#------------------------------------------------------------------------------
#$Date: 2016-03-23 23:28:34 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179503 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/00/4340026.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_4340026
loop_
_publ_author_name
'Connell, Timothy U.'
'Schieber, Christine'
'Silvestri, Ilaria Proietti'
'White, Jonathan M.'
'Williams, Spencer J.'
'Donnelly, Paul S.'
_publ_section_title
;
 Copper and Silver Complexes of Tris(triazole)amine and
 Tris(benzimidazole)amine Ligands: Evidence that Catalysis of an
 Azide-Alkyne Cycloaddition ("Click") Reaction by a Silver
 Tris(triazole)amine Complex Arises from Copper Impurities.
;
_journal_issue                   13
_journal_name_full               'Inorganic chemistry'
_journal_page_first              6503
_journal_page_last               6511
_journal_paper_doi               10.1021/ic5008999
_journal_volume                  53
_journal_year                    2014
_chemical_formula_sum            'C32 H31 Ag B F4 N11'
_chemical_formula_weight         764.36
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2012
_cell_angle_alpha                108.487(3)
_cell_angle_beta                 96.896(3)
_cell_angle_gamma                117.111(4)
_cell_formula_units_Z            2
_cell_length_a                   11.8407(5)
_cell_length_b                   12.2913(5)
_cell_length_c                   14.6737(6)
_cell_measurement_reflns_used    10532
_cell_measurement_temperature    130.0(2)
_cell_measurement_theta_max      73.2592
_cell_measurement_theta_min      3.3474
_cell_volume                     1712.01(16)
_computing_cell_refinement
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov  6 2009,16:24:50)
;
_computing_data_collection
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov  6 2009,16:24:50)
;
_computing_data_reduction
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov  6 2009,16:24:50)
;
_computing_structure_refinement  'SHELXL-2012 (Sheldrick, 2012)'
_diffrn_ambient_temperature      130.0(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.974
_diffrn_measurement_device_type  'Xcalibur, Sapphire3'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Enhance (Cu) X-ray Source'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0192
_diffrn_reflns_av_unetI/netI     0.0209
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.974
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            12409
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.974
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         73.336
_diffrn_reflns_theta_min         3.344
_exptl_absorpt_coefficient_mu    5.261
_exptl_absorpt_correction_T_max  0.625
_exptl_absorpt_correction_T_min  0.276
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov  6 2009,16:24:50)
Numerical absorption correction based on gaussian integration over
            a multifaceted crystal model
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.483
_exptl_crystal_description       block
_exptl_crystal_F_000             776
_exptl_crystal_size_max          0.4661
_exptl_crystal_size_mid          0.2064
_exptl_crystal_size_min          0.1200
_refine_diff_density_max         0.778
_refine_diff_density_min         -0.423
_refine_diff_density_rms         0.067
_refine_ls_extinction_coef       0.00033(12)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.087
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     463
_refine_ls_number_reflns         6716
_refine_ls_number_restraints     34
_refine_ls_restrained_S_all      1.130
_refine_ls_R_factor_all          0.0337
_refine_ls_R_factor_gt           0.0317
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
 w=1/[σ²(Fo²)+(0.0490P)²+1.1840P]
 where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0841
_refine_ls_wR_factor_ref         0.0870
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6321
_reflns_number_total             6716
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic5008999_si_001.cif
_cod_data_source_block           shelxl
_cod_depositor_comments
'Adding full bibliography for 4340023--4340026.cif.'
_cod_original_cell_volume        1712.01(14)
_cod_database_code               4340026
#BEGIN Tags that were not found in dictionaries:
_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.
;
_shelxl_version_number           2012-9
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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
C13 C 0.5348(3) 0.5903(2) 0.26412(19) 0.0319(5) Uani 1 1 d . . . . .
H13 H 0.5403 0.6071 0.2068 0.038 Uiso 1 1 calc R U . . .
C12 C 0.4468(2) 0.4730(2) 0.26869(18) 0.0296(5) Uani 1 1 d . . . . .
C14 C 0.7212(3) 0.8180(3) 0.4007(2) 0.0379(6) Uani 1 1 d . . . . .
H14A H 0.7359 0.8617 0.4725 0.045 Uiso 1 1 calc R U . . .
H14B H 0.6950 0.8636 0.3677 0.045 Uiso 1 1 calc R U . . .
C15 C 0.8496(2) 0.8330(2) 0.38527(18) 0.0289(5) Uani 1 1 d . . . . .
C16 C 0.8873(4) 0.8591(3) 0.3059(2) 0.0489(7) Uani 1 1 d . . . . .
H16 H 0.8350 0.8684 0.2598 0.059 Uiso 1 1 calc R U . . .
C17 C 1.0144(5) 0.8716(4) 0.2978(3) 0.0800(15) Uani 1 1 d . . . . .
H17 H 1.0464 0.8903 0.2464 0.096 Uiso 1 1 calc R U . . .
C18 C 1.0861(3) 0.8547(3) 0.3688(3) 0.0627(10) Uani 1 1 d . . . . .
H18 H 1.1661 0.8612 0.3632 0.075 Uiso 1 1 calc R U . . .
C19 C 1.0455(3) 0.8301(4) 0.4436(3) 0.0620(9) Uani 1 1 d . . . . .
H19 H 1.0965 0.8199 0.4899 0.074 Uiso 1 1 calc R U . . .
C20 C 0.9299(3) 0.8197(3) 0.4525(2) 0.0455(7) Uani 1 1 d . . . . .
H20 H 0.9025 0.8029 0.5060 0.055 Uiso 1 1 calc R U . . .
C11 C 0.3308(3) 0.3449(3) 0.18695(19) 0.0342(5) Uani 1 1 d . . . . .
H11A H 0.2517 0.3512 0.1810 0.041 Uiso 1 1 calc R U . . .
H11B H 0.3490 0.3322 0.1229 0.041 Uiso 1 1 calc R U . . .
C23 C 0.4302(3) 0.0066(3) 0.2279(2) 0.0387(6) Uani 1 1 d . . . . .
H23 H 0.4388 -0.0384 0.1675 0.046 Uiso 1 1 calc R U . . .
C22 C 0.4091(3) 0.1112(3) 0.2508(2) 0.0363(6) Uani 1 1 d . . . . .
C24 C 0.4582(3) -0.1180(3) 0.3291(3) 0.0443(7) Uani 1 1 d . . . . .
H24A H 0.5100 -0.0794 0.3995 0.053 Uiso 1 1 calc R U . . .
H24B H 0.5109 -0.1370 0.2881 0.053 Uiso 1 1 calc R U . . .
C25 C 0.3321(3) -0.2489(3) 0.3060(2) 0.0389(6) Uani 1 1 d . . . . .
C26 C 0.3209(3) -0.3055(3) 0.3749(3) 0.0476(7) Uani 1 1 d . . . . .
H26 H 0.3888 -0.2604 0.4361 0.057 Uiso 1 1 calc R U . . .
C27 C 0.2090(4) -0.4291(4) 0.3531(3) 0.0570(8) Uani 1 1 d . . . . .
H27 H 0.2021 -0.4670 0.3994 0.068 Uiso 1 1 calc R U . . .
C28 C 0.1083(4) -0.4954(3) 0.2630(3) 0.0597(9) Uani 1 1 d . . . . .
H28 H 0.0333 -0.5785 0.2482 0.072 Uiso 1 1 calc R U . . .
C29 C 0.1183(4) -0.4393(3) 0.1945(3) 0.0588(8) Uani 1 1 d . . . . .
H29 H 0.0494 -0.4839 0.1340 0.071 Uiso 1 1 calc R U . . .
C30 C 0.2304(3) -0.3167(3) 0.2153(2) 0.0486(7) Uani 1 1 d . . . . .
H30 H 0.2373 -0.2800 0.1683 0.058 Uiso 1 1 calc R U . . .
C21 C 0.4043(3) 0.1899(3) 0.1916(2) 0.0393(6) Uani 1 1 d . . . . .
C2 C 0.0753(3) 0.1407(2) 0.20933(18) 0.0322(5) Uani 1 1 d . . . . .
C3 C -0.0566(3) 0.0961(3) 0.1733(2) 0.0372(6) Uani 1 1 d . . . . .
H3 H -0.1117 0.0455 0.1064 0.045 Uiso 1 1 calc R U . . .
C4 C -0.2191(3) 0.1256(3) 0.2619(3) 0.0440(7) Uani 1 1 d . . . . .
H4A H -0.2346 0.1101 0.3213 0.053 Uiso 1 1 calc R U . . .
H4B H -0.2899 0.0474 0.2028 0.053 Uiso 1 1 calc R U . . .
C5 C -0.2240(3) 0.2481(3) 0.2679(2) 0.0393(6) Uani 1 1 d . . . . .
C10 C -0.1833(3) 0.3529(3) 0.3611(3) 0.0498(7) Uani 1 1 d . . . . .
H10 H -0.1574 0.3457 0.4202 0.060 Uiso 1 1 calc R U . . .
C9 C -0.1811(4) 0.4687(3) 0.3662(3) 0.0576(8) Uani 1 1 d . . . . .
H9 H -0.1533 0.5393 0.4287 0.069 Uiso 1 1 calc R U . . .
C8 C -0.2203(3) 0.4785(3) 0.2780(3) 0.0523(8) Uani 1 1 d . . . . .
H8 H -0.2180 0.5563 0.2811 0.063 Uiso 1 1 calc R U . . .
C7 C -0.2627(3) 0.3738(3) 0.1861(3) 0.0500(7) Uani 1 1 d . . . . .
H7 H -0.2902 0.3804 0.1270 0.060 Uiso 1 1 calc R U . . .
C6 C -0.2649(3) 0.2585(3) 0.1801(2) 0.0446(6) Uani 1 1 d . . . . .
H6 H -0.2938 0.1879 0.1174 0.053 Uiso 1 1 calc R U . . .
C1 C 0.1677(3) 0.1164(3) 0.1560(2) 0.0365(6) Uani 1 1 d . . . . .
H1A H 0.1612 0.0338 0.1533 0.044 Uiso 1 1 calc R U . . .
H1B H 0.1414 0.1059 0.0870 0.044 Uiso 1 1 calc R U . . .
C31 C 0.0929(5) 0.2999(4) 0.9752(3) 0.0825(15) Uani 1 1 d . . . . .
C32 C 0.2107(5) 0.4040(4) 0.9652(4) 0.0797(12) Uani 1 1 d . . . . .
H32A H 0.2391 0.4906 1.0169 0.120 Uiso 1 1 calc R U . . .
H32B H 0.1886 0.4033 0.8998 0.120 Uiso 1 1 calc R U . . .
H32C H 0.2814 0.3862 0.9724 0.120 Uiso 1 1 calc R U . . .
N5 N 0.4746(2) 0.4919(2) 0.36681(15) 0.0304(4) Uani 1 1 d . . . . .
N6 N 0.5751(2) 0.6154(2) 0.42284(16) 0.0313(4) Uani 1 1 d . . . . .
N7 N 0.6115(2) 0.6761(2) 0.36071(16) 0.0304(4) Uani 1 1 d . . . . .
N8 N 0.4020(2) 0.1452(2) 0.34678(17) 0.0365(5) Uani 1 1 d . . . . .
N9 N 0.4180(2) 0.0662(2) 0.38375(18) 0.0380(5) Uani 1 1 d . . . . .
N10 N 0.4357(2) -0.0174(2) 0.31070(19) 0.0384(5) Uani 1 1 d . . . . .
N2 N 0.1164(2) 0.2124(2) 0.31107(15) 0.0313(4) Uani 1 1 d . . . . .
N3 N 0.0154(2) 0.2136(2) 0.33977(17) 0.0342(4) Uani 1 1 d . . . . .
N4 N -0.0898(2) 0.1411(2) 0.25555(17) 0.0343(5) Uani 1 1 d . . . . .
N1 N 0.3057(2) 0.2290(2) 0.20869(16) 0.0325(4) Uani 1 1 d . . . . .
N11 N 0.0040(6) 0.2197(4) 0.9839(3) 0.120(2) Uani 1 1 d . . . . .
F1 F 0.5021(2) 0.3613(2) 0.0106(2) 0.0792(7) Uani 1 1 d D . . . .
F3 F 0.4052(3) 0.2125(3) -0.16021(17) 0.0925(9) Uani 1 1 d D . . . .
F2 F 0.3193(4) 0.1734(4) -0.0515(4) 0.0662(16) Uani 0.570(8) 1 d D U P A 1
F4 F 0.4973(6) 0.1587(5) -0.0469(3) 0.0681(15) Uani 0.570(8) 1 d D U P A 1
F2' F 0.3746(8) 0.1295(6) -0.0394(4) 0.097(3) Uani 0.430(8) 1 d D U P A 2
F4' F 0.5644(5) 0.2363(8) -0.0652(5) 0.083(3) Uani 0.430(8) 1 d D U P A 2
Ag1 Ag 0.33495(2) 0.30766(2) 0.40641(2) 0.03149(8) Uani 1 1 d . . . . .
B1 B 0.4464(2) 0.2334(2) -0.06230(18) 0.0372(6) Uani 1 1 d D . . . .
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'
N N 0.0311 0.0180 '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'
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'
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
N7 C13 C12 105.0(2) . .
N5 C12 C13 108.1(2) . .
N5 C12 C11 121.8(2) . .
C13 C12 C11 129.9(2) . .
N7 C14 C15 113.0(2) . .
C16 C15 C20 120.4(3) . .
C16 C15 C14 120.9(3) . .
C20 C15 C14 118.8(3) . .
C15 C16 C17 116.3(3) . .
C18 C17 C16 118.5(3) . .
C19 C18 C17 122.8(3) . .
C18 C19 C20 119.4(4) . .
C19 C20 C15 122.6(3) . .
N1 C11 C12 111.1(2) . .
N10 C23 C22 105.5(2) . .
N8 C22 C23 107.4(3) . .
N8 C22 C21 121.9(2) . .
C23 C22 C21 130.5(3) . .
N10 C24 C25 114.4(2) . .
C30 C25 C26 119.3(3) . .
C30 C25 C24 121.3(3) . .
C26 C25 C24 119.3(3) . .
C25 C26 C27 120.3(3) . .
C28 C27 C26 119.9(3) . .
C27 C28 C29 120.1(3) . .
C28 C29 C30 120.3(3) . .
C29 C30 C25 120.0(3) . .
N1 C21 C22 110.5(2) . .
N2 C2 C3 107.8(2) . .
N2 C2 C1 121.5(2) . .
C3 C2 C1 130.7(2) . .
N4 C3 C2 105.0(2) . .
N4 C4 C5 112.0(2) . .
C10 C5 C6 119.6(3) . .
C10 C5 C4 120.2(3) . .
C6 C5 C4 120.2(3) . .
C5 C10 C9 120.1(3) . .
C8 C9 C10 119.7(3) . .
C7 C8 C9 120.0(3) . .
C8 C7 C6 120.7(3) . .
C7 C6 C5 119.9(3) . .
N1 C1 C2 110.5(2) . .
N11 C31 C32 178.8(6) . .
N6 N5 C12 109.1(2) . .
N6 N5 Ag1 132.96(16) . .
C12 N5 Ag1 117.89(15) . .
N5 N6 N7 107.31(19) . .
N5 N6 Ag1 122.12(16) . 2_666
N7 N6 Ag1 130.51(15) . 2_666
N6 N7 C13 110.5(2) . .
N6 N7 C14 120.9(2) . .
C13 N7 C14 128.6(2) . .
N9 N8 C22 109.6(2) . .
N9 N8 Ag1 132.81(17) . .
C22 N8 Ag1 116.95(18) . .
N8 N9 N10 106.2(2) . .
C23 N10 N9 111.3(2) . .
C23 N10 C24 129.1(2) . .
N9 N10 C24 119.6(2) . .
N3 N2 C2 109.7(2) . .
N3 N2 Ag1 129.95(16) . .
C2 N2 Ag1 120.39(16) . .
N2 N3 N4 106.1(2) . .
N3 N4 C3 111.5(2) . .
N3 N4 C4 119.5(2) . .
C3 N4 C4 128.9(2) . .
C1 N1 C11 111.6(2) . .
C1 N1 C21 112.9(2) . .
C11 N1 C21 112.8(2) . .
N6 Ag1 N2 129.59(7) 2_666 .
N6 Ag1 N5 104.77(7) 2_666 .
N2 Ag1 N5 107.45(7) . .
N6 Ag1 N8 99.19(8) 2_666 .
N2 Ag1 N8 108.40(8) . .
N5 Ag1 N8 105.09(7) . .
F2' B1 F3 116.0(3) . .
F3 B1 F4 115.4(3) . .
F2' B1 F1 118.1(4) . .
F3 B1 F1 117.5(2) . .
F4 B1 F1 117.3(3) . .
F2' B1 F4' 105.5(4) . .
F3 B1 F4' 96.3(4) . .
F1 B1 F4' 97.5(3) . .
F3 B1 F2 96.6(3) . .
F4 B1 F2 105.0(3) . .
F1 B1 F2 100.0(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C13 N7 1.348(3) .
C13 C12 1.370(3) .
C12 N5 1.356(3) .
C12 C11 1.497(3) .
C14 N7 1.475(3) .
C14 C15 1.500(3) .
C15 C16 1.375(4) .
C15 C20 1.387(4) .
C16 C17 1.465(6) .
C17 C18 1.390(7) .
C18 C19 1.316(6) .
C19 C20 1.342(5) .
C11 N1 1.464(3) .
C23 N10 1.340(4) .
C23 C22 1.366(4) .
C22 N8 1.361(4) .
C22 C21 1.505(4) .
C24 N10 1.471(4) .
C24 C25 1.509(4) .
C25 C30 1.383(4) .
C25 C26 1.386(4) .
C26 C27 1.386(5) .
C27 C28 1.373(6) .
C28 C29 1.377(6) .
C29 C30 1.382(5) .
C21 N1 1.470(3) .
C2 N2 1.358(3) .
C2 C3 1.363(4) .
C2 C1 1.501(4) .
C3 N4 1.344(4) .
C4 N4 1.472(3) .
C4 C5 1.508(4) .
C5 C10 1.385(4) .
C5 C6 1.386(4) .
C10 C9 1.390(5) .
C9 C8 1.382(5) .
C8 C7 1.370(5) .
C7 C6 1.380(4) .
C1 N1 1.464(3) .
C31 N11 1.124(6) .
C31 C32 1.464(6) .
N5 N6 1.312(3) .
N5 Ag1 2.419(2) .
N6 N7 1.344(3) .
N6 Ag1 2.290(2) 2_666
N8 N9 1.322(3) .
N8 Ag1 2.426(2) .
N9 N10 1.342(3) .
N2 N3 1.319(3) .
N2 Ag1 2.314(2) .
N3 N4 1.339(3) .
F1 B1 1.368(3) .
F3 B1 1.360(3) .
F2 B1 1.398(3) .
F4 B1 1.365(3) .
F2' B1 1.348(3) .
F4' B1 1.388(3) .
Ag1 N6 2.290(2) 2_666
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_4
N7 C13 C12 N5 -0.7(3) . .
N7 C13 C12 C11 174.9(2) . .
N7 C14 C15 C16 98.6(3) . .
N7 C14 C15 C20 -81.3(3) . .
C20 C15 C16 C17 0.0(4) . .
C14 C15 C16 C17 -179.9(2) . .
C15 C16 C17 C18 0.8(4) . .
C16 C17 C18 C19 -1.0(5) . .
C17 C18 C19 C20 0.4(6) . .
C18 C19 C20 C15 0.5(5) . .
C16 C15 C20 C19 -0.6(4) . .
C14 C15 C20 C19 179.2(3) . .
N5 C12 C11 N1 -33.0(3) . .
C13 C12 C11 N1 152.0(3) . .
N10 C23 C22 N8 -0.4(3) . .
N10 C23 C22 C21 174.7(3) . .
N10 C24 C25 C30 49.3(4) . .
N10 C24 C25 C26 -133.9(3) . .
C30 C25 C26 C27 0.1(4) . .
C24 C25 C26 C27 -176.7(3) . .
C25 C26 C27 C28 -0.4(5) . .
C26 C27 C28 C29 -0.2(5) . .
C27 C28 C29 C30 0.9(6) . .
C28 C29 C30 C25 -1.1(5) . .
C26 C25 C30 C29 0.6(5) . .
C24 C25 C30 C29 177.3(3) . .
N8 C22 C21 N1 -40.2(3) . .
C23 C22 C21 N1 145.3(3) . .
N2 C2 C3 N4 -1.1(3) . .
C1 C2 C3 N4 175.8(3) . .
N4 C4 C5 C10 -89.7(3) . .
N4 C4 C5 C6 88.1(3) . .
C6 C5 C10 C9 -1.3(5) . .
C4 C5 C10 C9 176.5(3) . .
C5 C10 C9 C8 0.4(5) . .
C10 C9 C8 C7 0.7(5) . .
C9 C8 C7 C6 -0.9(5) . .
C8 C7 C6 C5 0.0(5) . .
C10 C5 C6 C7 1.1(4) . .
C4 C5 C6 C7 -176.7(3) . .
N2 C2 C1 N1 -31.0(3) . .
C3 C2 C1 N1 152.5(3) . .
C13 C12 N5 N6 0.3(3) . .
C11 C12 N5 N6 -175.8(2) . .
C13 C12 N5 Ag1 178.24(16) . .
C11 C12 N5 Ag1 2.2(3) . .
C12 N5 N6 N7 0.3(3) . .
Ag1 N5 N6 N7 -177.25(16) . .
C12 N5 N6 Ag1 -177.22(15) . 2_666
Ag1 N5 N6 Ag1 5.2(3) . 2_666
N5 N6 N7 C13 -0.8(3) . .
Ag1 N6 N7 C13 176.46(16) 2_666 .
N5 N6 N7 C14 178.9(2) . .
Ag1 N6 N7 C14 -3.9(3) 2_666 .
C12 C13 N7 N6 0.9(3) . .
C12 C13 N7 C14 -178.7(2) . .
C15 C14 N7 N6 101.8(3) . .
C15 C14 N7 C13 -78.6(3) . .
C23 C22 N8 N9 0.1(3) . .
C21 C22 N8 N9 -175.5(2) . .
C23 C22 N8 Ag1 -171.89(17) . .
C21 C22 N8 Ag1 12.5(3) . .
C22 N8 N9 N10 0.2(3) . .
Ag1 N8 N9 N10 170.48(17) . .
C22 C23 N10 N9 0.5(3) . .
C22 C23 N10 C24 -179.2(2) . .
N8 N9 N10 C23 -0.5(3) . .
N8 N9 N10 C24 179.3(2) . .
C25 C24 N10 C23 -93.8(3) . .
C25 C24 N10 N9 86.5(3) . .
C3 C2 N2 N3 0.3(3) . .
C1 C2 N2 N3 -176.9(2) . .
C3 C2 N2 Ag1 179.55(17) . .
C1 C2 N2 Ag1 2.3(3) . .
C2 N2 N3 N4 0.6(3) . .
Ag1 N2 N3 N4 -178.57(16) . .
N2 N3 N4 C3 -1.3(3) . .
N2 N3 N4 C4 -178.7(2) . .
C2 C3 N4 N3 1.5(3) . .
C2 C3 N4 C4 178.5(2) . .
C5 C4 N4 N3 79.4(3) . .
C5 C4 N4 C3 -97.5(3) . .
C2 C1 N1 C11 -77.6(3) . .
C2 C1 N1 C21 154.1(2) . .
C12 C11 N1 C1 156.9(2) . .
C12 C11 N1 C21 -74.8(3) . .
C22 C21 N1 C1 -74.4(3) . .
C22 C21 N1 C11 158.0(2) . .
