#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:11:35 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179779 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/75/7007582.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_7007582
loop_
_publ_author_name
'Argent, Stephen P.'
'Adams, Harry'
'Riis-Johannessen, Thomas'
'Jeffery, John C.'
'Harding, Lindsay P.'
'Clegg, William'
'Harrington, Ross W.'
'Ward, Michael D.'
_publ_section_title
;
 Complexes of Ag(I), Hg(I) and Hg(II) with multidentate
 pyrazolyl-pyridine ligands: From mononuclear complexes to coordination
 polymers via helicates, a mesocate, a cage and a catenate.
;
_journal_issue                   42
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              4996
_journal_page_last               5013
_journal_paper_doi               10.1039/b607541j
_journal_year                    2006
_chemical_formula_moiety         '4(C24 H20 Ag N6), 2(C6 H14 O), 4(B F4)'
_chemical_formula_sum            'C108 H108 Ag4 B4 F16 N24 O2'
_chemical_formula_weight         2552.90
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 92.500(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   10.565(3)
_cell_length_b                   11.280(4)
_cell_length_c                   23.344(7)
_cell_measurement_reflns_used    6487
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      54.986
_cell_measurement_theta_min      5.031
_cell_volume                     2779.3(15)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 100
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'BRUKER SMART 1000'
_diffrn_measurement_method       'phi and 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  0.0584
_diffrn_reflns_av_sigmaI/netI    0.0547
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            22834
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.75
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.782
_exptl_absorpt_correction_T_max  0.9619
_exptl_absorpt_correction_T_min  0.8285
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            COLOURLESS
_exptl_crystal_density_diffrn    1.525
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             1292
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.149
_refine_diff_density_min         -1.374
_refine_diff_density_rms         0.102
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.987
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     388
_refine_ls_number_reflns         6259
_refine_ls_number_restraints     114
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0838
_refine_ls_R_factor_gt           0.0516
_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)+(0.0897P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1312
_refine_ls_wR_factor_ref         0.1479
_reflns_number_gt                4240
_reflns_number_total             6259
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b607541j.txt
_cod_data_source_block           imw259m
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_refine_ls_hydrogen_treatment' value 'CONSTR' changed to
'constr' according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7007582
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.61589(3) 0.57437(3) 0.140066(15) 0.04473(15) Uani 1 1 d . . .
N11 N 0.7250(3) 0.7321(3) 0.10955(14) 0.0341(7) Uani 1 1 d . . .
C12 C 0.8429(3) 0.7472(3) 0.13276(16) 0.0313(8) Uani 1 1 d . . .
C13 C 0.9265(4) 0.8286(4) 0.1102(2) 0.0432(10) Uani 1 1 d . . .
H13 H 1.0102 0.8371 0.1263 0.052 Uiso 1 1 calc R . .
C14 C 0.8851(5) 0.8964(4) 0.0641(2) 0.0538(13) Uani 1 1 d . . .
H14 H 0.9403 0.9529 0.0482 0.065 Uiso 1 1 calc R . .
C15 C 0.7630(5) 0.8824(5) 0.0408(2) 0.0603(14) Uani 1 1 d . . .
H15 H 0.7331 0.9288 0.0091 0.072 Uiso 1 1 calc R . .
C16 C 0.6871(4) 0.7996(4) 0.06499(19) 0.0513(12) Uani 1 1 d . . .
H16 H 0.6033 0.7897 0.0493 0.062 Uiso 1 1 calc R . .
N21 N 0.8096(3) 0.5807(3) 0.19640(14) 0.0301(7) Uani 1 1 d . . .
N22 N 0.8651(3) 0.5357(3) 0.24439(14) 0.0345(7) Uani 1 1 d . . .
C23 C 0.9700(4) 0.5988(4) 0.2611(2) 0.0423(10) Uani 1 1 d . . .
H23 H 1.0241 0.5836 0.2938 0.051 Uiso 1 1 calc R . .
C24 C 0.9832(4) 0.6870(4) 0.22254(18) 0.0394(10) Uani 1 1 d . . .
H24 H 1.0480 0.7454 0.2225 0.047 Uiso 1 1 calc R . .
C25 C 0.8805(3) 0.6739(3) 0.18255(16) 0.0301(8) Uani 1 1 d . . .
C31 C 0.8170(4) 0.4271(4) 0.2698(2) 0.0428(10) Uani 1 1 d . . .
H31A H 0.7237 0.4247 0.2638 0.051 Uiso 1 1 calc R . .
H31B H 0.8368 0.4282 0.3116 0.051 Uiso 1 1 calc R . .
C32 C 0.8725(4) 0.3180(4) 0.24474(17) 0.0365(9) Uani 1 1 d . . .
C33 C 0.9838(3) 0.2689(3) 0.26894(16) 0.0317(8) Uani 1 1 d . . .
H33 H 1.0228 0.3039 0.3022 0.038 Uiso 1 1 calc R . .
C34 C 1.0386(3) 0.1692(3) 0.24495(17) 0.0319(8) Uani 1 1 d . . .
C35 C 0.9815(4) 0.1171(4) 0.19690(18) 0.0395(9) Uani 1 1 d . . .
H35 H 1.0188 0.0494 0.1803 0.047 Uiso 1 1 calc R . .
C36 C 0.8698(4) 0.1635(4) 0.1729(2) 0.0485(11) Uani 1 1 d . . .
H36 H 0.8302 0.1271 0.1401 0.058 Uiso 1 1 calc R . .
C37 C 0.8158(4) 0.2631(4) 0.19675(19) 0.0454(11) Uani 1 1 d . . .
H37 H 0.7392 0.2942 0.1801 0.054 Uiso 1 1 calc R . .
C38 C 1.1619(3) 0.1210(4) 0.27159(18) 0.0343(9) Uani 1 1 d . . .
H38A H 1.2259 0.1179 0.2419 0.041 Uiso 1 1 calc R . .
H38B H 1.1935 0.1760 0.3020 0.041 Uiso 1 1 calc R . .
N41 N 1.0598(3) -0.0180(3) 0.33494(13) 0.0291(7) Uani 1 1 d . . .
N42 N 1.1485(3) 0.0034(3) 0.29616(13) 0.0298(7) Uani 1 1 d . . .
C43 C 1.2271(4) -0.0911(3) 0.29188(18) 0.0329(9) Uani 1 1 d . . .
H43 H 1.2970 -0.0967 0.2677 0.039 Uiso 1 1 calc R . .
C44 C 1.1880(3) -0.1761(3) 0.32831(16) 0.0326(9) Uani 1 1 d . . .
H44 H 1.2243 -0.2522 0.3348 0.039 Uiso 1 1 calc R . .
C45 C 1.0819(3) -0.1274(3) 0.35436(15) 0.0291(8) Uani 1 1 d . . .
N51 N 0.9052(3) -0.1081(3) 0.41443(15) 0.0423(9) Uani 1 1 d . . .
C52 C 0.9987(3) -0.1788(4) 0.39704(16) 0.0323(9) Uani 1 1 d . . .
C53 C 1.0139(4) -0.2933(4) 0.41675(18) 0.0418(10) Uani 1 1 d . . .
H53 H 1.0796 -0.3422 0.4034 0.050 Uiso 1 1 calc R . .
C54 C 0.9316(4) -0.3355(5) 0.4563(2) 0.0545(13) Uani 1 1 d . . .
H54 H 0.9409 -0.4138 0.4708 0.065 Uiso 1 1 calc R . .
C55 C 0.8366(4) -0.2643(5) 0.4747(2) 0.0593(14) Uani 1 1 d . . .
H55 H 0.7791 -0.2919 0.5019 0.071 Uiso 1 1 calc R . .
C56 C 0.8271(4) -0.1524(5) 0.4527(2) 0.0580(14) Uani 1 1 d . . .
H56 H 0.7611 -0.1029 0.4654 0.070 Uiso 1 1 calc R . .
B1 B 0.7219(4) 0.0640(4) 0.8828(2) 0.0359(10) Uani 1 1 d . . .
F1 F 0.8009(3) 0.0458(3) 0.92929(13) 0.0756(10) Uani 1 1 d . . .
F2 F 0.5998(3) 0.0804(3) 0.89994(17) 0.0827(11) Uani 1 1 d . . .
F3 F 0.7628(3) 0.1602(3) 0.85346(16) 0.0858(11) Uani 1 1 d . . .
F4 F 0.7188(3) -0.0291(3) 0.84568(16) 0.0880(12) Uani 1 1 d . . .
C1 C 1.1281(9) 0.5465(9) 0.0791(4) 0.063(2) Uani 0.50 1 d PDU A -1
H1A H 1.1371 0.6235 0.0603 0.095 Uiso 0.50 1 calc PR A -1
H1B H 1.2122 0.5129 0.0881 0.095 Uiso 0.50 1 calc PR A -1
H1C H 1.0834 0.5570 0.1147 0.095 Uiso 0.50 1 calc PR A -1
C2 C 1.0560(12) 0.4661(11) 0.0410(5) 0.083(4) Uani 0.50 1 d PDU A -1
H2A H 1.1200 0.4511 0.0115 0.099 Uiso 0.50 1 calc PR A -1
C3 C 1.0432(13) 0.3425(10) 0.0651(7) 0.100(4) Uani 0.50 1 d PDU A -1
H3A H 0.9985 0.2919 0.0366 0.151 Uiso 0.50 1 calc PR A -1
H3B H 0.9951 0.3457 0.1000 0.151 Uiso 0.50 1 calc PR A -1
H3C H 1.1276 0.3097 0.0741 0.151 Uiso 0.50 1 calc PR A -1
O4 O 0.9515(6) 0.4795(9) 0.0068(4) 0.090(2) Uani 0.50 1 d PDU A -1
C5 C 0.9950(19) 0.510(2) -0.0794(6) 0.161(8) Uani 0.50 1 d PDU A -1
H5A H 1.0845 0.4896 -0.0731 0.241 Uiso 0.50 1 calc PR A -1
H5B H 0.9838 0.5569 -0.1147 0.241 Uiso 0.50 1 calc PR A -1
H5C H 0.9442 0.4379 -0.0828 0.241 Uiso 0.50 1 calc PR A -1
C6 C 0.9549(16) 0.5784(15) -0.0324(6) 0.120(5) Uani 0.50 1 d PDU A -1
H6A H 1.0160 0.6420 -0.0200 0.144 Uiso 0.50 1 calc PR A -1
C7 C 0.8233(16) 0.6145(18) -0.0318(7) 0.154(8) Uani 0.50 1 d PDU A -1
H7A H 0.8096 0.6833 -0.0570 0.231 Uiso 0.50 1 calc PR A -1
H7B H 0.8024 0.6356 0.0074 0.231 Uiso 0.50 1 calc PR A -1
H7C H 0.7690 0.5490 -0.0455 0.231 Uiso 0.50 1 calc PR A -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'
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'
O O 0.0106 0.0060 '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
_geom_angle_publ_flag
N41 Ag1 N11 153.60(11) 2_655 . ?
N41 Ag1 N21 125.03(11) 2_655 . ?
N11 Ag1 N21 73.28(11) . . ?
N41 Ag1 N51 71.48(11) 2_655 2_655 ?
N11 Ag1 N51 122.75(12) . 2_655 ?
N21 Ag1 N51 111.80(11) . 2_655 ?
C16 N11 C12 118.7(3) . . ?
C16 N11 Ag1 123.8(3) . . ?
C12 N11 Ag1 116.7(2) . . ?
N11 C12 C13 121.5(4) . . ?
N11 C12 C25 117.4(3) . . ?
C13 C12 C25 121.1(4) . . ?
C14 C13 C12 118.5(4) . . ?
C13 C14 C15 120.1(4) . . ?
C16 C15 C14 117.9(4) . . ?
N11 C16 C15 123.3(4) . . ?
C25 N21 N22 105.6(3) . . ?
C25 N21 Ag1 111.5(2) . . ?
N22 N21 Ag1 141.5(2) . . ?
N21 N22 C23 111.3(3) . . ?
N21 N22 C31 120.6(3) . . ?
C23 N22 C31 128.0(4) . . ?
C24 C23 N22 107.5(4) . . ?
C23 C24 C25 105.4(4) . . ?
N21 C25 C24 110.2(3) . . ?
N21 C25 C12 119.9(3) . . ?
C24 C25 C12 129.8(3) . . ?
N22 C31 C32 112.5(3) . . ?
C37 C32 C33 118.3(4) . . ?
C37 C32 C31 121.3(4) . . ?
C33 C32 C31 120.4(4) . . ?
C34 C33 C32 121.0(4) . . ?
C35 C34 C33 119.7(4) . . ?
C35 C34 C38 121.1(4) . . ?
C33 C34 C38 119.2(4) . . ?
C34 C35 C36 120.0(4) . . ?
C35 C36 C37 120.1(4) . . ?
C36 C37 C32 120.8(4) . . ?
N42 C38 C34 113.0(3) . . ?
C45 N41 N42 106.1(3) . . ?
C45 N41 Ag1 118.7(2) . 2_645 ?
N42 N41 Ag1 134.5(2) . 2_645 ?
N41 N42 C43 110.7(3) . . ?
N41 N42 C38 120.6(3) . . ?
C43 N42 C38 128.0(3) . . ?
N42 C43 C44 107.7(3) . . ?
C43 C44 C45 105.3(3) . . ?
N41 C45 C44 110.2(3) . . ?
N41 C45 C52 119.6(3) . . ?
C44 C45 C52 130.2(4) . . ?
C56 N51 C52 117.5(4) . . ?
C56 N51 Ag1 128.5(3) . 2_645 ?
C52 N51 Ag1 113.3(3) . 2_645 ?
N51 C52 C53 122.1(4) . . ?
N51 C52 C45 115.9(3) . . ?
C53 C52 C45 122.0(3) . . ?
C52 C53 C54 118.6(4) . . ?
C55 C54 C53 120.0(5) . . ?
C56 C55 C54 117.9(4) . . ?
N51 C56 C55 124.0(4) . . ?
F1 B1 F4 112.9(4) . . ?
F1 B1 F3 109.0(4) . . ?
F4 B1 F3 107.1(4) . . ?
F1 B1 F2 109.7(4) . . ?
F4 B1 F2 107.0(4) . . ?
F3 B1 F2 111.1(4) . . ?
O4 C2 C1 133.3(12) . . ?
O4 C2 C3 103.9(9) . . ?
C1 C2 C3 113.4(9) . . ?
C2 O4 C6 114.9(10) . . ?
C5 C6 O4 95.2(12) . . ?
C5 C6 C7 118.6(14) . . ?
O4 C6 C7 99.2(12) . . ?
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 N41 2.228(3) 2_655 ?
Ag1 N11 2.252(3) . ?
Ag1 N21 2.385(3) . ?
Ag1 N51 2.425(4) 2_655 ?
N11 C16 1.337(5) . ?
N11 C12 1.348(5) . ?
C12 C13 1.392(5) . ?
C12 C25 1.467(5) . ?
C13 C14 1.377(6) . ?
C14 C15 1.387(7) . ?
C15 C16 1.369(7) . ?
N21 C25 1.339(5) . ?
N21 N22 1.341(4) . ?
N22 C23 1.359(5) . ?
N22 C31 1.462(5) . ?
C23 C24 1.353(6) . ?
C24 C25 1.408(5) . ?
C31 C32 1.493(6) . ?
C32 C37 1.392(6) . ?
C32 C33 1.397(5) . ?
C33 C34 1.393(5) . ?
C34 C35 1.381(6) . ?
C34 C38 1.520(5) . ?
C35 C36 1.387(6) . ?
C36 C37 1.387(6) . ?
C38 N42 1.455(5) . ?
N41 C45 1.332(5) . ?
N41 N42 1.352(4) . ?
N41 Ag1 2.228(3) 2_645 ?
N42 C43 1.357(5) . ?
C43 C44 1.358(5) . ?
C44 C45 1.410(5) . ?
C45 C52 1.476(5) . ?
N51 C56 1.340(5) . ?
N51 C52 1.346(5) . ?
N51 Ag1 2.425(4) 2_645 ?
C52 C53 1.379(6) . ?
C53 C54 1.381(6) . ?
C54 C55 1.369(7) . ?
C55 C56 1.364(7) . ?
B1 F1 1.356(6) . ?
B1 F4 1.361(5) . ?
B1 F3 1.363(5) . ?
B1 F2 1.379(5) . ?
C1 C2 1.463(11) . ?
C2 O4 1.341(11) . ?
C2 C3 1.512(11) . ?
O4 C6 1.445(13) . ?
C5 C6 1.416(12) . ?
C6 C7 1.450(12) . ?
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
N41 Ag1 N11 C16 -46.8(5) 2_655 . . . ?
N21 Ag1 N11 C16 175.2(4) . . . . ?
N51 Ag1 N11 C16 69.7(4) 2_655 . . . ?
N41 Ag1 N11 C12 143.0(3) 2_655 . . . ?
N21 Ag1 N11 C12 5.0(3) . . . . ?
N51 Ag1 N11 C12 -100.5(3) 2_655 . . . ?
C16 N11 C12 C13 -2.0(6) . . . . ?
Ag1 N11 C12 C13 168.7(3) . . . . ?
C16 N11 C12 C25 178.4(4) . . . . ?
Ag1 N11 C12 C25 -10.8(4) . . . . ?
N11 C12 C13 C14 1.6(6) . . . . ?
C25 C12 C13 C14 -178.9(4) . . . . ?
C12 C13 C14 C15 -0.5(7) . . . . ?
C13 C14 C15 C16 -0.2(8) . . . . ?
C12 N11 C16 C15 1.3(7) . . . . ?
Ag1 N11 C16 C15 -168.7(4) . . . . ?
C14 C15 C16 N11 -0.2(8) . . . . ?
N41 Ag1 N21 C25 -157.0(2) 2_655 . . . ?
N11 Ag1 N21 C25 1.7(2) . . . . ?
N51 Ag1 N21 C25 120.9(2) 2_655 . . . ?
N41 Ag1 N21 N22 6.8(4) 2_655 . . . ?
N11 Ag1 N21 N22 165.5(4) . . . . ?
N51 Ag1 N21 N22 -75.3(4) 2_655 . . . ?
C25 N21 N22 C23 -0.1(4) . . . . ?
Ag1 N21 N22 C23 -164.5(3) . . . . ?
C25 N21 N22 C31 -175.9(3) . . . . ?
Ag1 N21 N22 C31 19.7(6) . . . . ?
N21 N22 C23 C24 -0.3(5) . . . . ?
C31 N22 C23 C24 175.2(4) . . . . ?
N22 C23 C24 C25 0.5(5) . . . . ?
N22 N21 C25 C24 0.4(4) . . . . ?
Ag1 N21 C25 C24 170.1(2) . . . . ?
N22 N21 C25 C12 -177.5(3) . . . . ?
Ag1 N21 C25 C12 -7.9(4) . . . . ?
C23 C24 C25 N21 -0.6(5) . . . . ?
C23 C24 C25 C12 177.1(4) . . . . ?
N11 C12 C25 N21 13.0(5) . . . . ?
C13 C12 C25 N21 -166.6(4) . . . . ?
N11 C12 C25 C24 -164.5(4) . . . . ?
C13 C12 C25 C24 15.9(6) . . . . ?
N21 N22 C31 C32 86.7(4) . . . . ?
C23 N22 C31 C32 -88.3(5) . . . . ?
N22 C31 C32 C37 -89.5(5) . . . . ?
N22 C31 C32 C33 90.1(5) . . . . ?
C37 C32 C33 C34 1.5(5) . . . . ?
C31 C32 C33 C34 -178.1(3) . . . . ?
C32 C33 C34 C35 -0.7(5) . . . . ?
C32 C33 C34 C38 178.1(3) . . . . ?
C33 C34 C35 C36 -0.4(6) . . . . ?
C38 C34 C35 C36 -179.2(4) . . . . ?
C34 C35 C36 C37 0.6(7) . . . . ?
C35 C36 C37 C32 0.2(7) . . . . ?
C33 C32 C37 C36 -1.2(6) . . . . ?
C31 C32 C37 C36 178.3(4) . . . . ?
C35 C34 C38 N42 -66.3(5) . . . . ?
C33 C34 C38 N42 114.8(4) . . . . ?
C45 N41 N42 C43 -1.0(4) . . . . ?
Ag1 N41 N42 C43 -170.5(3) 2_645 . . . ?
C45 N41 N42 C38 -172.3(3) . . . . ?
Ag1 N41 N42 C38 18.2(5) 2_645 . . . ?
C34 C38 N42 N41 -53.8(5) . . . . ?
C34 C38 N42 C43 136.6(4) . . . . ?
N41 N42 C43 C44 0.6(4) . . . . ?
C38 N42 C43 C44 171.0(4) . . . . ?
N42 C43 C44 C45 0.1(4) . . . . ?
N42 N41 C45 C44 1.1(4) . . . . ?
Ag1 N41 C45 C44 172.6(2) 2_645 . . . ?
N42 N41 C45 C52 -178.8(3) . . . . ?
Ag1 N41 C45 C52 -7.3(4) 2_645 . . . ?
C43 C44 C45 N41 -0.7(4) . . . . ?
C43 C44 C45 C52 179.1(4) . . . . ?
C56 N51 C52 C53 1.0(6) . . . . ?
Ag1 N51 C52 C53 -170.3(3) 2_645 . . . ?
C56 N51 C52 C45 179.4(4) . . . . ?
Ag1 N51 C52 C45 8.1(4) 2_645 . . . ?
N41 C45 C52 N51 -1.2(5) . . . . ?
C44 C45 C52 N51 179.0(4) . . . . ?
N41 C45 C52 C53 177.2(4) . . . . ?
C44 C45 C52 C53 -2.6(6) . . . . ?
N51 C52 C53 C54 -1.2(6) . . . . ?
C45 C52 C53 C54 -179.4(4) . . . . ?
C52 C53 C54 C55 0.7(7) . . . . ?
C53 C54 C55 C56 0.0(8) . . . . ?
C52 N51 C56 C55 -0.3(7) . . . . ?
Ag1 N51 C56 C55 169.5(4) 2_645 . . . ?
C54 C55 C56 N51 -0.2(8) . . . . ?
C1 C2 O4 C6 52(2) . . . . ?
C3 C2 O4 C6 -165.3(11) . . . . ?
C2 O4 C6 C5 96.0(14) . . . . ?
C2 O4 C6 C7 -143.9(13) . . . . ?
