#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/91/2019144.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2019144
loop_
_publ_author_name
'Gui, Liu-cheng'
'Liang, Guang-ming'
'Zou, Hua-hong'
'Hou, Zhong'
_publ_section_title
;
 One-dimensional CuI and AgI ladder-like coordination polymers
 supported by 2-ethyl-1-(pyridin-3-ylmethyl)-1H-benzimidazole
;
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1017
_journal_page_last               1021
_journal_paper_doi               10.1107/S0108270113019963
_journal_volume                  69
_journal_year                    2013
_chemical_formula_iupac          '[Ag (C15 H15 N3)2] Cl O4, C H4 O'
_chemical_formula_moiety         'C30 H30 Ag N6 +, Cl O4 -, C H4 O'
_chemical_formula_sum            'C31 H34 Ag Cl N6 O5'
_chemical_formula_weight         713.96
_chemical_name_systematic
'Poly[[bis[μ₂-2-ethyl-1-(pyridin-3-ylmethyl)-1H-benzimidazole-κ²N¹:N³]silver(I)] perchlorate methanol monosolvate]'
_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                90.163(10)
_cell_angle_beta                 108.773(9)
_cell_angle_gamma                95.518(9)
_cell_formula_units_Z            2
_cell_length_a                   9.560(7)
_cell_length_b                   12.946(10)
_cell_length_c                   13.849(11)
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.12
_cell_measurement_theta_min      2.21
_cell_volume                     1614(2)
_computing_cell_refinement       'SAINT (Bruker, 2007)'
_computing_data_collection       'SMART (Bruker, 2001)'
_computing_data_reduction        'SAINT (Bruker, 2007)'
_computing_molecular_graphics    'SHELXTL97 (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.877
_diffrn_measurement_device_type  'Bruker SMART CCD 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  0.0175
_diffrn_reflns_av_sigmaI/netI    0.0364
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            10939
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         28.42
_diffrn_reflns_theta_min         1.55
_exptl_absorpt_coefficient_mu    0.755
_exptl_absorpt_correction_T_max  0.860
_exptl_absorpt_correction_T_min  0.850
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2001)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.469
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             732
_exptl_crystal_size_max          0.60
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.778
_refine_diff_density_min         -0.508
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.019
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     400
_refine_ls_number_reflns         7140
_refine_ls_number_restraints     9
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.0633
_refine_ls_R_factor_gt           0.0444
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0557P)²+1.1704P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1070
_refine_ls_wR_factor_ref         0.1184
_reflns_number_gt                5396
_reflns_number_total             7140
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            wq3040.cif
_cod_data_source_block           2
_cod_database_code               2019144
_cod_database_fobs_code          2019144
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_symmetry_multiplicity
Ag Ag1 0.09029(3) 0.24459(2) 0.33648(2) 0.05197(11) Uani d . 1 1
N N1 0.2835(3) 0.2553(2) 0.2788(2) 0.0438(6) Uani d . 1 1
N N2 0.4372(3) 0.3144(2) 0.1958(2) 0.0428(6) Uani d . 1 1
N N3 0.9311(3) 0.3858(2) 0.2933(3) 0.0551(8) Uani d . 1 1
N N4 0.0594(3) 0.2031(2) 0.4870(2) 0.0469(7) Uani d . 1 1
N N5 0.1199(3) 0.1824(2) 0.6552(2) 0.0446(6) Uani d . 1 1
N N6 0.0661(3) -0.1111(2) 0.7796(2) 0.0518(7) Uani d . 1 1
C C1 0.3400(3) 0.1709(3) 0.2472(2) 0.0416(7) Uani d . 1 1
C C2 0.3108(4) 0.0648(3) 0.2578(3) 0.0501(8) Uani d . 1 1
H H2A 0.2469 0.0398 0.2927 0.060 Uiso calc R 1 1
C C3 0.3800(4) -0.0015(3) 0.2145(3) 0.0575(9) Uani d . 1 1
H H3A 0.3626 -0.0727 0.2207 0.069 Uiso calc R 1 1
C C4 0.4753(4) 0.0351(3) 0.1619(3) 0.0585(10) Uani d . 1 1
H H4A 0.5196 -0.0122 0.1336 0.070 Uiso calc R 1 1
C C5 0.5057(4) 0.1397(3) 0.1506(3) 0.0520(9) Uani d . 1 1
H H5A 0.5696 0.1640 0.1155 0.062 Uiso calc R 1 1
C C6 0.4363(3) 0.2073(3) 0.1943(2) 0.0395(7) Uani d . 1 1
C C7 0.3426(4) 0.3380(3) 0.2465(3) 0.0435(7) Uani d . 1 1
C C8 0.3099(5) 0.4448(3) 0.2645(3) 0.0608(10) Uani d . 1 1
H H8A 0.2032 0.4471 0.2429 0.073 Uiso calc R 1 1
H H8B 0.3497 0.4925 0.2236 0.073 Uiso calc R 1 1
C C9 0.3757(7) 0.4793(4) 0.3750(4) 0.0968(17) Uani d . 1 1
H H9A 0.3511 0.5481 0.3839 0.145 Uiso calc R 1 1
H H9B 0.4817 0.4794 0.3960 0.145 Uiso calc R 1 1
H H9C 0.3363 0.4325 0.4157 0.145 Uiso calc R 1 1
C C10 0.5223(4) 0.3859(3) 0.1479(3) 0.0511(9) Uani d . 1 1
H H10A 0.4692 0.4463 0.1259 0.061 Uiso calc R 1 1
H H10B 0.5309 0.3516 0.0880 0.061 Uiso calc R 1 1
C C11 0.6758(4) 0.4204(3) 0.2204(3) 0.0461(8) Uani d . 1 1
C C12 0.7055(5) 0.5094(3) 0.2813(4) 0.0722(13) Uani d . 1 1
H H12A 0.6309 0.5521 0.2769 0.087 Uiso calc R 1 1
C C13 0.8473(5) 0.5351(3) 0.3493(4) 0.0796(14) Uani d . 1 1
H H13A 0.8686 0.5943 0.3918 0.096 Uiso calc R 1 1
C C14 0.9555(5) 0.4717(3) 0.3527(4) 0.0665(11) Uani d . 1 1
H H14A 1.0503 0.4892 0.3985 0.080 Uiso calc R 1 1
C C15 0.7942(4) 0.3627(3) 0.2289(3) 0.0494(8) Uani d . 1 1
H H15A 0.7765 0.3036 0.1866 0.059 Uiso calc R 1 1
C C16 -0.0661(4) 0.2120(3) 0.5159(3) 0.0427(7) Uani d . 1 1
C C17 -0.2091(4) 0.2305(3) 0.4579(3) 0.0568(9) Uani d . 1 1
H H17A -0.2350 0.2378 0.3877 0.068 Uiso calc R 1 1
C C18 -0.3115(4) 0.2377(3) 0.5084(4) 0.0667(11) Uani d . 1 1
H H18A -0.4084 0.2493 0.4715 0.080 Uiso calc R 1 1
C C19 -0.2722(5) 0.2277(3) 0.6133(4) 0.0676(11) Uani d . 1 1
H H19A -0.3432 0.2345 0.6451 0.081 Uiso calc R 1 1
C C20 -0.1319(4) 0.2082(3) 0.6716(3) 0.0560(9) Uani d . 1 1
H H20A -0.1066 0.2007 0.7418 0.067 Uiso calc R 1 1
C C21 -0.0300(4) 0.2003(2) 0.6208(3) 0.0424(7) Uani d . 1 1
C C22 0.1662(4) 0.1848(3) 0.5719(3) 0.0445(7) Uani d . 1 1
C C23 0.3188(4) 0.1660(3) 0.5739(3) 0.0632(10) Uani d . 1 1
H H23A 0.3887 0.1872 0.6406 0.076 Uiso calc R 1 1
H H23B 0.3457 0.2087 0.5239 0.076 Uiso calc R 1 1
C C24 0.3314(5) 0.0544(4) 0.5517(4) 0.0851(15) Uani d . 1 1
H H24A 0.4281 0.0477 0.5469 0.128 Uiso calc R 1 1
H H24B 0.2569 0.0314 0.4884 0.128 Uiso calc R 1 1
H H24C 0.3173 0.0128 0.6057 0.128 Uiso calc R 1 1
C C25 0.2061(4) 0.1685(3) 0.7615(3) 0.0561(9) Uani d . 1 1
H H25A 0.1954 0.2261 0.8027 0.067 Uiso calc R 1 1
H H25B 0.3103 0.1708 0.7673 0.067 Uiso calc R 1 1
C C26 0.1611(4) 0.0682(3) 0.8038(3) 0.0452(8) Uani d . 1 1
C C27 0.1843(5) 0.0609(3) 0.9076(3) 0.0657(11) Uani d . 1 1
H H27A 0.2250 0.1186 0.9513 0.079 Uiso calc R 1 1
C C28 0.1472(6) -0.0313(4) 0.9453(3) 0.0785(14) Uani d . 1 1
H H28A 0.1616 -0.0371 1.0147 0.094 Uiso calc R 1 1
C C29 0.0884(5) -0.1154(3) 0.8793(3) 0.0620(10) Uani d . 1 1
H H29A 0.0631 -0.1779 0.9054 0.074 Uiso calc R 1 1
C C30 0.1028(4) -0.0205(3) 0.7438(3) 0.0464(8) Uani d . 1 1
H H30A 0.0880 -0.0171 0.6742 0.056 Uiso calc R 1 1
C C31 0.9220(17) 0.5758(11) 0.0796(13) 0.298(8) Uani d DU 1 1
H H31A 0.9462 0.5905 0.1515 0.446 Uiso calc R 1 1
H H31B 1.0083 0.5566 0.0656 0.446 Uiso calc RD 1 1
H H31C 0.8441 0.5197 0.0587 0.446 Uiso calc R 1 1
Cl Cl1 0.36635(11) 0.70352(7) 0.10573(7) 0.0550(2) Uani d . 1 1
O O1 0.2294(5) 0.7397(4) 0.1060(5) 0.152(2) Uani d . 1 1
O O2 0.4377(5) 0.7825(3) 0.0640(3) 0.1128(14) Uani d . 1 1
O O3 0.3390(6) 0.6084(3) 0.0533(3) 0.1209(16) Uani d . 1 1
O O4 0.4470(5) 0.6944(3) 0.2100(2) 0.0987(12) Uani d . 1 1
O O5 0.8712(11) 0.6702(9) 0.0222(8) 0.264(5) Uani d DU 1 1
H H5B 0.9534 0.7072 0.0322 0.316 Uiso d R 1 1
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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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'
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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
N1 Ag1 N4 . . 134.12(10) y
N1 Ag1 N6 . 2_556 98.85(11) y
N4 Ag1 N6 . 2_556 103.37(11) y
N1 Ag1 N3 . 1_455 116.32(11) y
N4 Ag1 N3 . 1_455 98.91(11) y
N6 Ag1 N3 2_556 1_455 99.63(12) y
C7 N1 C1 . . 106.2(3) ?
C7 N1 Ag1 . . 127.2(2) ?
C1 N1 Ag1 . . 125.0(2) ?
C7 N2 C6 . . 106.9(3) ?
C7 N2 C10 . . 128.2(3) ?
C6 N2 C10 . . 124.9(3) ?
C15 N3 C14 . . 117.0(3) ?
C15 N3 Ag1 . 1_655 117.1(2) ?
C14 N3 Ag1 . 1_655 122.5(3) ?
C22 N4 C16 . . 105.6(3) ?
C22 N4 Ag1 . . 125.9(2) ?
C16 N4 Ag1 . . 127.3(2) ?
C22 N5 C21 . . 106.6(3) ?
C22 N5 C25 . . 128.6(3) ?
C21 N5 C25 . . 124.8(3) ?
C29 N6 C30 . . 117.7(3) ?
C29 N6 Ag1 . 2_556 120.8(3) ?
C30 N6 Ag1 . 2_556 119.6(2) ?
C2 C1 N1 . . 130.6(3) ?
C2 C1 C6 . . 120.5(3) ?
N1 C1 C6 . . 108.9(3) ?
C3 C2 C1 . . 117.5(3) ?
C3 C2 H2A . . 121.3 ?
C1 C2 H2A . . 121.3 ?
C2 C3 C4 . . 121.7(4) ?
C2 C3 H3A . . 119.2 ?
C4 C3 H3A . . 119.2 ?
C5 C4 C3 . . 121.8(3) ?
C5 C4 H4A . . 119.1 ?
C3 C4 H4A . . 119.1 ?
C4 C5 C6 . . 116.9(3) ?
C4 C5 H5A . . 121.6 ?
C6 C5 H5A . . 121.6 ?
N2 C6 C5 . . 132.7(3) ?
N2 C6 C1 . . 105.6(3) ?
C5 C6 C1 . . 121.7(3) ?
N1 C7 N2 . . 112.4(3) ?
N1 C7 C8 . . 123.0(3) ?
N2 C7 C8 . . 124.5(3) ?
C7 C8 C9 . . 111.8(4) ?
C7 C8 H8A . . 109.3 ?
C9 C8 H8A . . 109.3 ?
C7 C8 H8B . . 109.3 ?
C9 C8 H8B . . 109.3 ?
H8A C8 H8B . . 107.9 ?
C8 C9 H9A . . 109.5 ?
C8 C9 H9B . . 109.5 ?
H9A C9 H9B . . 109.5 ?
C8 C9 H9C . . 109.5 ?
H9A C9 H9C . . 109.5 ?
H9B C9 H9C . . 109.5 ?
N2 C10 C11 . . 111.8(3) ?
N2 C10 H10A . . 109.3 ?
C11 C10 H10A . . 109.3 ?
N2 C10 H10B . . 109.3 ?
C11 C10 H10B . . 109.3 ?
H10A C10 H10B . . 107.9 ?
C12 C11 C15 . . 116.8(3) ?
C12 C11 C10 . . 122.2(3) ?
C15 C11 C10 . . 121.0(3) ?
C11 C12 C13 . . 119.6(4) ?
C11 C12 H12A . . 120.2 ?
C13 C12 H12A . . 120.2 ?
C14 C13 C12 . . 118.8(4) ?
C14 C13 H13A . . 120.6 ?
C12 C13 H13A . . 120.6 ?
N3 C14 C13 . . 123.1(4) ?
N3 C14 H14A . . 118.4 ?
C13 C14 H14A . . 118.4 ?
N3 C15 C11 . . 124.7(3) ?
N3 C15 H15A . . 117.7 ?
C11 C15 H15A . . 117.7 ?
C17 C16 C21 . . 120.3(3) ?
C17 C16 N4 . . 130.3(3) ?
C21 C16 N4 . . 109.3(3) ?
C18 C17 C16 . . 117.5(4) ?
C18 C17 H17A . . 121.3 ?
C16 C17 H17A . . 121.3 ?
C17 C18 C19 . . 121.2(4) ?
C17 C18 H18A . . 119.4 ?
C19 C18 H18A . . 119.4 ?
C20 C19 C18 . . 122.1(3) ?
C20 C19 H19A . . 119.0 ?
C18 C19 H19A . . 119.0 ?
C19 C20 C21 . . 116.6(4) ?
C19 C20 H20A . . 121.7 ?
C21 C20 H20A . . 121.7 ?
C20 C21 C16 . . 122.3(3) ?
C20 C21 N5 . . 131.9(3) ?
C16 C21 N5 . . 105.8(3) ?
N4 C22 N5 . . 112.7(3) ?
N4 C22 C23 . . 123.0(3) ?
N5 C22 C23 . . 124.4(3) ?
C22 C23 C24 . . 112.8(3) ?
C22 C23 H23A . . 109.0 ?
C24 C23 H23A . . 109.0 ?
C22 C23 H23B . . 109.0 ?
C24 C23 H23B . . 109.0 ?
H23A C23 H23B . . 107.8 ?
C23 C24 H24A . . 109.5 ?
C23 C24 H24B . . 109.5 ?
H24A C24 H24B . . 109.5 ?
C23 C24 H24C . . 109.5 ?
H24A C24 H24C . . 109.5 ?
H24B C24 H24C . . 109.5 ?
N5 C25 C26 . . 113.9(3) ?
N5 C25 H25A . . 108.8 ?
C26 C25 H25A . . 108.8 ?
N5 C25 H25B . . 108.8 ?
C26 C25 H25B . . 108.8 ?
H25A C25 H25B . . 107.7 ?
C30 C26 C27 . . 117.1(3) ?
C30 C26 C25 . . 122.5(3) ?
C27 C26 C25 . . 120.3(3) ?
C28 C27 C26 . . 119.7(4) ?
C28 C27 H27A . . 120.2 ?
C26 C27 H27A . . 120.2 ?
C27 C28 C29 . . 119.0(4) ?
C27 C28 H28A . . 120.5 ?
C29 C28 H28A . . 120.5 ?
N6 C29 C28 . . 122.7(4) ?
N6 C29 H29A . . 118.7 ?
C28 C29 H29A . . 118.7 ?
N6 C30 C26 . . 123.9(3) ?
N6 C30 H30A . . 118.1 ?
C26 C30 H30A . . 118.1 ?
O5 C31 H31A . . 109.5 ?
O5 C31 H31B . . 109.5 ?
H31A C31 H31B . . 109.5 ?
O5 C31 H31C . . 109.5 ?
H31A C31 H31C . . 109.5 ?
H31B C31 H31C . . 109.5 ?
O3 Cl1 O2 . . 114.3(3) ?
O3 Cl1 O4 . . 111.3(3) ?
O2 Cl1 O4 . . 109.9(2) ?
O3 Cl1 O1 . . 110.2(3) ?
O2 Cl1 O1 . . 106.2(3) ?
O4 Cl1 O1 . . 104.4(3) ?
C31 O5 H5B . . 101.2 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 N1 . 2.230(3) y
Ag1 N4 . 2.257(3) y
Ag1 N6 2_556 2.397(3) y
Ag1 N3 1_455 2.443(3) y
N1 C7 . 1.309(4) ?
N1 C1 . 1.393(4) ?
N2 C7 . 1.365(4) ?
N2 C6 . 1.386(4) ?
N2 C10 . 1.471(4) ?
N3 C15 . 1.330(5) ?
N3 C14 . 1.339(5) ?
N3 Ag1 1_655 2.443(3) ?
N4 C22 . 1.325(4) ?
N4 C16 . 1.397(4) ?
N5 C22 . 1.362(4) ?
N5 C21 . 1.400(4) ?
N5 C25 . 1.458(5) ?
N6 C29 . 1.330(5) ?
N6 C30 . 1.334(5) ?
N6 Ag1 2_556 2.397(3) ?
C1 C2 . 1.392(5) ?
C1 C6 . 1.399(4) ?
C2 C3 . 1.377(5) ?
C2 H2A . 0.9300 ?
C3 C4 . 1.390(6) ?
C3 H3A . 0.9300 ?
C4 C5 . 1.377(5) ?
C4 H4A . 0.9300 ?
C5 C6 . 1.393(5) ?
C5 H5A . 0.9300 ?
C7 C8 . 1.485(5) ?
C8 C9 . 1.503(7) ?
C8 H8A . 0.9700 ?
C8 H8B . 0.9700 ?
C9 H9A . 0.9600 ?
C9 H9B . 0.9600 ?
C9 H9C . 0.9600 ?
C10 C11 . 1.511(5) ?
C10 H10A . 0.9700 ?
C10 H10B . 0.9700 ?
C11 C12 . 1.378(6) ?
C11 C15 . 1.390(5) ?
C12 C13 . 1.388(6) ?
C12 H12A . 0.9300 ?
C13 C14 . 1.369(6) ?
C13 H13A . 0.9300 ?
C14 H14A . 0.9300 ?
C15 H15A . 0.9300 ?
C16 C17 . 1.388(5) ?
C16 C21 . 1.393(5) ?
C17 C18 . 1.384(5) ?
C17 H17A . 0.9300 ?
C18 C19 . 1.388(6) ?
C18 H18A . 0.9300 ?
C19 C20 . 1.373(6) ?
C19 H19A . 0.9300 ?
C20 C21 . 1.384(5) ?
C20 H20A . 0.9300 ?
C22 C23 . 1.494(5) ?
C23 C24 . 1.501(6) ?
C23 H23A . 0.9700 ?
C23 H23B . 0.9700 ?
C24 H24A . 0.9600 ?
C24 H24B . 0.9600 ?
C24 H24C . 0.9600 ?
C25 C26 . 1.509(5) ?
C25 H25A . 0.9700 ?
C25 H25B . 0.9700 ?
C26 C30 . 1.376(5) ?
C26 C27 . 1.387(5) ?
C27 C28 . 1.366(6) ?
C27 H27A . 0.9300 ?
C28 C29 . 1.371(6) ?
C28 H28A . 0.9300 ?
C29 H29A . 0.9300 ?
C30 H30A . 0.9300 ?
C31 O5 . 1.494(9) ?
C31 H31A . 0.9600 ?
C31 H31B . 0.9600 ?
C31 H31C . 0.9600 ?
Cl1 O3 . 1.386(4) ?
Cl1 O2 . 1.402(3) ?
Cl1 O4 . 1.412(4) ?
Cl1 O1 . 1.434(5) ?
O5 H5B . 0.8500 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
O5 H5B O1 1_655 0.85 2.50 3.275(13) 153
C10 H10A O3 . 0.97 2.58 3.550(7) 174
C23 H23A O4 2_666 0.97 2.55 3.481(6) 160
C31 H31C O3 2_665 0.96 2.43 3.343(17) 159
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_site_symmetry_1
_geom_torsion
N4 Ag1 N1 C7 . -118.2(3)
N6 Ag1 N1 C7 2_556 123.3(3)
N3 Ag1 N1 C7 1_455 17.9(3)
N4 Ag1 N1 C1 . 78.5(3)
N6 Ag1 N1 C1 2_556 -40.0(3)
N3 Ag1 N1 C1 1_455 -145.4(3)
N1 Ag1 N4 C22 . 5.6(3)
N6 Ag1 N4 C22 2_556 122.4(3)
N3 Ag1 N4 C22 1_455 -135.4(3)
N1 Ag1 N4 C16 . 171.5(2)
N6 Ag1 N4 C16 2_556 -71.7(3)
N3 Ag1 N4 C16 1_455 30.5(3)
C7 N1 C1 C2 . -177.5(4)
Ag1 N1 C1 C2 . -11.3(5)
C7 N1 C1 C6 . 0.1(4)
Ag1 N1 C1 C6 . 166.3(2)
N1 C1 C2 C3 . 177.4(3)
C6 C1 C2 C3 . 0.1(5)
C1 C2 C3 C4 . -0.2(6)
C2 C3 C4 C5 . 0.2(6)
C3 C4 C5 C6 . -0.1(6)
C7 N2 C6 C5 . 177.2(4)
C10 N2 C6 C5 . -1.1(6)
C7 N2 C6 C1 . -0.9(3)
C10 N2 C6 C1 . -179.2(3)
C4 C5 C6 N2 . -177.9(3)
C4 C5 C6 C1 . 0.0(5)
C2 C1 C6 N2 . 178.4(3)
N1 C1 C6 N2 . 0.5(4)
C2 C1 C6 C5 . 0.1(5)
N1 C1 C6 C5 . -177.8(3)
C1 N1 C7 N2 . -0.7(4)
Ag1 N1 C7 N2 . -166.5(2)
C1 N1 C7 C8 . 179.8(3)
Ag1 N1 C7 C8 . 14.0(5)
C6 N2 C7 N1 . 1.0(4)
C10 N2 C7 N1 . 179.2(3)
C6 N2 C7 C8 . -179.4(3)
C10 N2 C7 C8 . -1.3(6)
N1 C7 C8 C9 . 69.7(5)
N2 C7 C8 C9 . -109.8(4)
C7 N2 C10 C11 . 92.2(4)
C6 N2 C10 C11 . -89.9(4)
N2 C10 C11 C12 . -92.2(4)
N2 C10 C11 C15 . 87.4(4)
C15 C11 C12 C13 . -2.1(6)
C10 C11 C12 C13 . 177.5(4)
C11 C12 C13 C14 . 1.1(7)
C15 N3 C14 C13 . -0.3(6)
Ag1 N3 C14 C13 1_655 -158.6(4)
C12 C13 C14 N3 . 0.1(8)
C14 N3 C15 C11 . -0.9(6)
Ag1 N3 C15 C11 1_655 158.6(3)
C12 C11 C15 N3 . 2.1(5)
C10 C11 C15 N3 . -177.5(3)
C22 N4 C16 C17 . -179.7(4)
Ag1 N4 C16 C17 . 12.2(5)
C22 N4 C16 C21 . 1.1(4)
Ag1 N4 C16 C21 . -167.1(2)
C21 C16 C17 C18 . 0.6(6)
N4 C16 C17 C18 . -178.6(4)
C16 C17 C18 C19 . 0.6(6)
C17 C18 C19 C20 . -1.4(7)
C18 C19 C20 C21 . 0.9(6)
C19 C20 C21 C16 . 0.4(5)
C19 C20 C21 N5 . 179.3(4)
C17 C16 C21 C20 . -1.2(5)
N4 C16 C21 C20 . 178.2(3)
C17 C16 C21 N5 . 179.7(3)
N4 C16 C21 N5 . -0.9(4)
C22 N5 C21 C20 . -178.6(4)
C25 N5 C21 C20 . -0.8(6)
C22 N5 C21 C16 . 0.4(3)
C25 N5 C21 C16 . 178.2(3)
C16 N4 C22 N5 . -0.8(4)
Ag1 N4 C22 N5 . 167.6(2)
C16 N4 C22 C23 . 177.5(3)
Ag1 N4 C22 C23 . -14.1(5)
C21 N5 C22 N4 . 0.2(4)
C25 N5 C22 N4 . -177.4(3)
C21 N5 C22 C23 . -178.0(3)
C25 N5 C22 C23 . 4.3(5)
N4 C22 C23 C24 . -85.9(5)
N5 C22 C23 C24 . 92.2(5)
C22 N5 C25 C26 . -113.3(4)
C21 N5 C25 C26 . 69.5(4)
N5 C25 C26 C30 . 29.7(5)
N5 C25 C26 C27 . -153.4(4)
C30 C26 C27 C28 . -1.0(6)
C25 C26 C27 C28 . -178.0(4)
C26 C27 C28 C29 . 0.5(7)
C30 N6 C29 C28 . -0.2(6)
Ag1 N6 C29 C28 2_556 -164.5(4)
C27 C28 C29 N6 . 0.2(8)
C29 N6 C30 C26 . -0.4(5)
Ag1 N6 C30 C26 2_556 164.1(3)
C27 C26 C30 N6 . 1.0(5)
C25 C26 C30 N6 . 177.9(3)
