108.9 . .
H6A C6 H6B 107.7 . .
N1 C7 C8 106.9(6) . .
N1 C7 H7 126.5 . .
C8 C7 H7 126.5 . .
C7 C8 C9 105.0(5) . .
C7 C8 H8 127.5 . .
C9 C8 H8 127.5 . .
N2 C9 C8 110.6(5) . .
N2 C9 C10 119.0(5) . .
C8 C9 C10 130.3(5) . .
N3 C10 C11 121.5(6) . .
N3 C10 C9 117.1(5) . .
C11 C10 C9 121.4(6) . .
C12' C11 C10 121.5(16) . .
C12' C11 C12 25.4(17) . .
C10 C11 C12 113.5(13) . .
C12' C12 C13 103(7) . .
C12' C12 C11 64(6) . .
C13 C12 C11 120.3(18) . .
C12 C12' C11 90(6) . .
C12 C12' C13 53(6) . .
C11 C12' C13 112(2) . .
C12 C13 C14 117.2(14) . .
C12 C13 C12' 24(2) . .
C14 C13 C12' 114.9(15) . .
N3 C14 C13 124.8(8) . .
N3 C14 H14 117.6 . .
C13 C14 H14 117.6 . .
N4 C15 C16 106.9(6) . .
N4 C15 H15 126.6 . .
C16 C15 H15 126.6 . .
C15 C16 C17 105.2(5) . .
C15 C16 H16 127.4 . .
C17 C16 H16 127.4 . .
N5 C17 C16 111.4(5) . .
N5 C17 C18 119.8(5) . .
C16 C17 C18 128.8(5) . .
N6 C18 C19 121.5(6) . .
N6 C18 C17 116.9(5) . .
C19 C18 C17 121.5(6) . .
C20 C19 C18 119.7(7) . .
C20 C19 H19 120.1 . .
C18 C19 H19 120.1 . .
C21 C20 C19 119.2(6) . .
C21 C20 H20 120.4 . .
C19 C20 H20 120.4 . .
C20 C21 C22 118.5(7) . .
C20 C21 H21 120.7 . .
C22 C21 H21 120.7 . .
N6 C22 C21 122.9(7) . .
N6 C22 H22 118.6 . .
C21 C22 H22 118.6 . .
N7 C23 C24 106.5(7) . .
N7 C23 H23 126.8 . .
C24 C23 H23 126.8 . .
C23 C24 C25 105.5(6) . .
C23 C24 H24 127.3 . .
C25 C24 H24 127.3 . .
N8 C25 C24 111.0(6) . .
N8 C25 C26 119.9(6) . .
C24 C25 C26 129.1(6) . .
N9 C26 C27 122.2(7) . .
N9 C26 C25 116.8(5) . .
C27 C26 C25 120.9(7) . .
C28 C27 C26 119.8(8) . .
C28 C27 H27 120.1 . .
C26 C27 H27 120.1 . .
C29 C28 C27 118.3(8) . .
C29 C28 H28 120.9 . .
C27 C28 H28 120.9 . .
C28 C29 C30 119.0(8) . .
C28 C29 H29 120.5 . .
C30 C29 H29 120.5 . .
N9 C30 C29 123.3(8) . .
N9 C30 H30 118.3 . .
C29 C30 H30 118.3 . .
O8 C31 O7 125.7(6) . .
O8 C31 C33 118.0(5) . .
O7 C31 C33 116.3(5) . .
O6 C32 O5 127.6(6) . .
O6 C32 C35 117.0(5) . .
O5 C32 C35 115.5(5) . .
C38 C33 C34 119.2(5) . .
C38 C33 C31 119.1(5) . .
C34 C33 C31 121.7(5) . .
C35 C34 C33 121.3(5) . .
C35 C34 H34 119.4 . .
C33 C34 H34 119.4 . .
C36 C35 C34 119.0(6) . .
C36 C35 C32 120.2(5) . .
C34 C35 C32 120.8(5) . .
C35 C36 C37 120.3(6) . .
C35 C36 H36 119.8 . .
C37 C36 H36 119.8 . .
C36 C37 C38 120.6(6) . .
C36 C37 H37 119.7 . .
C38 C37 H37 119.7 . .
C33 C38 C37 119.6(6) . .
C33 C38 H38 120.2 . .
C37 C38 H38 120.2 . .
O2 C39 O1 124.9(7) . .
O2 C39 C41 119.6(7) . .
O1 C39 C41 115.5(7) . .
O3 C40 O4 124.3(5) . .
O3 C40 C43 117.4(5) . .
O4 C40 C43 118.3(5) . .
C42 C41 C46 118.7(6) . .
C42 C41 C39 120.9(6) . .
C46 C41 C39 120.4(6) . .
C41 C42 C43 121.4(5) . .
C41 C42 H42 119.3 . .
C43 C42 H42 119.3 . .
C44 C43 C42 118.8(5) . .
C44 C43 C40 121.7(5) . .
C42 C43 C40 119.3(5) . .
C45 C44 C43 120.2(6) . .
C45 C44 H44 119.9 . .
C43 C44 H44 119.9 . .
C44 C45 C46 120.7(6) . .
C44 C45 H45 119.6 . .
C46 C45 H45 119.6 . .
C45 C46 C41 120.1(6) . .
C45 C46 H46 120.0 . .
C41 C46 H46 120.0 . .
C39 O1 Ag4 128.6(5) . .
C39 O2 Ag4 115.1(5) . 2_554
C39 O2 Ag5 136.4(5) . 2_655
Ag4 O2 Ag5 81.60(16) 2_554 2_655
C40 O3 Ag1 131.7(4) . .
C40 O4 Ag2 120.3(3) . .
C32 O5 Ag5 128.6(4) . .
C32 O6 Ag4 127.0(4) . 1_656
C31 O7 Ag3 119.4(4) . .
C31 O7 Ag2 110.4(3) . .
Ag3 O7 Ag2 95.22(15) . .
C31 O8 Ag3 130.3(4) . 2_765
O9' O9 N10 56.1(10) . .
O9' O9 Ag3 82.8(10) . 2_655
N10 O9 Ag3 116.2(8) . 2_655
N10 O9' O9 65.6(12) . .
N10 O9' O11 58.3(10) . .
O9 O9' O11 109.7(15) . .
N10 O9' Ag3 113.9(11) . 2_655
O9 O9' Ag3 71.5(10) . 2_655
O11 O9' Ag3 95.3(9) . 2_655
N10 O11 O9' 49.3(8) . .
N2 N1 C7 112.0(5) . .
N2 N1 C4 122.6(5) . .
C7 N1 C4 124.9(5) . .
N1 N2 C9 105.4(5) . .
N1 N2 Ag1 134.3(3) . .
C9 N2 Ag1 114.2(4) . .
C14 N3 C10 118.5(6) . .
C14 N3 Ag1 127.1(5) . .
C10 N3 Ag1 114.4(4) . .
C15 N4 N5 112.1(5) . .
C15 N4 C5 128.0(5) . .
N5 N4 C5 119.9(4) . .
C17 N5 N4 104.5(4) . .
C22 N6 C18 118.1(5) . .
C22 N6 Ag5 122.2(5) . 2_655
C18 N6 Ag5 117.5(4) . 2_655
N8 N7 C23 112.2(5) . .
N8 N7 C6 120.8(5) . .
C23 N7 C6 126.8(6) . .
N7 N8 C25 104.9(5) . .
N7 N8 Ag2 141.6(3) . .
C25 N8 Ag2 113.2(4) . .
C26 N9 C30 117.3(6) . .
C26 N9 Ag2 117.0(4) . .
C30 N9 Ag2 125.5(5) . .
O9' N10 O10 136.7(11) . .
O9' N10 O9 58.3(9) . .
O10 N10 O9 127.2(12) . .
O9' N10 O11 72.3(10) . .
O10 N10 O11 117.8(11) . .
O9 N10 O11 114.8(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 O3 2.148(4) .
Ag1 N2 2.293(5) .
Ag1 N3 2.377(5) .
Ag1 Ag2 2.9335(7) .
Ag2 O4 2.190(4) .
Ag2 N9 2.300(5) .
Ag2 N8 2.339(5) .
Ag2 O7 2.542(4) .
Ag3 O8 2.170(4) 2_765
Ag3 O7 2.208(4) .
Ag3 O9 2.483(12) 2_655
Ag3 O9' 2.598(15) 2_655
Ag3 Ag3 2.8605(10) 2_765
Ag4 O1 2.188(6) .
Ag4 O2 2.252(5) 2_554
Ag4 O6 2.313(5) 1_454
Ag4 Ag4 3.0432(11) 2_554
Ag4 Ag5 3.1799(7) 1_454
Ag5 O5 2.158(4) .
Ag5 N6 2.209(5) 2_655
Ag5 O2 2.598(5) 2_655
Ag5 Ag4 3.1799(7) 1_656
C1 C2 1.390(8) .
C1 C3 1.403(8) .
C1 C4 1.509(8) .
C2 C3 1.393(8) 2_655
C2 C5 1.503(8) .
C3 C2 1.393(8) 2_655
C3 C6 1.510(8) .
C4 N1 1.461(7) .
C4 H4A 0.9700 .
C4 H4B 0.9700 .
C5 N4 1.455(7) .
C5 H5A 0.9700 .
C5 H5B 0.9700 .
C6 N7 1.451(7) .
C6 H6A 0.9700 .
C6 H6B 0.9700 .
C7 N1 1.337(8) .
C7 C8 1.369(9) .
C7 H7 0.9300 .
C8 C9 1.385(9) .
C8 H8 0.9300 .
C9 N2 1.332(7) .
C9 C10 1.460(8) .
C10 N3 1.318(8) .
C10 C11 1.379(9) .
C11 C12' 1.34(4) .
C11 C12 1.49(3) .
C12 C12' 0.64(4) .
C12 C13 1.25(4) .
C12' C13 1.53(3) .
C13 C14 1.353(11) .
C14 N3 1.317(9) .
C14 H14 0.9300 .
C15 N4 1.332(7) .
C15 C16 1.366(9) .
C15 H15 0.9300 .
C16 C17 1.371(9) .
C16 H16 0.9300 .
C17 N5 1.333(7) .
C17 C18 1.456(8) .
C18 N6 1.336(8) .
C18 C19 1.374(8) .
C19 C20 1.367(10) .
C19 H19 0.9300 .
C20 C21 1.348(11) .
C20 H20 0.9300 .
C21 C22 1.387(10) .
C21 H21 0.9300 .
C22 N6 1.323(8) .
C22 H22 0.9300 .
C23 N7 1.344(8) .
C23 C24 1.364(10) .
C23 H23 0.9300 .
C24 C25 1.378(10) .
C24 H24 0.9300 .
C25 N8 1.334(7) .
C25 C26 1.485(9) .
C26 N9 1.313(8) .
C26 C27 1.366(9) .
C27 C28 1.366(12) .
C27 H27 0.9300 .
C28 C29 1.348(12) .
C28 H28 0.9300 .
C29 C30 1.360(10) .
C29 H29 0.9300 .
C30 N9 1.334(8) .
C30 H30 0.9300 .
C31 O8 1.227(7) .
C31 O7 1.271(7) .
C31 C33 1.489(8) .
C32 O6 1.233(7) .
C32 O5 1.245(7) .
C32 C35 1.514(8) .
C33 C38 1.370(8) .
C33 C34 1.391(8) .
C34 C35 1.373(8) .
C34 H34 0.9300 .
C35 C36 1.369(8) .
C36 C37 1.376(10) .
C36 H36 0.9300 .
C37 C38 1.383(10) .
C37 H37 0.9300 .
C38 H38 0.9300 .
C39 O2 1.228(9) .
C39 O1 1.249(9) .
C39 C41 1.492(9) .
C40 O3 1.227(7) .
C40 O4 1.242(6) .
C40 C43 1.491(7) .
C41 C42 1.374(8) .
C41 C46 1.380(9) .
C42 C43 1.384(7) .
C42 H42 0.9300 .
C43 C44 1.377(8) .
C44 C45 1.362(8) .
C44 H44 0.9300 .
C45 C46 1.377(9) .
C45 H45 0.9300 .
C46 H46 0.9300 .
O2 Ag4 2.252(5) 2_554
O2 Ag5 2.598(5) 2_655
O6 Ag4 2.313(5) 1_656
O8 Ag3 2.170(4) 2_765
O9 O9' 1.138(16) .
O9 N10 1.217(13) .
O9 Ag3 2.483(12) 2_655
O9' N10 1.109(16) .
O9' O11 1.392(17) .
O9' Ag3 2.598(15) 2_655
O10 N10 1.150(8) .
O11 N10 1.244(12) .
N1 N2 1.329(6) .
N4 N5 1.338(6) .
N6 Ag5 2.209(5) 2_655
N7 N8 1.331(7) .
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_4
O3 Ag1 Ag2 O4 -13.81(19) . .
N2 Ag1 Ag2 O4 157.75(16) . .
N3 Ag1 Ag2 O4 -129.65(19) . .
O3 Ag1 Ag2 N9 125.1(2) . .
N2 Ag1 Ag2 N9 -63.35(18) . .
N3 Ag1 Ag2 N9 9.2(2) . .
O3 Ag1 Ag2 N8 -164.58(19) . .
N2 Ag1 Ag2 N8 6.99(15) . .
N3 Ag1 Ag2 N8 79.58(18) . .
O3 Ag1 Ag2 O7 -49.0(4) . .
N2 Ag1 Ag2 O7 122.5(4) . .
N3 Ag1 Ag2 O7 -164.9(4) . .
C3 C1 C2 C3 -2.6(8) . 2_655
C4 C1 C2 C3 -178.4(5) . 2_655
C3 C1 C2 C5 177.0(5) . .
C4 C1 C2 C5 1.2(7) . .
C2 C1 C3 C2 2.6(8) . 2_655
C4 C1 C3 C2 178.4(5) . 2_655
C2 C1 C3 C6 -175.3(5) . .
C4 C1 C3 C6 0.5(7) . .
C2 C1 C4 N1 -79.8(6) . .
C3 C1 C4 N1 104.3(6) . .
C1 C2 C5 N4 87.4(6) . .
C3 C2 C5 N4 -93.1(6) 2_655 .
C2 C3 C6 N7 110.5(6) 2_655 .
C1 C3 C6 N7 -71.6(7) . .
N1 C7 C8 C9 0.4(9) . .
C7 C8 C9 N2 -1.2(9) . .
C7 C8 C9 C10 -179.7(7) . .
N2 C9 C10 N3 14.6(9) . .
C8 C9 C10 N3 -167.1(7) . .
N2 C9 C10 C11 -166.2(7) . .
C8 C9 C10 C11 12.2(12) . .
N3 C10 C11 C12' 15(2) . .
C9 C10 C11 C12' -164.5(17) . .
N3 C10 C11 C12 -12.6(18) . .
C9 C10 C11 C12 168.2(15) . .
C10 C11 C12 C12' 114(6) . .
C12' C11 C12 C13 -91(7) . .
C10 C11 C12 C13 24(3) . .
C13 C12 C12' C11 118(3) . .
C11 C12 C12' C13 -118(3) . .
C10 C11 C12' C12 -78(6) . .
C10 C11 C12' C13 -29(3) . .
C12 C11 C12' C13 50(4) . .
C12' C12 C13 C14 -91(6) . .
C11 C12 C13 C14 -23(3) . .
C11 C12 C13 C12' 68(5) . .
C11 C12' C13 C12 -73(5) . .
C12 C12' C13 C14 101(5) . .
C11 C12' C13 C14 28(3) . .
C12 C13 C14 N3 12(2) . .
C12' C13 C14 N3 -15(2) . .
N4 C15 C16 C17 0.7(8) . .
C15 C16 C17 N5 -0.7(8) . .
C15 C16 C17 C18 179.7(6) . .
N5 C17 C18 N6 39.6(8) . .
C16 C17 C18 N6 -140.8(7) . .
N5 C17 C18 C19 -140.0(6) . .
C16 C17 C18 C19 39.6(10) . .
N6 C18 C19 C20 -1.7(10) . .
C17 C18 C19 C20 177.9(6) . .
C18 C19 C20 C21 -0.8(12) . .
C19 C20 C21 C22 1.7(13) . .
C20 C21 C22 N6 -0.2(14) . .
N7 C23 C24 C25 0.6(10) . .
C23 C24 C25 N8 -0.2(9) . .
C23 C24 C25 C26 179.8(7) . .
N8 C25 C26 N9 -0.1(10) . .
C24 C25 C26 N9 179.8(8) . .
N8 C25 C26 C27 -177.9(7) . .
C24 C25 C26 C27 2.1(13) . .
N9 C26 C27 C28 2.3(14) . .
C25 C26 C27 C28 179.9(8) . .
C26 C27 C28 C29 -2.2(16) . .
C27 C28 C29 C30 0.8(16) . .
C28 C29 C30 N9 0.7(14) . .
O8 C31 C33 C38 1.6(9) . .
O7 C31 C33 C38 -179.6(6) . .
O8 C31 C33 C34 -176.1(5) . .
O7 C31 C33 C34 2.6(8) . .
C38 C33 C34 C35 0.0(9) . .
C31 C33 C34 C35 177.7(5) . .
C33 C34 C35 C36 -1.5(9) . .
C33 C34 C35 C32 179.7(5) . .
O6 C32 C35 C36 -0.7(9) . .
O5 C32 C35 C36 179.9(6) . .
O6 C32 C35 C34 178.1(6) . .
O5 C32 C35 C34 -1.3(8) . .
C34 C35 C36 C37 1.7(12) . .
C32 C35 C36 C37 -179.5(7) . .
C35 C36 C37 C38 -0.3(14) . .
C34 C33 C38 C37 1.5(11) . .
C31 C33 C38 C37 -176.3(7) . .
C36 C37 C38 C33 -1.3(14) . .
O2 C39 C41 C42 10.2(10) . .
O1 C39 C41 C42 -169.0(6) . .
O2 C39 C41 C46 -169.6(7) . .
O1 C39 C41 C46 11.2(10) . .
C46 C41 C42 C43 -1.2(9) . .
C39 C41 C42 C43 179.0(5) . .
C41 C42 C43 C44 2.5(8) . .
C41 C42 C43 C40 -172.5(5) . .
O3 C40 C43 C44 178.1(6) . .
O4 C40 C43 C44 -3.9(8) . .
O3 C40 C43 C42 -7.1(8) . .
O4 C40 C43 C42 170.9(5) . .
C42 C43 C44 C45 -1.6(9) . .
C40 C43 C44 C45 173.2(6) . .
C43 C44 C45 C46 -0.6(11) . .
C44 C45 C46 C41 1.9(11) . .
C42 C41 C46 C45 -1.0(10) . .
C39 C41 C46 C45 178.8(7) . .
O2 C39 O1 Ag4 26.9(12) . .
C41 C39 O1 Ag4 -153.9(5) . .
O2 Ag4 O1 C39 -88.0(7) 2_554 .
O6 Ag4 O1 C39 81.6(7) 1_454 .
Ag4 Ag4 O1 C39 -42.0(7) 2_554 .
Ag5 Ag4 O1 C39 170.0(5) 1_454 .
O1 C39 O2 Ag4 19.9(10) . 2_554
C41 C39 O2 Ag4 -159.3(5) . 2_554
O1 C39 O2 Ag5 124.8(7) . 2_655
C41 C39 O2 Ag5 -54.3(10) . 2_655
O4 C40 O3 Ag1 -22.6(9) . .
C43 C40 O3 Ag1 155.2(4) . .
N2 Ag1 O3 C40 -87.7(12) . .
N3 Ag1 O3 C40 115.7(6) . .
Ag2 Ag1 O3 C40 25.1(5) . .
O3 C40 O4 Ag2 -1.5(8) . .
C43 C40 O4 Ag2 -179.3(3) . .
N9 Ag2 O4 C40 -83.1(5) . .
N8 Ag2 O4 C40 75.5(5) . .
O7 Ag2 O4 C40 -173.7(4) . .
Ag1 Ag2 O4 C40 13.8(4) . .
O6 C32 O5 Ag5 -8.0(10) . .
C35 C32 O5 Ag5 171.3(4) . .
N6 Ag5 O5 C32 -154.3(5) 2_655 .
O2 Ag5 O5 C32 49.6(5) 2_655 .
Ag4 Ag5 O5 C32 13.4(5) 1_656 .
O5 C32 O6 Ag4 -8.9(10) . 1_656
C35 C32 O6 Ag4 171.8(4) . 1_656
O8 C31 O7 Ag3 12.3(8) . .
C33 C31 O7 Ag3 -166.4(4) . .
O8 C31 O7 Ag2 -96.4(6) . .
C33 C31 O7 Ag2 84.9(5) . .
O8 Ag3 O7 C31 -41.7(7) 2_765 .
O9 Ag3 O7 C31 124.4(5) 2_655 .
O9' Ag3 O7 C31 147.5(5) 2_655 .
Ag3 Ag3 O7 C31 -14.3(4) 2_765 .
O8 Ag3 O7 Ag2 75.2(5) 2_765 .
O9 Ag3 O7 Ag2 -118.7(3) 2_655 .
O9' Ag3 O7 Ag2 -95.6(4) 2_655 .
Ag3 Ag3 O7 Ag2 102.66(10) 2_765 .
O4 Ag2 O7 C31 143.2(4) . .
N9 Ag2 O7 C31 4.1(4) . .
N8 Ag2 O7 C31 -68.7(4) . .
Ag1 Ag2 O7 C31 178.2(3) . .
O4 Ag2 O7 Ag3 19.19(16) . .
N9 Ag2 O7 Ag3 -119.98(18) . .
N8 Ag2 O7 Ag3 167.24(14) . .
Ag1 Ag2 O7 Ag3 54.2(5) . .
O7 C31 O8 Ag3 1.5(9) . 2_765
C33 C31 O8 Ag3 -179.9(4) . 2_765
Ag3 O9 O9' N10 -128.4(8) 2_655 .
N10 O9 O9' O11 39.3(10) . .
Ag3 O9 O9' O11 -89.1(12) 2_655 .
N10 O9 O9' Ag3 128.4(8) . 2_655
O9 O9' O11 N10 -42.6(12) . .
Ag3 O9' O11 N10 -114.8(11) 2_655 .
C8 C7 N1 N2 0.5(8) . .
C8 C7 N1 C4 172.3(6) . .
C1 C4 N1 N2 -22.5(8) . .
C1 C4 N1 C7 166.5(6) . .
C7 N1 N2 C9 -1.3(7) . .
C4 N1 N2 C9 -173.3(5) . .
C7 N1 N2 Ag1 -150.9(5) . .
C4 N1 N2 Ag1 37.1(8) . .
C8 C9 N2 N1 1.5(7) . .
C10 C9 N2 N1 -179.8(5) . .
C8 C9 N2 Ag1 158.2(5) . .
C10 C9 N2 Ag1 -23.2(7) . .
O3 Ag1 N2 N1 6.6(14) . .
N3 Ag1 N2 N1 164.6(6) . .
Ag2 Ag1 N2 N1 -103.8(5) . .
O3 Ag1 N2 C9 -141.1(10) . .
N3 Ag1 N2 C9 16.9(4) . .
Ag2 Ag1 N2 C9 108.5(4) . .
C13 C14 N3 C10 -0.7(14) . .
C13 C14 N3 Ag1 179.2(7) . .
C11 C10 N3 C14 2.4(11) . .
C9 C10 N3 C14 -178.4(7) . .
C11 C10 N3 Ag1 -177.6(7) . .
C9 C10 N3 Ag1 1.7(8) . .
O3 Ag1 N3 C14 -13.2(8) . .
N2 Ag1 N3 C14 170.5(7) . .
Ag2 Ag1 N3 C14 63.8(7) . .
O3 Ag1 N3 C10 166.8(5) . .
N2 Ag1 N3 C10 -9.6(5) . .
Ag2 Ag1 N3 C10 -116.3(5) . .
C16 C15 N4 N5 -0.5(8) . .
C16 C15 N4 C5 -179.4(6) . .
C2 C5 N4 C15 -137.3(6) . .
C2 C5 N4 N5 43.9(7) . .
C16 C17 N5 N4 0.4(7) . .
C18 C17 N5 N4 -180.0(5) . .
C15 N4 N5 C17 0.1(7) . .
C5 N4 N5 C17 179.0(5) . .
C21 C22 N6 C18 -2.2(12) . .
C21 C22 N6 Ag5 160.5(7) . 2_655
C19 C18 N6 C22 3.2(9) . .
C17 C18 N6 C22 -176.4(6) . .
C19 C18 N6 Ag5 -160.3(5) . 2_655
C17 C18 N6 Ag5 20.1(7) . 2_655
C24 C23 N7 N8 -0.9(9) . .
C24 C23 N7 C6 173.8(7) . .
C3 C6 N7 N8 -53.6(8) . .
C3 C6 N7 C23 132.1(7) . .
C23 N7 N8 C25 0.8(7) . .
C6 N7 N8 C25 -174.3(5) . .
C23 N7 N8 Ag2 -172.1(6) . .
C6 N7 N8 Ag2 12.8(9) . .
C24 C25 N8 N7 -0.4(8) . .
C26 C25 N8 N7 179.6(6) . .
C24 C25 N8 Ag2 174.8(5) . .
C26 C25 N8 Ag2 -5.2(7) . .
O4 Ag2 N8 N7 12.7(8) . .
N9 Ag2 N8 N7 178.2(6) . .
O7 Ag2 N8 N7 -92.8(6) . .
Ag1 Ag2 N8 N7 74.9(6) . .
O4 Ag2 N8 C25 -159.8(4) . .
N9 Ag2 N8 C25 5.7(4) . .
O7 Ag2 N8 C25 94.7(4) . .
Ag1 Ag2 N8 C25 -97.6(4) . .
C27 C26 N9 C30 -0.7(11) . .
C25 C26 N9 C30 -178.4(6) . .
C27 C26 N9 Ag2 -176.6(7) . .
C25 C26 N9 Ag2 5.7(8) . .
C29 C30 N9 C26 -0.7(11) . .
C29 C30 N9 Ag2 174.8(6) . .
O4 Ag2 N9 C26 161.8(4) . .
N8 Ag2 N9 C26 -6.1(5) . .
O7 Ag2 N9 C26 -110.3(5) . .
Ag1 Ag2 N9 C26 71.1(5) . .
O4 Ag2 N9 C30 -13.7(7) . .
N8 Ag2 N9 C30 178.4(6) . .
O7 Ag2 N9 C30 74.2(5) . .
Ag1 Ag2 N9 C30 -104.4(5) . .
O9 O9' N10 O10 -112(2) . .
O11 O9' N10 O10 112(2) . .
Ag3 O9' N10 O10 -166.8(14) 2_655 .
O11 O9' N10 O9 -135.6(12) . .
Ag3 O9' N10 O9 -54.4(10) 2_655 .
O9 O9' N10 O11 135.6(12) . .
Ag3 O9' N10 O11 81.2(11) 2_655 .
Ag3 O9 N10 O9' 60.1(12) 2_655 .
O9' O9 N10 O10 127.3(15) . .
Ag3 O9 N10 O10 -172.6(7) 2_655 .
O9' O9 N10 O11 -47.3(13) . .
Ag3 O9 N10 O11 12.7(13) 2_655 .
O9' O11 N10 O10 -134.1(13) . .
O9' O11 N10 O9 41.0(11) . .
