# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# 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. 
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data_n150407d
_database_code_depnum_ccdc_archive 'CCDC 1059661'
_audit_update_record             
;
2015-04-15 deposited with the CCDC.
2015-09-25 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C24 H24 Ag2 B2 F8 N12'
_chemical_formula_weight         869.91

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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 '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                   11.6184(4)
_cell_length_b                   20.1448(6)
_cell_length_c                   13.2501(4)
_cell_angle_alpha                90
_cell_angle_beta                 102.0930(10)
_cell_angle_gamma                90
_cell_volume                     3032.37(17)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9348
_cell_measurement_theta_min      2.56
_cell_measurement_theta_max      28.30

_exptl_crystal_description       BLOCK
_exptl_crystal_colour            COLOURLESS
_exptl_crystal_density_meas      NONE
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.905
_exptl_crystal_F_000             1712
_exptl_transmission_factor_min   0.698
_exptl_transmission_factor_max   0.770
_exptl_crystal_size_max          0.280
_exptl_crystal_size_mid          0.210
_exptl_crystal_size_min          0.200
_exptl_absorpt_coefficient_mu    1.381
_shelx_estimated_absorpt_T_min   0.698
_shelx_estimated_absorpt_T_max   0.770
_exptl_absorpt_correction_type   MULTI-SCAN
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            17352
_diffrn_reflns_av_unetI/netI     0.0229
_diffrn_reflns_av_R_equivalents  0.0231
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_theta_min         1.869
_diffrn_reflns_theta_max         25.006
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 0.977
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 0.977
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 0.977
_reflns_number_total             5350
_reflns_number_gt                4804
_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       'Bruker SMART'
_computing_cell_refinement       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_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)+(0.0176P)²+2.8913P] 
 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         5350
_refine_ls_number_parameters     436
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0271
_refine_ls_R_factor_gt           0.0227
_refine_ls_wR_factor_ref         0.0506
_refine_ls_wR_factor_gt          0.0488
_refine_ls_goodness_of_fit_ref   1.069
_refine_ls_restrained_S_all      1.069
_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
Ag1 Ag -0.01536(2) -0.12056(2) 0.46129(2) 0.02291(6) Uani 1 1 d . . . . .
Ag2 Ag 0.23915(2) -0.00417(2) 0.52394(2) 0.02228(6) Uani 1 1 d . . . . .
N1 N 0.25952(18) -0.11158(9) 0.53317(16) 0.0188(4) Uani 1 1 d . . . . .
N2 N 0.16621(17) -0.15627(10) 0.51618(16) 0.0187(4) Uani 1 1 d . . . . .
N3 N 0.33096(17) -0.21207(9) 0.55294(15) 0.0147(4) Uani 1 1 d . . . . .
N4 N 0.35966(17) -0.32596(10) 0.56308(16) 0.0195(4) Uani 1 1 d . . . . .
N5 N 0.07247(18) 0.02765(10) 0.38834(16) 0.0228(5) Uani 1 1 d . . . . .
N6 N -0.00766(18) -0.02435(10) 0.36018(16) 0.0211(5) Uani 1 1 d . . . . .
N7 N -0.00199(17) 0.03455(9) 0.22190(15) 0.0159(4) Uani 1 1 d . . . . .
N8 N -0.11592(17) 0.02011(10) 0.05823(16) 0.0182(4) Uani 1 1 d . . . . .
N9 N 0.28859(17) 0.09520(9) 0.58470(16) 0.0192(5) Uani 1 1 d . . . . .
N10 N 0.20541(17) 0.14559(10) 0.57230(17) 0.0211(5) Uani 1 1 d . . . . .
N11 N 0.38007(17) 0.18959(9) 0.62108(15) 0.0164(4) Uani 1 1 d . . . . .
N12 N 0.58231(19) 0.21411(10) 0.66590(16) 0.0242(5) Uani 1 1 d . . . . .
B1 B 0.4016(3) 0.02945(15) 0.3225(2) 0.0243(7) Uani 1 1 d . . . . .
B2 B 0.0714(3) 0.24481(14) 0.7643(2) 0.0234(6) Uani 1 1 d . . . . .
F1 F 0.51996(14) 0.02245(8) 0.32035(13) 0.0328(4) Uani 1 1 d . . . . .
F2 F 0.38824(14) 0.08583(8) 0.38104(13) 0.0361(4) Uani 1 1 d . . . . .
F3 F 0.33595(16) 0.03740(9) 0.22395(13) 0.0482(5) Uani 1 1 d . . . . .
F4 F 0.36495(16) -0.02693(8) 0.36888(14) 0.0418(4) Uani 1 1 d . . . . .
F5 F 0.11185(13) 0.18097(7) 0.79404(13) 0.0311(4) Uani 1 1 d . . . . .
F6 F 0.16750(13) 0.28617(7) 0.76219(13) 0.0318(4) Uani 1 1 d . . . . .
F7 F 0.00750(17) 0.26986(9) 0.83294(16) 0.0511(5) Uani 1 1 d . . . . .
F8 F 0.00076(16) 0.24177(8) 0.66616(14) 0.0467(5) Uani 1 1 d . . . . .
C1 C 0.2115(2) -0.21564(12) 0.52875(18) 0.0177(5) Uani 1 1 d . . . . .
H1 H 0.1673 -0.2557 0.5220 0.021 Uiso 1 1 calc R U . . .
C2 C 0.3564(2) -0.14622(11) 0.55466(18) 0.0173(5) Uani 1 1 d . . . . .
H2 H 0.4336 -0.1280 0.5694 0.021 Uiso 1 1 calc R U . . .
C3 C 0.4118(2) -0.26709(11) 0.57331(18) 0.0163(5) Uani 1 1 d . . . . .
C4 C 0.5319(2) -0.25692(12) 0.60113(18) 0.0184(5) Uani 1 1 d . . . . .
H4 H 0.5645 -0.2135 0.6084 0.022 Uiso 1 1 calc R U . . .
C5 C 0.6028(2) -0.31294(13) 0.61792(19) 0.0228(6) Uani 1 1 d . . . . .
H5 H 0.6859 -0.3083 0.6369 0.027 Uiso 1 1 calc R U . . .
C6 C 0.5525(2) -0.37600(13) 0.60712(19) 0.0214(5) Uani 1 1 d . . . . .
C7 C 0.4309(2) -0.37888(12) 0.5808(2) 0.0232(6) Uani 1 1 d . . . . .
H7 H 0.3952 -0.4215 0.5748 0.028 Uiso 1 1 calc R U . . .
C8 C 0.6259(2) -0.43877(14) 0.6227(2) 0.0324(7) Uani 1 1 d . . . . .
H8A H 0.6617 -0.4439 0.6961 0.049 Uiso 1 1 calc R U . . .
H8B H 0.6879 -0.4359 0.5828 0.049 Uiso 1 1 calc R U . . .
H8C H 0.5755 -0.4771 0.5992 0.049 Uiso 1 1 calc R U . . .
C9 C -0.0496(2) -0.01880(12) 0.2620(2) 0.0204(5) Uani 1 1 d . . . . .
H9 H -0.1061 -0.0480 0.2229 0.024 Uiso 1 1 calc R U . . .
C10 C 0.0735(2) 0.06163(12) 0.30438(19) 0.0208(5) Uani 1 1 d . . . . .
H10 H 0.1204 0.0999 0.3013 0.025 Uiso 1 1 calc R U . . .
C11 C -0.0321(2) 0.05653(11) 0.11664(18) 0.0163(5) Uani 1 1 d . . . . .
C12 C 0.0210(2) 0.11108(11) 0.0834(2) 0.0200(5) Uani 1 1 d . . . . .
H12 H 0.0818 0.1346 0.1284 0.024 Uiso 1 1 calc R U . . .
C13 C -0.0180(2) 0.13007(12) -0.0185(2) 0.0218(6) Uani 1 1 d . . . . .
H13 H 0.0158 0.1677 -0.0445 0.026 Uiso 1 1 calc R U . . .
C14 C -0.1066(2) 0.09435(12) -0.08318(19) 0.0197(5) Uani 1 1 d . . . . .
C15 C -0.1506(2) 0.03917(12) -0.04022(19) 0.0186(5) Uani 1 1 d . . . . .
H15 H -0.2091 0.0133 -0.0838 0.022 Uiso 1 1 calc R U . . .
C16 C -0.1560(2) 0.11401(13) -0.1934(2) 0.0253(6) Uani 1 1 d . . . . .
H16A H -0.1861 0.0745 -0.2336 0.038 Uiso 1 1 calc R U . . .
H16B H -0.0939 0.1345 -0.2228 0.038 Uiso 1 1 calc R U . . .
H16C H -0.2203 0.1458 -0.1956 0.038 Uiso 1 1 calc R U . . .
C17 C 0.3920(2) 0.12268(12) 0.61365(19) 0.0201(5) Uani 1 1 d . . . . .
H17 H 0.4647 0.0994 0.6275 0.024 Uiso 1 1 calc R U . . .
C18 C 0.2627(2) 0.20133(12) 0.5946(2) 0.0215(6) Uani 1 1 d . . . . .
H18 H 0.2272 0.2439 0.5926 0.026 Uiso 1 1 calc R U . . .
C19 C 0.4435(2) 0.30213(12) 0.65405(18) 0.0185(5) Uani 1 1 d . . . . .
H19 H 0.3635 0.3157 0.6427 0.022 Uiso 1 1 calc R U . . .
C20 C 0.5331(2) 0.34728(13) 0.6760(2) 0.0238(6) Uani 1 1 d . . . . .
H20 H 0.5151 0.3931 0.6800 0.029 Uiso 1 1 calc R U . . .
C21 C 0.6498(2) 0.32740(12) 0.69243(18) 0.0187(5) Uani 1 1 d . . . . .
C22 C 0.6708(2) 0.25974(12) 0.68823(19) 0.0217(5) Uani 1 1 d . . . . .
H22 H 0.7500 0.2446 0.7014 0.026 Uiso 1 1 calc R U . . .
C23 C 0.7491(3) 0.37663(14) 0.7096(2) 0.0333(7) Uani 1 1 d . . . . .
H23A H 0.7603 0.3934 0.6429 0.050 Uiso 1 1 calc R U . . .
H23B H 0.8216 0.3549 0.7459 0.050 Uiso 1 1 calc R U . . .
H23C H 0.7303 0.4137 0.7513 0.050 Uiso 1 1 calc R U . . .
C24 C 0.4729(2) 0.23775(12) 0.64912(17) 0.0173(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
Ag1 N2 2.203(2) . ?
Ag1 N10 2.217(2) 3_556 ?
Ag1 N6 2.368(2) . ?
Ag2 N1 2.1772(19) . ?
Ag2 N9 2.1891(19) . ?
Ag2 N5 2.435(2) . ?
N1 C2 1.304(3) . ?
N1 N2 1.391(3) . ?
N2 C1 1.303(3) . ?
N3 C2 1.358(3) . ?
N3 C1 1.360(3) . ?
N3 C3 1.441(3) . ?
N4 C3 1.326(3) . ?
N4 C7 1.339(3) . ?
N5 C10 1.308(3) . ?
N5 N6 1.399(3) . ?
N6 C9 1.295(3) . ?
N7 C10 1.364(3) . ?
N7 C9 1.366(3) . ?
N7 C11 1.435(3) . ?
N8 C11 1.330(3) . ?
N8 C15 1.338(3) . ?
N9 C17 1.305(3) . ?
N9 N10 1.387(3) . ?
N10 C18 1.307(3) . ?
N10 Ag1 2.217(2) 3_556 ?
N11 C18 1.356(3) . ?
N11 C17 1.361(3) . ?
N11 C24 1.441(3) . ?
N12 C24 1.331(3) . ?
N12 C22 1.365(3) . ?
B1 F3 1.377(3) . ?
B1 F1 1.388(3) . ?
B1 F4 1.399(3) . ?
B1 F2 1.402(3) . ?
B2 F7 1.384(4) . ?
B2 F8 1.387(3) . ?
B2 F5 1.397(3) . ?
B2 F6 1.398(3) . ?
C1 H1 0.9500 . ?
C2 H2 0.9500 . ?
C3 C4 1.382(3) . ?
C4 C5 1.387(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.393(4) . ?
C5 H5 0.9500 . ?
C6 C7 1.385(4) . ?
C6 C8 1.514(3) . ?
C7 H7 0.9500 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9 0.9500 . ?
C10 H10 0.9500 . ?
C11 C12 1.377(3) . ?
C12 C13 1.386(4) . ?
C12 H12 0.9500 . ?
C13 C14 1.393(4) . ?
C13 H13 0.9500 . ?
C14 C15 1.394(3) . ?
C14 C16 1.506(4) . ?
C15 H15 0.9500 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C24 1.346(3) . ?
C19 C20 1.367(3) . ?
C19 H19 0.9500 . ?
C20 C21 1.387(4) . ?
C20 H20 0.9500 . ?
C21 C22 1.388(3) . ?
C21 C23 1.502(3) . ?
C22 H22 0.9500 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?

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
N2 Ag1 N10 146.77(7) . 3_556 ?
N2 Ag1 N6 107.88(7) . . ?
N10 Ag1 N6 103.09(7) 3_556 . ?
N1 Ag2 N9 150.58(8) . . ?
N1 Ag2 N5 111.31(7) . . ?
N9 Ag2 N5 97.90(7) . . ?
C2 N1 N2 107.27(19) . . ?
C2 N1 Ag2 128.51(16) . . ?
N2 N1 Ag2 124.22(15) . . ?
C1 N2 N1 107.06(19) . . ?
C1 N2 Ag1 132.44(16) . . ?
N1 N2 Ag1 120.14(14) . . ?
C2 N3 C1 105.28(19) . . ?
C2 N3 C3 128.1(2) . . ?
C1 N3 C3 126.63(19) . . ?
C3 N4 C7 116.2(2) . . ?
C10 N5 N6 106.8(2) . . ?
C10 N5 Ag2 128.13(17) . . ?
N6 N5 Ag2 112.42(14) . . ?
C9 N6 N5 107.0(2) . . ?
C9 N6 Ag1 126.02(16) . . ?
N5 N6 Ag1 124.31(15) . . ?
C10 N7 C9 104.4(2) . . ?
C10 N7 C11 129.8(2) . . ?
C9 N7 C11 125.8(2) . . ?
C11 N8 C15 116.3(2) . . ?
C17 N9 N10 107.45(19) . . ?
C17 N9 Ag2 130.57(17) . . ?
N10 N9 Ag2 120.19(14) . . ?
C18 N10 N9 107.02(19) . . ?
C18 N10 Ag1 132.78(17) . 3_556 ?
N9 N10 Ag1 119.81(14) . 3_556 ?
C18 N11 C17 105.43(19) . . ?
C18 N11 C24 127.4(2) . . ?
C17 N11 C24 127.1(2) . . ?
C24 N12 C22 116.4(2) . . ?
F3 B1 F1 110.3(2) . . ?
F3 B1 F4 110.6(2) . . ?
F1 B1 F4 108.7(2) . . ?
F3 B1 F2 109.1(2) . . ?
F1 B1 F2 108.6(2) . . ?
F4 B1 F2 109.6(2) . . ?
F7 B2 F8 109.8(2) . . ?
F7 B2 F5 110.2(2) . . ?
F8 B2 F5 108.8(2) . . ?
F7 B2 F6 109.7(2) . . ?
F8 B2 F6 109.0(2) . . ?
F5 B2 F6 109.4(2) . . ?
N2 C1 N3 110.3(2) . . ?
N2 C1 H1 124.9 . . ?
N3 C1 H1 124.9 . . ?
N1 C2 N3 110.1(2) . . ?
N1 C2 H2 124.9 . . ?
N3 C2 H2 124.9 . . ?
N4 C3 C4 125.0(2) . . ?
N4 C3 N3 113.8(2) . . ?
C4 C3 N3 121.2(2) . . ?
C3 C4 C5 117.0(2) . . ?
C3 C4 H4 121.5 . . ?
C5 C4 H4 121.5 . . ?
C4 C5 C6 120.3(2) . . ?
C4 C5 H5 119.9 . . ?
C6 C5 H5 119.9 . . ?
C7 C6 C5 116.6(2) . . ?
C7 C6 C8 121.0(2) . . ?
C5 C6 C8 122.4(2) . . ?
N4 C7 C6 124.8(2) . . ?
N4 C7 H7 117.6 . . ?
C6 C7 H7 117.6 . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N6 C9 N7 111.1(2) . . ?
N6 C9 H9 124.4 . . ?
N7 C9 H9 124.4 . . ?
N5 C10 N7 110.7(2) . . ?
N5 C10 H10 124.7 . . ?
N7 C10 H10 124.7 . . ?
N8 C11 C12 125.2(2) . . ?
N8 C11 N7 113.3(2) . . ?
C12 C11 N7 121.5(2) . . ?
C11 C12 C13 117.0(2) . . ?
C11 C12 H12 121.5 . . ?
C13 C12 H12 121.5 . . ?
C12 C13 C14 120.4(2) . . ?
C12 C13 H13 119.8 . . ?
C14 C13 H13 119.8 . . ?
C13 C14 C15 116.6(2) . . ?
C13 C14 C16 122.9(2) . . ?
C15 C14 C16 120.5(2) . . ?
N8 C15 C14 124.5(2) . . ?
N8 C15 H15 117.8 . . ?
C14 C15 H15 117.8 . . ?
C14 C16 H16A 109.5 . . ?
C14 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C14 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
N9 C17 N11 109.9(2) . . ?
N9 C17 H17 125.1 . . ?
N11 C17 H17 125.1 . . ?
N10 C18 N11 110.2(2) . . ?
N10 C18 H18 124.9 . . ?
N11 C18 H18 124.9 . . ?
C24 C19 C20 117.5(2) . . ?
C24 C19 H19 121.3 . . ?
C20 C19 H19 121.3 . . ?
C19 C20 C21 121.2(2) . . ?
C19 C20 H20 119.4 . . ?
C21 C20 H20 119.4 . . ?
C20 C21 C22 116.8(2) . . ?
C20 C21 C23 121.9(2) . . ?
C22 C21 C23 121.3(2) . . ?
N12 C22 C21 122.7(2) . . ?
N12 C22 H22 118.7 . . ?
C21 C22 H22 118.7 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
N12 C24 C19 125.4(2) . . ?
N12 C24 N11 116.1(2) . . ?
C19 C24 N11 118.5(2) . . ?

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
C2 N1 N2 C1 0.3(3) . . . . ?
Ag2 N1 N2 C1 -179.70(16) . . . . ?
C2 N1 N2 Ag1 -173.61(16) . . . . ?
Ag2 N1 N2 Ag1 6.4(2) . . . . ?
C10 N5 N6 C9 0.1(3) . . . . ?
Ag2 N5 N6 C9 -145.22(16) . . . . ?
C10 N5 N6 Ag1 162.53(16) . . . . ?
Ag2 N5 N6 Ag1 17.2(2) . . . . ?
C17 N9 N10 C18 -0.1(3) . . . . ?
Ag2 N9 N10 C18 -166.47(17) . . . . ?
C17 N9 N10 Ag1 -173.80(16) . . . 3_556 ?
Ag2 N9 N10 Ag1 19.9(2) . . . 3_556 ?
N1 N2 C1 N3 -0.3(3) . . . . ?
Ag1 N2 C1 N3 172.59(16) . . . . ?
C2 N3 C1 N2 0.1(3) . . . . ?
C3 N3 C1 N2 179.5(2) . . . . ?
N2 N1 C2 N3 -0.2(3) . . . . ?
Ag2 N1 C2 N3 179.77(15) . . . . ?
C1 N3 C2 N1 0.1(3) . . . . ?
C3 N3 C2 N1 -179.3(2) . . . . ?
C7 N4 C3 C4 -0.5(4) . . . . ?
C7 N4 C3 N3 179.7(2) . . . . ?
C2 N3 C3 N4 -178.5(2) . . . . ?
C1 N3 C3 N4 2.3(3) . . . . ?
C2 N3 C3 C4 1.8(4) . . . . ?
C1 N3 C3 C4 -177.5(2) . . . . ?
N4 C3 C4 C5 1.1(4) . . . . ?
N3 C3 C4 C5 -179.2(2) . . . . ?
C3 C4 C5 C6 -0.3(3) . . . . ?
C4 C5 C6 C7 -0.9(4) . . . . ?
C4 C5 C6 C8 178.9(2) . . . . ?
C3 N4 C7 C6 -0.8(4) . . . . ?
C5 C6 C7 N4 1.5(4) . . . . ?
C8 C6 C7 N4 -178.3(2) . . . . ?
N5 N6 C9 N7 -0.1(3) . . . . ?
Ag1 N6 C9 N7 -162.12(15) . . . . ?
C10 N7 C9 N6 0.0(3) . . . . ?
C11 N7 C9 N6 -177.5(2) . . . . ?
N6 N5 C10 N7 -0.1(3) . . . . ?
Ag2 N5 C10 N7 137.94(18) . . . . ?
C9 N7 C10 N5 0.1(3) . . . . ?
C11 N7 C10 N5 177.4(2) . . . . ?
C15 N8 C11 C12 -0.5(3) . . . . ?
C15 N8 C11 N7 178.14(19) . . . . ?
C10 N7 C11 N8 -175.5(2) . . . . ?
C9 N7 C11 N8 1.3(3) . . . . ?
C10 N7 C11 C12 3.2(4) . . . . ?
C9 N7 C11 C12 -180.0(2) . . . . ?
N8 C11 C12 C13 1.4(4) . . . . ?
N7 C11 C12 C13 -177.1(2) . . . . ?
C11 C12 C13 C14 -0.5(3) . . . . ?
C12 C13 C14 C15 -1.1(3) . . . . ?
C12 C13 C14 C16 177.6(2) . . . . ?
C11 N8 C15 C14 -1.3(3) . . . . ?
C13 C14 C15 N8 2.1(4) . . . . ?
C16 C14 C15 N8 -176.6(2) . . . . ?
N10 N9 C17 N11 0.1(3) . . . . ?
Ag2 N9 C17 N11 164.55(16) . . . . ?
C18 N11 C17 N9 -0.1(3) . . . . ?
C24 N11 C17 N9 -179.0(2) . . . . ?
N9 N10 C18 N11 0.1(3) . . . . ?
Ag1 N10 C18 N11 172.58(16) 3_556 . . . ?
C17 N11 C18 N10 0.0(3) . . . . ?
C24 N11 C18 N10 178.9(2) . . . . ?
C24 C19 C20 C21 0.0(4) . . . . ?
C19 C20 C21 C22 -1.6(4) . . . . ?
C19 C20 C21 C23 175.9(2) . . . . ?
C24 N12 C22 C21 -0.7(3) . . . . ?
C20 C21 C22 N12 2.0(4) . . . . ?
C23 C21 C22 N12 -175.5(2) . . . . ?
C22 N12 C24 C19 -1.1(4) . . . . ?
C22 N12 C24 N11 177.3(2) . . . . ?
C20 C19 C24 N12 1.5(4) . . . . ?
C20 C19 C24 N11 -176.9(2) . . . . ?
C18 N11 C24 N12 -176.0(2) . . . . ?
C17 N11 C24 N12 2.6(3) . . . . ?
C18 N11 C24 C19 2.5(4) . . . . ?
C17 N11 C24 C19 -178.9(2) . . . . ?

_refine_diff_density_max         0.373
_refine_diff_density_min         -0.465
_refine_diff_density_rms         0.062

_shelxl_version_number           2013-2

####################################################################### 
# 
# 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_n150525b
_database_code_depnum_ccdc_archive 'CCDC 1413788'
_audit_update_record             
;
2015-07-18 deposited with the CCDC.
2015-09-25 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C10 H12 Ag F3 N4 O4'
_chemical_formula_weight         417.11

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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'

_cell_length_a                   6.482(2)
_cell_length_b                   8.871(3)
_cell_length_c                   12.896(4)
_cell_angle_alpha                79.298(7)
_cell_angle_beta                 84.228(7)
_cell_angle_gamma                86.626(6)
_cell_volume                     724.3(4)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    1408
_cell_measurement_theta_min      2.34
_cell_measurement_theta_max      23.58

_exptl_crystal_description       BLOCK
_exptl_crystal_colour            Yellow
_exptl_crystal_density_meas      NONE
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.912
_exptl_crystal_F_000             412
_exptl_transmission_factor_min   0.812
_exptl_transmission_factor_max   0.834
_exptl_crystal_size_max          0.150
_exptl_crystal_size_mid          0.140
_exptl_crystal_size_min          0.130
_exptl_absorpt_coefficient_mu    1.448
_shelx_estimated_absorpt_T_min   0.812
_shelx_estimated_absorpt_T_max   0.834
_exptl_absorpt_correction_type   MULTI-SCAN
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            5395
_diffrn_reflns_av_unetI/netI     0.0462
_diffrn_reflns_av_R_equivalents  0.0215
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_theta_min         1.614
_diffrn_reflns_theta_max         28.271
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.989
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.989
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             3554
_reflns_number_gt                2345
_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       'Bruker SMART'
_computing_cell_refinement       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_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)+(0.0339P)²+0.2935P] 
 where P=(Fo²+2Fc²)/3 
;
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         3554
_refine_ls_number_parameters     210
_refine_ls_number_restraints     12
_refine_ls_R_factor_all          0.0743
_refine_ls_R_factor_gt           0.0400
_refine_ls_wR_factor_ref         0.0917
_refine_ls_wR_factor_gt          0.0773
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_restrained_S_all      1.038
_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
Ag1 Ag -0.49543(5) 0.69636(4) 0.01997(3) 0.06065(14) Uani 1 1 d . . . . .
O1W O -0.6599(4) 0.8580(3) 0.1412(2) 0.0513(7) Uani 1 1 d . . . . .
H1A H -0.5832 0.8446 0.1922 0.077 Uiso 1 1 d R U . . .
H1B H -0.7850 0.8641 0.1676 0.077 Uiso 1 1 d R U . . .
O2W O -0.2315(4) 0.8799(3) -0.0011(2) 0.0521(7) Uani 1 1 d . . . . .
H2A H -0.2086 0.8922 0.0605 0.078 Uiso 1 1 d R U . . .
H2B H -0.2520 0.9685 -0.0379 0.078 Uiso 1 1 d R U . . .
O3 O 0.6132(5) 0.8205(4) 0.2919(3) 0.0824(10) Uani 1 1 d . . . . .
O4 O 0.9108(4) 0.8822(3) 0.1970(2) 0.0602(7) Uani 1 1 d . . . . .
N1 N 0.2460(5) 0.4769(4) 0.2457(3) 0.0608(9) Uani 1 1 d . . . . .
N2 N -0.0029(4) 0.3837(3) 0.1632(2) 0.0399(7) Uani 1 1 d . . . . .
N3 N -0.2531(5) 0.5122(3) 0.0798(2) 0.0451(7) Uani 1 1 d . . . . .
N4 N -0.2651(4) 0.3583(3) 0.0752(2) 0.0432(7) Uani 1 1 d . . . . .
C1 C -0.0954(6) 0.5231(4) 0.1332(3) 0.0466(9) Uani 1 1 d . . . . .
H1 H -0.0519 0.6162 0.1487 0.056 Uiso 1 1 calc R U . . .
C2 C -0.1150(6) 0.2857(4) 0.1252(3) 0.0441(9) Uani 1 1 d . . . . .
H2 H -0.0873 0.1780 0.1340 0.053 Uiso 1 1 calc R U . . .
C3 C 0.1739(5) 0.3526(4) 0.2238(3) 0.0403(8) Uani 1 1 d . . . . .
C4 C 0.2482(6) 0.2084(5) 0.2554(3) 0.0537(10) Uani 1 1 d . . . . .
H4 H 0.1902 0.1232 0.2356 0.064 Uiso 1 1 calc R U . . .
C5 C 0.4118(6) 0.1890(5) 0.3177(3) 0.0597(11) Uani 1 1 d . . . . .
H5 H 0.4694 0.0891 0.3414 0.072 Uiso 1 1 calc R U . . .
C6 C 0.4917(6) 0.3146(5) 0.3458(3) 0.0557(11) Uani 1 1 d . . . . .
C7 C 0.4050(7) 0.4553(5) 0.3066(4) 0.0665(12) Uani 1 1 d . . . . .
H7 H 0.4609 0.5433 0.3235 0.080 Uiso 1 1 calc R U . . .
C8 C 0.6641(7) 0.2998(7) 0.4180(4) 0.0804(15) Uani 1 1 d . . . . .
H8A H 0.7256 0.3997 0.4117 0.121 Uiso 1 1 calc R U . . .
H8B H 0.7707 0.2250 0.3976 0.121 Uiso 1 1 calc R U . . .
H8C H 0.6078 0.2649 0.4914 0.121 Uiso 1 1 calc R U . . .
C9 C 0.7988(6) 0.8399(4) 0.2788(3) 0.0474(9) Uani 1 1 d . . . . .
C10 C 0.9076(7) 0.8086(6) 0.3813(4) 0.0671(12) Uani 1 1 d D . . . .
F1 F 0.8775(9) 0.6729(5) 0.4360(4) 0.1305(19) Uani 0.881(5) 1 d D . P A 1
F2 F 0.8398(8) 0.9011(6) 0.4447(4) 0.135(2) Uani 0.881(5) 1 d D . P A 1
F3 F 1.1090(5) 0.8207(7) 0.3663(3) 0.1139(18) Uani 0.881(5) 1 d D . P A 1
F1' F 0.786(4) 0.763(4) 0.4610(19) 0.1305(19) Uani 0.119(5) 1 d D . P A 2
F2' F 0.988(5) 0.930(2) 0.392(3) 0.135(2) Uani 0.119(5) 1 d D . P A 2
F3' F 1.047(4) 0.707(3) 0.371(2) 0.1139(18) Uani 0.119(5) 1 d D . P A 2


_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 N4 2.200(3) 2_465 ?
Ag1 N3 2.282(3) . ?
Ag1 O2W 2.392(3) . ?
Ag1 O1W 2.440(2) . ?
O1W H1A 0.8500 . ?
O1W H1B 0.8500 . ?
O2W H2A 0.8500 . ?
O2W H2B 0.8500 . ?
O3 C9 1.216(5) . ?
O4 C9 1.229(5) . ?
N1 C3 1.310(5) . ?
N1 C7 1.341(5) . ?
N2 C1 1.349(4) . ?
N2 C2 1.352(4) . ?
N2 C3 1.436(4) . ?
N3 C1 1.306(4) . ?
N3 N4 1.384(4) . ?
N4 C2 1.295(4) . ?
N4 Ag1 2.200(3) 2_465 ?
C1 H1 0.9500 . ?
C2 H2 0.9500 . ?
C3 C4 1.345(5) . ?
C4 C5 1.378(5) . ?
C4 H4 0.9500 . ?
C5 C6 1.377(6) . ?
C5 H5 0.9500 . ?
C6 C7 1.367(6) . ?
C6 C8 1.509(5) . ?
C7 H7 0.9500 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 C10 1.532(6) . ?
C10 F1' 1.248(9) . ?
C10 F3' 1.256(9) . ?
C10 F2' 1.261(9) . ?
C10 F2 1.292(5) . ?
C10 F1 1.292(5) . ?
C10 F3 1.309(5) . ?

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
N4 Ag1 N3 119.85(10) 2_465 . ?
N4 Ag1 O2W 136.61(10) 2_465 . ?
N3 Ag1 O2W 87.80(10) . . ?
N4 Ag1 O1W 107.78(10) 2_465 . ?
N3 Ag1 O1W 118.79(10) . . ?
O2W Ag1 O1W 81.86(9) . . ?
Ag1 O1W H1A 104.6 . . ?
Ag1 O1W H1B 130.4 . . ?
H1A O1W H1B 107.4 . . ?
Ag1 O2W H2A 107.4 . . ?
Ag1 O2W H2B 119.0 . . ?
H2A O2W H2B 107.4 . . ?
C3 N1 C7 116.0(4) . . ?
C1 N2 C2 104.7(3) . . ?
C1 N2 C3 125.7(3) . . ?
C2 N2 C3 129.6(3) . . ?
C1 N3 N4 106.8(3) . . ?
C1 N3 Ag1 129.2(2) . . ?
N4 N3 Ag1 123.6(2) . . ?
C2 N4 N3 106.9(3) . . ?
C2 N4 Ag1 137.2(2) . 2_465 ?
N3 N4 Ag1 115.7(2) . 2_465 ?
N3 C1 N2 110.6(3) . . ?
N3 C1 H1 124.7 . . ?
N2 C1 H1 124.7 . . ?
N4 C2 N2 111.0(3) . . ?
N4 C2 H2 124.5 . . ?
N2 C2 H2 124.5 . . ?
N1 C3 C4 125.5(3) . . ?
N1 C3 N2 113.0(3) . . ?
C4 C3 N2 121.5(3) . . ?
C3 C4 C5 117.4(4) . . ?
C3 C4 H4 121.3 . . ?
C5 C4 H4 121.3 . . ?
C6 C5 C4 120.0(4) . . ?
C6 C5 H5 120.0 . . ?
C4 C5 H5 120.0 . . ?
C7 C6 C5 116.8(4) . . ?
C7 C6 C8 120.8(4) . . ?
C5 C6 C8 122.3(4) . . ?
N1 C7 C6 124.2(4) . . ?
N1 C7 H7 117.9 . . ?
C6 C7 H7 117.9 . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
O3 C9 O4 130.2(4) . . ?
O3 C9 C10 114.2(4) . . ?
O4 C9 C10 115.6(3) . . ?
F1' C10 F3' 109.6(10) . . ?
F1' C10 F2' 109.5(10) . . ?
F3' C10 F2' 109.6(10) . . ?
F2 C10 F1 104.7(4) . . ?
F2 C10 F3 106.5(4) . . ?
F1 C10 F3 105.8(4) . . ?
F1' C10 C9 112.4(16) . . ?
F3' C10 C9 106.6(12) . . ?
F2' C10 C9 109.0(15) . . ?
F2 C10 C9 112.1(4) . . ?
F1 C10 C9 113.1(4) . . ?
F3 C10 C9 113.9(4) . . ?

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
C1 N3 N4 C2 -0.2(4) . . . . ?
Ag1 N3 N4 C2 -173.7(2) . . . . ?
C1 N3 N4 Ag1 -175.9(2) . . . 2_465 ?
Ag1 N3 N4 Ag1 10.6(3) . . . 2_465 ?
N4 N3 C1 N2 0.3(4) . . . . ?
Ag1 N3 C1 N2 173.3(2) . . . . ?
C2 N2 C1 N3 -0.3(4) . . . . ?
C3 N2 C1 N3 -179.5(3) . . . . ?
N3 N4 C2 N2 0.0(4) . . . . ?
Ag1 N4 C2 N2 174.3(3) 2_465 . . . ?
C1 N2 C2 N4 0.2(4) . . . . ?
C3 N2 C2 N4 179.3(3) . . . . ?
C7 N1 C3 C4 -1.3(6) . . . . ?
C7 N1 C3 N2 176.9(4) . . . . ?
C1 N2 C3 N1 -2.2(5) . . . . ?
C2 N2 C3 N1 178.9(4) . . . . ?
C1 N2 C3 C4 176.0(4) . . . . ?
C2 N2 C3 C4 -2.9(6) . . . . ?
N1 C3 C4 C5 1.2(6) . . . . ?
N2 C3 C4 C5 -176.8(4) . . . . ?
C3 C4 C5 C6 0.4(6) . . . . ?
C4 C5 C6 C7 -1.7(7) . . . . ?
C4 C5 C6 C8 177.1(4) . . . . ?
C3 N1 C7 C6 -0.3(7) . . . . ?
C5 C6 C7 N1 1.7(7) . . . . ?
C8 C6 C7 N1 -177.1(4) . . . . ?
O3 C9 C10 F1' 2.3(18) . . . . ?
O4 C9 C10 F1' -178.7(17) . . . . ?
O3 C9 C10 F3' 122.4(16) . . . . ?
O4 C9 C10 F3' -58.5(16) . . . . ?
O3 C9 C10 F2' -119.3(17) . . . . ?
O4 C9 C10 F2' 59.8(18) . . . . ?
O3 C9 C10 F2 -62.8(6) . . . . ?
O4 C9 C10 F2 116.3(5) . . . . ?
O3 C9 C10 F1 55.3(6) . . . . ?
O4 C9 C10 F1 -125.6(5) . . . . ?
O3 C9 C10 F3 176.2(5) . . . . ?
O4 C9 C10 F3 -4.8(6) . . . . ?

_refine_diff_density_max         0.373
_refine_diff_density_min         -0.667
_refine_diff_density_rms         0.083

_shelxl_version_number           2013-2

####################################################################### 
# 
# 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_a150428c
_database_code_depnum_ccdc_archive 'CCDC 1413895'
_audit_update_record             
;
2015-07-20 deposited with the CCDC.
2015-09-25 downloaded from the CCDC.
;
_audit_creation_date             2015-04-28
_audit_creation_method           
;
Olex2 1.2
(compiled 2014.11.28 svn.r3106 for OlexSys, GUI svn.r4959)
;
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.5(C32 H32 Ag4 N16), 0.5(H4 O2), 2(B F4)'
_chemical_formula_sum            'C16 H18 Ag2 B2 F8 N8 O'
_chemical_formula_weight         727.74
_chemical_melting_point          ?
_chemical_oxdiff_formula         'C H O N Zn'
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
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                   17.6545(11)
_cell_length_b                   8.1711(3)
_cell_length_c                   18.4625(13)
_cell_angle_alpha                90
_cell_angle_beta                 118.187(9)
_cell_angle_gamma                90
_cell_volume                     2347.5(3)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    5504
_cell_measurement_temperature    173.00(10)
_cell_measurement_theta_max      74.3300
_cell_measurement_theta_min      5.4250
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    14.246
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.38453
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    2.059
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       needle
_exptl_crystal_F_000             1416
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.11
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0385
_diffrn_reflns_av_unetI/netI     0.0297
_diffrn_reflns_Laue_measured_fraction_full 0.985
_diffrn_reflns_Laue_measured_fraction_max 0.985
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            7142
_diffrn_reflns_point_group_measured_fraction_full 0.985
_diffrn_reflns_point_group_measured_fraction_max 0.985
_diffrn_reflns_theta_full        67.076
_diffrn_reflns_theta_max         67.076
_diffrn_reflns_theta_min         5.437
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      173.00(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 5.2740
_diffrn_detector_type            AtlasS2
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_details      
;
#__ type_ start__ end____ width___ exp.time_
  1 omega  -50.00   33.00   1.0000    5.0000
omega____ theta____ kappa____ phi______ frames
    -      -38.5000   38.0000  -90.0000 83

#__ type_ start__ end____ width___ exp.time_
  2 omega  -65.00   -2.00   1.0000    5.0000
omega____ theta____ kappa____ phi______ frames
    -      -38.5000  125.0000    0.0000 63

#__ type_ start__ end____ width___ exp.time_
  3 omega -116.00   -6.00   1.0000    5.0000
omega____ theta____ kappa____ phi______ frames
    -      -38.5000  -19.0000   90.0000 110

#__ type_ start__ end____ width___ exp.time_
  4 omega   10.00   65.00   1.0000    5.0000
omega____ theta____ kappa____ phi______ frames
    -       42.9014  -99.0000  -30.0000 55

#__ type_ start__ end____ width___ exp.time_
  5 omega   53.00  109.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -94.0000   30.0000 56

#__ type_ start__ end____ width___ exp.time_
  6 omega   73.00  124.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -61.0000   90.0000 51

#__ type_ start__ end____ width___ exp.time_
  7 omega   97.00  176.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351   45.0000   90.0000 79

#__ type_ start__ end____ width___ exp.time_
  8 omega  130.00  157.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  125.0000  120.0000 27

#__ type_ start__ end____ width___ exp.time_
  9 omega   41.00   89.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -30.0000  -60.0000 48

#__ type_ start__ end____ width___ exp.time_
 10 omega   42.00   95.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -45.0000 -120.0000 53

#__ type_ start__ end____ width___ exp.time_
 11 omega   60.00  107.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -94.0000  -60.0000 47

#__ type_ start__ end____ width___ exp.time_
 12 omega   41.00   93.00   1.0000    5.0000
omega____ theta____ kappa____ phi______ frames
    -       42.9014 -125.0000 -180.0000 52

#__ type_ start__ end____ width___ exp.time_
 13 omega   41.00  122.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351 -125.0000  -90.0000 81

#__ type_ start__ end____ width___ exp.time_
 14 omega   36.00   63.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -30.0000 -150.0000 27

#__ type_ start__ end____ width___ exp.time_
 15 omega   41.00   75.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -30.0000  -90.0000 34

#__ type_ start__ end____ width___ exp.time_
 16 omega   37.00   97.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -45.0000    0.0000 60

#__ type_ start__ end____ width___ exp.time_
 17 omega   47.00  104.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -94.0000  120.0000 57

#__ type_ start__ end____ width___ exp.time_
 18 omega   33.00   86.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -30.0000   60.0000 53

#__ type_ start__ end____ width___ exp.time_
 19 omega   33.00   83.00   1.0000   20.0000
omega____ theta____ kappa____ phi______ frames
    -      106.0351  -15.0000   90.0000 50
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_UB_11      -0.0513492000
_diffrn_orient_matrix_UB_12      -0.1383659000
_diffrn_orient_matrix_UB_13      0.0133660000
_diffrn_orient_matrix_UB_21      -0.0255718000
_diffrn_orient_matrix_UB_22      -0.0667414000
_diffrn_orient_matrix_UB_23      -0.0865672000
_diffrn_orient_matrix_UB_31      0.0806532000
_diffrn_orient_matrix_UB_32      -0.1093629000
_diffrn_orient_matrix_UB_33      0.0359181000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'sealed X-ray tube'
_diffrn_source_type              'SuperNova (Cu) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                1963
_reflns_number_total             2065
_reflns_odcompleteness_completeness 99.71
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2008)'
_computing_structure_solution    'ShelXT (Sheldrick, 2008)'
_refine_diff_density_max         1.543
_refine_diff_density_min         -0.878
_refine_diff_density_rms         0.126
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     172
_refine_ls_number_reflns         2065
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0404
_refine_ls_R_factor_gt           0.0388
_refine_ls_restrained_S_all      1.059
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0582P)²+12.9968P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0994
_refine_ls_wR_factor_ref         0.1009
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H,H) groups
2. Others
 Fixed Sof: H1A(0.5) H1B(0.5)
3.a Free rotating group:
 O1(H1A,H1B)
3.b Aromatic/amide H refined with riding coordinates:
 C7(H7), C3(H3), C4(H4), C6(H6), C9(H9)
3.c Idealised Me refined as rotating group:
 C12(H12A,H12B,H12C)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   ?
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
N1 N 0.4774(3) 0.2064(4) 0.3448(3) 0.0258(8) Uani 1 1 d . . . . .
N2 N 0.4022(3) 0.1924(4) 0.2712(2) 0.0264(8) Uani 1 1 d . . . . .
C7 C 0.3431(3) 0.1496(6) 0.2894(3) 0.0257(9) Uani 1 1 d . . . . .
H7 H 0.2860 0.1318 0.2511 0.031 Uiso 1 1 calc R . . . .
Ag1 Ag 0.09589(2) -0.19766(4) 0.34934(2) 0.02793(16) Uani 1 1 d . . . . .
O1 O 0.0000 0.0334(6) 0.2500 0.0387(11) Uani 1 2 d S T P . .
H1A H 0.0042 0.0671 0.2085 0.058 Uiso 0.5 1 d G . . . .
H1B H -0.0255 0.1052 0.2639 0.058 Uiso 0.5 1 d G . . . .
N3 N 0.3750(2) 0.1340(4) 0.3717(2) 0.0201(7) Uani 1 1 d . . . . .
N4 N 0.2178(2) -0.0633(4) 0.4197(2) 0.0238(7) Uani 1 1 d . . . . .
C1 C 0.3318(3) 0.0863(5) 0.4171(3) 0.0207(8) Uani 1 1 d . . . . .
C3 C 0.2592(3) -0.0131(5) 0.3794(3) 0.0210(8) Uani 1 1 d . . . . .
H3 H 0.2393 -0.0450 0.3251 0.025 Uiso 1 1 calc R . . . .
C4 C 0.4596(3) 0.1723(5) 0.4036(3) 0.0251(9) Uani 1 1 d . . . . .
H4 H 0.4989 0.1738 0.4593 0.030 Uiso 1 1 calc R . . . .
C5 C 0.3192(3) 0.0806(5) 0.5402(3) 0.0245(9) Uani 1 1 d . . . . .
C6 C 0.2478(3) -0.0175(5) 0.4987(3) 0.0231(8) Uani 1 1 d . . . . .
H6 H 0.2189 -0.0539 0.5267 0.028 Uiso 1 1 calc R . . . .
C9 C 0.3610(3) 0.1358(5) 0.4971(3) 0.0220(8) Uani 1 1 d . . . . .
H9 H 0.4082 0.2052 0.5221 0.026 Uiso 1 1 calc R . . . .
C12 C 0.3493(3) 0.1305(6) 0.6280(3) 0.0324(10) Uani 1 1 d . . . . .
H12A H 0.3039 0.1136 0.6418 0.049 Uiso 1 1 calc GR . . . .
H12B H 0.3651 0.2440 0.6346 0.049 Uiso 1 1 calc GR . . . .
H12C H 0.3982 0.0656 0.6635 0.049 Uiso 1 1 calc GR . . . .
F1 F 0.1543(2) 0.0083(5) 0.1509(3) 0.0653(11) Uani 1 1 d . . . . .
F2 F 0.1094(3) 0.2256(6) 0.0672(3) 0.0714(13) Uani 1 1 d . . . . .
F5 F 0.0212(2) 0.1075(7) 0.1076(3) 0.0905(17) Uani 1 1 d . . . . .
F7 F 0.1416(4) 0.2478(8) 0.1985(3) 0.104(2) Uani 1 1 d . . . . .
B1 B 0.1049(4) 0.1459(8) 0.1312(4) 0.0364(12) 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
N1 N2 1.384(6) . ?
N1 Ag1 2.198(4) 3 ?
N1 C4 1.295(6) . ?
N2 C7 1.288(6) . ?
N2 Ag1 2.414(4) 4 ?
C7 H7 0.9300 . ?
C7 N3 1.353(6) . ?
Ag1 N1 2.199(4) 3_445 ?
Ag1 N2 2.414(4) 4_545 ?
Ag1 N4 2.209(4) . ?
O1 H1A 0.8498 . ?
O1 H1B 0.8499 . ?
N3 C1 1.429(5) . ?
N3 C4 1.359(6) . ?
N4 C3 1.329(5) . ?
N4 C6 1.350(6) . ?
C1 C3 1.395(6) . ?
C1 C9 1.375(6) . ?
C3 H3 0.9300 . ?
C4 H4 0.9300 . ?
C5 C6 1.380(6) . ?
C5 C9 1.392(6) . ?
C5 C12 1.503(6) . ?
C6 H6 0.9300 . ?
C9 H9 0.9300 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
F1 B1 1.363(7) . ?
F2 B1 1.384(7) . ?
F5 B1 1.365(7) . ?
F7 B1 1.377(8) . ?

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
N2 N1 Ag1 121.4(3) . 3 ?
C4 N1 N2 107.8(4) . . ?
C4 N1 Ag1 130.4(3) . 3 ?
N1 N2 Ag1 116.7(3) . 4 ?
C7 N2 N1 106.5(4) . . ?
C7 N2 Ag1 135.1(3) . 4 ?
N2 C7 H7 124.4 . . ?
N2 C7 N3 111.2(4) . . ?
N3 C7 H7 124.4 . . ?
N1 Ag1 N2 105.01(14) 3_445 4_545 ?
N1 Ag1 N4 147.66(14) 3_445 . ?
N4 Ag1 N2 107.03(14) . 4_545 ?
H1A O1 H1B 109.5 . . ?
C7 N3 C1 129.1(4) . . ?
C7 N3 C4 104.7(4) . . ?
C4 N3 C1 126.2(4) . . ?
C3 N4 Ag1 117.7(3) . . ?
C3 N4 C6 118.7(4) . . ?
C6 N4 Ag1 123.3(3) . . ?
C3 C1 N3 119.0(4) . . ?
C9 C1 N3 121.1(4) . . ?
C9 C1 C3 119.9(4) . . ?
N4 C3 C1 121.2(4) . . ?
N4 C3 H3 119.4 . . ?
C1 C3 H3 119.4 . . ?
N1 C4 N3 109.8(4) . . ?
N1 C4 H4 125.1 . . ?
N3 C4 H4 125.1 . . ?
C6 C5 C9 117.6(4) . . ?
C6 C5 C12 121.4(4) . . ?
C9 C5 C12 121.0(4) . . ?
N4 C6 C5 123.4(4) . . ?
N4 C6 H6 118.3 . . ?
C5 C6 H6 118.3 . . ?
C1 C9 C5 119.1(4) . . ?
C1 C9 H9 120.4 . . ?
C5 C9 H9 120.4 . . ?
C5 C12 H12A 109.5 . . ?
C5 C12 H12B 109.5 . . ?
C5 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
F1 B1 F2 109.1(5) . . ?
F1 B1 F5 110.8(5) . . ?
F1 B1 F7 106.8(5) . . ?
F5 B1 F2 109.1(5) . . ?
F5 B1 F7 113.8(6) . . ?
F7 B1 F2 107.1(6) . . ?

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 N2 C7 N3 -0.1(5) . . . . ?
N2 N1 C4 N3 0.7(5) . . . . ?
N2 C7 N3 C1 -178.8(4) . . . . ?
N2 C7 N3 C4 0.5(5) . . . . ?
C7 N3 C1 C3 26.4(6) . . . . ?
C7 N3 C1 C9 -154.1(4) . . . . ?
C7 N3 C4 N1 -0.7(5) . . . . ?
Ag1 N1 N2 C7 -173.4(3) 3 . . . ?
Ag1 N1 N2 Ag1 -5.7(4) 3 . . 4 ?
Ag1 N1 C4 N3 172.9(3) 3 . . . ?
Ag1 N2 C7 N3 -164.4(3) 4 . . . ?
Ag1 N4 C3 C1 173.5(3) . . . . ?
Ag1 N4 C6 C5 -173.2(3) . . . . ?
N3 C1 C3 N4 178.7(4) . . . . ?
N3 C1 C9 C5 -177.2(4) . . . . ?
C1 N3 C4 N1 178.6(4) . . . . ?
C3 N4 C6 C5 0.7(6) . . . . ?
C3 C1 C9 C5 2.2(6) . . . . ?
C4 N1 N2 C7 -0.4(5) . . . . ?
C4 N1 N2 Ag1 167.3(3) . . . 4 ?
C4 N3 C1 C3 -152.8(4) . . . . ?
C4 N3 C1 C9 26.7(6) . . . . ?
C6 N4 C3 C1 -0.7(6) . . . . ?
C6 C5 C9 C1 -2.2(6) . . . . ?
C9 C1 C3 N4 -0.8(6) . . . . ?
C9 C5 C6 N4 0.8(6) . . . . ?
C12 C5 C6 N4 179.0(4) . . . . ?
C12 C5 C9 C1 179.5(4) . . . . ?

_shelx_SHELXL_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
