#------------------------------------------------------------------------------
#$Date: 2016-03-26 00:46:38 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180095 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/41/7054193.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_7054193
loop_
_publ_author_name
'Wu, Huilu'
'Zhang, Yanhui'
'Chen, Chengyong'
'Zhang, Jiawen'
'Bai, Yuchen'
'Shi, Furong'
'Wang, Xiaoli'
_publ_section_title
;
 DNA-binding studies and antioxidant activities of two-, three- and
 four-coordinate silver(i) complexes containing
 bis(2-benzimidazolyl)aniline derivatives
;
_journal_issue                   8
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              3688
_journal_paper_doi               10.1039/C4NJ00503A
_journal_volume                  38
_journal_year                    2014
_chemical_formula_sum            'C62 H56 Ag2 N18 O16'
_chemical_formula_weight         1524.99
_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                99.118(2)
_cell_angle_beta                 96.954(2)
_cell_angle_gamma                94.303(2)
_cell_formula_units_Z            1
_cell_length_a                   9.5997(12)
_cell_length_b                   10.9697(15)
_cell_length_c                   15.236(2)
_cell_measurement_reflns_used    5161
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.50
_cell_measurement_theta_min      2.95
_cell_volume                     1565.2(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART APEX II'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measurement_device_type  'Bruker APEX II area detector'
_diffrn_measurement_method       'ω 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  0.0342
_diffrn_reflns_av_sigmaI/netI    0.0471
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            12722
_diffrn_reflns_theta_full        25.49
_diffrn_reflns_theta_max         25.49
_diffrn_reflns_theta_min         2.99
_exptl_absorpt_coefficient_mu    0.712
_exptl_absorpt_correction_T_max  0.808
_exptl_absorpt_correction_T_min  0.760
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colour
_exptl_crystal_density_diffrn    1.618
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             776
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.38
_exptl_crystal_size_min          0.30
_refine_diff_density_max         0.746
_refine_diff_density_min         -0.600
_refine_diff_density_rms         0.095
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.096
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     445
_refine_ls_number_reflns         5736
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.116
_refine_ls_R_factor_all          0.0400
_refine_ls_R_factor_gt           0.0359
_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)+(0.0483P)²+1.7808P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0984
_refine_ls_wR_factor_ref         0.1053
_reflns_number_gt                5178
_reflns_number_total             5736
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4nj00503a1.cif
_cod_data_source_block           1
_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.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' 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 7054193--7054195.cif.
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7054193
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 0.71184(2) 0.04868(2) 0.592613(15) 0.02728(10) Uani 1 1 d .
N1 N 0.3090(3) -0.1542(3) 0.68491(19) 0.0280(6) Uani 1 1 d .
N2 N 0.1257(3) 0.0542(3) 0.65637(18) 0.0284(6) Uani 1 1 d .
H2 H 0.1079 0.0403 0.7081 0.034 Uiso 1 1 calc R
N3 N 0.1937(3) 0.0226(2) 0.52091(16) 0.0218(5) Uani 1 1 d .
N4 N 0.4264(3) 0.0870(2) 0.78676(17) 0.0236(6) Uani 1 1 d .
H4A H 0.3533 0.0588 0.8075 0.028 Uiso 1 1 calc R
N5 N 0.6002(3) 0.0945(2) 0.70300(17) 0.0235(6) Uani 1 1 d .
C1 C 0.4913(3) 0.0261(3) 0.72143(19) 0.0220(6) Uani 1 1 d .
C2 C 0.4991(3) 0.2032(3) 0.8142(2) 0.0235(6) Uani 1 1 d .
C3 C 0.4781(4) 0.3047(3) 0.8772(2) 0.0295(7) Uani 1 1 d .
H3 H 0.4028 0.3031 0.9102 0.035 Uiso 1 1 calc R
C4 C 0.5741(4) 0.4071(3) 0.8884(2) 0.0350(8) Uani 1 1 d .
H4 H 0.5640 0.4761 0.9304 0.042 Uiso 1 1 calc R
C5 C 0.6870(4) 0.4106(3) 0.8381(2) 0.0348(8) Uani 1 1 d .
H5 H 0.7507 0.4812 0.8484 0.042 Uiso 1 1 calc R
C6 C 0.7059(4) 0.3116(3) 0.7734(2) 0.0288(7) Uani 1 1 d .
H6 H 0.7794 0.3148 0.7390 0.035 Uiso 1 1 calc R
C7 C 0.6095(3) 0.2067(3) 0.7622(2) 0.0223(6) Uani 1 1 d .
C8 C 0.4505(4) -0.1062(3) 0.6762(2) 0.0280(7) Uani 1 1 d .
H8A H 0.4591 -0.1121 0.6129 0.034 Uiso 1 1 calc R
H8B H 0.5167 -0.1583 0.7012 0.034 Uiso 1 1 calc R
C9 C 0.2885(3) -0.2323(3) 0.7478(2) 0.0253(7) Uani 1 1 d .
C10 C 0.3867(4) -0.2209(3) 0.8255(2) 0.0320(8) Uani 1 1 d .
H10 H 0.4648 -0.1628 0.8339 0.038 Uiso 1 1 calc R
C11 C 0.3690(5) -0.2948(4) 0.8898(3) 0.0410(9) Uani 1 1 d .
H11 H 0.4356 -0.2857 0.9406 0.049 Uiso 1 1 calc R
C12 C 0.2539(5) -0.3819(4) 0.8796(3) 0.0463(10) Uani 1 1 d .
H12 H 0.2431 -0.4318 0.9228 0.056 Uiso 1 1 calc R
C13 C 0.1559(5) -0.3933(4) 0.8045(3) 0.0429(10) Uani 1 1 d .
H13 H 0.0776 -0.4510 0.7975 0.052 Uiso 1 1 calc R
C14 C 0.1711(4) -0.3200(3) 0.7381(2) 0.0312(7) Uani 1 1 d .
H14 H 0.1036 -0.3296 0.6877 0.037 Uiso 1 1 calc R
C15 C 0.2040(4) -0.1542(3) 0.6072(2) 0.0344(8) Uani 1 1 d .
H15A H 0.1166 -0.1989 0.6151 0.041 Uiso 1 1 calc R
H15B H 0.2366 -0.1970 0.5539 0.041 Uiso 1 1 calc R
C16 C 0.1770(3) -0.0253(3) 0.5943(2) 0.0247(7) Uani 1 1 d .
C17 C 0.1068(3) 0.1621(3) 0.6223(2) 0.0249(7) Uani 1 1 d .
C18 C 0.0566(4) 0.2736(4) 0.6574(2) 0.0398(9) Uani 1 1 d .
H18 H 0.0299 0.2873 0.7145 0.048 Uiso 1 1 calc R
C19 C 0.0488(5) 0.3615(4) 0.6028(3) 0.0455(10) Uani 1 1 d .
H19 H 0.0129 0.4358 0.6229 0.055 Uiso 1 1 calc R
C20 C 0.0931(4) 0.3435(4) 0.5181(3) 0.0420(9) Uani 1 1 d .
H20 H 0.0874 0.4066 0.4840 0.050 Uiso 1 1 calc R
C21 C 0.1454(4) 0.2341(3) 0.4832(2) 0.0302(7) Uani 1 1 d .
H21 H 0.1762 0.2228 0.4272 0.036 Uiso 1 1 calc R
C22 C 0.1493(3) 0.1416(3) 0.5367(2) 0.0238(7) Uani 1 1 d .
O1 O 1.1913(3) 0.3653(3) -0.01525(18) 0.0437(7) Uani 1 1 d .
O2 O 1.0175(3) 0.3044(3) -0.12140(18) 0.0505(8) Uani 1 1 d .
O3 O 0.6727(3) -0.0120(3) -0.09593(16) 0.0427(7) Uani 1 1 d .
O4 O 0.6410(3) -0.0680(3) 0.03020(17) 0.0476(7) Uani 1 1 d .
O5 O 1.1038(3) 0.0394(3) 0.2637(2) 0.0564(9) Uani 1 1 d .
O6 O 1.2069(3) 0.2186(3) 0.26023(18) 0.0553(8) Uani 1 1 d .
O7 O 0.8491(2) -0.0101(2) 0.16601(14) 0.0270(5) Uani 1 1 d .
N11 N 1.0796(3) 0.3015(3) -0.0464(2) 0.0333(7) Uani 1 1 d .
N12 N 1.1198(3) 0.1303(3) 0.22743(19) 0.0342(7) Uani 1 1 d .
N13 N 0.7084(3) -0.0079(3) -0.01438(18) 0.0254(6) Uani 1 1 d .
C45 C 1.0191(3) 0.2187(3) 0.0077(2) 0.0250(7) Uani 1 1 d .
C46 C 1.0910(3) 0.2125(3) 0.0908(2) 0.0251(7) Uani 1 1 d .
H46 H 1.1755 0.2614 0.1118 0.030 Uiso 1 1 calc R
C47 C 1.0365(3) 0.1335(3) 0.1421(2) 0.0237(7) Uani 1 1 d .
C48 C 0.9014(3) 0.0564(3) 0.11686(19) 0.0206(6) Uani 1 1 d .
C49 C 0.8373(3) 0.0688(3) 0.0272(2) 0.0217(6) Uani 1 1 d .
C50 C 0.8933(3) 0.1467(3) -0.0250(2) 0.0241(7) Uani 1 1 d .
H50 H 0.8470 0.1509 -0.0815 0.029 Uiso 1 1 calc R
O15 O 0.4152(5) 0.7428(4) 0.4674(2) 0.0796(13) Uani 1 1 d .
N16 N 0.4735(4) 0.5670(3) 0.3876(2) 0.0407(8) Uani 1 1 d .
C57 C 0.4922(5) 0.6864(4) 0.4203(3) 0.0465(10) Uani 1 1 d .
H57 H 0.5702 0.7315 0.4066 0.056 Uiso 1 1 calc R
C58 C 0.3515(7) 0.4940(6) 0.4029(4) 0.0807(17) Uani 1 1 d U
H58A H 0.3003 0.5438 0.4431 0.121 Uiso 1 1 calc R
H58B H 0.3803 0.4242 0.4289 0.121 Uiso 1 1 calc R
H58C H 0.2922 0.4652 0.3469 0.121 Uiso 1 1 calc R
C59 C 0.5691(7) 0.5070(7) 0.3331(4) 0.0902(19) Uani 1 1 d U
H59A H 0.6408 0.5676 0.3237 0.135 Uiso 1 1 calc R
H59B H 0.5182 0.4677 0.2763 0.135 Uiso 1 1 calc R
H59C H 0.6121 0.4458 0.3630 0.135 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'
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'
O O 0.0106 0.0060 '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'
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
N3 Ag1 N5 171.67(10) 2_656 .
C9 N1 C8 119.8(3) . .
C9 N1 C15 121.6(3) . .
C8 N1 C15 115.0(3) . .
C16 N2 C17 107.9(3) . .
C16 N2 H2 126.1 . .
C17 N2 H2 126.1 . .
C16 N3 C22 105.6(2) . .
C16 N3 Ag1 129.8(2) . 2_656
C22 N3 Ag1 124.3(2) . 2_656
C1 N4 C2 107.4(3) . .
C1 N4 H4A 126.3 . .
C2 N4 H4A 126.3 . .
C1 N5 C7 105.6(3) . .
C1 N5 Ag1 125.3(2) . .
C7 N5 Ag1 128.4(2) . .
N5 C1 N4 112.4(3) . .
N5 C1 C8 122.7(3) . .
N4 C1 C8 124.9(3) . .
N4 C2 C3 132.5(3) . .
N4 C2 C7 105.8(3) . .
C3 C2 C7 121.8(3) . .
C4 C3 C2 116.8(3) . .
C4 C3 H3 121.6 . .
C2 C3 H3 121.6 . .
C3 C4 C5 121.8(3) . .
C3 C4 H4 119.1 . .
C5 C4 H4 119.1 . .
C6 C5 C4 121.6(3) . .
C6 C5 H5 119.2 . .
C4 C5 H5 119.2 . .
C5 C6 C7 116.9(3) . .
C5 C6 H6 121.6 . .
C7 C6 H6 121.6 . .
C6 C7 N5 130.2(3) . .
C6 C7 C2 121.0(3) . .
N5 C7 C2 108.8(3) . .
N1 C8 C1 114.6(3) . .
N1 C8 H8A 108.6 . .
C1 C8 H8A 108.6 . .
N1 C8 H8B 108.6 . .
C1 C8 H8B 108.6 . .
H8A C8 H8B 107.6 . .
N1 C9 C10 119.3(3) . .
N1 C9 C14 122.9(3) . .
C10 C9 C14 117.7(3) . .
C11 C10 C9 121.1(4) . .
C11 C10 H10 119.5 . .
C9 C10 H10 119.5 . .
C12 C11 C10 121.0(4) . .
C12 C11 H11 119.5 . .
C10 C11 H11 119.5 . .
C13 C12 C11 118.7(3) . .
C13 C12 H12 120.7 . .
C11 C12 H12 120.7 . .
C12 C13 C14 121.6(4) . .
C12 C13 H13 119.2 . .
C14 C13 H13 119.2 . .
C13 C14 C9 119.9(3) . .
C13 C14 H14 120.1 . .
C9 C14 H14 120.1 . .
N1 C15 C16 111.7(3) . .
N1 C15 H15A 109.3 . .
C16 C15 H15A 109.3 . .
N1 C15 H15B 109.3 . .
C16 C15 H15B 109.3 . .
H15A C15 H15B 107.9 . .
N3 C16 N2 112.3(3) . .
N3 C16 C15 125.3(3) . .
N2 C16 C15 122.4(3) . .
N2 C17 C18 132.3(3) . .
N2 C17 C22 105.6(3) . .
C18 C17 C22 122.2(3) . .
C19 C18 C17 116.3(3) . .
C19 C18 H18 121.8 . .
C17 C18 H18 121.8 . .
C18 C19 C20 122.2(3) . .
C18 C19 H19 118.9 . .
C20 C19 H19 118.9 . .
C21 C20 C19 121.9(3) . .
C21 C20 H20 119.0 . .
C19 C20 H20 119.0 . .
C20 C21 C22 116.6(3) . .
C20 C21 H21 121.7 . .
C22 C21 H21 121.7 . .
C21 C22 N3 130.5(3) . .
C21 C22 C17 120.8(3) . .
N3 C22 C17 108.7(3) . .
O2 N11 O1 122.9(3) . .
O2 N11 C45 118.5(3) . .
O1 N11 C45 118.6(3) . .
O5 N12 O6 122.0(3) . .
O5 N12 C47 119.4(3) . .
O6 N12 C47 118.6(3) . .
O4 N13 O3 122.0(3) . .
O4 N13 C49 120.2(3) . .
O3 N13 C49 117.7(3) . .
C46 C45 C50 121.4(3) . .
C46 C45 N11 118.6(3) . .
C50 C45 N11 120.0(3) . .
C47 C46 C45 119.3(3) . .
C47 C46 H46 120.4 . .
C45 C46 H46 120.4 . .
C46 C47 N12 115.9(3) . .
C46 C47 C48 124.6(3) . .
N12 C47 C48 119.5(3) . .
O7 C48 C49 125.0(3) . .
O7 C48 C47 124.1(3) . .
C49 C48 C47 110.9(3) . .
C50 C49 N13 115.4(3) . .
C50 C49 C48 124.4(3) . .
N13 C49 C48 120.1(3) . .
C49 C50 C45 119.3(3) . .
C49 C50 H50 120.4 . .
C45 C50 H50 120.4 . .
C57 N16 C58 119.8(4) . .
C57 N16 C59 122.0(5) . .
C58 N16 C59 118.1(5) . .
O15 C57 N16 125.3(5) . .
O15 C57 H57 117.4 . .
N16 C57 H57 117.4 . .
N16 C58 H58A 109.5 . .
N16 C58 H58B 109.5 . .
H58A C58 H58B 109.5 . .
N16 C58 H58C 109.5 . .
H58A C58 H58C 109.5 . .
H58B C58 H58C 109.5 . .
N16 C59 H59A 109.5 . .
N16 C59 H59B 109.5 . .
H59A C59 H59B 109.5 . .
N16 C59 H59C 109.5 . .
H59A C59 H59C 109.5 . .
H59B C59 H59C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N3 2.118(2) 2_656
Ag1 N5 2.116(3) .
N1 C9 1.404(4) .
N1 C8 1.449(4) .
N1 C15 1.460(4) .
N2 C16 1.346(4) .
N2 C17 1.381(4) .
N2 H2 0.8600 .
N3 C16 1.330(4) .
N3 C22 1.397(4) .
N3 Ag1 2.118(2) 2_656
N4 C1 1.352(4) .
N4 C2 1.383(4) .
N4 H4A 0.8600 .
N5 C1 1.325(4) .
N5 C7 1.396(4) .
C1 C8 1.505(5) .
C2 C3 1.395(5) .
C2 C7 1.399(4) .
C3 C4 1.373(5) .
C3 H3 0.9300 .
C4 C5 1.402(5) .
C4 H4 0.9300 .
C5 C6 1.385(5) .
C5 H5 0.9300 .
C6 C7 1.396(5) .
C6 H6 0.9300 .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 C10 1.404(5) .
C9 C14 1.403(5) .
C10 C11 1.384(5) .
C10 H10 0.9300 .
C11 C12 1.382(6) .
C11 H11 0.9300 .
C12 C13 1.373(6) .
C12 H12 0.9300 .
C13 C14 1.403(5) .
C13 H13 0.9300 .
C14 H14 0.9300 .
C15 C16 1.495(5) .
C15 H15A 0.9700 .
C15 H15B 0.9700 .
C17 C18 1.399(5) .
C17 C22 1.403(4) .
C18 C19 1.370(6) .
C18 H18 0.9300 .
C19 C20 1.398(6) .
C19 H19 0.9300 .
C20 C21 1.388(5) .
C20 H20 0.9300 .
C21 C22 1.398(5) .
C21 H21 0.9300 .
O1 N11 1.234(4) .
O2 N11 1.229(4) .
O3 N13 1.241(4) .
O4 N13 1.224(4) .
O5 N12 1.223(4) .
O6 N12 1.230(4) .
O7 C48 1.247(4) .
N11 C45 1.455(4) .
N12 C47 1.449(4) .
N13 C49 1.458(4) .
C45 C46 1.381(5) .
C45 C50 1.385(5) .
C46 C47 1.371(5) .
C46 H46 0.9300 .
C47 C48 1.469(4) .
C48 C49 1.459(4) .
C49 C50 1.380(4) .
C50 H50 0.9300 .
O15 C57 1.224(5) .
N16 C57 1.316(5) .
N16 C58 1.431(7) .
N16 C59 1.438(6) .
C57 H57 0.9300 .
C58 H58A 0.9600 .
C58 H58B 0.9600 .
C58 H58C 0.9600 .
C59 H59A 0.9600 .
C59 H59B 0.9600 .
C59 H59C 0.9600 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C10 H10 O3 0.93 2.51 3.408(5) 163.1 1_556
C18 H18 O2 0.93 2.49 3.403(5) 165.4 1_456
C3 H3 O1 0.93 2.53 3.425(4) 161.7 1_456
C50 H50 O3 0.93 2.32 2.642(4) 99.8 .
N2 H2 N4 0.86 3.12 3.261(4) 91.8 .
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
N3 Ag1 N5 C1 -9.1(8) 2_656
N3 Ag1 N5 C7 -178.6(5) 2_656
C7 N5 C1 N4 1.8(3) .
Ag1 N5 C1 N4 -169.67(19) .
C7 N5 C1 C8 -175.9(3) .
Ag1 N5 C1 C8 12.6(4) .
C2 N4 C1 N5 -0.9(3) .
C2 N4 C1 C8 176.8(3) .
C1 N4 C2 C3 178.5(3) .
C1 N4 C2 C7 -0.4(3) .
N4 C2 C3 C4 179.1(3) .
C7 C2 C3 C4 -2.2(5) .
C2 C3 C4 C5 0.8(5) .
C3 C4 C5 C6 1.2(6) .
C4 C5 C6 C7 -1.7(5) .
C5 C6 C7 N5 179.4(3) .
C5 C6 C7 C2 0.3(5) .
C1 N5 C7 C6 178.9(3) .
Ag1 N5 C7 C6 -10.0(5) .
C1 N5 C7 C2 -2.0(3) .
Ag1 N5 C7 C2 169.1(2) .
N4 C2 C7 C6 -179.3(3) .
C3 C2 C7 C6 1.7(5) .
N4 C2 C7 N5 1.4(3) .
C3 C2 C7 N5 -177.6(3) .
C9 N1 C8 C1 -101.5(3) .
C15 N1 C8 C1 99.6(3) .
N5 C1 C8 N1 -163.2(3) .
N4 C1 C8 N1 19.4(4) .
C8 N1 C9 C10 28.2(4) .
C15 N1 C9 C10 -174.3(3) .
C8 N1 C9 C14 -153.7(3) .
C15 N1 C9 C14 3.8(5) .
N1 C9 C10 C11 179.0(3) .
C14 C9 C10 C11 0.7(5) .
C9 C10 C11 C12 -0.2(6) .
C10 C11 C12 C13 -0.6(6) .
C11 C12 C13 C14 0.8(6) .
C12 C13 C14 C9 -0.2(5) .
N1 C9 C14 C13 -178.7(3) .
C10 C9 C14 C13 -0.5(5) .
C9 N1 C15 C16 134.0(3) .
C8 N1 C15 C16 -67.5(4) .
C22 N3 C16 N2 -0.3(4) .
Ag1 N3 C16 N2 173.0(2) 2_656
C22 N3 C16 C15 176.9(3) .
Ag1 N3 C16 C15 -9.8(5) 2_656
C17 N2 C16 N3 0.1(4) .
C17 N2 C16 C15 -177.2(3) .
N1 C15 C16 N3 121.7(4) .
N1 C15 C16 N2 -61.4(4) .
C16 N2 C17 C18 179.7(4) .
C16 N2 C17 C22 0.2(4) .
N2 C17 C18 C19 -178.4(4) .
C22 C17 C18 C19 1.0(6) .
C17 C18 C19 C20 -2.2(6) .
C18 C19 C20 C21 1.2(7) .
C19 C20 C21 C22 1.1(6) .
C20 C21 C22 N3 179.3(3) .
C20 C21 C22 C17 -2.2(5) .
C16 N3 C22 C21 179.1(3) .
Ag1 N3 C22 C21 5.3(5) 2_656
C16 N3 C22 C17 0.4(4) .
Ag1 N3 C22 C17 -173.4(2) 2_656
N2 C17 C22 C21 -179.2(3) .
C18 C17 C22 C21 1.2(5) .
N2 C17 C22 N3 -0.4(4) .
C18 C17 C22 N3 -179.9(3) .
O2 N11 C45 C46 178.1(3) .
O1 N11 C45 C46 -1.6(5) .
O2 N11 C45 C50 -0.9(5) .
O1 N11 C45 C50 179.4(3) .
C50 C45 C46 C47 0.0(5) .
N11 C45 C46 C47 -179.0(3) .
C45 C46 C47 N12 178.6(3) .
C45 C46 C47 C48 -2.8(5) .
O5 N12 C47 C46 -157.8(3) .
O6 N12 C47 C46 20.7(5) .
O5 N12 C47 C48 23.5(5) .
O6 N12 C47 C48 -158.0(3) .
C46 C47 C48 O7 -176.0(3) .
N12 C47 C48 O7 2.6(5) .
C46 C47 C48 C49 3.9(4) .
N12 C47 C48 C49 -177.5(3) .
O4 N13 C49 C50 -170.6(3) .
O3 N13 C49 C50 11.3(4) .
O4 N13 C49 C48 11.7(4) .
O3 N13 C49 C48 -166.4(3) .
O7 C48 C49 C50 177.1(3) .
C47 C48 C49 C50 -2.8(4) .
O7 C48 C49 N13 -5.4(4) .
C47 C48 C49 N13 174.7(3) .
N13 C49 C50 C45 -177.1(3) .
C48 C49 C50 C45 0.5(5) .
C46 C45 C50 C49 1.1(5) .
N11 C45 C50 C49 -179.9(3) .
C58 N16 C57 O15 3.1(6) .
C59 N16 C57 O15 -179.7(4) .
