# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_1
_database_code_depnum_ccdc_archive 'CCDC 1576775'
_audit_update_record             
;
2017-09-27 deposited with the CCDC.
2018-01-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C13 H8 Ag F3 N8 O3 S'
_chemical_formula_sum            'C13 H8 Ag F3 N8 O3 S'
_chemical_formula_weight         521.20

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           60
_space_group_name_H-M_alt        'P b c n'
_space_group_name_Hall           '-P 2n 2ab'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

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

_cell_length_a                   11.5086(3)
_cell_length_b                   13.4430(4)
_cell_length_c                   11.8588(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     1834.68(9)
_cell_formula_units_Z            4
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    4044
_cell_measurement_theta_min      2.33
_cell_measurement_theta_max      27.47

_exptl_crystal_description       needle
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.887
_exptl_crystal_F_000             1024
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.134
_exptl_crystal_size_mid          0.093
_exptl_crystal_size_min          0.073
_exptl_absorpt_coefficient_mu    1.277
_shelx_estimated_absorpt_T_min   0.848
_shelx_estimated_absorpt_T_max   0.913
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.848
_exptl_absorpt_correction_T_max  0.913
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'

_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_monochromator  'curved graphite crystal'
_diffrn_measurement_device_type  'Bruker KAPPA APEX II DUO CCD'
_diffrn_measurement_device       '62mm x 62mm CCD camera on κ-goniostat'
_diffrn_detector_area_resol_mean 16 # 8 for binned mode
_diffrn_measurement_method       'φ scans and ω scans with κ offset'
_diffrn_reflns_number            8095
_diffrn_reflns_av_unetI/netI     0.0154
_diffrn_reflns_av_R_equivalents  0.0148
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       9
_diffrn_reflns_theta_min         2.330
_diffrn_reflns_theta_max         27.494
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             2105
_reflns_number_gt                1744
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX2 (Bruker AXS, 2010)'
_computing_cell_refinement       'SAINT (Bruker AXS, 2009)'
_computing_data_reduction        'SAINT (Bruker AXS, 2009)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Diamond v.4.03 (Brandenburg, 2014)'
_computing_publication_material  'SHELXL-2014 (Sheldrick, 2014)'

_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0226P)²+1.4133P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         2105
_refine_ls_number_parameters     165
_refine_ls_number_restraints     11
_refine_ls_R_factor_all          0.0281
_refine_ls_R_factor_gt           0.0205
_refine_ls_wR_factor_ref         0.0531
_refine_ls_wR_factor_gt          0.0492
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_restrained_S_all      1.116
_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.82007(15) 0.53029(14) 0.55263(14) 0.0222(4) Uani 1 1 d . . . . .
H1 H 0.8325 0.4609 0.5618 0.027 Uiso 1 1 calc R U . . .
C2 C 0.83174(15) 0.68836(13) 0.57311(14) 0.0190(3) Uani 1 1 d . . . . .
C3 C 0.86903(16) 0.78413(14) 0.61106(15) 0.0229(4) Uani 1 1 d . . . . .
C4 C 0.75315(16) 0.67103(12) 0.48863(14) 0.0198(3) Uani 1 1 d . . . . .
C5 C 0.69027(16) 0.74085(14) 0.42244(15) 0.0239(4) Uani 1 1 d . . . . .
C6 C 0.67637(17) 0.51577(15) 0.39336(16) 0.0304(4) Uani 1 1 d . . . . .
H6A H 0.6768 0.4446 0.4114 0.046 Uiso 1 1 calc R U . . .
H6B H 0.7094 0.5260 0.3181 0.046 Uiso 1 1 calc R U . . .
H6C H 0.5963 0.5406 0.3949 0.046 Uiso 1 1 calc R U . . .
N1 N 0.87330(13) 0.59964(11) 0.61281(12) 0.0208(3) Uani 1 1 d . . . . .
N2 N 0.89608(16) 0.86316(13) 0.63501(14) 0.0334(4) Uani 1 1 d . . . . .
N3 N 0.64277(16) 0.80088(13) 0.37259(15) 0.0358(4) Uani 1 1 d . . . . .
N4 N 0.74618(13) 0.56982(11) 0.47684(12) 0.0216(3) Uani 1 1 d . . . . .
O3 O 0.9246(4) 0.3950(2) 0.8096(4) 0.0539(11) Uani 0.5 1 d D . P . .
O1 O 1.0176(3) 0.3454(3) 0.8796(2) 0.0466(9) Uani 0.5 1 d D . P . .
O2 O 0.8722(3) 0.3588(3) 0.7342(3) 0.0466(9) Uani 0.5 1 d D . P . .
F1 F 0.8809(3) 0.1827(3) 0.7497(3) 0.0524(9) Uani 0.5 1 d D . P . .
F2 F 0.9998(2) 0.1963(2) 0.6163(2) 0.0468(7) Uani 0.5 1 d D . P . .
F3 F 0.9375(4) 0.1555(3) 0.7778(4) 0.0706(14) Uani 0.5 1 d . U P . .
S1 S 1.0000 0.34279(5) 0.7500 0.03821(18) Uani 1 2 d DS T P . .
Ag1 Ag 1.0000 0.58378(2) 0.7500 0.02695(7) Uani 1 2 d S T P . .
C7 C 1.0127(5) 0.2133(3) 0.7264(4) 0.0262(11) Uani 0.5 1 d . . P . .


_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
C1 N1 1.324(2) . ?
C1 N4 1.347(2) . ?
C1 H1 0.9500 . ?
C2 N1 1.369(2) . ?
C2 C4 1.370(2) . ?
C2 C3 1.430(3) . ?
C3 N2 1.143(2) . ?
C4 N4 1.370(2) . ?
C4 C5 1.422(2) . ?
C5 N3 1.140(2) . ?
C6 N4 1.467(2) . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
N1 Ag1 2.1951(14) . ?
O3 O2 1.183(5) . ?
O3 S1 1.321(3) . ?
O3 O1 1.510(5) . ?
O1 S1 1.551(3) . ?
O2 S1 1.498(3) . ?
F1 F3 0.818(5) . ?
F1 C7 1.322(7) 3_756 ?
F1 C7 1.596(6) . ?
F2 C7 1.334(5) . ?
F2 F3 1.549(6) 3_756 ?
F2 C7 1.885(5) 3_756 ?
F3 C7 0.966(6) 3_756 ?
F3 C7 1.313(5) . ?
F3 F2 1.549(6) 3_756 ?
F3 F3 1.581(8) 3_756 ?
S1 O3 1.321(3) 3_756 ?
S1 O2 1.498(3) 3_756 ?
S1 O1 1.551(3) 3_756 ?
S1 C7 1.769(4) 3_756 ?
S1 C7 1.769(4) . ?
Ag1 N1 2.1951(14) 3_756 ?
C7 C7 0.632(7) 3_756 ?
C7 F3 0.966(6) 3_756 ?
C7 F1 1.322(7) 3_756 ?
C7 F2 1.885(5) 3_756 ?

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
N1 C1 N4 111.96(16) . . ?
N1 C1 H1 124.0 . . ?
N4 C1 H1 124.0 . . ?
N1 C2 C4 109.52(15) . . ?
N1 C2 C3 124.86(16) . . ?
C4 C2 C3 125.56(16) . . ?
N2 C3 C2 175.6(2) . . ?
C2 C4 N4 106.39(15) . . ?
C2 C4 C5 128.88(16) . . ?
N4 C4 C5 124.72(15) . . ?
N3 C5 C4 176.3(2) . . ?
N4 C6 H6A 109.5 . . ?
N4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
N4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C1 N1 C2 105.46(14) . . ?
C1 N1 Ag1 129.66(12) . . ?
C2 N1 Ag1 124.87(12) . . ?
C1 N4 C4 106.67(14) . . ?
C1 N4 C6 126.91(15) . . ?
C4 N4 C6 126.34(15) . . ?
O2 O3 S1 73.3(2) . . ?
O2 O3 O1 126.6(3) . . ?
S1 O3 O1 66.1(2) . . ?
O3 O1 S1 51.10(16) . . ?
O3 O2 S1 57.6(2) . . ?
F3 F1 C7 46.7(4) . 3_756 ?
F3 F1 C7 55.1(4) . . ?
C7 F1 C7 22.6(3) 3_756 . ?
C7 F2 F3 38.3(3) . 3_756 ?
C7 F2 C7 11.2(4) . 3_756 ?
F3 F2 C7 43.6(2) 3_756 3_756 ?
F1 F3 C7 95.3(6) . 3_756 ?
F1 F3 C7 94.1(6) . . ?
C7 F3 C7 27.1(4) 3_756 . ?
F1 F3 F2 122.9(6) . 3_756 ?
C7 F3 F2 58.7(4) 3_756 3_756 ?
C7 F3 F2 82.0(4) . 3_756 ?
F1 F3 F3 123.7(7) . 3_756 ?
C7 F3 F3 56.0(3) 3_756 3_756 ?
C7 F3 F3 37.6(3) . 3_756 ?
F2 F3 F3 85.1(4) 3_756 3_756 ?
O3 S1 O3 115.8(3) . 3_756 ?
O3 S1 O2 49.1(2) . . ?
O3 S1 O2 120.1(2) 3_756 . ?
O3 S1 O2 120.1(2) . 3_756 ?
O3 S1 O2 49.1(2) 3_756 3_756 ?
O2 S1 O2 163.4(3) . 3_756 ?
O3 S1 O1 115.6(2) . 3_756 ?
O3 S1 O1 62.8(2) 3_756 3_756 ?
O2 S1 O1 75.21(17) . 3_756 ?
O2 S1 O1 104.41(17) 3_756 3_756 ?
O3 S1 O1 62.8(2) . . ?
O3 S1 O1 115.6(2) 3_756 . ?
O2 S1 O1 104.41(17) . . ?
O2 S1 O1 75.21(17) 3_756 . ?
O1 S1 O1 177.4(3) 3_756 . ?
O3 S1 C7 112.55(19) . 3_756 ?
O3 S1 C7 131.4(2) 3_756 3_756 ?
O2 S1 C7 94.6(2) . 3_756 ?
O2 S1 C7 101.7(3) 3_756 3_756 ?
O1 S1 C7 99.7(2) 3_756 3_756 ?
O1 S1 C7 82.9(2) . 3_756 ?
O3 S1 C7 131.4(2) . . ?
O3 S1 C7 112.55(19) 3_756 . ?
O2 S1 C7 101.7(3) . . ?
O2 S1 C7 94.6(2) 3_756 . ?
O1 S1 C7 82.9(2) 3_756 . ?
O1 S1 C7 99.7(2) . . ?
C7 S1 C7 20.6(2) 3_756 . ?
N1 Ag1 N1 168.85(8) . 3_756 ?
C7 C7 F3 108.7(8) 3_756 3_756 ?
C7 C7 F3 44.2(6) 3_756 . ?
F3 C7 F3 86.5(5) 3_756 . ?
C7 C7 F1 103.8(12) 3_756 3_756 ?
F3 C7 F1 38.0(4) 3_756 3_756 ?
F3 C7 F1 109.1(5) . 3_756 ?
C7 C7 F2 144.6(13) 3_756 . ?
F3 C7 F2 83.0(5) 3_756 . ?
F3 C7 F2 106.2(5) . . ?
F1 C7 F2 105.1(3) 3_756 . ?
C7 C7 F1 53.6(10) 3_756 . ?
F3 C7 F1 111.4(5) 3_756 . ?
F3 C7 F1 30.8(2) . . ?
F1 C7 F1 139.7(4) 3_756 . ?
F2 C7 F1 91.1(4) . . ?
C7 C7 S1 79.71(11) 3_756 . ?
F3 C7 S1 148.0(6) 3_756 . ?
F3 C7 S1 117.0(3) . . ?
F1 C7 S1 110.4(4) 3_756 . ?
F2 C7 S1 108.3(3) . . ?
F1 C7 S1 98.5(3) . . ?
C7 C7 F2 24.2(10) 3_756 3_756 ?
F3 C7 F2 89.9(4) 3_756 3_756 ?
F3 C7 F2 54.4(3) . 3_756 ?
F1 C7 F2 79.7(3) 3_756 3_756 ?
F2 C7 F2 159.9(4) . 3_756 ?
F1 C7 F2 74.0(2) . 3_756 ?
S1 C7 F2 87.5(2) . 3_756 ?

_refine_diff_density_max         0.455
_refine_diff_density_min         -0.443
_refine_diff_density_rms         0.058

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_3
_database_code_depnum_ccdc_archive 'CCDC 1576777'
_audit_update_record             
;
2017-09-27 deposited with the CCDC.
2018-01-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C6 H4 Ag Cl N4 O3'
_chemical_formula_sum            'C6 H4 Ag Cl N4 O3'
_chemical_formula_weight         323.45

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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_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                   28.5595(19)
_cell_length_b                   5.7123(4)
_cell_length_c                   12.7499(8)
_cell_angle_alpha                90
_cell_angle_beta                 113.076(2)
_cell_angle_gamma                90
_cell_volume                     1913.6(2)
_cell_formula_units_Z            8
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    8812
_cell_measurement_theta_min      3.10
_cell_measurement_theta_max      30.05
_exptl_crystal_description       block
_exptl_crystal_colour            colourless

_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.245
_exptl_crystal_F_000             1248
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.243
_exptl_crystal_size_mid          0.156
_exptl_crystal_size_min          0.098
_exptl_absorpt_coefficient_mu    2.377
_shelx_estimated_absorpt_T_min   0.596
_shelx_estimated_absorpt_T_max   0.800
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.596
_exptl_absorpt_correction_T_max  0.800
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'


_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  'curved graphite crystal'
_diffrn_measurement_device_type  'Bruker KAPPA APEX II DUO CCD'
_diffrn_measurement_device       '62mm x 62mm CCD camera on κ-goniostat'
_diffrn_detector_area_resol_mean 16 # 8 for binned mode
_diffrn_measurement_method       'φ scans and ω scans with κ offset'
_diffrn_reflns_number            12208
_diffrn_reflns_av_unetI/netI     0.0151
_diffrn_reflns_av_R_equivalents  0.0175
_diffrn_reflns_limit_h_min       -40
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         3.101
_diffrn_reflns_theta_max         30.062
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             2798
_reflns_number_gt                2609
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX2 (Bruker AXS, 2010)'
_computing_cell_refinement       'SAINT (Bruker AXS, 2009)'
_computing_data_reduction        'SAINT (Bruker AXS, 2009)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Diamond v.4.03 (Brandenburg, 2014)'
_computing_publication_material  'SHELXL-2014 (Sheldrick, 2014)'

_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0186P)²+2.1028P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         2798
_refine_ls_number_parameters     137
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0182
_refine_ls_R_factor_gt           0.0159
_refine_ls_wR_factor_ref         0.0396
_refine_ls_wR_factor_gt          0.0386
_refine_ls_goodness_of_fit_ref   1.083
_refine_ls_restrained_S_all      1.083
_refine_ls_shift/su_max          0.000
_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.15636(5) 0.3359(2) 0.12168(12) 0.0144(2) Uani 1 1 d . . . . .
H5 H 0.1868 0.2856 0.1817 0.017 Uiso 1 1 calc R U . . .
C2 C 0.07861(5) 0.3547(2) 0.00238(11) 0.0133(2) Uani 1 1 d . . . . .
C3 C 0.02630(5) 0.2938(2) -0.05493(12) 0.0158(2) Uani 1 1 d . . . . .
C4 C 0.10341(5) 0.5449(2) -0.01812(11) 0.0128(2) Uani 1 1 d . . . . .
C5 C 0.08504(5) 0.7241(2) -0.10161(12) 0.0163(3) Uani 1 1 d . . . . .
C6 C 0.19366(5) 0.6968(2) 0.06950(13) 0.0174(3) Uani 1 1 d . . . . .
H4A H 0.2268 0.6246 0.1130 0.026 Uiso 1 1 calc R U . . .
H4B H 0.1897 0.8371 0.1095 0.026 Uiso 1 1 calc R U . . .
H4C H 0.1917 0.7403 -0.0064 0.026 Uiso 1 1 calc R U . . .
N1 N 0.11211(4) 0.2241(2) 0.09007(10) 0.0147(2) Uani 1 1 d . . . . .
N2 N -0.01589(5) 0.2485(2) -0.09967(12) 0.0211(3) Uani 1 1 d . . . . .
N3 N 0.06985(5) 0.8691(2) -0.16850(12) 0.0231(3) Uani 1 1 d . . . . .
N4 N 0.15284(4) 0.52932(19) 0.05826(10) 0.0128(2) Uani 1 1 d . . . . .
O1 O 0.14244(4) -0.37504(19) 0.30682(10) 0.0209(2) Uani 1 1 d . . . . .
O2 O 0.18694(5) -0.0145(2) 0.33602(11) 0.0254(2) Uani 1 1 d . . . . .
O3 O 0.23118(4) -0.3721(2) 0.33915(11) 0.0276(3) Uani 1 1 d . . . . .
Cl1 Cl 0.19297(2) -0.26284(6) 0.37402(3) 0.01673(7) Uani 1 1 d . . . . .
Ag1 Ag 0.09231(2) -0.06560(2) 0.18592(2) 0.01627(4) Uani 1 1 d . . . . .


_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
C1 N1 1.3297(17) . ?
C1 N4 1.3496(17) . ?
C1 H5 0.9500 . ?
C2 N1 1.3723(17) . ?
C2 C4 1.3770(19) . ?
C2 C3 1.4251(19) . ?
C3 N2 1.1426(19) . ?
C4 N4 1.3681(17) . ?
C4 C5 1.4207(19) . ?
C5 N3 1.145(2) . ?
C6 N4 1.4711(17) . ?
C6 H4A 0.9800 . ?
C6 H4B 0.9800 . ?
C6 H4C 0.9800 . ?
N1 Ag1 2.2568(12) . ?
N2 Ag1 2.2766(13) 5 ?
N3 Ag1 2.4597(14) 6_565 ?
O1 Cl1 1.5028(11) . ?
O1 Ag1 2.4126(11) . ?
O2 Cl1 1.4869(12) . ?
O3 Cl1 1.4693(13) . ?
Ag1 N2 2.2766(13) 5 ?
Ag1 N3 2.4596(14) 6_566 ?

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
N1 C1 N4 111.89(12) . . ?
N1 C1 H5 124.1 . . ?
N4 C1 H5 124.1 . . ?
N1 C2 C4 109.72(12) . . ?
N1 C2 C3 122.76(12) . . ?
C4 C2 C3 127.53(12) . . ?
N2 C3 C2 178.58(16) . . ?
N4 C4 C2 106.11(11) . . ?
N4 C4 C5 123.73(12) . . ?
C2 C4 C5 130.13(13) . . ?
N3 C5 C4 179.28(17) . . ?
N4 C6 H4A 109.5 . . ?
N4 C6 H4B 109.5 . . ?
H4A C6 H4B 109.5 . . ?
N4 C6 H4C 109.5 . . ?
H4A C6 H4C 109.5 . . ?
H4B C6 H4C 109.5 . . ?
C1 N1 C2 105.21(11) . . ?
C1 N1 Ag1 126.73(9) . . ?
C2 N1 Ag1 126.66(9) . . ?
C3 N2 Ag1 165.64(12) . 5 ?
C5 N3 Ag1 139.22(13) . 6_565 ?
C1 N4 C4 107.08(11) . . ?
C1 N4 C6 127.16(12) . . ?
C4 N4 C6 125.75(11) . . ?
Cl1 O1 Ag1 104.39(6) . . ?
O3 Cl1 O2 108.15(8) . . ?
O3 Cl1 O1 107.91(7) . . ?
O2 Cl1 O1 104.98(6) . . ?
N1 Ag1 N2 118.12(5) . 5 ?
N1 Ag1 O1 132.17(4) . . ?
N2 Ag1 O1 100.88(4) 5 . ?
N1 Ag1 N3 105.60(5) . 6_566 ?
N2 Ag1 N3 95.15(5) 5 6_566 ?
O1 Ag1 N3 96.72(5) . 6_566 ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C4 N4 0.13(16) . . . . ?
C3 C2 C4 N4 179.71(14) . . . . ?
N1 C2 C4 C5 178.16(14) . . . . ?
C3 C2 C4 C5 -2.3(3) . . . . ?
N4 C1 N1 C2 -0.45(16) . . . . ?
N4 C1 N1 Ag1 -167.56(9) . . . . ?
C4 C2 N1 C1 0.19(16) . . . . ?
C3 C2 N1 C1 -179.42(13) . . . . ?
C4 C2 N1 Ag1 167.31(9) . . . . ?
C3 C2 N1 Ag1 -12.30(19) . . . . ?
N1 C1 N4 C4 0.54(16) . . . . ?
N1 C1 N4 C6 179.26(13) . . . . ?
C2 C4 N4 C1 -0.39(15) . . . . ?
C5 C4 N4 C1 -178.58(13) . . . . ?
C2 C4 N4 C6 -179.14(13) . . . . ?
C5 C4 N4 C6 2.7(2) . . . . ?
Ag1 O1 Cl1 O3 -113.44(7) . . . . ?
Ag1 O1 Cl1 O2 1.73(8) . . . . ?

_refine_diff_density_max         0.421
_refine_diff_density_min         -0.674
_refine_diff_density_rms         0.084

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2
_database_code_depnum_ccdc_archive 'CCDC 1576776'
_audit_update_record             
;
2017-09-27 deposited with the CCDC.
2018-01-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C6 H4 Ag N5 O3'
_chemical_formula_sum            'C6 H4 Ag N5 O3'
_chemical_formula_weight         302.01

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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

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

_cell_length_a                   5.8782(2)
_cell_length_b                   8.5137(3)
_cell_length_c                   17.6073(6)
_cell_angle_alpha                90
_cell_angle_beta                 93.1060(10)
_cell_angle_gamma                90
_cell_volume                     879.87(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    7925
_cell_measurement_theta_min      2.32
_cell_measurement_theta_max      29.98
_exptl_crystal_description       needle
_exptl_crystal_colour            colourless

_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.280
_exptl_crystal_F_000             584
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.064
_exptl_crystal_size_min          0.038
_exptl_absorpt_coefficient_mu    2.285
_shelx_estimated_absorpt_T_min   0.804
_shelx_estimated_absorpt_T_max   0.918
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.804
_exptl_absorpt_correction_T_max  0.918
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'


_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  'curved graphite crystal'
_diffrn_measurement_device_type  'Bruker KAPPA APEX II DUO CCD'
_diffrn_measurement_device       '62mm x 62mm CCD camera on κ-goniostat'
_diffrn_detector_area_resol_mean 16 # 8 for binned mode
_diffrn_measurement_method       'φ scans and ω scans with κ offset'
_diffrn_reflns_number            12410
_diffrn_reflns_av_unetI/netI     0.0144
_diffrn_reflns_av_R_equivalents  0.0185
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         2.317
_diffrn_reflns_theta_max         29.995
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             2571
_reflns_number_gt                2363
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX2 (Bruker AXS, 2010)'
_computing_cell_refinement       'SAINT (Bruker AXS, 2009)'
_computing_data_reduction        'SAINT (Bruker AXS, 2009)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Diamond v.4.03 (Brandenburg, 2014)'
_computing_publication_material  'SHELXL-2014 (Sheldrick, 2014)'

_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0178P)²+0.9879P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         2571
_refine_ls_number_parameters     137
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0228
_refine_ls_R_factor_gt           0.0194
_refine_ls_wR_factor_ref         0.0444
_refine_ls_wR_factor_gt          0.0431
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_restrained_S_all      1.061
_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.1382(3) 0.6485(2) 0.84123(10) 0.0157(3) Uani 1 1 d . . . . .
H5 H 0.1792 0.6133 0.7926 0.019 Uiso 1 1 calc R U . . .
C2 C 0.1374(3) 0.7731(2) 0.94704(9) 0.0145(3) Uani 1 1 d . . . . .
C3 C 0.2099(3) 0.8783(2) 1.00677(10) 0.0165(3) Uani 1 1 d . . . . .
C4 C -0.0475(3) 0.6733(2) 0.94494(9) 0.0139(3) Uani 1 1 d . . . . .
C5 C -0.2182(3) 0.6519(2) 0.99826(10) 0.0161(3) Uani 1 1 d . . . . .
C6 C -0.1996(3) 0.4682(2) 0.85061(10) 0.0175(3) Uani 1 1 d . . . . .
H6A H -0.1651 0.4372 0.7989 0.026 Uiso 1 1 calc R U . . .
H6B H -0.3569 0.5062 0.8507 0.026 Uiso 1 1 calc R U . . .
H6C H -0.1810 0.3773 0.8846 0.026 Uiso 1 1 calc R U . . .
N1 N 0.2524(2) 0.75731(17) 0.88180(8) 0.0156(3) Uani 1 1 d . . . . .
N3 N -0.3528(3) 0.6366(2) 1.04255(9) 0.0237(3) Uani 1 1 d . . . . .
N2 N 0.7325(3) 1.03866(19) 0.94510(9) 0.0212(3) Uani 1 1 d . . . . .
N4 N -0.0430(2) 0.59395(16) 0.87716(8) 0.0135(3) Uani 1 1 d . . . . .
N5 N 0.2934(3) 1.22431(18) 0.78459(8) 0.0171(3) Uani 1 1 d . . . . .
O1 O 0.7788(2) 0.84520(15) 0.75085(8) 0.0216(3) Uani 1 1 d . . . . .
O2 O 0.4987(2) 1.18394(16) 0.77986(8) 0.0228(3) Uani 1 1 d . . . . .
O3 O 0.1630(2) 1.14453(17) 0.82204(8) 0.0247(3) Uani 1 1 d . . . . .
Ag1 Ag 0.52114(2) 0.92637(2) 0.84383(2) 0.01822(5) Uani 1 1 d . . . . .


_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
C1 N1 1.329(2) . ?
C1 N4 1.350(2) . ?
C1 H5 0.9500 . ?
C2 N1 1.371(2) . ?
C2 C4 1.378(2) . ?
C2 C3 1.429(2) . ?
C3 N2 1.141(2) 3_677 ?
C4 N4 1.373(2) . ?
C4 C5 1.422(2) . ?
C5 N3 1.148(2) . ?
C6 N4 1.472(2) . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
N1 Ag1 2.2645(14) . ?
N2 C3 1.141(2) 3_677 ?
N2 Ag1 2.3230(16) . ?
N5 O3 1.240(2) . ?
N5 O2 1.262(2) . ?
N5 O1 1.265(2) 2_656 ?
O1 N5 1.265(2) 2_646 ?
O1 Ag1 2.3918(14) . ?
O2 Ag1 2.4654(14) . ?

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
N1 C1 N4 112.11(15) . . ?
N1 C1 H5 123.9 . . ?
N4 C1 H5 123.9 . . ?
N1 C2 C4 109.96(15) . . ?
N1 C2 C3 122.49(16) . . ?
C4 C2 C3 127.55(16) . . ?
N2 C3 C2 179.4(2) 3_677 . ?
N4 C4 C2 105.91(15) . . ?
N4 C4 C5 123.92(15) . . ?
C2 C4 C5 130.15(16) . . ?
N3 C5 C4 178.37(19) . . ?
N4 C6 H6A 109.5 . . ?
N4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
N4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C1 N1 C2 105.11(14) . . ?
C1 N1 Ag1 128.64(12) . . ?
C2 N1 Ag1 124.67(11) . . ?
C3 N2 Ag1 161.82(15) 3_677 . ?
C1 N4 C4 106.91(14) . . ?
C1 N4 C6 126.67(14) . . ?
C4 N4 C6 126.36(15) . . ?
O3 N5 O2 120.44(16) . . ?
O3 N5 O1 120.48(15) . 2_656 ?
O2 N5 O1 119.06(15) . 2_656 ?
N5 O1 Ag1 111.38(11) 2_646 . ?
N5 O2 Ag1 103.87(11) . . ?
N1 Ag1 N2 112.80(6) . . ?
N1 Ag1 O1 119.75(5) . . ?
N2 Ag1 O1 108.19(5) . . ?
N1 Ag1 O2 132.79(5) . . ?
N2 Ag1 O2 89.87(5) . . ?
O1 Ag1 O2 87.96(5) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C4 N4 0.65(19) . . . . ?
C3 C2 C4 N4 -178.51(16) . . . . ?
N1 C2 C4 C5 -178.05(17) . . . . ?
C3 C2 C4 C5 2.8(3) . . . . ?
N4 C1 N1 C2 -0.14(19) . . . . ?
N4 C1 N1 Ag1 -166.11(11) . . . . ?
C4 C2 N1 C1 -0.33(19) . . . . ?
C3 C2 N1 C1 178.88(16) . . . . ?
C4 C2 N1 Ag1 166.36(11) . . . . ?
C3 C2 N1 Ag1 -14.4(2) . . . . ?
N1 C1 N4 C4 0.54(19) . . . . ?
N1 C1 N4 C6 -176.80(15) . . . . ?
C2 C4 N4 C1 -0.71(18) . . . . ?
C5 C4 N4 C1 178.10(16) . . . . ?
C2 C4 N4 C6 176.64(15) . . . . ?
C5 C4 N4 C6 -4.6(3) . . . . ?
O3 N5 O2 Ag1 6.18(18) . . . . ?
O1 N5 O2 Ag1 -172.19(12) 2_656 . . . ?

_refine_diff_density_max         0.963
_refine_diff_density_min         -0.714
_refine_diff_density_rms         0.082

