#------------------------------------------------------------------------------
#$Date: 2019-11-28 15:41:55 +0200 (Thu, 28 Nov 2019) $
#$Revision: 244053 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/28/7702866.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_7702866
loop_
_publ_author_name
'Muthu, Sebastian'
'Yip, John H. K.'
'Vittal, Jagadese J.'
_publ_section_title
;
 Coordination networks of Ag(i) and N,N′-
 bis(3-pyridinecarboxamide)-1,6-hexane: structures and anion exchange
;
_journal_issue                   24
_journal_name_full               'J. Chem. Soc., Dalton Trans.'
_journal_page_first              4561
_journal_paper_doi               10.1039/B206680G
_journal_year                    2002
_chemical_formula_sum            'C54 H72 Ag2 Cl N12 O13.5'
_chemical_formula_weight         1356.43
_chemical_name_common            '[Ag2L3(OH)][ClO4].2.5H2O'
_space_group_IT_number           145
_space_group_name_Hall           'P 32'
_space_group_name_H-M_alt        'P 32'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32'
_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                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   15.1300(2)
_cell_length_b                   15.1300(2)
_cell_length_c                   22.1343(5)
_cell_measurement_reflns_used    6842
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      29.29
_cell_measurement_theta_min      1.55
_cell_volume                     4388.08(13)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_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      223(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.0286
_diffrn_reflns_av_sigmaI/netI    0.0445
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            27380
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.55
_exptl_absorpt_coefficient_mu    0.789
_exptl_absorpt_correction_T_max  0.8789
_exptl_absorpt_correction_T_min  0.7281
_exptl_absorpt_correction_type   'Sadabs, (Sheldrick 1996)'
_exptl_crystal_colour            Colourless
_exptl_crystal_density_diffrn    1.540
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'Needle, cut'
_exptl_crystal_F_000             2097
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.393
_refine_diff_density_min         -0.998
_refine_diff_density_rms         0.085
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.12(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.041
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     748
_refine_ls_number_reflns         12302
_refine_ls_number_restraints     7
_refine_ls_restrained_S_all      1.041
_refine_ls_R_factor_all          0.0790
_refine_ls_R_factor_gt           0.0608
_refine_ls_shift/su_max          0.012
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0638P)²+6.0246P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1359
_refine_ls_wR_factor_ref         0.1462
_reflns_number_gt                9835
_reflns_number_total             12302
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b206680g.txt
_cod_data_source_block           '[Ag2L3(OH)][ClO4].2.5H2O'
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Trigonal' was changed to
'trigonal' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/RSC/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      P3(2)
_cod_original_formula_sum        'C54 H72 Ag2 Cl N12 O13.50'
_cod_database_code               7702866
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z+2/3'
'-x+y, -x, z+1/3'
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 0.62300(4) 0.64491(4) 0.29385(3) 0.06269(17) Uani 1 1 d .
Ag2 Ag 0.99608(4) 0.30159(4) 1.04428(3) 0.05960(15) Uani 1 1 d .
O1 O 0.8759(5) 0.4439(4) 0.4450(3) 0.0728(16) Uani 1 1 d .
O2 O 0.7640(4) 0.5423(4) 0.9174(3) 0.0683(14) Uani 1 1 d .
O3 O 0.2035(4) 0.4208(6) 0.4765(3) 0.102(2) Uani 1 1 d .
O4 O 0.4727(4) 0.5415(6) 0.9289(3) 0.099(2) Uani 1 1 d .
O5 O 0.8791(5) 1.1261(5) 0.4049(3) 0.0909(19) Uani 1 1 d .
O6 O 0.8071(5) -0.1344(4) 0.8786(3) 0.0810(17) Uani 1 1 d .
O7 O 0.5713(7) 0.6114(5) 0.1847(3) 0.118(3) Uani 1 1 d .
H7A H 0.6225 0.6279 0.1635 0.177 Uiso 1 1 calc R
N1 N 0.7063(4) 0.5561(4) 0.3108(2) 0.0407(11) Uani 1 1 d .
N2 N 0.8480(4) 0.5684(4) 0.4789(2) 0.0460(12) Uani 1 1 d .
H2A H 0.8205 0.6058 0.4712 0.055 Uiso 1 1 calc R
N3 N 0.8305(5) 0.4577(5) 0.8693(3) 0.0552(15) Uani 1 1 d .
H3B H 0.8716 0.4332 0.8717 0.066 Uiso 1 1 calc R
N4 N 0.9374(4) 0.4147(3) 1.0386(2) 0.0400(11) Uani 1 1 d .
N5 N 0.4568(4) 0.5779(4) 0.3242(3) 0.0560(15) Uani 1 1 d .
N6 N 0.3659(4) 0.4905(5) 0.5076(3) 0.0669(18) Uani 1 1 d .
H6A H 0.4300 0.5238 0.4973 0.080 Uiso 1 1 calc R
N7 N 0.3232(5) 0.4868(7) 0.8830(3) 0.082(2) Uani 1 1 d .
H7B H 0.2579 0.4625 0.8872 0.098 Uiso 1 1 calc R
N8 N 0.7340(4) 0.8155(4) 0.2930(3) 0.0512(13) Uani 1 1 d .
N9 N 0.7754(5) 0.9823(5) 0.4561(3) 0.0610(16) Uani 1 1 d .
H9A H 0.7367 0.9164 0.4540 0.073 Uiso 1 1 calc R
N10 N 1.1687(5) 0.3697(4) 1.0486(3) 0.0597(15) Uani 1 1 d .
N11 N 0.8961(4) 0.1326(4) 1.0214(3) 0.0477(12) Uani 1 1 d .
N12 N 0.8919(5) 0.0267(4) 0.8434(3) 0.0570(15) Uani 1 1 d .
H12C H 0.9164 0.0911 0.8514 0.068 Uiso 1 1 calc R
C1 C 0.7260(5) 0.5101(5) 0.2651(3) 0.0505(16) Uani 1 1 d .
H1A H 0.7001 0.5110 0.2266 0.061 Uiso 1 1 calc R
C2 C 0.7812(6) 0.4625(6) 0.2712(3) 0.0550(18) Uani 1 1 d .
H2B H 0.7939 0.4324 0.2377 0.066 Uiso 1 1 calc R
C3 C 0.8190(5) 0.4588(5) 0.3283(3) 0.0509(16) Uani 1 1 d .
H3C H 0.8566 0.4253 0.3339 0.061 Uiso 1 1 calc R
C4 C 0.8000(5) 0.5054(5) 0.3763(3) 0.0394(12) Uani 1 1 d .
C5 C 0.7430(4) 0.5532(4) 0.3659(3) 0.0402(13) Uani 1 1 d .
H5A H 0.7295 0.5845 0.3985 0.048 Uiso 1 1 calc R
C6 C 0.8446(5) 0.5038(5) 0.4377(3) 0.0461(15) Uani 1 1 d .
C7 C 0.8978(5) 0.5781(5) 0.5380(3) 0.0510(15) Uani 1 1 d .
H7C H 0.9462 0.6504 0.5458 0.061 Uiso 1 1 calc R
H7D H 0.9367 0.5423 0.5361 0.061 Uiso 1 1 calc R
C8 C 0.8243(5) 0.5362(5) 0.5893(3) 0.0436(13) Uani 1 1 d .
H8A H 0.7734 0.4649 0.5810 0.052 Uiso 1 1 calc R
H8B H 0.7886 0.5750 0.5934 0.052 Uiso 1 1 calc R
C9 C 0.8804(5) 0.5426(5) 0.6485(3) 0.0422(14) Uani 1 1 d .
H9B H 0.9161 0.5038 0.6439 0.051 Uiso 1 1 calc R
H9C H 0.9319 0.6140 0.6562 0.051 Uiso 1 1 calc R
C10 C 0.8088(5) 0.5012(5) 0.7027(3) 0.0439(14) Uani 1 1 d .
H10A H 0.7567 0.4303 0.6944 0.053 Uiso 1 1 calc R
H10B H 0.7740 0.5407 0.7073 0.053 Uiso 1 1 calc R
C11 C 0.8619(5) 0.5048(5) 0.7621(3) 0.0471(15) Uani 1 1 d .
H11A H 0.9010 0.4696 0.7573 0.057 Uiso 1 1 calc R
H11B H 0.9094 0.5759 0.7731 0.057 Uiso 1 1 calc R
C12 C 0.7833(5) 0.4541(6) 0.8114(3) 0.0584(18) Uani 1 1 d .
H12A H 0.7431 0.4884 0.8151 0.070 Uiso 1 1 calc R
H12B H 0.7366 0.3827 0.8004 0.070 Uiso 1 1 calc R
C13 C 0.8137(5) 0.4963(5) 0.9179(3) 0.0448(14) Uani 1 1 d .
C14 C 0.9124(5) 0.4484(5) 1.0876(3) 0.0465(14) Uani 1 1 d .
H14A H 0.9314 0.4356 1.1257 0.056 Uiso 1 1 calc R
C15 C 0.8612(6) 0.5001(6) 1.0854(3) 0.0597(19) Uani 1 1 d .
H15A H 0.8473 0.5243 1.1212 0.072 Uiso 1 1 calc R
C16 C 0.8289(5) 0.5175(5) 1.0301(3) 0.0527(16) Uani 1 1 d .
H16A H 0.7919 0.5522 1.0279 0.063 Uiso 1 1 calc R
C17 C 0.8531(5) 0.4821(5) 0.9779(3) 0.0460(15) Uani 1 1 d .
C18 C 0.9079(4) 0.4324(4) 0.9848(3) 0.0404(13) Uani 1 1 d .
H18A H 0.9258 0.4096 0.9498 0.048 Uiso 1 1 calc R
C19 C 0.3823(7) 0.5511(6) 0.2831(4) 0.069(2) Uani 1 1 d .
H19A H 0.4000 0.5672 0.2423 0.082 Uiso 1 1 calc R
C20 C 0.2788(7) 0.4996(7) 0.2995(5) 0.078(3) Uani 1 1 d .
H20A H 0.2278 0.4825 0.2701 0.094 Uiso 1 1 calc R
C21 C 0.2535(6) 0.4752(6) 0.3582(5) 0.070(2) Uani 1 1 d .
H21A H 0.1845 0.4402 0.3697 0.084 Uiso 1 1 calc R
C22 C 0.3292(5) 0.5015(5) 0.4017(4) 0.062(2) Uani 1 1 d .
C23 C 0.4304(5) 0.5538(5) 0.3816(4) 0.062(2) Uani 1 1 d .
H23A H 0.4826 0.5729 0.4104 0.074 Uiso 1 1 calc R
C24 C 0.2984(6) 0.4703(6) 0.4663(4) 0.0584(19) Uani 1 1 d .
C25 C 0.3408(6) 0.4610(5) 0.5696(4) 0.070(2) Uani 1 1 d .
H25A H 0.3699 0.4183 0.5811 0.083 Uiso 1 1 calc R
H25B H 0.2665 0.4192 0.5732 0.083 Uiso 1 1 calc R
C26 C 0.3775(5) 0.5476(5) 0.6133(4) 0.062(2) Uani 1 1 d .
H26A H 0.3534 0.5938 0.6000 0.074 Uiso 1 1 calc R
H26B H 0.4523 0.5860 0.6127 0.074 Uiso 1 1 calc R
C27 C 0.3414(5) 0.5137(6) 0.6787(4) 0.069(3) Uani 1 1 d .
H27A H 0.2666 0.4769 0.6792 0.083 Uiso 1 1 calc R
H27B H 0.3634 0.4655 0.6911 0.083 Uiso 1 1 calc R
C28 C 0.3792(6) 0.5981(6) 0.7247(4) 0.080(2) Uani 1 1 d .
H28A H 0.3663 0.6509 0.7085 0.096 Uiso 1 1 calc R
H28B H 0.4535 0.6284 0.7274 0.096 Uiso 1 1 calc R
C29 C 0.3360(7) 0.5745(7) 0.7913(5) 0.082(3) Uani 1 1 d .
H29A H 0.3605 0.6387 0.8134 0.098 Uiso 1 1 calc R
H29B H 0.2613 0.5395 0.7902 0.098 Uiso 1 1 calc R
C30 C 0.3675(8) 0.5124(11) 0.8217(5) 0.105(4) Uani 1 1 d .
H30A H 0.4422 0.5486 0.8245 0.126 Uiso 1 1 calc R
H30B H 0.3456 0.4495 0.7987 0.126 Uiso 1 1 calc R
C31 C 0.3774(6) 0.4990(6) 0.9304(4) 0.064(2) Uani 1 1 d .
C32 C 0.7779(5) 0.8694(6) 0.2433(4) 0.0583(17) Uani 1 1 d .
H32A H 0.7680 0.8341 0.2067 0.070 Uiso 1 1 calc R
C33 C 0.8369(6) 0.9739(6) 0.2428(4) 0.067(2) Uani 1 1 d .
H33A H 0.8679 1.0086 0.2069 0.080 Uiso 1 1 calc R
C34 C 0.8501(6) 1.0268(6) 0.2951(4) 0.068(2) Uani 1 1 d .
H34A H 0.8874 1.0985 0.2946 0.082 Uiso 1 1 calc R
C35 C 0.8091(5) 0.9758(5) 0.3493(4) 0.0529(17) Uani 1 1 d .
C36 C 0.7503(5) 0.8682(5) 0.3447(3) 0.0522(16) Uani 1 1 d .
H36A H 0.7205 0.8310 0.3802 0.063 Uiso 1 1 calc R
C37 C 0.8253(6) 1.0335(6) 0.4060(4) 0.062(2) Uani 1 1 d .
C38 C 0.7832(7) 1.0324(6) 0.5136(4) 0.072(2) Uani 1 1 d .
H38A H 0.7151 1.0181 0.5262 0.086 Uiso 1 1 calc R
H38B H 0.8261 1.1064 0.5086 0.086 Uiso 1 1 calc R
C39 C 0.8277(5) 0.9970(5) 0.5620(3) 0.0520(16) Uani 1 1 d .
H39A H 0.7870 0.9225 0.5653 0.062 Uiso 1 1 calc R
H39B H 0.8972 1.0148 0.5505 0.062 Uiso 1 1 calc R
C40 C 0.8305(5) 1.0435(5) 0.6223(3) 0.0491(16) Uani 1 1 d .
H40A H 0.7615 1.0285 0.6328 0.059 Uiso 1 1 calc R
H40B H 0.8738 1.1178 0.6193 0.059 Uiso 1 1 calc R
C41 C 0.8704(5) 1.0049(5) 0.6718(3) 0.0489(16) Uani 1 1 d .
H41A H 0.9413 1.0248 0.6626 0.059 Uiso 1 1 calc R
H41B H 0.8306 0.9302 0.6723 0.059 Uiso 1 1 calc R
C42 C 0.8663(5) 1.0445(5) 0.7345(3) 0.0487(15) Uani 1 1 d .
H42A H 0.9101 1.1189 0.7356 0.058 Uiso 1 1 calc R
H42B H 0.7962 1.0282 0.7434 0.058 Uiso 1 1 calc R
C43 C 0.9017(5) 0.9963(5) 0.7821(3) 0.0571(17) Uani 1 1 d .
H43A H 0.8611 0.9218 0.7787 0.069 Uiso 1 1 calc R
H43B H 0.9732 1.0167 0.7746 0.069 Uiso 1 1 calc R
C44 C 1.2188(5) 0.4035(5) 0.9957(4) 0.0559(19) Uani 1 1 d .
H44A H 1.1800 0.3868 0.9601 0.067 Uiso 1 1 calc R
C45 C 1.3250(5) 0.4618(5) 0.9908(4) 0.0551(18) Uani 1 1 d .
C46 C 1.3819(6) 0.4854(6) 1.0432(5) 0.070(2) Uani 1 1 d .
H46A H 1.4535 0.5248 1.0418 0.085 Uiso 1 1 calc R
C47 C 1.3323(7) 0.4506(6) 1.0972(5) 0.076(3) Uani 1 1 d .
H47A H 1.3693 0.4646 1.1335 0.091 Uiso 1 1 calc R
C48 C 1.2290(6) 0.3957(5) 1.0975(4) 0.0628(19) Uani 1 1 d .
H48A H 1.1968 0.3738 1.1353 0.075 Uiso 1 1 calc R
C49 C 0.8474(5) 0.0629(6) 1.0647(3) 0.0523(16) Uani 1 1 d .
H49A H 0.8483 0.0851 1.1045 0.063 Uiso 1 1 calc R
C50 C 0.7952(6) -0.0426(6) 1.0525(4) 0.061(2) Uani 1 1 d .
H50A H 0.7613 -0.0901 1.0836 0.073 Uiso 1 1 calc R
C51 C 0.7945(5) -0.0742(5) 0.9953(3) 0.0545(18) Uani 1 1 d .
H51A H 0.7598 -0.1444 0.9864 0.065 Uiso 1 1 calc R
C52 C 0.8455(4) -0.0029(5) 0.9491(3) 0.0452(15) Uani 1 1 d .
C53 C 0.8947(4) 0.0988(5) 0.9650(3) 0.0414(14) Uani 1 1 d .
H53A H 0.9294 0.1475 0.9346 0.050 Uiso 1 1 calc R
C54 C 0.8463(5) -0.0420(5) 0.8874(3) 0.0487(15) Uani 1 1 d .
Cl1 Cl 0.66659(12) 0.68523(11) 0.51282(7) 0.0400(3) Uani 1 1 d .
O8 O 0.5909(3) 0.5791(3) 0.4982(2) 0.0551(12) Uani 1 1 d .
O9 O 0.6399(5) 0.7558(4) 0.4838(4) 0.100(2) Uani 1 1 d .
O10 O 0.7684(3) 0.7066(4) 0.4940(2) 0.0608(13) Uani 1 1 d .
O11 O 0.6720(4) 0.6974(5) 0.5804(2) 0.0775(17) Uani 1 1 d .
O1S O 0.9343(7) 0.2567(7) 1.1608(3) 0.109(2) Uani 1 1 d .
O2S O 0.6646(7) 0.6493(6) 0.9932(7) 0.170(5) Uani 1 1 d D
H2SA H 0.6765 0.6018 0.9774 0.050 Uiso 1 1 d RD
H2SB H 0.6369 0.6606 0.9602 0.050 Uiso 1 1 d RD
O3S O 0.7125(8) 0.6086(10) 0.1294(6) 0.086(4) Uani 0.50 1 d PD
H3SA H 0.6697 0.6170 0.1043 0.050 Uiso 0.50 1 d PRD
H3SB H 0.7710 0.6579 0.1125 0.050 Uiso 0.50 1 d PRD
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'
Ag Ag -0.8971 1.1015 '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'
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
N8 Ag1 N1 110.96(17) . .
N8 Ag1 N5 122.00(19) . .
N1 Ag1 N5 119.84(18) . .
N8 Ag1 O7 101.6(2) . .
N1 Ag1 O7 104.2(2) . .
N5 Ag1 O7 91.8(3) . .
N10 Ag2 N11 118.88(18) . .
N10 Ag2 N4 116.65(18) . .
N11 Ag2 N4 122.48(17) . .
C1 N1 C5 117.6(5) . .
C1 N1 Ag1 120.8(4) . .
C5 N1 Ag1 121.5(4) . .
C6 N2 C7 120.9(5) . .
C13 N3 C12 122.6(6) . .
C14 N4 C18 117.3(5) . .
C14 N4 Ag2 122.1(4) . .
C18 N4 Ag2 119.2(4) . .
C23 N5 C19 118.3(7) . .
C23 N5 Ag1 121.0(5) . .
C19 N5 Ag1 120.3(6) . .
C24 N6 C25 123.4(7) . .
C31 N7 C30 122.6(8) . .
C32 N8 C36 116.9(6) . .
C32 N8 Ag1 124.2(5) . .
C36 N8 Ag1 118.6(5) . .
C37 N9 C38 123.0(7) . .
C48 N10 C44 114.7(7) . .
C48 N10 Ag2 128.5(6) . .
C44 N10 Ag2 115.8(4) . .
C49 N11 C53 117.9(6) . .
C49 N11 Ag2 121.2(5) . .
C53 N11 Ag2 120.4(4) . .
C54 N12 C43 121.7(6) . 1_545
N1 C1 C2 123.7(6) . .
C1 C2 C3 119.0(6) . .
C4 C3 C2 118.6(6) . .
C3 C4 C5 118.6(6) . .
C3 C4 C6 118.0(6) . .
C5 C4 C6 123.4(5) . .
N1 C5 C4 122.4(5) . .
O1 C6 N2 124.8(7) . .
O1 C6 C4 118.0(6) . .
N2 C6 C4 117.2(5) . .
N2 C7 C8 113.3(5) . .
C7 C8 C9 110.5(5) . .
C10 C9 C8 112.8(5) . .
C9 C10 C11 114.2(5) . .
C12 C11 C10 109.8(5) . .
N3 C12 C11 111.7(6) . .
O2 C13 N3 123.0(6) . .
O2 C13 C17 118.3(6) . .
N3 C13 C17 118.7(6) . .
N4 C14 C15 123.2(6) . .
C14 C15 C16 120.0(6) . .
C15 C16 C17 118.1(6) . .
C18 C17 C16 117.6(6) . .
C18 C17 C13 124.1(6) . .
C16 C17 C13 118.3(6) . .
N4 C18 C17 123.8(6) . .
N5 C19 C20 121.9(9) . .
C21 C20 C19 118.9(8) . .
C20 C21 C22 120.5(8) . .
C21 C22 C23 116.9(9) . .
C21 C22 C24 119.1(7) . .
C23 C22 C24 124.0(7) . .
N5 C23 C22 123.6(7) . .
O3 C24 N6 123.1(8) . .
O3 C24 C22 115.8(7) . .
N6 C24 C22 121.0(7) . .
N6 C25 C26 115.0(6) . .
C25 C26 C27 113.6(6) . .
C28 C27 C26 115.5(6) . .
C27 C28 C29 120.0(7) . .
C30 C29 C28 110.7(8) . .
C29 C30 N7 110.5(9) . .
O4 C31 N7 122.5(9) . .
O4 C31 C45 118.1(7) . 1_455
N7 C31 C45 119.4(7) . 1_455
N8 C32 C33 123.3(7) . .
C34 C33 C32 119.3(8) . .
C33 C34 C35 120.8(8) . .
C34 C35 C36 115.2(7) . .
C34 C35 C37 120.5(7) . .
C36 C35 C37 124.3(7) . .
N8 C36 C35 124.5(7) . .
O5 C37 N9 122.5(8) . .
O5 C37 C35 118.7(8) . .
N9 C37 C35 118.7(6) . .
N9 C38 C39 111.9(6) . .
C40 C39 C38 112.3(6) . .
C39 C40 C41 112.9(5) . .
C40 C41 C42 114.1(5) . .
C43 C42 C41 110.4(5) . .
N12 C43 C42 112.0(5) 1_565 .
N10 C44 C45 124.0(7) . .
C46 C45 C44 117.9(8) . .
C46 C45 C31 120.2(7) . 1_655
C44 C45 C31 121.9(7) . 1_655
C47 C46 C45 118.9(8) . .
C48 C47 C46 118.9(8) . .
N10 C48 C47 125.6(9) . .
N11 C49 C50 122.0(7) . .
C51 C50 C49 118.8(7) . .
C50 C51 C52 120.4(7) . .
C53 C52 C51 117.0(7) . .
C53 C52 C54 124.7(6) . .
C51 C52 C54 118.2(6) . .
N11 C53 C52 123.9(6) . .
O6 C54 N12 122.4(7) . .
O6 C54 C52 120.0(6) . .
N12 C54 C52 117.6(6) . .
O9 Cl1 O10 110.9(4) . .
O9 Cl1 O8 110.6(3) . .
O10 Cl1 O8 109.7(3) . .
O9 Cl1 O11 111.4(4) . .
O10 Cl1 O11 105.6(3) . .
O8 Cl1 O11 108.5(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N8 2.268(6) .
Ag1 N1 2.288(5) .
Ag1 N5 2.292(6) .
Ag1 O7 2.511(7) .
Ag2 N10 2.281(6) .
Ag2 N11 2.284(6) .
Ag2 N4 2.291(5) .
O1 C6 1.224(8) .
O2 C13 1.255(8) .
O3 C24 1.265(9) .
O4 C31 1.252(10) .
O5 C37 1.218(9) .
O6 C54 1.230(8) .
N1 C1 1.342(8) .
N1 C5 1.350(8) .
N2 C6 1.320(9) .
N2 C7 1.481(8) .
N3 C13 1.308(9) .
N3 C12 1.456(9) .
N4 C14 1.333(8) .
N4 C18 1.346(8) .
N5 C23 1.328(10) .
N5 C19 1.343(10) .
N6 C24 1.287(10) .
N6 C25 1.436(11) .
N7 C31 1.288(10) .
N7 C30 1.476(12) .
N8 C32 1.332(9) .
N8 C36 1.345(9) .
N9 C37 1.348(10) .
N9 C38 1.456(10) .
N10 C48 1.343(9) .
N10 C44 1.347(10) .
N11 C49 1.341(8) .
N11 C53 1.345(8) .
N12 C54 1.338(9) .
N12 C43 1.462(9) 1_545
C1 C2 1.354(10) .
C2 C3 1.399(10) .
C3 C4 1.383(9) .
C4 C5 1.394(8) .
C4 C6 1.524(9) .
C7 C8 1.489(9) .
C8 C9 1.539(8) .
C9 C10 1.525(9) .
C10 C11 1.527(8) .
C11 C12 1.512(10) .
C13 C17 1.514(9) .
C14 C15 1.350(10) .
C15 C16 1.391(10) .
C16 C17 1.397(10) .
C17 C18 1.379(9) .
C19 C20 1.405(12) .
C20 C21 1.352(13) .
C21 C22 1.395(11) .
C22 C23 1.399(11) .
C22 C24 1.504(12) .
C25 C26 1.494(12) .
C26 C27 1.542(12) .
C27 C28 1.505(13) .
C28 C29 1.579(13) .
C29 C30 1.418(14) .
C31 C45 1.511(12) 1_455
C32 C33 1.374(11) .
C33 C34 1.364(12) .
C34 C35 1.392(11) .
C35 C36 1.416(10) .
C35 C37 1.478(11) .
C38 C39 1.499(11) .
C39 C40 1.499(10) .
C40 C41 1.502(10) .
C41 C42 1.526(9) .
C42 C43 1.524(10) .
C43 N12 1.462(9) 1_565
C44 C45 1.397(10) .
C45 C46 1.381(11) .
C45 C31 1.511(12) 1_655
C46 C47 1.370(14) .
C47 C48 1.354(12) .
C49 C50 1.408(11) .
C50 C51 1.352(11) .
C51 C52 1.405(9) .
C52 C53 1.380(9) .
C52 C54 1.490(10) .
Cl1 O9 1.465(5) .
Cl1 O10 1.467(5) .
Cl1 O8 1.468(4) .
Cl1 O11 1.505(5) .
