# Electronic Supplementary Material (ESI) for CrystEngComm
# This journal is © The Royal Society of Chemistry 2011


data_globa
_journal_name_full               CrystEngComm
_journal_coden_cambridge         1350
#TrackingRef '5889_web_deposit_cif_file_0_DiSun_1308486063.Dalton-p1-2.cif'

_audit_update_record             
;
2010-01-10 # Formatted by publCIF
;

#====================================================================

# 1. SUBMISSION DETAILS

_publ_contact_author             
# Name and address of author for correspondence
;
Huang, Rongbin
Department of Chemistry
Xiamen University
Xiamen, 361005
P. R. China
;
_publ_contact_author_phone       86-592-2185191
_publ_contact_author_fax         86-592-2183047
_publ_contact_author_email       rbhuang@xmu.edu.cn
_publ_requested_coeditor_name    ?
_publ_contact_letter             
;

;
#=================================================================

# 2. PROCESSING SUMMARY (IUCr Office Use Only)

# 3. TITLE AND AUTHOR LIST

_publ_section_title              
;
Syntheses, crystal structures and luminescent properties
of two novel Ag(I) coordination
polymers with benzoguanamine and pyrazine-carboxylate ligands:
>From 1D helix to 1D-2D interdigitation
;

loop_
_publ_author_name
_publ_author_address

'Di Sun'
;
Department of chemistry,
Xiamen University,
Xiamen 361005, People's Republic of China
;
'Hong-Jun Hao'
;
Department of chemistry,
Xiamen University,
Xiamen 361005, People's Republic of China
;
'Fu-Jing Liu'
;
Department of chemistry,
Xiamen University,
Xiamen 361005, People's Republic of China
;
'Rong-Bin Huang'
;
Department of chemistry,
Xiamen University,
Xiamen 361005, People's Republic of China
;
'Lan-Sun Zheng'
;
State key Laboratory for Physical Chemistry of Solid Surfaces,
Xiamen University, Xiamen 361005, People's Republic of China
;

_publ_section_exptl_refinement   
;
All H atoms were placed geometrically with C---H = 0.93 (aromatic)
or 0.96 \%A (CH~3~), N---H distances of 0.86\%A and refined using
a riding atom model with their isotropic displacement factors,
U~iso~ fixed at 1.2 time the <i>U</i>~eq~ of
the parent C and N atom.
;
_publ_contact_author_name        'Huang, Rongbin'
#====================================================================
data_p1
_database_code_depnum_ccdc_archive 'CCDC 829489'
#TrackingRef '5889_web_deposit_cif_file_0_DiSun_1308486063.Dalton-p1-2.cif'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         '2(C14 H12 Ag N7 O2), H2 O'
_chemical_formula_sum            'C28 H26 Ag2 N14 O5'
_chemical_formula_weight         854.37

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'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   c2/c

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   23.8597(8)
_cell_length_b                   7.2670(2)
_cell_length_c                   19.5048(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 117.7130(10)
_cell_angle_gamma                90.00
_cell_volume                     2993.96(18)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    8896
_cell_measurement_theta_min      6.04
_cell_measurement_theta_max      55.03

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.895
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1704
_exptl_absorpt_coefficient_mu    1.375
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8203
_exptl_absorpt_correction_T_max  0.8747
_exptl_absorpt_process_details   '(ABSCOR; Higashi, 1995)'

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID Imaging Plate'
_diffrn_measurement_method       \w
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            8120
_diffrn_reflns_av_R_equivalents  0.0330
_diffrn_reflns_av_sigmaI/netI    0.0341
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         3.02
_diffrn_reflns_theta_max         25.00
_reflns_number_total             2633
_reflns_number_gt                2453
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
Refinement of F^2^ against ALL reflections. The weighted R-factor wR and
goodness of fit S are based on F^2^, conventional R-factors R are based
on F, with F set to zero for negative F^2^. The threshold expression of
F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is
not relevant to the choice of reflections for refinement. R-factors based
on F^2^ are statistically about twice as large as those based on F, and R-
factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.0376P)^2^+5.7693P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         2633
_refine_ls_number_parameters     222
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0253
_refine_ls_R_factor_gt           0.0223
_refine_ls_wR_factor_ref         0.0790
_refine_ls_wR_factor_gt          0.0615
_refine_ls_goodness_of_fit_ref   1.195
_refine_ls_restrained_S_all      1.195
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.636574(9) 0.42937(3) 0.640723(12) 0.01896(11) Uani 1 1 d . . .
O1 O 0.43793(9) 0.3091(3) 0.58473(12) 0.0275(5) Uani 1 1 d . . .
O1W O 0.5000 0.6395(5) 0.7500 0.0347(8) Uani 1 2 d S . .
H1WA H 0.5099 0.5711 0.7219 0.042 Uiso 1 1 d R . .
O2 O 0.53677(10) 0.4187(3) 0.64522(12) 0.0202(5) Uani 1 1 d . . .
C9 C 0.73947(13) 0.6735(4) 0.78338(16) 0.0149(6) Uani 1 1 d . . .
C2 C 0.50105(12) 0.2735(4) 0.52226(15) 0.0145(6) Uani 1 1 d . . .
C3 C 0.45216(13) 0.1880(4) 0.45881(16) 0.0200(6) Uani 1 1 d . . .
H3A H 0.4126 0.1716 0.4587 0.024 Uiso 1 1 calc R . .
C4 C 0.51503(16) 0.1539(5) 0.40203(18) 0.0252(7) Uani 1 1 d . . .
H4A H 0.5220 0.1130 0.3604 0.030 Uiso 1 1 calc R . .
C5 C 0.56415(14) 0.2383(4) 0.46466(18) 0.0233(7) Uani 1 1 d . . .
H5A H 0.6035 0.2545 0.4644 0.028 Uiso 1 1 calc R . .
C10 C 0.78182(14) 0.6104(4) 0.85753(16) 0.0168(6) Uani 1 1 d . . .
H10A H 0.8225 0.5668 0.8678 0.020 Uiso 1 1 calc R . .
C11 C 0.76401(15) 0.6121(4) 0.91550(17) 0.0224(7) Uani 1 1 d . . .
H11A H 0.7925 0.5686 0.9657 0.027 Uiso 1 1 calc R . .
C12 C 0.70470(16) 0.6772(5) 0.90078(19) 0.0273(7) Uani 1 1 d . . .
H12A H 0.6929 0.6782 0.9411 0.033 Uiso 1 1 calc R . .
C13 C 0.66258(14) 0.7406(5) 0.82760(18) 0.0254(7) Uani 1 1 d . . .
H13A H 0.6222 0.7860 0.8180 0.030 Uiso 1 1 calc R . .
C14 C 0.67936(13) 0.7376(4) 0.76884(16) 0.0183(6) Uani 1 1 d . . .
H14A H 0.6503 0.7789 0.7185 0.022 Uiso 1 1 calc R . .
C7 C 0.73289(13) 0.6492(4) 0.59439(15) 0.0144(6) Uani 1 1 d . . .
C8 C 0.75855(12) 0.6759(4) 0.72167(15) 0.0129(6) Uani 1 1 d . . .
C6 C 0.83316(12) 0.7308(4) 0.68257(16) 0.0140(6) Uani 1 1 d . . .
C1 C 0.49106(13) 0.3385(4) 0.59019(16) 0.0166(6) Uani 1 1 d . . .
N1 N 0.55798(11) 0.2978(3) 0.52563(13) 0.0168(5) Uani 1 1 d . . .
N2 N 0.45842(12) 0.1278(4) 0.39786(14) 0.0233(6) Uani 1 1 d . . .
N5 N 0.71481(10) 0.6250(3) 0.65021(13) 0.0141(5) Uani 1 1 d . . .
N6 N 0.68967(11) 0.6249(4) 0.52083(13) 0.0188(5) Uani 1 1 d . . .
H6A H 0.7002 0.6391 0.4835 0.023 Uiso 1 1 calc R . .
H6B H 0.6506 0.5946 0.5096 0.023 Uiso 1 1 calc R . .
N7 N 0.89225(11) 0.7683(4) 0.70030(14) 0.0212(6) Uani 1 1 d . . .
H7B H 0.9042 0.7698 0.6638 0.025 Uiso 1 1 calc R . .
H7C H 0.9199 0.7918 0.7486 0.025 Uiso 1 1 calc R . .
N4 N 0.81725(10) 0.7314(3) 0.74151(13) 0.0136(5) Uani 1 1 d . . .
N3 N 0.79173(10) 0.6953(3) 0.60819(13) 0.0159(5) Uani 1 1 d . . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.01148(15) 0.02379(17) 0.01998(16) -0.00059(8) 0.00594(11) -0.00401(8)
O1 0.0125(10) 0.0482(15) 0.0228(11) -0.0029(10) 0.0092(9) -0.0046(10)
O1W 0.040(2) 0.035(2) 0.0375(19) 0.000 0.0250(17) 0.000
O2 0.0144(10) 0.0279(13) 0.0157(10) -0.0016(8) 0.0048(9) -0.0004(8)
C9 0.0166(14) 0.0146(15) 0.0144(13) -0.0065(11) 0.0081(11) -0.0066(11)
C2 0.0115(13) 0.0146(15) 0.0158(13) 0.0032(10) 0.0051(11) 0.0029(11)
C3 0.0151(14) 0.0193(16) 0.0205(15) 0.0021(12) 0.0041(12) 0.0012(12)
C4 0.0351(18) 0.0251(18) 0.0196(15) -0.0001(12) 0.0161(14) 0.0046(14)
C5 0.0202(15) 0.0288(18) 0.0245(16) 0.0041(13) 0.0134(13) 0.0023(13)
C10 0.0182(14) 0.0156(14) 0.0152(14) -0.0037(11) 0.0066(12) -0.0031(12)
C11 0.0310(17) 0.0211(16) 0.0146(14) -0.0027(12) 0.0103(13) -0.0064(13)
C12 0.0391(19) 0.0292(19) 0.0258(16) -0.0050(13) 0.0256(15) -0.0113(15)
C13 0.0207(16) 0.0318(19) 0.0286(16) -0.0066(13) 0.0157(14) -0.0043(13)
C14 0.0162(14) 0.0226(16) 0.0174(14) -0.0050(11) 0.0088(12) -0.0030(12)
C7 0.0129(13) 0.0171(15) 0.0130(13) -0.0001(11) 0.0059(11) 0.0013(11)
C8 0.0138(13) 0.0119(14) 0.0138(13) -0.0021(10) 0.0069(11) 0.0010(11)
C6 0.0140(13) 0.0125(14) 0.0159(13) 0.0018(10) 0.0071(11) 0.0006(11)
C1 0.0135(14) 0.0201(16) 0.0146(14) 0.0061(11) 0.0051(12) 0.0018(11)
N1 0.0143(12) 0.0180(13) 0.0182(12) 0.0009(10) 0.0078(10) -0.0001(10)
N2 0.0272(14) 0.0194(14) 0.0181(13) 0.0000(10) 0.0062(11) 0.0025(11)
N5 0.0106(11) 0.0184(12) 0.0124(11) -0.0015(9) 0.0045(9) -0.0020(9)
N6 0.0144(12) 0.0309(14) 0.0118(11) -0.0037(10) 0.0068(10) -0.0048(10)
N7 0.0108(11) 0.0408(16) 0.0126(11) -0.0046(11) 0.0059(10) -0.0050(11)
N4 0.0121(11) 0.0156(12) 0.0135(11) 0.0002(9) 0.0064(9) -0.0022(9)
N3 0.0118(11) 0.0234(13) 0.0127(11) 0.0006(9) 0.0059(9) -0.0025(10)

_geom_special_details            
;
All esds (except the esd in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell esds are taken
into account individually in the estimation of esds in distances, angles
and torsion angles; correlations between esds in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 N5 2.284(2) . y
Ag1 N1 2.357(2) . y
Ag1 O2 2.425(2) . y
Ag1 N4 2.491(2) 4_646 y
O1 C1 1.240(4) . ?
O1W H1WA 0.8501 . ?
O2 C1 1.262(4) . ?
C9 C10 1.401(4) . ?
C9 C14 1.406(4) . ?
C9 C8 1.472(4) . ?
C2 N1 1.341(4) . ?
C2 C3 1.391(4) . ?
C2 C1 1.526(4) . ?
C3 N2 1.339(4) . ?
C3 H3A 0.9500 . ?
C4 N2 1.328(4) . ?
C4 C5 1.382(5) . ?
C4 H4A 0.9500 . ?
C5 N1 1.336(4) . ?
C5 H5A 0.9500 . ?
C10 C11 1.381(4) . ?
C10 H10A 0.9500 . ?
C11 C12 1.389(5) . ?
C11 H11A 0.9500 . ?
C12 C13 1.388(5) . ?
C12 H12A 0.9500 . ?
C13 C14 1.379(4) . ?
C13 H13A 0.9500 . ?
C14 H14A 0.9500 . ?
C7 N6 1.333(4) . ?
C7 N3 1.343(4) . ?
C7 N5 1.356(4) . ?
C8 N4 1.331(4) . ?
C8 N5 1.347(3) . ?
C6 N7 1.314(4) . ?
C6 N3 1.347(4) . ?
C6 N4 1.368(4) . ?
N6 H6A 0.8800 . ?
N6 H6B 0.8800 . ?
N7 H7B 0.8800 . ?
N7 H7C 0.8800 . ?
N4 Ag1 2.491(2) 4_656 ?

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
_geom_angle_publ_flag
N5 Ag1 N1 126.01(8) . . y
N5 Ag1 O2 142.76(8) . . y
N1 Ag1 O2 70.23(8) . . y
N5 Ag1 N4 106.88(8) . 4_646 y
N1 Ag1 N4 117.31(8) . 4_646 y
O2 Ag1 N4 88.22(7) . 4_646 y
C1 O2 Ag1 117.30(19) . . ?
C10 C9 C14 119.7(3) . . ?
C10 C9 C8 119.9(3) . . ?
C14 C9 C8 120.4(3) . . ?
N1 C2 C3 120.9(3) . . ?
N1 C2 C1 118.7(2) . . ?
C3 C2 C1 120.4(3) . . ?
N2 C3 C2 122.8(3) . . ?
N2 C3 H3A 118.6 . . ?
C2 C3 H3A 118.6 . . ?
N2 C4 C5 122.5(3) . . ?
N2 C4 H4A 118.7 . . ?
C5 C4 H4A 118.7 . . ?
N1 C5 C4 122.1(3) . . ?
N1 C5 H5A 119.0 . . ?
C4 C5 H5A 119.0 . . ?
C11 C10 C9 119.6(3) . . ?
C11 C10 H10A 120.2 . . ?
C9 C10 H10A 120.2 . . ?
C10 C11 C12 120.4(3) . . ?
C10 C11 H11A 119.8 . . ?
C12 C11 H11A 119.8 . . ?
C13 C12 C11 120.4(3) . . ?
C13 C12 H12A 119.8 . . ?
C11 C12 H12A 119.8 . . ?
C14 C13 C12 119.9(3) . . ?
C14 C13 H13A 120.1 . . ?
C12 C13 H13A 120.1 . . ?
C13 C14 C9 120.1(3) . . ?
C13 C14 H14A 120.0 . . ?
C9 C14 H14A 120.0 . . ?
N6 C7 N3 117.5(3) . . ?
N6 C7 N5 118.1(2) . . ?
N3 C7 N5 124.4(2) . . ?
N4 C8 N5 126.0(3) . . ?
N4 C8 C9 116.7(2) . . ?
N5 C8 C9 117.2(2) . . ?
N7 C6 N3 118.9(3) . . ?
N7 C6 N4 117.5(2) . . ?
N3 C6 N4 123.7(2) . . ?
O1 C1 O2 126.7(3) . . ?
O1 C1 C2 116.0(2) . . ?
O2 C1 C2 117.3(2) . . ?
C5 N1 C2 116.2(2) . . ?
C5 N1 Ag1 127.64(19) . . ?
C2 N1 Ag1 116.07(18) . . ?
C4 N2 C3 115.4(3) . . ?
C8 N5 C7 114.3(2) . . ?
C8 N5 Ag1 117.73(19) . . ?
C7 N5 Ag1 124.65(18) . . ?
C7 N6 H6A 120.0 . . ?
C7 N6 H6B 120.0 . . ?
H6A N6 H6B 120.0 . . ?
C6 N7 H7B 120.0 . . ?
C6 N7 H7C 120.0 . . ?
H7B N7 H7C 120.0 . . ?
C8 N4 C6 114.9(2) . . ?
C8 N4 Ag1 113.43(18) . 4_656 ?
C6 N4 Ag1 126.88(18) . 4_656 ?
C7 N3 C6 116.0(2) . . ?

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
O1W H1WA O2 0.85 2.18 3.031(3) 174.7 .
N6 H6A N3 0.88 2.24 3.046(3) 152.7 7_666
N6 H6B O1 0.88 2.17 2.812(3) 129.0 5_666
N7 H7B O1 0.88 2.07 2.940(3) 171.9 3
N7 H7C O2 0.88 2.05 2.898(3) 160.4 4_656

_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         0.450
_refine_diff_density_min         -0.708
_refine_diff_density_rms         0.123

data_p2
_database_code_depnum_ccdc_archive 'CCDC 829490'
#TrackingRef '5889_web_deposit_cif_file_0_DiSun_1308486063.Dalton-p1-2.cif'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C24 H22 Ag2 N12 O5 '
_chemical_formula_sum            'C24 H22 Ag2 N12 O5'
_chemical_formula_weight         774.28

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'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   c2/c

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   49.174(8)
_cell_length_b                   8.9007(15)
_cell_length_c                   12.382(2)
_cell_angle_alpha                90.00
_cell_angle_beta                 102.613(3)
_cell_angle_gamma                90.00
_cell_volume                     5288.4(15)
_cell_formula_units_Z            8
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    8314
_cell_measurement_theta_min      5.252
_cell_measurement_theta_max      56.917

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.945
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3072
_exptl_absorpt_coefficient_mu    1.544
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7476
_exptl_absorpt_correction_T_max  0.8609
_exptl_absorpt_process_details   'SADABS (Bruker, 2002)'

_exptl_special_details           ?

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker SMART CCD'
_diffrn_measurement_method       '\f and \w'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            12148
_diffrn_reflns_av_R_equivalents  0.0367
_diffrn_reflns_av_sigmaI/netI    0.0470
_diffrn_reflns_limit_h_min       -42
_diffrn_reflns_limit_h_max       60
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_theta_min         0.85
_diffrn_reflns_theta_max         26.00
_reflns_number_total             5110
_reflns_number_gt                4964
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
Refinement of F^2^ against ALL reflections. The weighted R-factor wR and
goodness of fit S are based on F^2^, conventional R-factors R are based
on F, with F set to zero for negative F^2^. The threshold expression of
F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is
not relevant to the choice of reflections for refinement. R-factors based
on F^2^ are statistically about twice as large as those based on F, and R-
factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.0460P)^2^+229.4548P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         5110
_refine_ls_number_parameters     388
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0684
_refine_ls_R_factor_gt           0.0666
_refine_ls_wR_factor_ref         0.1732
_refine_ls_wR_factor_gt          0.1718
_refine_ls_goodness_of_fit_ref   1.087
_refine_ls_restrained_S_all      1.087
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.666310(14) 1.10502(7) 0.98515(5) 0.02095(18) Uani 1 1 d . . .
Ag2 Ag 0.590660(15) 0.46072(8) 0.72513(6) 0.0288(2) Uani 1 1 d . . .
C1 C 0.54280(18) 0.4056(10) 0.5115(7) 0.0258(18) Uani 1 1 d . . .
C2 C 0.53332(18) 0.2918(9) 0.6640(7) 0.0212(17) Uani 1 1 d . . .
C3 C 0.50308(18) 0.2732(10) 0.4979(8) 0.0267(19) Uani 1 1 d . . .
C4 C 0.4774(2) 0.2070(11) 0.4302(8) 0.031(2) Uani 1 1 d . . .
C5 C 0.4625(2) 0.0966(11) 0.4711(9) 0.035(2) Uani 1 1 d . . .
H5A H 0.4683 0.0649 0.5459 0.042 Uiso 1 1 calc R . .
C6 C 0.4393(2) 0.0324(13) 0.4043(11) 0.044(3) Uani 1 1 d . . .
H6A H 0.4290 -0.0415 0.4337 0.053 Uiso 1 1 calc R . .
C7 C 0.4309(2) 0.0751(13) 0.2942(10) 0.044(3) Uani 1 1 d . . .
H7A H 0.4150 0.0307 0.2480 0.053 Uiso 1 1 calc R . .
C8 C 0.4461(2) 0.1836(14) 0.2527(11) 0.049(3) Uani 1 1 d . . .
H8A H 0.4408 0.2112 0.1769 0.059 Uiso 1 1 calc R . .
C9 C 0.4688(2) 0.2519(13) 0.3199(9) 0.038(2) Uani 1 1 d . . .
H9A H 0.4786 0.3290 0.2913 0.046 Uiso 1 1 calc R . .
C10 C 0.62654(19) 0.6571(11) 0.9239(7) 0.0279(19) Uani 1 1 d . . .
H10A H 0.6217 0.5816 0.9706 0.034 Uiso 1 1 calc R . .
C11 C 0.63978(17) 0.7853(10) 0.9703(6) 0.0223(17) Uani 1 1 d . . .
H11A H 0.6437 0.7972 1.0484 0.027 Uiso 1 1 calc R . .
C12 C 0.64213(16) 0.8736(9) 0.7988(6) 0.0163(15) Uani 1 1 d . . .
C13 C 0.62840(16) 0.7424(9) 0.7498(7) 0.0203(16) Uani 1 1 d . . .
C14 C 0.62076(17) 0.7198(9) 0.6257(7) 0.0205(17) Uani 1 1 d . . .
C15 C 0.65178(16) 1.0010(9) 0.7330(6) 0.0167(15) Uani 1 1 d . . .
C16 C 0.69334(18) 1.3965(9) 1.0991(7) 0.0206(17) Uani 1 1 d . . .
C17 C 0.68748(19) 1.4164(10) 0.9120(6) 0.0217(17) Uani 1 1 d . . .
C18 C 0.70526(16) 1.6139(9) 1.0230(6) 0.0182(16) Uani 1 1 d . . .
C19 C 0.71616(16) 1.7689(9) 1.0384(7) 0.0188(16) Uani 1 1 d . . .
C20 C 0.71570(18) 1.8636(9) 0.9485(7) 0.0225(17) Uani 1 1 d . . .
H20A H 0.7085 1.8281 0.8755 0.027 Uiso 1 1 calc R . .
C21 C 0.72566(19) 2.0101(10) 0.9650(8) 0.0281(19) Uani 1 1 d . . .
H21A H 0.7248 2.0750 0.9034 0.034 Uiso 1 1 calc R . .
C22 C 0.73679(18) 2.0610(10) 1.0699(7) 0.0245(18) Uani 1 1 d . . .
H22A H 0.7437 2.1608 1.0809 0.029 Uiso 1 1 calc R . .
C23 C 0.7379(2) 1.9664(10) 1.1599(8) 0.0280(19) Uani 1 1 d . . .
H23A H 0.7460 2.0009 1.2324 0.034 Uiso 1 1 calc R . .
C24 C 0.72738(18) 1.8229(10) 1.1446(7) 0.0240(18) Uani 1 1 d . . .
H24A H 0.7278 1.7600 1.2069 0.029 Uiso 1 1 calc R . .
N1 N 0.55162(15) 0.3720(8) 0.6210(6) 0.0231(15) Uani 1 1 d . . .
N2 N 0.50854(15) 0.2424(8) 0.6079(6) 0.0243(15) Uani 1 1 d . . .
N3 N 0.51875(16) 0.3555(9) 0.4478(6) 0.0265(16) Uani 1 1 d . . .
N4 N 0.54031(16) 0.2622(9) 0.7730(6) 0.0278(16) Uani 1 1 d . . .
H4A H 0.5287 0.2121 0.8048 0.033 Uiso 1 1 calc R . .
H4B H 0.5564 0.2929 0.8126 0.033 Uiso 1 1 calc R . .
N5 N 0.55871(16) 0.4909(10) 0.4620(6) 0.0315(18) Uani 1 1 d . . .
H5C H 0.5533 0.4902 0.3911 0.038 Uiso 1 1 d R . .
H5B H 0.5746 0.5263 0.5002 0.038 Uiso 1 1 d R . .
N6 N 0.69789(15) 1.5579(8) 0.9202(6) 0.0234(15) Uani 1 1 d . . .
N7 N 0.70310(14) 1.5387(7) 1.1143(5) 0.0183(14) Uani 1 1 d . . .
N8 N 0.68433(14) 1.3322(7) 0.9992(5) 0.0171(13) Uani 1 1 d . . .
N9 N 0.69206(17) 1.3168(8) 1.1884(5) 0.0263(16) Uani 1 1 d . . .
H9B H 0.6855 1.2246 1.1814 0.032 Uiso 1 1 calc R . .
H9C H 0.6978 1.3561 1.2547 0.032 Uiso 1 1 calc R . .
N10 N 0.6805(2) 1.3565(9) 0.8109(6) 0.038(2) Uani 1 1 d . . .
H10B H 0.6741 1.2641 0.8021 0.046 Uiso 1 1 calc R . .
H10C H 0.6824 1.4095 0.7529 0.046 Uiso 1 1 calc R . .
N11 N 0.62031(14) 0.6368(8) 0.8136(6) 0.0206(14) Uani 1 1 d . . .
N12 N 0.64717(14) 0.8933(8) 0.9077(5) 0.0189(14) Uani 1 1 d . . .
O1 O 0.61236(14) 0.5920(7) 0.5901(5) 0.0310(15) Uani 1 1 d . . .
O1W O 0.60119(13) 0.2355(7) 0.8473(5) 0.0275(13) Uani 1 1 d . . .
H1WC H 0.6074 0.2634 0.9138 0.033 Uiso 1 1 d R . .
H1WA H 0.6132 0.1811 0.8260 0.041 Uiso 1 1 d R . .
O2 O 0.62329(13) 0.8317(7) 0.5671(5) 0.0248(13) Uani 1 1 d . . .
O3 O 0.67224(12) 0.9796(7) 0.6924(5) 0.0216(12) Uani 1 1 d . . .
O4 O 0.63908(14) 1.1225(6) 0.7343(5) 0.0253(13) Uani 1 1 d . . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.0303(4) 0.0183(3) 0.0146(3) -0.0031(2) 0.0059(2) -0.0063(2)
Ag2 0.0323(4) 0.0278(4) 0.0265(4) -0.0038(3) 0.0069(3) -0.0144(3)
C1 0.025(4) 0.029(5) 0.023(4) -0.007(4) 0.005(3) -0.002(4)
C2 0.028(4) 0.016(4) 0.021(4) -0.006(3) 0.006(3) 0.001(3)
C3 0.023(4) 0.026(5) 0.034(5) -0.009(4) 0.012(4) 0.001(4)
C4 0.032(5) 0.032(5) 0.033(5) -0.011(4) 0.013(4) 0.001(4)
C5 0.026(5) 0.033(5) 0.047(6) -0.018(5) 0.012(4) -0.005(4)
C6 0.026(5) 0.034(6) 0.075(8) -0.018(6) 0.016(5) -0.005(4)
C7 0.024(5) 0.044(6) 0.057(7) -0.023(5) -0.005(5) -0.001(5)
C8 0.029(5) 0.054(7) 0.055(7) -0.013(6) -0.011(5) 0.009(5)
C9 0.032(5) 0.039(6) 0.037(5) -0.010(5) -0.004(4) 0.001(4)
C10 0.031(5) 0.029(5) 0.024(4) 0.009(4) 0.005(4) -0.003(4)
C11 0.025(4) 0.030(5) 0.012(4) 0.000(3) 0.005(3) -0.004(4)
C12 0.018(4) 0.016(4) 0.015(4) -0.001(3) 0.005(3) 0.002(3)
C13 0.018(4) 0.017(4) 0.026(4) -0.001(3) 0.005(3) 0.001(3)
C14 0.021(4) 0.021(4) 0.020(4) -0.005(3) 0.005(3) -0.003(3)
C15 0.023(4) 0.015(4) 0.012(3) 0.001(3) 0.005(3) -0.002(3)
C16 0.028(4) 0.018(4) 0.016(4) -0.001(3) 0.007(3) 0.003(3)
C17 0.037(5) 0.022(4) 0.005(3) -0.002(3) 0.004(3) 0.003(4)
C18 0.020(4) 0.020(4) 0.011(3) 0.002(3) -0.003(3) 0.003(3)
C19 0.020(4) 0.019(4) 0.019(4) -0.001(3) 0.008(3) 0.003(3)
C20 0.031(5) 0.016(4) 0.018(4) -0.001(3) 0.001(3) -0.003(3)
C21 0.033(5) 0.017(4) 0.035(5) 0.001(4) 0.009(4) -0.003(4)
C22 0.026(4) 0.021(4) 0.028(4) -0.004(4) 0.010(4) -0.002(3)
C23 0.038(5) 0.021(4) 0.025(4) -0.004(4) 0.006(4) 0.000(4)
C24 0.028(4) 0.019(4) 0.024(4) -0.005(3) 0.005(3) -0.004(3)
N1 0.024(4) 0.022(4) 0.023(4) -0.005(3) 0.005(3) -0.006(3)
N2 0.025(4) 0.026(4) 0.024(4) -0.005(3) 0.009(3) -0.004(3)
N3 0.028(4) 0.034(4) 0.017(3) 0.000(3) 0.003(3) -0.005(3)
N4 0.027(4) 0.034(4) 0.024(4) 0.000(3) 0.009(3) -0.005(3)
N5 0.030(4) 0.043(5) 0.018(3) 0.007(3) -0.002(3) -0.013(4)
N6 0.029(4) 0.024(4) 0.017(3) -0.002(3) 0.004(3) -0.003(3)
N7 0.025(3) 0.013(3) 0.016(3) 0.000(3) 0.002(3) -0.001(3)
N8 0.023(3) 0.015(3) 0.014(3) 0.001(3) 0.006(3) -0.003(3)
N9 0.054(5) 0.013(3) 0.011(3) 0.001(3) 0.008(3) -0.004(3)
N10 0.076(6) 0.025(4) 0.014(4) -0.006(3) 0.010(4) -0.024(4)
N11 0.020(3) 0.023(4) 0.022(3) 0.000(3) 0.010(3) -0.001(3)
N12 0.026(4) 0.017(3) 0.014(3) -0.001(3) 0.005(3) -0.002(3)
O1 0.043(4) 0.025(3) 0.028(3) -0.010(3) 0.015(3) -0.016(3)
O1W 0.030(3) 0.032(3) 0.019(3) -0.001(3) 0.004(2) 0.006(3)
O2 0.031(3) 0.028(3) 0.016(3) -0.001(2) 0.006(2) -0.004(3)
O3 0.025(3) 0.022(3) 0.019(3) 0.002(2) 0.007(2) -0.003(2)
O4 0.041(4) 0.017(3) 0.021(3) 0.000(2) 0.014(3) 0.002(3)

_geom_special_details            
;
All esds (except the esd in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell esds are taken
into account individually in the estimation of esds in distances, angles
and torsion angles; correlations between esds in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 N8 2.200(7) . y
Ag1 N12 2.227(7) . y
Ag1 O2 2.600(6) 6_576 y
Ag1 O3 2.628(6) 6_576 y
Ag2 N1 2.212(7) . y
Ag2 N11 2.255(7) . y
Ag2 O1 2.465(6) . y
Ag2 O1W 2.497(6) . y
C1 N5 1.332(12) . ?
C1 N3 1.347(11) . ?
C1 N1 1.362(11) . ?
C2 N2 1.338(11) . ?
C2 N4 1.345(11) . ?
C2 N1 1.346(11) . ?
C3 N3 1.313(12) . ?
C3 N2 1.357(12) . ?
C3 C4 1.479(13) . ?
C4 C5 1.386(14) . ?
C4 C9 1.397(14) . ?
C5 C6 1.378(14) . ?
C5 H5A 0.9500 . ?
C6 C7 1.388(17) . ?
C6 H6A 0.9500 . ?
C7 C8 1.387(18) . ?
C7 H7A 0.9500 . ?
C8 C9 1.380(14) . ?
C8 H8A 0.9500 . ?
C9 H9A 0.9500 . ?
C10 N11 1.344(11) . ?
C10 C11 1.376(13) . ?
C10 H10A 0.9500 . ?
C11 N12 1.333(11) . ?
C11 H11A 0.9500 . ?
C12 N12 1.328(10) . ?
C12 C13 1.418(11) . ?
C12 C15 1.531(10) . ?
C13 N11 1.343(11) . ?
C13 C14 1.514(11) . ?
C14 O2 1.254(10) . ?
C14 O1 1.257(10) . ?
C15 O3 1.234(10) . ?
C15 O4 1.251(10) . ?
C16 N9 1.327(10) . ?
C16 N8 1.347(10) . ?
C16 N7 1.352(11) . ?
C17 N10 1.335(10) . ?
C17 N8 1.350(10) . ?
C17 N6 1.355(11) . ?
C18 N7 1.338(10) . ?
C18 N6 1.341(10) . ?
C18 C19 1.477(11) . ?
C19 C20 1.392(11) . ?
C19 C24 1.395(11) . ?
C20 C21 1.392(12) . ?
C20 H20A 0.9500 . ?
C21 C22 1.371(13) . ?
C21 H21A 0.9500 . ?
C22 C23 1.388(13) . ?
C22 H22A 0.9500 . ?
C23 C24 1.376(12) . ?
C23 H23A 0.9500 . ?
C24 H24A 0.9500 . ?
N4 H4A 0.8800 . ?
N4 H4B 0.8800 . ?
N5 H5C 0.8603 . ?
N5 H5B 0.8799 . ?
N9 H9B 0.8800 . ?
N9 H9C 0.8800 . ?
N10 H10B 0.8800 . ?
N10 H10C 0.8800 . ?
O1W H1WC 0.8501 . ?
O1W H1WA 0.8503 . ?
O2 Ag1 2.600(6) 6_575 ?

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
_geom_angle_publ_flag
N8 Ag1 N12 159.5(2) . . y
N8 Ag1 O2 96.8(2) . 6_576 y
N12 Ag1 O2 92.7(2) . 6_576 y
N8 Ag1 O3 103.3(2) . 6_576 y
N12 Ag1 O3 97.1(2) . 6_576 y
O2 Ag1 O3 66.88(18) 6_576 6_576 y
N1 Ag2 N11 156.7(3) . . y
N1 Ag2 O1 102.9(2) . . y
N11 Ag2 O1 70.8(2) . . y
N1 Ag2 O1W 96.1(2) . . y
N11 Ag2 O1W 103.7(2) . . y
O1 Ag2 O1W 136.7(2) . . y
N5 C1 N3 116.6(8) . . ?
N5 C1 N1 119.4(8) . . ?
N3 C1 N1 124.0(8) . . ?
N2 C2 N4 117.4(8) . . ?
N2 C2 N1 125.5(8) . . ?
N4 C2 N1 117.1(8) . . ?
N3 C3 N2 125.4(8) . . ?
N3 C3 C4 118.2(8) . . ?
N2 C3 C4 116.5(8) . . ?
C5 C4 C9 119.4(9) . . ?
C5 C4 C3 122.0(9) . . ?
C9 C4 C3 118.5(9) . . ?
C6 C5 C4 120.5(11) . . ?
C6 C5 H5A 119.7 . . ?
C4 C5 H5A 119.7 . . ?
C5 C6 C7 120.4(11) . . ?
C5 C6 H6A 119.8 . . ?
C7 C6 H6A 119.8 . . ?
C8 C7 C6 119.1(10) . . ?
C8 C7 H7A 120.4 . . ?
C6 C7 H7A 120.4 . . ?
C9 C8 C7 120.9(12) . . ?
C9 C8 H8A 119.5 . . ?
C7 C8 H8A 119.5 . . ?
C8 C9 C4 119.6(11) . . ?
C8 C9 H9A 120.2 . . ?
C4 C9 H9A 120.2 . . ?
N11 C10 C11 121.2(8) . . ?
N11 C10 H10A 119.4 . . ?
C11 C10 H10A 119.4 . . ?
N12 C11 C10 121.3(7) . . ?
N12 C11 H11A 119.4 . . ?
C10 C11 H11A 119.4 . . ?
N12 C12 C13 120.6(7) . . ?
N12 C12 C15 115.5(7) . . ?
C13 C12 C15 123.8(7) . . ?
N11 C13 C12 119.9(7) . . ?
N11 C13 C14 117.7(7) . . ?
C12 C13 C14 122.2(7) . . ?
O2 C14 O1 125.7(8) . . ?
O2 C14 C13 116.6(7) . . ?
O1 C14 C13 117.7(7) . . ?
O3 C15 O4 126.3(7) . . ?
O3 C15 C12 118.5(7) . . ?
O4 C15 C12 114.8(7) . . ?
N9 C16 N8 118.2(8) . . ?
N9 C16 N7 117.6(7) . . ?
N8 C16 N7 124.2(7) . . ?
N10 C17 N8 118.6(8) . . ?
N10 C17 N6 117.1(7) . . ?
N8 C17 N6 124.3(7) . . ?
N7 C18 N6 124.1(8) . . ?
N7 C18 C19 116.9(7) . . ?
N6 C18 C19 119.0(7) . . ?
C20 C19 C24 118.6(8) . . ?
C20 C19 C18 121.3(7) . . ?
C24 C19 C18 120.1(7) . . ?
C21 C20 C19 120.4(8) . . ?
C21 C20 H20A 119.8 . . ?
C19 C20 H20A 119.8 . . ?
C22 C21 C20 120.2(9) . . ?
C22 C21 H21A 119.9 . . ?
C20 C21 H21A 119.9 . . ?
C21 C22 C23 119.8(8) . . ?
C21 C22 H22A 120.1 . . ?
C23 C22 H22A 120.1 . . ?
C24 C23 C22 120.4(8) . . ?
C24 C23 H23A 119.8 . . ?
C22 C23 H23A 119.8 . . ?
C23 C24 C19 120.5(8) . . ?
C23 C24 H24A 119.7 . . ?
C19 C24 H24A 119.7 . . ?
C2 N1 C1 114.5(7) . . ?
C2 N1 Ag2 121.9(6) . . ?
C1 N1 Ag2 123.3(6) . . ?
C2 N2 C3 114.4(7) . . ?
C3 N3 C1 116.0(8) . . ?
C2 N4 H4A 120.0 . . ?
C2 N4 H4B 120.0 . . ?
H4A N4 H4B 120.0 . . ?
C1 N5 H5C 112.6 . . ?
C1 N5 H5B 120.0 . . ?
H5C N5 H5B 126.2 . . ?
C18 N6 C17 115.9(7) . . ?
C18 N7 C16 116.2(7) . . ?
C16 N8 C17 115.2(7) . . ?
C16 N8 Ag1 120.6(5) . . ?
C17 N8 Ag1 124.1(5) . . ?
C16 N9 H9B 120.0 . . ?
C16 N9 H9C 120.0 . . ?
H9B N9 H9C 120.0 . . ?
C17 N10 H10B 120.0 . . ?
C17 N10 H10C 120.0 . . ?
H10B N10 H10C 120.0 . . ?
C13 N11 C10 118.2(7) . . ?
C13 N11 Ag2 116.3(5) . . ?
C10 N11 Ag2 124.5(6) . . ?
C12 N12 C11 118.7(7) . . ?
C12 N12 Ag1 121.1(5) . . ?
C11 N12 Ag1 120.2(5) . . ?
C14 O1 Ag2 110.5(5) . . ?
Ag2 O1W H1WC 109.6 . . ?
Ag2 O1W H1WA 109.6 . . ?
H1WC O1W H1WA 109.7 . . ?
C14 O2 Ag1 126.1(5) . 6_575 ?

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
N4 H4B O1W 0.88 2.21 2.943(10) 140.8 .
N4 H4A N2 0.88 2.34 3.086(10) 142.8 2_656
N5 H5B O1 0.88 2.03 2.909(10) 175.7 .
N9 H9B O3 0.88 1.94 2.817(9) 170.6 6_576
N9 H9C N6 0.88 2.19 3.034(10) 161.3 6_586
N10 H10B O4 0.88 2.15 2.924(10) 146.4 .
N10 H10C N7 0.88 2.23 3.033(10) 152.5 6_585
O1W H1WC O2 0.85 2.07 2.767(8) 138.8 6_566
O1W H1WA O4 0.85 1.95 2.753(8) 156.8 1_545

_diffrn_measured_fraction_theta_max 0.984
_diffrn_reflns_theta_full        26.00
_diffrn_measured_fraction_theta_full 0.984
_refine_diff_density_max         1.740
_refine_diff_density_min         -0.967
_refine_diff_density_rms         0.177