#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/00/2220071.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2220071
loop_
_publ_author_name
'Wan, Xin-Sheng'
'Dang, Yu-Li'
'Kou, Chun-Hong'
'Zhou, Zhan-Fang'
'Niu, Cao-Yuan'
_publ_section_title
;catena-Poly[[[N'-(4-cyanobenzylidene)nicotinohydrazide)silver(I)]-μ-N'-(4-cyanobenzylidene)nicotinohydrazide]
 hexafluoridophosphate]
;
_journal_coeditor_code           BH2203
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1618
_journal_page_last               m1619
_journal_paper_doi               10.1107/S1600536808038907
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac          '[Ag (C14 H10 N4 O)2] P F6'
_chemical_formula_moiety         'C28 H20 Ag N8 O2 +, F6 P -'
_chemical_formula_sum            'C28 H20 Ag F6 N8 O2 P'
_chemical_formula_weight         753.36
_chemical_name_systematic
;
catena-Poly[[[N'-(4-cyanobenzylidene)nicotinohydrazide)silver(I)]-μ-
N'-(4-cyanobenzylidene)nicotinohydrazide] hexafluorophosphate]
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 99.9770(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   22.3252(17)
_cell_length_b                   13.6939(11)
_cell_length_c                   19.8523(16)
_cell_measurement_reflns_used    5745
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.50
_cell_measurement_theta_min      2.08
_cell_volume                     5977.4(8)
_computing_cell_refinement       'SAINT (Siemens, 1996)'
_computing_data_collection       'SMART (Siemens, 1996)'
_computing_data_reduction        'SAINT (Siemens, 1996)'
_computing_molecular_graphics
;
SHELXL97 (Sheldrick, 2008) and DIAMOND (Brandenburg, 2005)
;
_computing_publication_material  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXL97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Siemens SMART CCD area-detector'
_diffrn_measurement_method       'φ and ω'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0215
_diffrn_reflns_av_sigmaI/netI    0.0254
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            19020
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.08
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    0.808
_exptl_absorpt_correction_T_max  0.7995
_exptl_absorpt_correction_T_min  0.7176
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Siemens, 1996)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.674
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             3008
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.29
_refine_diff_density_max         0.923
_refine_diff_density_min         -0.666
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.028
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     460
_refine_ls_number_reflns         6823
_refine_ls_number_restraints     96
_refine_ls_restrained_S_all      1.088
_refine_ls_R_factor_all          0.0538
_refine_ls_R_factor_gt           0.0368
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0457P)²+5.9377P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0902
_refine_ls_wR_factor_ref         0.0994
_reflns_number_gt                5105
_reflns_number_total             6823
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            bh2203.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               2220071
_cod_database_fobs_code          2220071
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'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
N N8 0.61351(13) 0.7668(2) -0.23514(14) 0.0680(8) Uani d . 1 . .
C C28 0.57801(14) 0.7655(3) -0.20064(15) 0.0538(7) Uani d . 1 . .
C C25 0.53188(13) 0.7592(2) -0.15834(14) 0.0478(7) Uani d . 1 . .
C C24 0.50609(14) 0.6686(2) -0.14987(15) 0.0531(7) Uani d . 1 . .
H H24 0.5184 0.6128 -0.1724 0.064 Uiso calc R 1 . .
C C26 0.51433(15) 0.8411(3) -0.12646(17) 0.0601(8) Uani d . 1 . .
H H26 0.5315 0.9031 -0.1330 0.072 Uiso calc R 1 . .
C C27 0.47114(15) 0.8310(2) -0.08462(18) 0.0601(8) Uani d . 1 . .
H H27 0.4592 0.8868 -0.0618 0.072 Uiso calc R 1 . .
C C23 0.46282(14) 0.6602(2) -0.10881(15) 0.0510(7) Uani d . 1 . .
H H23 0.4449 0.5985 -0.1032 0.061 Uiso calc R 1 . .
C C22 0.44513(13) 0.7418(2) -0.07544(14) 0.0477(7) Uani d . 1 . .
C C21 0.40138(14) 0.7334(2) -0.02860(15) 0.0520(7) Uani d . 1 . .
H H21 0.3960 0.7864 0.0006 0.062 Uiso calc R 1 . .
N N7 0.37061(11) 0.6556(2) -0.02684(12) 0.0494(6) Uani d . 1 . .
N N6 0.33253(11) 0.6554(2) 0.02109(12) 0.0486(6) Uani d D 1 . .
Ag Ag1 0.182725(12) 0.812121(16) 0.197931(13) 0.05723(10) Uani d . 1 . .
C C12 0.44862(16) 1.2299(3) -0.09411(17) 0.0643(9) Uani d . 1 . .
H H12 0.4699 1.1967 -0.1248 0.077 Uiso calc R 1 . .
C C19 0.24057(13) 0.66761(18) 0.10608(13) 0.0401(6) Uani d . 1 . .
H H19 0.2509 0.7270 0.0862 0.048 Uiso calc R 1 . .
C C15 0.19185(13) 0.5876(2) 0.18284(14) 0.0429(6) Uani d . 1 . .
H H15 0.1673 0.5897 0.2174 0.052 Uiso calc R 1 . .
C C6 0.24333(13) 1.19804(19) 0.14358(14) 0.0416(6) Uani d . 1 . .
C C18 0.26109(12) 0.58116(18) 0.08291(12) 0.0367(5) Uani d . 1 . .
C C9 0.38638(14) 1.3271(2) -0.00520(16) 0.0532(7) Uani d . 1 . .
H H9 0.3651 1.3608 0.0253 0.064 Uiso calc R 1 . .
C C7 0.33364(14) 1.1743(2) 0.01789(15) 0.0502(7) Uani d . 1 . .
H H7 0.3256 1.1073 0.0076 0.060 Uiso calc R 1 . .
C C4 0.20356(12) 1.13009(19) 0.17502(13) 0.0380(6) Uani d . 1 . .
C C17 0.24587(13) 0.49446(19) 0.11196(14) 0.0449(6) Uani d . 1 . .
H H17 0.2594 0.4336 0.0971 0.054 Uiso calc R 1 . .
C C16 0.21082(14) 0.4979(2) 0.16270(14) 0.0486(7) Uani d . 1 . .
H H16 0.1999 0.4396 0.1834 0.058 Uiso calc R 1 . .
C C1 0.13502(14) 1.0108(2) 0.24051(14) 0.0507(7) Uani d . 1 . .
H H1 0.1108 0.9695 0.2634 0.061 Uiso calc R 1 . .
C C3 0.16615(14) 1.1703(2) 0.21661(15) 0.0482(7) Uani d . 1 . .
H H3 0.1647 1.2390 0.2226 0.058 Uiso calc R 1 . .
C C5 0.20473(13) 1.02969(19) 0.16908(13) 0.0410(6) Uani d . 1 . .
H H5 0.2304 1.0018 0.1408 0.049 Uiso calc R 1 . .
C C13 0.40755(16) 1.1802(2) -0.06192(17) 0.0606(8) Uani d . 1 . .
H H13 0.4006 1.1126 -0.0708 0.073 Uiso calc R 1 . .
C C11 0.45847(15) 1.3286(3) -0.08112(17) 0.0575(8) Uani d . 1 . .
C C8 0.37610(13) 1.2281(2) -0.01660(14) 0.0485(7) Uani d . 1 . .
C C14 0.50138(17) 1.3823(3) -0.1134(2) 0.0713(10) Uani d . 1 . .
C C2 0.13130(14) 1.1097(2) 0.24891(16) 0.0535(8) Uani d . 1 . .
H H2 0.1048 1.1361 0.2769 0.064 Uiso calc R 1 . .
C C10 0.42664(15) 1.3771(2) -0.03712(17) 0.0576(8) Uani d . 1 . .
H H10 0.4328 1.4450 -0.0291 0.069 Uiso calc R 1 . .
N N3 0.26781(11) 1.16107(18) 0.09093(12) 0.0452(5) Uani d D 1 . .
N N2 0.20658(11) 0.67179(15) 0.15560(11) 0.0417(5) Uani d . 1 . .
N N4 0.30732(11) 1.21732(18) 0.06194(12) 0.0474(6) Uani d . 1 . .
N N1 0.17155(11) 0.96955(16) 0.20120(11) 0.0443(5) Uani d . 1 . .
N N5 0.53463(17) 1.4260(3) -0.1381(2) 0.1005(13) Uani d . 1 . .
P P1 0.37466(4) 0.89969(6) 0.14663(5) 0.0599(2) Uani d D 1 . .
O O2 0.29542(10) 0.50513(15) -0.01052(10) 0.0563(5) Uani d . 1 . .
O O1 0.25284(10) 1.28063(15) 0.16533(11) 0.0584(6) Uani d . 1 . .
C C20 0.29779(12) 0.57604(19) 0.02673(13) 0.0409(6) Uani d . 1 . .
F F5 0.38656(13) 0.78661(16) 0.13688(14) 0.1030(8) Uani d DU 1 A .
F F6 0.35972(14) 1.01041(16) 0.15169(18) 0.1254(11) Uani d DU 1 A .
F F1 0.3229(3) 0.8764(3) 0.1891(3) 0.1111(19) Uani d PDU 0.773(8) A 1
F F2 0.4206(3) 0.9026(5) 0.2114(4) 0.182(3) Uani d PDU 0.773(8) A 1
F F3 0.4237(2) 0.9205(3) 0.1009(4) 0.129(2) Uani d PDU 0.773(8) A 1
F F4 0.3249(2) 0.8894(4) 0.0790(2) 0.1269(19) Uani d PDU 0.773(8) A 1
F F1' 0.3816(8) 0.8806(8) 0.2243(5) 0.096(5) Uani d PDU 0.227(8) A 2
F F2' 0.4440(4) 0.9236(7) 0.1569(9) 0.082(4) Uani d PDU 0.227(8) A 2
F F3' 0.3702(9) 0.9217(9) 0.0687(5) 0.112(5) Uani d PDU 0.227(8) A 2
F F4' 0.3055(4) 0.8774(9) 0.1384(11) 0.109(5) Uani d PDU 0.227(8) A 2
H H28 0.2574(13) 1.1069(16) 0.0696(14) 0.050(9) Uiso d D 1 . .
H H29 0.3373(14) 0.7020(18) 0.0501(13) 0.048(9) Uiso d D 1 . .
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'
P P 0.1023 0.0942 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
C28 N8 Ag1 8_565 153.0(3) ?
N8 C28 C25 . 177.1(4) ?
C26 C25 C24 . 120.9(3) ?
C26 C25 C28 . 120.5(3) ?
C24 C25 C28 . 118.5(3) ?
C23 C24 C25 . 119.7(3) ?
C23 C24 H24 . 120.1 ?
C25 C24 H24 . 120.1 ?
C25 C26 C27 . 118.5(3) ?
C25 C26 H26 . 120.7 ?
C27 C26 H26 . 120.7 ?
C22 C27 C26 . 121.4(3) ?
C22 C27 H27 . 119.3 ?
C26 C27 H27 . 119.3 ?
C24 C23 C22 . 120.2(3) ?
C24 C23 H23 . 119.9 ?
C22 C23 H23 . 119.9 ?
C27 C22 C23 . 119.2(3) ?
C27 C22 C21 . 119.7(3) ?
C23 C22 C21 . 121.0(3) ?
N7 C21 C22 . 120.4(3) ?
N7 C21 H21 . 119.8 ?
C22 C21 H21 . 119.8 ?
C21 N7 N6 . 114.8(3) ?
C20 N6 N7 . 119.3(2) ?
C20 N6 H29 . 123(2) ?
N7 N6 H29 . 116(2) ?
N1 Ag1 N2 . 156.22(8) yes
N1 Ag1 N8 8_466 109.53(9) yes
N2 Ag1 N8 8_466 92.22(9) yes
C13 C12 C11 . 119.3(3) ?
C13 C12 H12 . 120.3 ?
C11 C12 H12 . 120.3 ?
N2 C19 C18 . 123.0(2) ?
N2 C19 H19 . 118.5 ?
C18 C19 H19 . 118.5 ?
N2 C15 C16 . 122.7(2) ?
N2 C15 H15 . 118.7 ?
C16 C15 H15 . 118.7 ?
O1 C6 N3 . 123.4(3) ?
O1 C6 C4 . 120.7(2) ?
N3 C6 C4 . 115.9(2) ?
C19 C18 C17 . 118.5(2) ?
C19 C18 C20 . 123.1(2) ?
C17 C18 C20 . 118.4(2) ?
C10 C9 C8 . 121.1(3) ?
C10 C9 H9 . 119.5 ?
C8 C9 H9 . 119.5 ?
N4 C7 C8 . 120.0(3) ?
N4 C7 H7 . 120.0 ?
C8 C7 H7 . 120.0 ?
C5 C4 C3 . 117.9(2) ?
C5 C4 C6 . 124.2(2) ?
C3 C4 C6 . 117.7(2) ?
C16 C17 C18 . 119.0(2) ?
C16 C17 H17 . 120.5 ?
C18 C17 H17 . 120.5 ?
C17 C16 C15 . 118.9(2) ?
C17 C16 H16 . 120.5 ?
C15 C16 H16 . 120.5 ?
N1 C1 C2 . 122.8(3) ?
N1 C1 H1 . 118.6 ?
C2 C1 H1 . 118.6 ?
C2 C3 C4 . 119.2(3) ?
C2 C3 H3 . 120.4 ?
C4 C3 H3 . 120.4 ?
N1 C5 C4 . 123.4(2) ?
N1 C5 H5 . 118.3 ?
C4 C5 H5 . 118.3 ?
C12 C13 C8 . 120.9(3) ?
C12 C13 H13 . 119.6 ?
C8 C13 H13 . 119.6 ?
C10 C11 C12 . 120.1(3) ?
C10 C11 C14 . 119.2(3) ?
C12 C11 C14 . 120.7(3) ?
C9 C8 C13 . 118.5(3) ?
C9 C8 C7 . 121.3(3) ?
C13 C8 C7 . 120.3(3) ?
N5 C14 C11 . 178.6(4) ?
C1 C2 C3 . 119.4(3) ?
C1 C2 H2 . 120.3 ?
C3 C2 H2 . 120.3 ?
C9 C10 C11 . 120.1(3) ?
C9 C10 H10 . 119.9 ?
C11 C10 H10 . 119.9 ?
C6 N3 N4 . 119.2(2) ?
C6 N3 H28 . 126(2) ?
N4 N3 H28 . 114(2) ?
C15 N2 C19 . 117.9(2) ?
C15 N2 Ag1 . 120.36(17) ?
C19 N2 Ag1 . 121.45(17) ?
C7 N4 N3 . 115.7(2) ?
C5 N1 C1 . 117.3(2) ?
C5 N1 Ag1 . 121.31(17) ?
C1 N1 Ag1 . 121.18(18) ?
F2 P1 F4' . 127.9(7) ?
F1' P1 F4' . 89.8(7) ?
F2 P1 F6 . 92.4(3) ?
F1' P1 F6 . 94.9(5) ?
F4' P1 F6 . 88.7(5) ?
F2 P1 F2' . 50.8(5) ?
F1' P1 F2' . 88.9(7) ?
F4' P1 F2' . 178.3(8) ?
F6 P1 F2' . 90.3(4) ?
F2 P1 F3' . 139.5(7) ?
F1' P1 F3' . 177.5(8) ?
F4' P1 F3' . 92.5(8) ?
F6 P1 F3' . 84.2(4) ?
F2' P1 F3' . 88.8(7) ?
F2 P1 F3 . 92.8(4) ?
F1' P1 F3 . 130.6(6) ?
F4' P1 F3 . 139.2(7) ?
F6 P1 F3 . 92.24(19) ?
F3' P1 F3 . 47.2(6) ?
F2 P1 F1 . 90.2(4) ?
F1' P1 F1 . 52.3(6) ?
F6 P1 F1 . 88.72(18) ?
F2' P1 F1 . 140.8(6) ?
F3' P1 F1 . 129.9(7) ?
F3 P1 F1 . 176.8(3) ?
F2 P1 F5 . 91.5(3) ?
F1' P1 F5 . 88.1(4) ?
F4' P1 F5 . 88.8(5) ?
F6 P1 F5 . 176.14(19) ?
F2' P1 F5 . 92.2(4) ?
F3' P1 F5 . 92.9(4) ?
F3 P1 F5 . 87.63(19) ?
F1 P1 F5 . 91.21(18) ?
F2 P1 F4 . 176.3(4) ?
F1' P1 F4 . 139.5(6) ?
F4' P1 F4 . 50.2(7) ?
F6 P1 F4 . 90.8(2) ?
F2' P1 F4 . 131.2(6) ?
F3 P1 F4 . 89.0(3) ?
F1 P1 F4 . 87.9(3) ?
F5 P1 F4 . 85.3(2) ?
O2 C20 N6 . 123.8(2) ?
O2 C20 C18 . 121.3(2) ?
N6 C20 C18 . 114.9(2) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
N8 C28 . 1.134(4) ?
N8 Ag1 8_565 2.456(3) ?
C28 C25 . 1.440(4) ?
C25 C26 . 1.378(4) ?
C25 C24 . 1.389(4) ?
C24 C23 . 1.372(4) ?
C24 H24 . 0.9500 ?
C26 C27 . 1.384(4) ?
C26 H26 . 0.9500 ?
C27 C22 . 1.379(4) ?
C27 H27 . 0.9500 ?
C23 C22 . 1.390(4) ?
C23 H23 . 0.9500 ?
C22 C21 . 1.465(4) ?
C21 N7 . 1.271(4) ?
C21 H21 . 0.9500 ?
N7 N6 . 1.382(3) ?
N6 C20 . 1.351(4) ?
N6 H29 . 0.853(18) ?
Ag1 N1 . 2.172(2) yes
Ag1 N2 . 2.199(2) yes
Ag1 N8 8_466 2.456(3) yes
C12 C13 . 1.384(5) ?
C12 C11 . 1.387(5) ?
C12 H12 . 0.9500 ?
C19 N2 . 1.343(3) ?
C19 C18 . 1.377(3) ?
C19 H19 . 0.9500 ?
C15 N2 . 1.338(3) ?
C15 C16 . 1.381(4) ?
C15 H15 . 0.9500 ?
C6 O1 . 1.216(3) ?
C6 N3 . 1.358(3) ?
C6 C4 . 1.495(4) ?
C18 C17 . 1.388(4) ?
C18 C20 . 1.496(3) ?
C9 C10 . 1.369(4) ?
C9 C8 . 1.387(4) ?
C9 H9 . 0.9500 ?
C7 N4 . 1.279(4) ?
C7 C8 . 1.461(4) ?
C7 H7 . 0.9500 ?
C4 C5 . 1.381(4) ?
C4 C3 . 1.386(4) ?
C17 C16 . 1.379(4) ?
C17 H17 . 0.9500 ?
C16 H16 . 0.9500 ?
C1 N1 . 1.347(3) ?
C1 C2 . 1.369(4) ?
C1 H1 . 0.9500 ?
C3 C2 . 1.370(4) ?
C3 H3 . 0.9500 ?
C5 N1 . 1.341(3) ?
C5 H5 . 0.9500 ?
C13 C8 . 1.397(4) ?
C13 H13 . 0.9500 ?
C11 C10 . 1.387(4) ?
C11 C14 . 1.443(5) ?
C14 N5 . 1.130(4) ?
C2 H2 . 0.9500 ?
C10 H10 . 0.9500 ?
N3 N4 . 1.371(3) ?
N3 H28 . 0.865(18) ?
P1 F2 . 1.500(5) ?
P1 F1' . 1.545(9) ?
P1 F4' . 1.555(10) ?
P1 F6 . 1.559(2) ?
P1 F2' . 1.560(8) ?
P1 F3' . 1.562(9) ?
P1 F3 . 1.564(4) ?
P1 F1 . 1.577(3) ?
P1 F5 . 1.589(2) ?
P1 F4 . 1.594(4) ?
O2 C20 . 1.216(3) ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
N3 H28 O2 7_565 0.865(18) 2.15(2) 2.990(3) 162(3)
N6 H29 F5 . 0.853(18) 2.21(2) 3.001(4) 155(3)
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_site_symmetry_1
_geom_torsion
C26 C25 C24 C23 . -0.5(5)
C28 C25 C24 C23 . 178.8(3)
C24 C25 C26 C27 . 1.2(5)
C28 C25 C26 C27 . -178.1(3)
C25 C26 C27 C22 . -1.0(5)
C25 C24 C23 C22 . -0.4(5)
C26 C27 C22 C23 . 0.2(5)
C26 C27 C22 C21 . 177.6(3)
C24 C23 C22 C27 . 0.6(5)
C24 C23 C22 C21 . -176.8(3)
C27 C22 C21 N7 . 169.9(3)
C23 C22 C21 N7 . -12.7(5)
C22 C21 N7 N6 . 177.8(3)
C21 N7 N6 C20 . 179.8(3)
N2 C19 C18 C17 . 0.1(4)
N2 C19 C18 C20 . 178.6(3)
O1 C6 C4 C5 . -159.2(3)
N3 C6 C4 C5 . 20.1(4)
O1 C6 C4 C3 . 16.2(4)
N3 C6 C4 C3 . -164.5(3)
C19 C18 C17 C16 . 0.1(4)
C20 C18 C17 C16 . -178.5(3)
C18 C17 C16 C15 . 0.2(4)
N2 C15 C16 C17 . -0.7(5)
C5 C4 C3 C2 . -1.1(4)
C6 C4 C3 C2 . -176.9(3)
C3 C4 C5 N1 . 0.2(4)
C6 C4 C5 N1 . 175.6(3)
C11 C12 C13 C8 . -0.1(5)
C13 C12 C11 C10 . -1.0(5)
C13 C12 C11 C14 . 179.5(3)
C10 C9 C8 C13 . -0.4(5)
C10 C9 C8 C7 . 179.4(3)
C12 C13 C8 C9 . 0.8(5)
C12 C13 C8 C7 . -179.0(3)
N4 C7 C8 C9 . -3.3(5)
N4 C7 C8 C13 . 176.4(3)
N1 C1 C2 C3 . -0.4(5)
C4 C3 C2 C1 . 1.2(5)
C8 C9 C10 C11 . -0.7(5)
C12 C11 C10 C9 . 1.4(5)
C14 C11 C10 C9 . -179.0(3)
O1 C6 N3 N4 . 2.7(4)
C4 C6 N3 N4 . -176.6(2)
C16 C15 N2 C19 . 0.9(4)
C16 C15 N2 Ag1 . -173.5(2)
C18 C19 N2 C15 . -0.6(4)
C18 C19 N2 Ag1 . 173.8(2)
N1 Ag1 N2 C15 . -169.9(2)
N8 Ag1 N2 C15 8_466 -13.3(2)
N1 Ag1 N2 C19 . 15.9(4)
N8 Ag1 N2 C19 8_466 172.5(2)
C8 C7 N4 N3 . 179.3(3)
C6 N3 N4 C7 . 172.6(3)
C4 C5 N1 C1 . 0.7(4)
C4 C5 N1 Ag1 . -173.5(2)
C2 C1 N1 C5 . -0.6(4)
C2 C1 N1 Ag1 . 173.6(2)
N2 Ag1 N1 C5 . -25.6(4)
N8 Ag1 N1 C5 8_466 179.3(2)
N2 Ag1 N1 C1 . 160.4(2)
N8 Ag1 N1 C1 8_466 5.3(2)
N7 N6 C20 O2 . -3.9(4)
N7 N6 C20 C18 . 176.5(2)
C19 C18 C20 O2 . -150.7(3)
C17 C18 C20 O2 . 27.8(4)
C19 C18 C20 N6 . 29.0(4)
C17 C18 C20 N6 . -152.5(3)
