#------------------------------------------------------------------------------
#$Date: 2016-03-24 14:21:51 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179661 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/14/4511434.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4511434
loop_
_publ_author_name
'Reger, Daniel L.'
'Semeniuc, Radu F.'
'Elgin, J. Derek'
'Rassolov, Vitaly'
'Smith, Mark D.'
_publ_section_title
;
 1,8-Naphthalimide Synthon in Silver Coordination Chemistry: 
 Control of Supramolecular Arrangement
;
_journal_issue                   12
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              2758
_journal_paper_doi               10.1021/cg060460p
_journal_volume                  6
_journal_year                    2006
_chemical_formula_moiety         'C40 H30 Ag N10 O4, B F4'
_chemical_formula_sum            'C40 H30 Ag B F4 N10 O4'
_chemical_formula_weight         909.42
_chemical_name_systematic
; 
 ? 
;
_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                 95.1760(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   24.0689(11)
_cell_length_b                   11.0440(5)
_cell_length_c                   14.1809(7)
_cell_measurement_reflns_used    8433
_cell_measurement_temperature    150(1)
_cell_measurement_theta_max      26.341
_cell_measurement_theta_min      2.446
_cell_volume                     3754.2(3)
_computing_cell_refinement       'SAINT+ NT V6.22 (Bruker, 2001)'
_computing_data_collection       'SMART NT V5.625 (Bruker, 1998)'
_computing_data_reduction        'SAINT+ NT V6.22'
_computing_molecular_graphics    'SHELXTL V6.1 (Sheldrick, 2000)'
_computing_publication_material  'SHELXTL V6.1'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(1)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker SMART APEX CCD diffractometer'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0445
_diffrn_reflns_av_sigmaI/netI    0.0326
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            15622
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.70
_diffrn_standards_decay_%        none
_exptl_absorpt_coefficient_mu    0.616
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.609
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1840
_exptl_crystal_size_max          0.48
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.476
_refine_diff_density_min         -0.284
_refine_diff_density_rms         0.063
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.060
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     290
_refine_ls_number_reflns         3316
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.0445
_refine_ls_R_factor_gt           0.0375
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0578P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0947
_refine_ls_wR_factor_ref         0.0974
_reflns_number_gt                2770
_reflns_number_total             3316
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg060460psi20060716_123508.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4511434
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_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Ag1 Ag 0.5000 0.0000 0.0000 0.04866(14) Uani 1 2 d S
C1 C 0.55059(10) 0.2864(2) 0.06861(16) 0.0352(6) Uani 1 1 d .
H1 H 0.5605 0.3701 0.0913 0.042 Uiso 1 1 calc R
C2 C 0.58913(10) 0.2539(3) -0.00819(17) 0.0383(6) Uani 1 1 d .
H2A H 0.5722 0.1871 -0.0474 0.046 Uiso 1 1 calc R
H2B H 0.5927 0.3249 -0.0499 0.046 Uiso 1 1 calc R
C11 C 0.57233(11) 0.2386(3) 0.24071(17) 0.0495(7) Uani 1 1 d .
H11 H 0.5778 0.3186 0.2644 0.059 Uiso 1 1 calc R
C12 C 0.57766(12) 0.1349(3) 0.2914(2) 0.0594(9) Uani 1 1 d .
H12 H 0.5876 0.1271 0.3575 0.071 Uiso 1 1 calc R
C13 C 0.56566(12) 0.0428(3) 0.2270(2) 0.0549(8) Uani 1 1 d .
H13 H 0.5660 -0.0408 0.2430 0.066 Uiso 1 1 calc R
C21 C 0.45605(11) 0.3806(2) 0.03237(19) 0.0416(6) Uani 1 1 d .
H21 H 0.4624 0.4555 0.0644 0.050 Uiso 1 1 calc R
C22 C 0.40812(12) 0.3448(3) -0.01753(19) 0.0468(7) Uani 1 1 d .
H22 H 0.3744 0.3895 -0.0282 0.056 Uiso 1 1 calc R
C23 C 0.41867(11) 0.2299(3) -0.04948(18) 0.0420(7) Uani 1 1 d .
H23 H 0.3920 0.1819 -0.0862 0.050 Uiso 1 1 calc R
C31 C 0.66136(11) 0.0973(2) 0.02125(19) 0.0416(6) Uani 1 1 d .
C32 C 0.71609(11) 0.0627(3) 0.0697(2) 0.0443(7) Uani 1 1 d .
C33 C 0.74962(11) 0.1502(3) 0.12017(17) 0.0430(7) Uani 1 1 d .
C34 C 0.73252(10) 0.2703(3) 0.12420(16) 0.0386(6) Uani 1 1 d .
C35 C 0.67733(10) 0.3075(2) 0.07914(16) 0.0351(6) Uani 1 1 d .
C36 C 0.73437(15) -0.0550(3) 0.0654(3) 0.0676(9) Uani 1 1 d .
H36 H 0.7120 -0.1141 0.0312 0.081 Uiso 1 1 calc R
C37 C 0.78688(18) -0.0877(4) 0.1122(3) 0.0828(13) Uani 1 1 d .
H37 H 0.7993 -0.1691 0.1097 0.099 Uiso 1 1 calc R
C38 C 0.81942(19) -0.0044(4) 0.1604(3) 0.0810(14) Uani 1 1 d .
H38 H 0.8545 -0.0284 0.1908 0.097 Uiso 1 1 calc R
C39 C 0.80264(12) 0.1153(4) 0.1663(2) 0.0611(10) Uani 1 1 d .
C40 C 0.83547(13) 0.2065(4) 0.2141(2) 0.0713(11) Uani 1 1 d .
H40 H 0.8708 0.1858 0.2450 0.086 Uiso 1 1 calc R
C41 C 0.81803(13) 0.3202(4) 0.2167(2) 0.0707(11) Uani 1 1 d .
H41 H 0.8411 0.3790 0.2496 0.085 Uiso 1 1 calc R
C42 C 0.76617(11) 0.3554(3) 0.17166(19) 0.0525(8) Uani 1 1 d .
H42 H 0.7544 0.4373 0.1740 0.063 Uiso 1 1 calc R
N1 N 0.64471(8) 0.21723(18) 0.03262(13) 0.0336(5) Uani 1 1 d .
N11 N 0.55356(9) 0.0854(2) 0.13967(14) 0.0433(5) Uani 1 1 d .
N12 N 0.55769(8) 0.2064(2) 0.14964(13) 0.0371(5) Uani 1 1 d .
N21 N 0.47052(8) 0.1940(2) -0.02283(14) 0.0373(5) Uani 1 1 d .
N22 N 0.49298(8) 0.28902(19) 0.02762(14) 0.0331(5) Uani 1 1 d .
O1 O 0.63189(9) 0.02690(19) -0.02610(17) 0.0578(6) Uani 1 1 d .
O2 O 0.65965(7) 0.40950(16) 0.08269(14) 0.0479(5) Uani 1 1 d .
B1 B 0.5000 0.5916(4) 0.2500 0.0402(10) Uani 1 2 d S
F1 F 0.45708(12) 0.5173(3) 0.2834(3) 0.0756(9) Uani 0.70 1 d P
F2 F 0.52616(18) 0.6282(5) 0.3291(3) 0.0785(14) Uani 0.50 1 d P
F3 F 0.4795(3) 0.7093(5) 0.2282(5) 0.0805(18) Uani 0.35 1 d P
F4 F 0.5128(5) 0.5534(9) 0.1675(7) 0.079(2) Uiso 0.25 1 d P
F5 F 0.4543(5) 0.5746(12) 0.2020(9) 0.078(3) Uiso 0.20 1 d P
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'
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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
N21 Ag1 N21 180.0 5_655 .
N21 Ag1 N11 83.52(7) 5_655 5_655
N21 Ag1 N11 96.48(7) . 5_655
N21 Ag1 N11 96.48(7) 5_655 .
N21 Ag1 N11 83.52(7) . .
N11 Ag1 N11 180.00(9) 5_655 .
N21 Ag1 O1 78.82(6) 5_655 .
N21 Ag1 O1 101.18(6) . .
N11 Ag1 O1 113.07(6) 5_655 .
N11 Ag1 O1 66.93(6) . .
N12 C1 N22 111.7(2) . .
N12 C1 C2 112.6(2) . .
N22 C1 C2 109.64(18) . .
N12 C1 H1 107.6 . .
N22 C1 H1 107.6 . .
C2 C1 H1 107.6 . .
N1 C2 C1 111.88(18) . .
N1 C2 H2A 109.2 . .
C1 C2 H2A 109.2 . .
N1 C2 H2B 109.2 . .
C1 C2 H2B 109.2 . .
H2A C2 H2B 107.9 . .
C12 C11 N12 106.7(3) . .
C12 C11 H11 126.6 . .
N12 C11 H11 126.6 . .
C11 C12 C13 105.6(3) . .
C11 C12 H12 127.2 . .
C13 C12 H12 127.2 . .
N11 C13 C12 111.7(3) . .
N11 C13 H13 124.2 . .
C12 C13 H13 124.2 . .
N22 C21 C22 106.7(2) . .
N22 C21 H21 126.6 . .
C22 C21 H21 126.6 . .
C21 C22 C23 105.5(2) . .
C21 C22 H22 127.3 . .
C23 C22 H22 127.3 . .
N21 C23 C22 112.1(2) . .
N21 C23 H23 123.9 . .
C22 C23 H23 123.9 . .
O1 C31 N1 120.8(2) . .
O1 C31 C32 122.8(3) . .
N1 C31 C32 116.4(2) . .
C36 C32 C33 119.9(3) . .
C36 C32 C31 119.9(3) . .
C33 C32 C31 120.2(2) . .
C34 C33 C32 121.0(2) . .
C34 C33 C39 119.5(3) . .
C32 C33 C39 119.5(3) . .
C42 C34 C33 120.5(2) . .
C42 C34 C35 119.2(3) . .
C33 C34 C35 120.3(2) . .
O2 C35 N1 120.0(2) . .
O2 C35 C34 123.2(2) . .
N1 C35 C34 116.8(2) . .
C32 C36 C37 119.6(4) . .
C32 C36 H36 120.2 . .
C37 C36 H36 120.2 . .
C38 C37 C36 120.9(4) . .
C38 C37 H37 119.5 . .
C36 C37 H37 119.5 . .
C37 C38 C39 121.3(4) . .
C37 C38 H38 119.3 . .
C39 C38 H38 119.3 . .
C38 C39 C40 123.7(4) . .
C38 C39 C33 118.8(4) . .
C40 C39 C33 117.6(3) . .
C41 C40 C39 121.5(3) . .
C41 C40 H40 119.2 . .
C39 C40 H40 119.2 . .
C40 C41 C42 121.4(3) . .
C40 C41 H41 119.3 . .
C42 C41 H41 119.3 . .
C34 C42 C41 119.5(3) . .
C34 C42 H42 120.2 . .
C41 C42 H42 120.2 . .
C35 N1 C31 125.1(2) . .
C35 N1 C2 116.3(2) . .
C31 N1 C2 118.5(2) . .
C13 N11 N12 104.2(2) . .
C13 N11 Ag1 132.0(2) . .
N12 N11 Ag1 119.66(14) . .
N11 N12 C11 111.8(2) . .
N11 N12 C1 121.36(19) . .
C11 N12 C1 126.7(2) . .
C23 N21 N22 103.8(2) . .
C23 N21 Ag1 126.47(18) . .
N22 N21 Ag1 123.42(14) . .
C21 N22 N21 111.9(2) . .
C21 N22 C1 127.0(2) . .
N21 N22 C1 121.09(19) . .
C31 O1 Ag1 121.65(17) . .
F5 B1 F5 162.8(13) 2_655 .
F5 B1 F2 147.9(6) 2_655 2_655
F5 B1 F2 147.9(6) . .
F2 B1 F2 143.8(7) 2_655 .
F5 B1 F4 74.4(7) 2_655 2_655
F5 B1 F4 99.9(8) . 2_655
F2 B1 F4 137.6(5) 2_655 2_655
F2 B1 F4 57.5(5) . 2_655
F5 B1 F4 99.9(8) 2_655 .
F5 B1 F4 74.4(7) . .
F2 B1 F4 57.5(5) 2_655 .
F2 B1 F4 137.6(5) . .
F4 B1 F4 142.3(10) 2_655 .
F5 B1 F3 121.9(7) 2_655 .
F5 B1 F3 75.4(6) . .
F2 B1 F3 52.7(3) 2_655 .
F2 B1 F3 92.0(5) . .
F4 B1 F3 112.8(6) 2_655 .
F4 B1 F3 101.9(6) . .
F5 B1 F3 75.4(6) 2_655 2_655
F5 B1 F3 121.9(7) . 2_655
F2 B1 F3 92.0(5) 2_655 2_655
F2 B1 F3 52.7(3) . 2_655
F4 B1 F3 101.9(6) 2_655 2_655
F4 B1 F3 112.8(6) . 2_655
F5 B1 F1 111.0(6) 2_655 .
F5 B1 F1 58.0(7) . .
F2 B1 F1 98.9(3) 2_655 .
F2 B1 F1 101.6(3) . .
F4 B1 F1 110.2(5) . .
F3 B1 F1 110.5(3) . .
F3 B1 F1 134.6(3) 2_655 .
F5 B1 F1 58.0(7) 2_655 2_655
F5 B1 F1 111.0(6) . 2_655
F2 B1 F1 101.6(3) 2_655 2_655
F2 B1 F1 98.9(3) . 2_655
F4 B1 F1 110.2(5) 2_655 2_655
F3 B1 F1 134.6(3) . 2_655
F3 B1 F1 110.5(3) 2_655 2_655
F1 B1 F1 110.1(4) . 2_655
F4 F1 F5 112.4(8) 2_655 .
F4 F1 B1 61.4(5) 2_655 .
F5 F1 B1 54.2(5) . .
F5 F2 F3 101.0(10) 2_655 2_655
F5 F2 F4 90.6(10) 2_655 2_655
F3 F2 F4 118.4(6) 2_655 2_655
F5 F2 B1 66.8(8) 2_655 .
F3 F2 B1 68.6(4) 2_655 .
F4 F2 B1 61.5(5) 2_655 .
F3 F3 F2 114.3(6) 2_655 2_655
F3 F3 B1 66.8(3) 2_655 .
F2 F3 B1 58.8(3) 2_655 .
F3 F3 F5 114.6(5) 2_655 .
F1 F4 F2 135.0(9) 2_655 2_655
F1 F4 B1 74.3(6) 2_655 .
F2 F4 B1 61.0(5) 2_655 .
F1 F4 F5 116.5(9) 2_655 .
B1 F4 F5 51.3(6) . .
F2 F5 B1 72.2(8) 2_655 .
F2 F5 F1 139.7(12) 2_655 .
B1 F5 F1 67.8(6) . .
F2 F5 F4 54.0(8) 2_655 .
B1 F5 F4 54.3(6) . .
F1 F5 F4 103.2(9) . .
F2 F5 F3 46.4(7) 2_655 .
B1 F5 F3 56.8(5) . .
F1 F5 F3 104.5(8) . .
F4 F5 F3 83.1(8) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N21 2.271(2) 5_655
Ag1 N21 2.271(2) .
Ag1 N11 2.452(2) 5_655
Ag1 N11 2.452(2) .
Ag1 O1 3.243(2) .
C1 N12 1.448(3) .
C1 N22 1.455(3) .
C1 C2 1.535(3) .
C1 H1 1.0000 .
C2 N1 1.466(3) .
C2 H2A 0.9900 .
C2 H2B 0.9900 .
C11 C12 1.352(4) .
C11 N12 1.355(3) .
C11 H11 0.9500 .
C12 C13 1.380(4) .
C12 H12 0.9500 .
C13 N11 1.332(3) .
C13 H13 0.9500 .
C21 N22 1.352(3) .
C21 C22 1.357(4) .
C21 H21 0.9500 .
C22 C23 1.379(4) .
C22 H22 0.9500 .
C23 N21 1.331(3) .
C23 H23 0.9500 .
C31 O1 1.214(3) .
C31 N1 1.397(3) .
C31 C32 1.480(4) .
C32 C36 1.376(5) .
C32 C33 1.411(4) .
C33 C34 1.392(4) .
C33 C39 1.433(4) .
C34 C42 1.376(4) .
C34 C35 1.479(3) .
C35 O2 1.207(3) .
C35 N1 1.397(3) .
C36 C37 1.420(5) .
C36 H36 0.9500 .
C37 C38 1.352(6) .
C37 H37 0.9500 .
C38 C39 1.387(5) .
C38 H38 0.9500 .
C39 C40 1.415(5) .
C40 C41 1.325(5) .
C40 H40 0.9500 .
C41 C42 1.404(4) .
C41 H41 0.9500 .
C42 H42 0.9500 .
N11 N12 1.347(3) .
N21 N22 1.355(3) .
B1 F5 1.255(11) 2_655
B1 F5 1.255(11) .
B1 F2 1.300(3) 2_655
B1 F2 1.300(3) .
B1 F4 1.306(9) 2_655
B1 F4 1.306(9) .
B1 F3 1.415(7) .
B1 F3 1.415(7) 2_655
B1 F1 1.433(4) .
B1 F1 1.433(4) 2_655
F1 F4 1.039(11) 2_655
F1 F5 1.313(14) .
F2 F5 0.896(13) 2_655
F2 F3 1.209(7) 2_655
F2 F4 1.253(11) 2_655
F3 F3 1.117(11) 2_655
F3 F2 1.209(7) 2_655
F3 F5 1.637(14) .
F4 F1 1.039(11) 2_655
F4 F2 1.253(11) 2_655
F4 F5 1.549(15) .
F5 F2 0.896(13) 2_655
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
N12 C1 C2 N1 -39.2(3) .
N22 C1 C2 N1 -164.2(2) .
N12 C11 C12 C13 0.0(3) .
C11 C12 C13 N11 0.3(3) .
N22 C21 C22 C23 0.8(3) .
C21 C22 C23 N21 -0.7(3) .
O1 C31 C32 C36 -2.8(4) .
N1 C31 C32 C36 177.2(2) .
O1 C31 C32 C33 177.0(3) .
N1 C31 C32 C33 -3.0(4) .
C36 C32 C33 C34 178.8(3) .
C31 C32 C33 C34 -1.0(4) .
C36 C32 C33 C39 0.2(4) .
C31 C32 C33 C39 -179.7(2) .
C32 C33 C34 C42 -178.4(2) .
C39 C33 C34 C42 0.3(4) .
C32 C33 C34 C35 2.9(4) .
C39 C33 C34 C35 -178.4(2) .
C42 C34 C35 O2 -0.9(4) .
C33 C34 C35 O2 177.8(2) .
C42 C34 C35 N1 -179.5(2) .
C33 C34 C35 N1 -0.7(3) .
C33 C32 C36 C37 0.3(4) .
C31 C32 C36 C37 -179.8(3) .
C32 C36 C37 C38 -0.6(5) .
C36 C37 C38 C39 0.4(6) .
C37 C38 C39 C40 -178.7(3) .
C37 C38 C39 C33 0.1(5) .
C34 C33 C39 C38 -179.1(3) .
C32 C33 C39 C38 -0.4(4) .
C34 C33 C39 C40 -0.2(4) .
C32 C33 C39 C40 178.5(3) .
C38 C39 C40 C41 179.0(3) .
C33 C39 C40 C41 0.2(5) .
C39 C40 C41 C42 -0.3(5) .
C33 C34 C42 C41 -0.3(4) .
C35 C34 C42 C41 178.4(2) .
C40 C41 C42 C34 0.3(5) .
O2 C35 N1 C31 177.8(2) .
C34 C35 N1 C31 -3.6(3) .
O2 C35 N1 C2 -1.2(3) .
C34 C35 N1 C2 177.4(2) .
O1 C31 N1 C35 -174.6(2) .
C32 C31 N1 C35 5.4(3) .
O1 C31 N1 C2 4.3(4) .
C32 C31 N1 C2 -175.7(2) .
C1 C2 N1 C35 -67.6(3) .
C1 C2 N1 C31 113.4(2) .
C12 C13 N11 N12 -0.4(3) .
C12 C13 N11 Ag1 -156.7(2) .
N21 Ag1 N11 C13 -38.1(2) 5_655
N21 Ag1 N11 C13 141.9(2) .
O1 Ag1 N11 C13 -113.0(2) .
N21 Ag1 N11 N12 168.58(17) 5_655
N21 Ag1 N11 N12 -11.42(17) .
N11 Ag1 N11 N12 -162.3(14) 5_655
O1 Ag1 N11 N12 93.67(18) .
C13 N11 N12 C11 0.4(3) .
Ag1 N11 N12 C11 160.28(16) .
C13 N11 N12 C1 176.4(2) .
Ag1 N11 N12 C1 -23.7(3) .
C12 C11 N12 N11 -0.2(3) .
C12 C11 N12 C1 -176.0(2) .
N22 C1 N12 N11 69.9(3) .
C2 C1 N12 N11 -54.0(3) .
N22 C1 N12 C11 -114.7(3) .
C2 C1 N12 C11 121.4(3) .
C22 C23 N21 N22 0.3(3) .
C22 C23 N21 Ag1 152.71(19) .
N11 Ag1 N21 C23 42.1(2) 5_655
N11 Ag1 N21 C23 -137.9(2) .
O1 Ag1 N21 C23 157.2(2) .
N11 Ag1 N21 N22 -170.45(18) 5_655
N11 Ag1 N21 N22 9.55(18) .
O1 Ag1 N21 N22 -55.34(18) .
C22 C21 N22 N21 -0.7(3) .
C22 C21 N22 C1 178.5(2) .
C23 N21 N22 C21 0.3(3) .
Ag1 N21 N22 C21 -153.24(17) .
C23 N21 N22 C1 -179.0(2) .
Ag1 N21 N22 C1 27.4(3) .
N12 C1 N22 C21 107.7(3) .
C2 C1 N22 C21 -126.7(3) .
N12 C1 N22 N21 -73.1(3) .
C2 C1 N22 N21 52.5(3) .
N1 C31 O1 Ag1 -48.0(3) .
C32 C31 O1 Ag1 132.0(2) .
N21 Ag1 O1 C31 -124.1(2) 5_655
N21 Ag1 O1 C31 55.9(2) .
N11 Ag1 O1 C31 158.0(2) 5_655
N11 Ag1 O1 C31 -22.0(2) .
