#------------------------------------------------------------------------------
#$Date: 2016-02-16 02:10:39 +0100 (mar 16 de feb de 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/48/7214848.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_7214848
loop_
_publ_author_name
'Cheng, Lin'
'Zhang, Limin'
'Cao, Qingna'
'Gou, Shaohua'
'Zhang, Xiuying'
'Fang, Lei'
_publ_section_title
;
 Temperature-induced chiral Ag(i) coordination polymers with structural
 variation from 1D to 2D: synthesis, luminescence and SHG response
;
_journal_issue                   21
_journal_name_full               CrystEngComm
_journal_page_first              7502
_journal_paper_doi               10.1039/c2ce26198g
_journal_volume                  14
_journal_year                    2012
_chemical_formula_sum            'C36 H48 Ag2.5 Cl2.5 N8 O10'
_chemical_formula_weight         1111.12
_chemical_name_systematic
;
?
;
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 111.7460(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   23.966(3)
_cell_length_b                   15.116(2)
_cell_length_c                   13.0659(18)
_cell_measurement_temperature    173(2)
_cell_volume                     4396.5(10)
_computing_cell_refinement       'SMART (Bruker, 2000)'
_computing_data_collection       'SMART (Bruker, 2000)'
_computing_data_reduction        'SAINT (Bruker, 2000)'
_computing_molecular_graphics
;
ORTEPIII (Burnett & Johnson, 1996); ORTEP-3 for Windows (Farrugia, 1997);
PLATON (Spek, 2009)
;
_computing_publication_material  'SHELXTL (Bruker, 2000)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXTL (Bruker, 2000)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.956
_diffrn_measured_fraction_theta_max 0.956
_diffrn_measurement_device_type  'Bruker SMART APEX CCD'
_diffrn_measurement_method       'φ and 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  0.0359
_diffrn_reflns_av_sigmaI/netI    0.0568
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            13341
_diffrn_reflns_theta_full        25.05
_diffrn_reflns_theta_max         25.05
_diffrn_reflns_theta_min         2.08
_exptl_absorpt_coefficient_mu    1.321
_exptl_absorpt_correction_T_max  0.7251
_exptl_absorpt_correction_T_min  0.6772
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.679
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2240
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.26
_refine_diff_density_max         5.607
_refine_diff_density_min         -1.883
_refine_diff_density_rms         0.207
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   -0.04(13)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.078
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     502
_refine_ls_number_reflns         6451
_refine_ls_number_restraints     31
_refine_ls_restrained_S_all      1.910
_refine_ls_R_factor_all          0.0935
_refine_ls_R_factor_gt           0.0821
_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)+(0.0055P)²+188.9285P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1730
_refine_ls_wR_factor_ref         0.1815
_reflns_number_gt                5641
_reflns_number_total             6451
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2ce26198g.txt
_cod_data_source_block           4
_cod_original_cell_volume        4396.5(11)
_cod_original_sg_symbol_H-M      C2
_cod_original_formula_sum        'C36 H48 Ag2.50 Cl2.50 N8 O10'
_cod_database_code               7214848
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -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 -0.29138(8) 0.70956(18) 0.41004(16) 0.0345(5) Uani 1 1 d .
Ag2 Ag -0.26807(9) 0.79112(18) 0.20924(18) 0.0382(6) Uani 1 1 d .
Ag3 Ag -0.5000 0.5132(3) 0.5000 0.0648(12) Uani 1 2 d S
C1 C -0.2413(13) 0.597(2) 0.178(2) 0.042(7) Uani 1 1 d .
H1A H -0.2739 0.6082 0.1104 0.050 Uiso 1 1 calc R
C2 C -0.2163(16) 0.517(2) 0.192(3) 0.075(13) Uani 1 1 d .
H2A H -0.2373 0.4690 0.1471 0.089 Uiso 1 1 calc R
C3 C -0.1614(17) 0.504(2) 0.270(3) 0.055(9) Uani 1 1 d .
H3A H -0.1377 0.4535 0.2685 0.066 Uiso 1 1 calc R
C4 C -0.1411(12) 0.569(2) 0.354(2) 0.042(7) Uani 1 1 d .
H4A H -0.1064 0.5584 0.4184 0.050 Uiso 1 1 calc R
C5 C -0.1732(12) 0.6481(18) 0.340(3) 0.036(7) Uani 1 1 d .
C6 C -0.1539(10) 0.7209(19) 0.427(2) 0.029(6) Uani 1 1 d .
H6A H -0.1101 0.7175 0.4701 0.035 Uiso 1 1 calc R
H6B H -0.1633 0.7799 0.3922 0.035 Uiso 1 1 calc R
C7 C -0.1682(10) 0.7705(17) 0.593(2) 0.027(6) Uani 1 1 d .
H7A H -0.1674 0.8308 0.5617 0.033 Uiso 1 1 calc R
C8 C -0.1049(12) 0.750(2) 0.682(2) 0.046(8) Uani 1 1 d .
H8A H -0.1063 0.6922 0.7173 0.055 Uiso 1 1 calc R
H8B H -0.0750 0.7453 0.6468 0.055 Uiso 1 1 calc R
C9 C -0.0855(14) 0.821(3) 0.770(3) 0.060(10) Uani 1 1 d .
H9A H -0.0443 0.8087 0.8223 0.072 Uiso 1 1 calc R
H9B H -0.0852 0.8792 0.7348 0.072 Uiso 1 1 calc R
C10 C -0.1270(13) 0.825(2) 0.830(3) 0.052(8) Uani 1 1 d .
H10A H -0.1160 0.8754 0.8818 0.063 Uiso 1 1 calc R
H10B H -0.1231 0.7700 0.8733 0.063 Uiso 1 1 calc R
C11 C -0.1928(14) 0.835(2) 0.750(2) 0.050(8) Uani 1 1 d .
H11A H -0.2195 0.8285 0.7914 0.060 Uiso 1 1 calc R
H11B H -0.1983 0.8961 0.7191 0.060 Uiso 1 1 calc R
C12 C -0.2119(11) 0.7713(18) 0.656(2) 0.033(7) Uani 1 1 d .
H12A H -0.2100 0.7111 0.6890 0.040 Uiso 1 1 calc R
C13 C -0.3196(11) 0.765(2) 0.628(2) 0.036(7) Uani 1 1 d .
H13A H -0.3057 0.7137 0.6780 0.044 Uiso 1 1 calc R
H13B H -0.3235 0.8162 0.6714 0.044 Uiso 1 1 calc R
C14 C -0.3779(12) 0.745(2) 0.544(2) 0.040(7) Uani 1 1 d .
C15 C -0.4177(13) 0.812(2) 0.481(2) 0.042(8) Uani 1 1 d .
H15A H -0.4079 0.8726 0.4944 0.051 Uiso 1 1 calc R
C16 C -0.4716(12) 0.786(3) 0.398(2) 0.048(8) Uani 1 1 d .
H16A H -0.4969 0.8278 0.3482 0.058 Uiso 1 1 calc R
C17 C -0.4867(14) 0.701(3) 0.389(3) 0.053(9) Uani 1 1 d .
H17A H -0.5253 0.6863 0.3369 0.063 Uiso 1 1 calc R
C18 C -0.3984(12) 0.658(2) 0.524(2) 0.038(7) Uani 1 1 d .
H18A H -0.3727 0.6122 0.5657 0.046 Uiso 1 1 calc R
C19 C -0.3943(13) 0.5959(19) 0.253(2) 0.040(7) Uani 1 1 d .
H19A H -0.3664 0.5511 0.2905 0.048 Uiso 1 1 calc R
C20 C -0.4516(13) 0.5700(19) 0.184(2) 0.041(7) Uani 1 1 d .
H20A H -0.4627 0.5094 0.1759 0.049 Uiso 1 1 calc R
C21 C -0.4894(12) 0.631(2) 0.132(2) 0.040(7) Uani 1 1 d .
H21A H -0.5288 0.6146 0.0844 0.048 Uiso 1 1 calc R
C22 C -0.4737(9) 0.718(2) 0.1439(19) 0.032(6) Uani 1 1 d .
H22A H -0.5020 0.7624 0.1064 0.038 Uiso 1 1 calc R
C23 C -0.4145(11) 0.7412(19) 0.213(2) 0.030(6) Uani 1 1 d .
C24 C -0.3948(11) 0.8377(18) 0.227(2) 0.030(6) Uani 1 1 d .
H24A H -0.4303 0.8770 0.2082 0.036 Uiso 1 1 calc R
H24B H -0.3684 0.8493 0.3048 0.036 Uiso 1 1 calc R
C25 C -0.3586(11) 0.9503(18) 0.133(2) 0.030(6) Uani 1 1 d .
H25A H -0.3483 0.9817 0.2052 0.036 Uiso 1 1 calc R
C26 C -0.4193(11) 0.9889(19) 0.052(2) 0.038(7) Uani 1 1 d .
H26A H -0.4307 0.9569 -0.0192 0.045 Uiso 1 1 calc R
H26B H -0.4508 0.9775 0.0820 0.045 Uiso 1 1 calc R
C27 C -0.4178(13) 1.088(2) 0.030(3) 0.051(8) Uani 1 1 d .
H27A H -0.4566 1.1068 -0.0270 0.061 Uiso 1 1 calc R
H27B H -0.4118 1.1218 0.0979 0.061 Uiso 1 1 calc R
C28 C -0.3678(13) 1.108(2) -0.010(3) 0.049(9) Uani 1 1 d .
H28A H -0.3645 1.1731 -0.0163 0.059 Uiso 1 1 calc R
H28B H -0.3774 1.0821 -0.0838 0.059 Uiso 1 1 calc R
C29 C -0.3086(12) 1.0724(19) 0.067(2) 0.037(7) Uani 1 1 d .
H29A H -0.2772 1.0865 0.0372 0.044 Uiso 1 1 calc R
H29B H -0.2975 1.1019 0.1395 0.044 Uiso 1 1 calc R
C30 C -0.3103(12) 0.978(2) 0.082(2) 0.041(8) Uani 1 1 d .
H30A H -0.3217 0.9490 0.0080 0.050 Uiso 1 1 calc R
C31 C -0.2047(12) 0.941(2) 0.111(2) 0.038(7) Uani 1 1 d .
H31A H -0.1992 1.0036 0.0941 0.046 Uiso 1 1 calc R
H31B H -0.2168 0.9066 0.0422 0.046 Uiso 1 1 calc R
C32 C -0.1458(11) 0.9049(18) 0.194(2) 0.027(6) Uani 1 1 d .
C33 C -0.1295(13) 0.8168(19) 0.184(2) 0.040(7) Uani 1 1 d .
H33A H -0.1541 0.7794 0.1267 0.047 Uiso 1 1 calc R
C34 C -0.0754(13) 0.787(2) 0.263(3) 0.051(8) Uani 1 1 d .
H34A H -0.0625 0.7279 0.2595 0.062 Uiso 1 1 calc R
C35 C -0.0409(11) 0.843(2) 0.344(3) 0.050(9) Uani 1 1 d .
H35A H -0.0046 0.8203 0.3967 0.060 Uiso 1 1 calc R
C36 C -0.1077(11) 0.958(2) 0.275(2) 0.036(7) Uani 1 1 d .
H36A H -0.1176 1.0182 0.2761 0.044 Uiso 1 1 calc R
N1 N -0.2238(8) 0.6619(15) 0.2507(17) 0.029(5) Uani 1 1 d .
N2 N -0.1883(8) 0.7062(17) 0.5017(15) 0.030(5) Uani 1 1 d .
H2B H -0.1792 0.6546 0.5308 0.036 Uiso 1 1 d R
N3 N -0.2749(8) 0.7848(17) 0.5788(15) 0.029(5) Uani 1 1 d .
H3B H -0.2784 0.8403 0.5632 0.035 Uiso 1 1 d R
N4 N -0.4527(10) 0.6335(18) 0.448(2) 0.046(7) Uani 1 1 d .
N5 N -0.3764(9) 0.6793(14) 0.2694(16) 0.028(5) Uani 1 1 d .
N6 N -0.3620(9) 0.8548(15) 0.1532(18) 0.030(5) Uani 1 1 d .
H6C H -0.3828 0.8313 0.0907 0.036 Uiso 1 1 d R
N7 N -0.2522(9) 0.9352(15) 0.1592(17) 0.029(5) Uani 1 1 d .
H7B H -0.2405 0.9663 0.2186 0.035 Uiso 1 1 d R
N8 N -0.0551(9) 0.9262(17) 0.354(2) 0.043(6) Uani 1 1 d .
Cl1 Cl -0.3479(3) 0.7391(5) -0.0998(6) 0.0407(17) Uani 1 1 d D
O1 O -0.3838(11) 0.8138(13) -0.155(2) 0.092(9) Uani 1 1 d D
O2 O -0.3560(11) 0.6692(12) -0.1783(16) 0.067(7) Uani 1 1 d D
O3 O -0.2859(7) 0.7646(19) -0.052(2) 0.099(11) Uani 1 1 d D
O4 O -0.3672(10) 0.7089(18) -0.0141(14) 0.069(7) Uani 1 1 d D
Cl2 Cl -0.0165(5) 0.5420(8) 0.6499(10) 0.090(2) Uani 1 1 d D
O5 O -0.0082(13) 0.6270(13) 0.610(2) 0.090(2) Uani 1 1 d D
O6 O -0.0782(8) 0.527(2) 0.638(2) 0.090(2) Uani 1 1 d D
O7 O -0.0024(12) 0.4805(16) 0.5786(19) 0.090(2) Uani 1 1 d D
O8 O 0.0213(11) 0.5250(19) 0.7602(14) 0.090(2) Uani 1 1 d D
Cl3 Cl -0.2642(10) 0.4908(13) 0.5521(17) 0.090(2) Uani 0.50 1 d PD
O9 O -0.2326(19) 0.411(2) 0.597(3) 0.090(2) Uani 0.50 1 d PD
O10 O -0.250(2) 0.562(2) 0.630(3) 0.090(2) Uani 0.50 1 d PD
O11 O -0.257(2) 0.516(3) 0.452(2) 0.090(2) Uani 0.50 1 d PD
O12 O -0.3281(11) 0.472(3) 0.523(3) 0.090(2) Uani 0.50 1 d PD
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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
N5 Ag1 N2 153.9(7) . .
N5 Ag1 N3 130.5(7) . .
N2 Ag1 N3 75.6(6) . .
N5 Ag1 Ag2 77.4(5) . .
N2 Ag1 Ag2 87.4(5) . .
N3 Ag1 Ag2 124.6(6) . .
N1 Ag2 N6 141.0(8) . .
N1 Ag2 N7 141.5(7) . .
N6 Ag2 N7 76.3(7) . .
N1 Ag2 Ag1 70.3(5) . .
N6 Ag2 Ag1 88.5(5) . .
N7 Ag2 Ag1 134.2(5) . .
N8 Ag3 N8 109.9(13) 3_445 4_446
N8 Ag3 N4 112.9(9) 3_445 .
N8 Ag3 N4 119.4(8) 4_446 .
N8 Ag3 N4 119.4(8) 3_445 2_456
N8 Ag3 N4 112.9(9) 4_446 2_456
N4 Ag3 N4 80.0(12) . 2_456
N1 C1 C2 124(3) . .
N1 C1 H1A 117.8 . .
C2 C1 H1A 117.8 . .
C1 C2 C3 120(3) . .
C1 C2 H2A 119.8 . .
C3 C2 H2A 119.8 . .
C2 C3 C4 116(3) . .
C2 C3 H3A 121.9 . .
C4 C3 H3A 121.9 . .
C5 C4 C3 118(3) . .
C5 C4 H4A 120.8 . .
C3 C4 H4A 120.8 . .
N1 C5 C4 121(3) . .
N1 C5 C6 117(2) . .
C4 C5 C6 121(3) . .
N2 C6 C5 107(2) . .
N2 C6 H6A 110.4 . .
C5 C6 H6A 110.4 . .
N2 C6 H6B 110.4 . .
C5 C6 H6B 110.4 . .
H6A C6 H6B 108.6 . .
N2 C7 C12 110.7(19) . .
N2 C7 C8 114(2) . .
C12 C7 C8 105(2) . .
N2 C7 H7A 109.0 . .
C12 C7 H7A 109.0 . .
C8 C7 H7A 109.0 . .
C9 C8 C7 111(3) . .
C9 C8 H8A 109.4 . .
C7 C8 H8A 109.4 . .
C9 C8 H8B 109.4 . .
C7 C8 H8B 109.4 . .
H8A C8 H8B 108.0 . .
C10 C9 C8 110(3) . .
C10 C9 H9A 109.6 . .
C8 C9 H9A 109.6 . .
C10 C9 H9B 109.6 . .
C8 C9 H9B 109.6 . .
H9A C9 H9B 108.1 . .
C9 C10 C11 111(3) . .
C9 C10 H10A 109.4 . .
C11 C10 H10A 109.4 . .
C9 C10 H10B 109.4 . .
C11 C10 H10B 109.4 . .
H10A C10 H10B 108.0 . .
C12 C11 C10 115(3) . .
C12 C11 H11A 108.6 . .
C10 C11 H11A 108.6 . .
C12 C11 H11B 108.6 . .
C10 C11 H11B 108.6 . .
H11A C11 H11B 107.6 . .
N3 C12 C11 113(2) . .
N3 C12 C7 111(2) . .
C11 C12 C7 112(2) . .
N3 C12 H12A 106.8 . .
C11 C12 H12A 106.8 . .
C7 C12 H12A 106.8 . .
C14 C13 N3 112(2) . .
C14 C13 H13A 109.3 . .
N3 C13 H13A 109.3 . .
C14 C13 H13B 109.3 . .
N3 C13 H13B 109.3 . .
H13A C13 H13B 107.9 . .
C18 C14 C15 117(3) . .
C18 C14 C13 121(3) . .
C15 C14 C13 122(3) . .
C16 C15 C14 118(3) . .
C16 C15 H15A 120.8 . .
C14 C15 H15A 120.8 . .
C17 C16 C15 119(3) . .
C17 C16 H16A 120.6 . .
C15 C16 H16A 120.6 . .
C16 C17 N4 126(3) . .
C16 C17 H17A 116.8 . .
N4 C17 H17A 116.8 . .
N4 C18 C14 124(3) . .
N4 C18 H18A 117.8 . .
C14 C18 H18A 117.8 . .
N5 C19 C20 124(3) . .
N5 C19 H19A 118.1 . .
C20 C19 H19A 118.1 . .
C21 C20 C19 118(3) . .
C21 C20 H20A 120.9 . .
C19 C20 H20A 120.9 . .
C20 C21 C22 121(3) . .
C20 C21 H21A 119.4 . .
C22 C21 H21A 119.4 . .
C21 C22 C23 119(3) . .
C21 C22 H22A 120.7 . .
C23 C22 H22A 120.7 . .
N5 C23 C22 120(3) . .
N5 C23 C24 119(2) . .
C22 C23 C24 120(2) . .
N6 C24 C23 108(2) . .
N6 C24 H24A 110.2 . .
C23 C24 H24A 110.2 . .
N6 C24 H24B 110.2 . .
C23 C24 H24B 110.2 . .
H24A C24 H24B 108.5 . .
N6 C25 C26 113(2) . .
N6 C25 C30 115(2) . .
C26 C25 C30 105(2) . .
N6 C25 H25A 107.9 . .
C26 C25 H25A 107.9 . .
C30 C25 H25A 107.9 . .
C27 C26 C25 114(2) . .
C27 C26 H26A 108.7 . .
C25 C26 H26A 108.7 . .
C27 C26 H26B 108.7 . .
C25 C26 H26B 108.7 . .
H26A C26 H26B 107.6 . .
C28 C27 C26 110(2) . .
C28 C27 H27A 109.7 . .
C26 C27 H27A 109.7 . .
C28 C27 H27B 109.7 . .
C26 C27 H27B 109.7 . .
H27A C27 H27B 108.2 . .
C27 C28 C29 112(3) . .
C27 C28 H28A 109.2 . .
C29 C28 H28A 109.2 . .
C27 C28 H28B 109.2 . .
C29 C28 H28B 109.2 . .
H28A C28 H28B 107.9 . .
C30 C29 C28 112(2) . .
C30 C29 H29A 109.2 . .
C28 C29 H29A 109.2 . .
C30 C29 H29B 109.2 . .
C28 C29 H29B 109.2 . .
H29A C29 H29B 107.9 . .
C29 C30 N7 116(2) . .
C29 C30 C25 112(2) . .
N7 C30 C25 104(2) . .
C29 C30 H30A 108.2 . .
N7 C30 H30A 108.2 . .
C25 C30 H30A 108.2 . .
N7 C31 C32 109(2) . .
N7 C31 H31A 109.8 . .
C32 C31 H31A 109.8 . .
N7 C31 H31B 109.8 . .
C32 C31 H31B 109.8 . .
H31A C31 H31B 108.3 . .
C36 C32 C33 120(3) . .
C36 C32 C31 121(3) . .
C33 C32 C31 119(2) . .
C34 C33 C32 117(3) . .
C34 C33 H33A 121.6 . .
C32 C33 H33A 121.6 . .
C35 C34 C33 120(3) . .
C35 C34 H34A 120.0 . .
C33 C34 H34A 120.0 . .
N8 C35 C34 124(3) . .
N8 C35 H35A 118.0 . .
C34 C35 H35A 118.0 . .
C32 C36 N8 123(3) . .
C32 C36 H36A 118.6 . .
N8 C36 H36A 118.6 . .
C1 N1 C5 117(2) . .
C1 N1 Ag2 119.1(19) . .
C5 N1 Ag2 123.2(18) . .
C7 N2 C6 109(2) . .
C7 N2 Ag1 111.8(14) . .
C6 N2 Ag1 113.5(13) . .
C7 N2 H2B 106.8 . .
C6 N2 H2B 108.1 . .
Ag1 N2 H2B 107.1 . .
C13 N3 C12 113.5(19) . .
C13 N3 Ag1 114.0(16) . .
C12 N3 Ag1 110.0(14) . .
C13 N3 H3B 106.3 . .
C12 N3 H3B 106.3 . .
Ag1 N3 H3B 106.1 . .
C17 N4 C18 115(3) . .
C17 N4 Ag3 119.3(18) . .
C18 N4 Ag3 115(2) . .
C23 N5 C19 118(2) . .
C23 N5 Ag1 123.0(18) . .
C19 N5 Ag1 118.2(18) . .
C25 N6 C24 111.4(19) . .
C25 N6 Ag2 110.8(14) . .
C24 N6 Ag2 114.4(16) . .
C25 N6 H6C 106.6 . .
C24 N6 H6C 106.7 . .
Ag2 N6 H6C 106.5 . .
C31 N7 C30 110(2) . .
C31 N7 Ag2 113.6(17) . .
C30 N7 Ag2 111.9(16) . .
C31 N7 H7B 107.4 . .
C30 N7 H7B 106.3 . .
Ag2 N7 H7B 106.8 . .
C35 N8 C36 117(2) . .
C35 N8 Ag3 122.6(19) . 3
C36 N8 Ag3 120.8(19) . 3
O3 Cl1 O4 109.1(14) . .
O3 Cl1 O2 110.7(14) . .
O4 Cl1 O2 109.0(13) . .
O3 Cl1 O1 109.8(15) . .
O4 Cl1 O1 109.3(15) . .
O2 Cl1 O1 108.9(13) . .
O8 Cl2 O5 114.4(16) . .
O8 Cl2 O7 109.1(15) . .
O5 Cl2 O7 104.3(15) . .
O8 Cl2 O6 109.2(16) . .
O5 Cl2 O6 112.0(19) . .
O7 Cl2 O6 107.6(16) . .
O9 Cl3 O10 112.6(12) . .
O9 Cl3 O11 112.1(12) . .
O10 Cl3 O11 111.9(12) . .
O9 Cl3 O12 106.7(12) . .
O10 Cl3 O12 106.6(12) . .
O11 Cl3 O12 106.4(12) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N5 2.23(2) .
Ag1 N2 2.313(19) .
Ag1 N3 2.38(2) .
Ag1 Ag2 3.131(3) .
Ag2 N1 2.19(2) .
Ag2 N6 2.30(2) .
Ag2 N7 2.35(2) .
Ag3 N8 2.29(2) 3_445
Ag3 N8 2.29(2) 4_446
Ag3 N4 2.37(3) .
Ag3 N4 2.37(3) 2_456
C1 N1 1.32(4) .
C1 C2 1.33(4) .
C1 H1A 0.9500 .
C2 C3 1.35(5) .
C2 H2A 0.9500 .
C3 C4 1.42(4) .
C3 H3A 0.9500 .
C4 C5 1.40(4) .
C4 H4A 0.9500 .
C5 N1 1.35(4) .
C5 C6 1.53(4) .
C6 N2 1.50(3) .
C6 H6A 0.9900 .
C6 H6B 0.9900 .
C7 N2 1.47(3) .
C7 C12 1.56(3) .
C7 C8 1.57(4) .
C7 H7A 1.0000 .
C8 C9 1.51(4) .
C8 H8A 0.9900 .
C8 H8B 0.9900 .
C9 C10 1.48(4) .
C9 H9A 0.9900 .
C9 H9B 0.9900 .
C10 C11 1.54(4) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 C12 1.49(4) .
C11 H11A 0.9900 .
C11 H11B 0.9900 .
C12 N3 1.49(3) .
C12 H12A 1.0000 .
C13 C14 1.45(4) .
C13 N3 1.47(3) .
C13 H13A 0.9900 .
C13 H13B 0.9900 .
C14 C18 1.39(4) .
C14 C15 1.43(4) .
C15 C16 1.40(4) .
C15 H15A 0.9500 .
C16 C17 1.32(5) .
C16 H16A 0.9500 .
C17 N4 1.35(5) .
C17 H17A 0.9500 .
C18 N4 1.36(4) .
C18 H18A 0.9500 .
C19 N5 1.32(3) .
C19 C20 1.39(4) .
C19 H19A 0.9500 .
C20 C21 1.30(4) .
C20 H20A 0.9500 .
C21 C22 1.36(4) .
C21 H21A 0.9500 .
C22 C23 1.42(3) .
C22 H22A 0.9500 .
C23 N5 1.32(3) .
C23 C24 1.52(4) .
C24 N6 1.48(3) .
C24 H24A 0.9900 .
C24 H24B 0.9900 .
C25 N6 1.48(3) .
C25 C26 1.56(3) .
C25 C30 1.59(4) .
C25 H25A 1.0000 .
C26 C27 1.53(4) .
C26 H26A 0.9900 .
C26 H26B 0.9900 .
C27 C28 1.50(4) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C28 C29 1.50(4) .
C28 H28A 0.9900 .
C28 H28B 0.9900 .
C29 C30 1.45(4) .
C29 H29A 0.9900 .
C29 H29B 0.9900 .
C30 N7 1.53(4) .
C30 H30A 1.0000 .
C31 N7 1.49(3) .
C31 C32 1.53(4) .
C31 H31A 0.9900 .
C31 H31B 0.9900 .
C32 C36 1.36(4) .
C32 C33 1.41(4) .
C33 C34 1.40(4) .
C33 H33A 0.9500 .
C34 C35 1.37(5) .
C34 H34A 0.9500 .
C35 N8 1.33(4) .
C35 H35A 0.9500 .
C36 N8 1.39(3) .
C36 H36A 0.9500 .
N2 H2B 0.8600 .
N3 H3B 0.8600 .
N6 H6C 0.8600 .
N7 H7B 0.8600 .
N8 Ag3 2.29(2) 3
Cl1 O3 1.434(13) .
Cl1 O4 1.435(13) .
Cl1 O2 1.435(13) .
Cl1 O1 1.441(14) .
Cl2 O8 1.412(14) .
Cl2 O5 1.428(15) .
Cl2 O7 1.442(14) .
Cl2 O6 1.446(15) .
Cl3 O9 1.427(8) .
Cl3 O10 1.433(8) .
Cl3 O11 1.434(8) .
Cl3 O12 1.462(9) .
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
N3 H3B O9 0.86 2.45 3.05(5) 126.7 4_456
N6 H6C O4 0.86 2.41 3.07(3) 134.3 .
