#------------------------------------------------------------------------------
#$Date: 2016-03-26 17:22:32 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180390 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/59/7205979.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_7205979
loop_
_publ_author_name
'Liu, Qing-Xiang'
'Yu, Jie'
'Zhao, Xiao-Jun'
'Liu, Shu-Weng'
'Yang, Xiao-Qiong'
'Li, Kang-Ying'
'Wang, Xiu-Guang'
_publ_section_title
;
 Mercury(ii), copper(ii) and silver(i) complexes with ether or diether
 functionalized bis-NHC ligands: synthesis and structural studies
;
_journal_issue                   12
_journal_name_full               CrystEngComm
_journal_page_first              4086
_journal_paper_doi               10.1039/c1ce05134b
_journal_volume                  13
_journal_year                    2011
_chemical_formula_sum            'C27 H36 Ag F6 N4 O2 P'
_chemical_formula_weight         701.44
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                108.903(3)
_cell_angle_beta                 94.498(3)
_cell_angle_gamma                102.542(2)
_cell_formula_units_Z            2
_cell_length_a                   8.0951(12)
_cell_length_b                   12.3444(18)
_cell_length_c                   15.870(2)
_cell_measurement_reflns_used    2088
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      22.64
_cell_measurement_theta_min      2.61
_cell_volume                     1445.4(4)
_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      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'CCD area detector'
_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  0.0272
_diffrn_reflns_av_sigmaI/netI    0.0647
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            7347
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.37
_exptl_absorpt_coefficient_mu    0.824
_exptl_absorpt_correction_T_max  0.862
_exptl_absorpt_correction_T_min  0.821
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.612
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             716
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.725
_refine_diff_density_min         -0.607
_refine_diff_density_rms         0.103
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.045
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     372
_refine_ls_number_reflns         5085
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.066
_refine_ls_R_factor_all          0.0983
_refine_ls_R_factor_gt           0.0560
_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)+(0.0899P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1384
_refine_ls_wR_factor_ref         0.1667
_reflns_number_gt                3184
_reflns_number_total             5118
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1ce05134b.txt
_cod_data_source_block           080118b
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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 1555 2011-01-17 13:19:09Z saulius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7205979
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 1.03281(7) 0.49977(4) 0.24424(3) 0.0536(2) Uani 1 1 d . . .
P1 P 0.4770(3) 1.00120(16) 0.25554(14) 0.0588(5) Uani 1 1 d . . .
F1 F 0.4172(8) 1.0509(4) 0.3491(4) 0.121(2) Uani 1 1 d . . .
F2 F 0.4378(11) 1.1081(5) 0.2331(4) 0.155(3) Uani 1 1 d . . .
F3 F 0.5330(12) 0.9521(5) 0.1647(5) 0.179(4) Uani 1 1 d . . .
F4 F 0.5037(12) 0.8927(6) 0.2781(5) 0.173(3) Uani 1 1 d . . .
F5 F 0.2954(8) 0.9237(6) 0.2148(5) 0.155(3) Uani 1 1 d . . .
F6 F 0.6531(8) 1.0829(7) 0.2969(6) 0.195(4) Uani 1 1 d . . .
N1 N 0.7981(6) 0.3952(4) 0.0577(3) 0.0447(12) Uani 1 1 d . . .
N2 N 0.8865(6) 0.5862(4) 0.1003(3) 0.0408(12) Uani 1 1 d . . .
N3 N 1.2864(6) 0.5977(4) 0.4227(3) 0.0396(11) Uani 1 1 d . . .
N4 N 1.1199(6) 0.4301(4) 0.4103(3) 0.0437(12) Uani 1 1 d . . .
C1 C 0.6233(12) 0.2290(7) 0.0881(7) 0.097(3) Uani 1 1 d . . .
H1A H 0.6231 0.2801 0.1483 0.145 Uiso 1 1 calc R . .
H1B H 0.6197 0.1507 0.0879 0.145 Uiso 1 1 calc R . .
H1C H 0.5248 0.2263 0.0489 0.145 Uiso 1 1 calc R . .
C2 C 0.7794(10) 0.2745(6) 0.0563(5) 0.0621(19) Uani 1 1 d . . .
H2A H 0.8781 0.2724 0.0940 0.075 Uiso 1 1 calc R . .
H2B H 0.7779 0.2230 -0.0048 0.075 Uiso 1 1 calc R . .
C3 C 0.7268(7) 0.4266(5) -0.0104(4) 0.0407(14) Uani 1 1 d . . .
C4 C 0.6209(8) 0.3583(6) -0.0931(4) 0.0511(16) Uani 1 1 d . . .
H4 H 0.5831 0.2762 -0.1113 0.061 Uiso 1 1 calc R . .
C5 C 0.5761(9) 0.4196(7) -0.1458(4) 0.0568(18) Uani 1 1 d . . .
H5 H 0.5057 0.3778 -0.2012 0.068 Uiso 1 1 calc R . .
C6 C 0.6321(9) 0.5408(7) -0.1191(4) 0.0600(19) Uani 1 1 d . . .
H6 H 0.5974 0.5780 -0.1572 0.072 Uiso 1 1 calc R . .
C7 C 0.7376(9) 0.6099(6) -0.0381(4) 0.0525(16) Uani 1 1 d . . .
H7 H 0.7761 0.6918 -0.0209 0.063 Uiso 1 1 calc R . .
C8 C 0.7822(7) 0.5479(5) 0.0159(4) 0.0405(14) Uani 1 1 d . . .
C9 C 0.8947(8) 0.4935(6) 0.1247(4) 0.0462(15) Uani 1 1 d . . .
C10 C 0.9756(8) 0.7095(5) 0.1511(4) 0.0518(16) Uani 1 1 d . . .
H10A H 1.0191 0.7469 0.1093 0.062 Uiso 1 1 calc R . .
H10B H 1.0733 0.7117 0.1917 0.062 Uiso 1 1 calc R . .
C11 C 0.8661(9) 0.7795(5) 0.2049(4) 0.0539(17) Uani 1 1 d . . .
H11A H 0.9268 0.8628 0.2281 0.065 Uiso 1 1 calc R . .
H11B H 0.7617 0.7704 0.1659 0.065 Uiso 1 1 calc R . .
O1 O 0.8235(6) 0.7423(4) 0.2777(3) 0.0586(12) Uani 1 1 d . . .
C12 C 0.8718(8) 0.8357(6) 0.3643(4) 0.0548(17) Uani 1 1 d . . .
H12A H 0.8125 0.8094 0.4078 0.066 Uiso 1 1 calc R . .
H12B H 0.8349 0.9038 0.3604 0.066 Uiso 1 1 calc R . .
C13 C 1.0591(9) 0.8722(6) 0.3973(5) 0.0576(18) Uani 1 1 d . . .
H13A H 1.1190 0.9037 0.3563 0.069 Uiso 1 1 calc R . .
H13B H 1.0839 0.9343 0.4562 0.069 Uiso 1 1 calc R . .
O2 O 1.1173(6) 0.7749(4) 0.4033(3) 0.0668(14) Uani 1 1 d . . .
C14 C 1.2936(8) 0.8057(6) 0.4432(5) 0.0556(17) Uani 1 1 d . . .
H14A H 1.3031 0.8260 0.5081 0.067 Uiso 1 1 calc R . .
H14B H 1.3570 0.8738 0.4310 0.067 Uiso 1 1 calc R . .
C15 C 1.3654(8) 0.7025(6) 0.4040(4) 0.0525(17) Uani 1 1 d . . .
H15A H 1.3528 0.6829 0.3391 0.063 Uiso 1 1 calc R . .
H15B H 1.4871 0.7254 0.4272 0.063 Uiso 1 1 calc R . .
C16 C 1.3275(7) 0.5795(5) 0.5035(4) 0.0395(14) Uani 1 1 d . . .
C17 C 1.4452(8) 0.6475(6) 0.5810(4) 0.0457(15) Uani 1 1 d . . .
H17 H 1.5183 0.7195 0.5861 0.055 Uiso 1 1 calc R . .
C18 C 1.4483(9) 0.6033(6) 0.6493(4) 0.0525(17) Uani 1 1 d . . .
H18 H 1.5273 0.6457 0.7018 0.063 Uiso 1 1 calc R . .
C19 C 1.3378(9) 0.4974(7) 0.6431(5) 0.0577(18) Uani 1 1 d . . .
H19 H 1.3431 0.4713 0.6918 0.069 Uiso 1 1 calc R . .
C20 C 1.2188(8) 0.4289(6) 0.5657(5) 0.0520(17) Uani 1 1 d . . .
H20 H 1.1435 0.3580 0.5613 0.062 Uiso 1 1 calc R . .
C21 C 1.2195(7) 0.4730(5) 0.4956(4) 0.0406(14) Uani 1 1 d . . .
C22 C 1.1614(7) 0.5061(5) 0.3665(4) 0.0432(15) Uani 1 1 d . . .
C23 C 0.9889(8) 0.3165(5) 0.3734(5) 0.0566(18) Uani 1 1 d . . .
H23A H 0.9076 0.3193 0.3264 0.068 Uiso 1 1 calc R . .
H23B H 0.9269 0.3042 0.4208 0.068 Uiso 1 1 calc R . .
C24 C 1.0659(11) 0.2143(7) 0.3350(7) 0.119(4) Uani 1 1 d . . .
H24A H 1.1190 0.2227 0.2847 0.179 Uiso 1 1 calc R . .
H24B H 0.9775 0.1415 0.3153 0.179 Uiso 1 1 calc R . .
H24C H 1.1504 0.2134 0.3806 0.179 Uiso 1 1 calc R . .
C25 C 0.0067(15) -0.0098(8) 0.9108(6) 0.116(4) Uani 1 1 d D . .
H25A H 0.0976 -0.0497 0.8984 0.139 Uiso 1 1 calc R . .
H25B H -0.0342 0.0029 0.8565 0.139 Uiso 1 1 calc R . .
C26 C 0.0727(9) 0.1038(5) 0.9841(5) 0.0571(18) Uani 1 1 d D . .
H26A H 0.1657 0.1530 0.9675 0.068 Uiso 1 1 calc R . .
H26B H -0.0173 0.1447 0.9956 0.068 Uiso 1 1 calc R . .
C27 C 0.1335(13) 0.0832(8) 1.0638(7) 0.117(4) Uani 1 1 d D . .
H27A H 0.1788 0.1583 1.1129 0.141 Uiso 1 1 calc R . .
H27B H 0.2251 0.0438 1.0524 0.141 Uiso 1 1 calc R . .
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'
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'
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'
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
C9 Ag1 C22 177.5(2) . . ?
F6 P1 F3 92.1(5) . . ?
F6 P1 F5 177.3(4) . . ?
F3 P1 F5 89.3(5) . . ?
F6 P1 F4 98.0(6) . . ?
F3 P1 F4 89.8(4) . . ?
F5 P1 F4 84.4(5) . . ?
F6 P1 F2 85.2(5) . . ?
F3 P1 F2 91.9(4) . . ?
F5 P1 F2 92.4(4) . . ?
F4 P1 F2 176.4(4) . . ?
F6 P1 F1 88.5(4) . . ?
F3 P1 F1 179.4(4) . . ?
F5 P1 F1 90.1(4) . . ?
F4 P1 F1 90.1(4) . . ?
F2 P1 F1 88.2(4) . . ?
C9 N1 C3 109.8(5) . . ?
C9 N1 C2 124.6(5) . . ?
C3 N1 C2 125.5(5) . . ?
C9 N2 C8 110.0(5) . . ?
C9 N2 C10 126.0(5) . . ?
C8 N2 C10 124.0(5) . . ?
C22 N3 C16 110.7(5) . . ?
C22 N3 C15 125.1(5) . . ?
C16 N3 C15 124.2(5) . . ?
C22 N4 C21 110.7(5) . . ?
C22 N4 C23 124.9(5) . . ?
C21 N4 C23 124.4(5) . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
H1A C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
N1 C2 C1 113.0(6) . . ?
N1 C2 H2A 109.0 . . ?
C1 C2 H2A 109.0 . . ?
N1 C2 H2B 109.0 . . ?
C1 C2 H2B 109.0 . . ?
H2A C2 H2B 107.8 . . ?
C8 C3 N1 106.8(5) . . ?
C8 C3 C4 121.6(6) . . ?
N1 C3 C4 131.6(6) . . ?
C5 C4 C3 116.0(6) . . ?
C5 C4 H4 122.0 . . ?
C3 C4 H4 122.0 . . ?
C4 C5 C6 122.1(6) . . ?
C4 C5 H5 119.0 . . ?
C6 C5 H5 119.0 . . ?
C5 C6 C7 122.9(6) . . ?
C5 C6 H6 118.6 . . ?
C7 C6 H6 118.6 . . ?
C6 C7 C8 115.2(6) . . ?
C6 C7 H7 122.4 . . ?
C8 C7 H7 122.4 . . ?
C3 C8 C7 122.2(6) . . ?
C3 C8 N2 106.2(5) . . ?
C7 C8 N2 131.6(6) . . ?
N2 C9 N1 107.2(5) . . ?
N2 C9 Ag1 126.1(4) . . ?
N1 C9 Ag1 126.7(4) . . ?
N2 C10 C11 113.9(5) . . ?
N2 C10 H10A 108.8 . . ?
C11 C10 H10A 108.8 . . ?
N2 C10 H10B 108.8 . . ?
C11 C10 H10B 108.8 . . ?
H10A C10 H10B 107.7 . . ?
O1 C11 C10 111.6(5) . . ?
O1 C11 H11A 109.3 . . ?
C10 C11 H11A 109.3 . . ?
O1 C11 H11B 109.3 . . ?
C10 C11 H11B 109.3 . . ?
H11A C11 H11B 108.0 . . ?
C11 O1 C12 113.9(5) . . ?
O1 C12 C13 113.2(5) . . ?
O1 C12 H12A 108.9 . . ?
C13 C12 H12A 108.9 . . ?
O1 C12 H12B 108.9 . . ?
C13 C12 H12B 108.9 . . ?
H12A C12 H12B 107.8 . . ?
O2 C13 C12 110.4(5) . . ?
O2 C13 H13A 109.6 . . ?
C12 C13 H13A 109.6 . . ?
O2 C13 H13B 109.6 . . ?
C12 C13 H13B 109.6 . . ?
H13A C13 H13B 108.1 . . ?
C13 O2 C14 113.7(5) . . ?
O2 C14 C15 108.5(5) . . ?
O2 C14 H14A 110.0 . . ?
C15 C14 H14A 110.0 . . ?
O2 C14 H14B 110.0 . . ?
C15 C14 H14B 110.0 . . ?
H14A C14 H14B 108.4 . . ?
N3 C15 C14 114.6(5) . . ?
N3 C15 H15A 108.6 . . ?
C14 C15 H15A 108.6 . . ?
N3 C15 H15B 108.6 . . ?
C14 C15 H15B 108.6 . . ?
H15A C15 H15B 107.6 . . ?
C21 C16 C17 122.0(6) . . ?
C21 C16 N3 105.8(5) . . ?
C17 C16 N3 132.2(6) . . ?
C18 C17 C16 116.6(6) . . ?
C18 C17 H17 121.7 . . ?
C16 C17 H17 121.7 . . ?
C17 C18 C19 122.1(6) . . ?
C17 C18 H18 118.9 . . ?
C19 C18 H18 118.9 . . ?
C18 C19 C20 121.6(6) . . ?
C18 C19 H19 119.2 . . ?
C20 C19 H19 119.2 . . ?
C21 C20 C19 115.9(6) . . ?
C21 C20 H20 122.0 . . ?
C19 C20 H20 122.0 . . ?
C16 C21 C20 121.7(6) . . ?
C16 C21 N4 106.5(5) . . ?
C20 C21 N4 131.7(6) . . ?
N4 C22 N3 106.3(5) . . ?
N4 C22 Ag1 127.4(4) . . ?
N3 C22 Ag1 125.6(4) . . ?
N4 C23 C24 112.0(6) . . ?
N4 C23 H23A 109.2 . . ?
C24 C23 H23A 109.2 . . ?
N4 C23 H23B 109.2 . . ?
C24 C23 H23B 109.2 . . ?
H23A C23 H23B 107.9 . . ?
C23 C24 H24A 109.5 . . ?
C23 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C23 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C26 C25 C27 109.6(8) . 2_557 ?
C26 C25 H25A 109.8 . . ?
C27 C25 H25A 109.8 2_557 . ?
C26 C25 H25B 109.8 . . ?
C27 C25 H25B 109.8 2_557 . ?
H25A C25 H25B 108.2 . . ?
C27 C26 C25 108.9(7) . . ?
C27 C26 H26A 109.9 . . ?
C25 C26 H26A 109.9 . . ?
C27 C26 H26B 109.9 . . ?
C25 C26 H26B 109.9 . . ?
H26A C26 H26B 108.3 . . ?
C26 C27 C25 110.0(7) . 2_557 ?
C26 C27 H27A 109.7 . . ?
C25 C27 H27A 109.7 2_557 . ?
C26 C27 H27B 109.7 . . ?
C25 C27 H27B 109.7 2_557 . ?
H27A C27 H27B 108.2 . . ?
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 C9 2.095(6) . ?
Ag1 C22 2.099(6) . ?
P1 F6 1.510(6) . ?
P1 F3 1.518(6) . ?
P1 F5 1.528(6) . ?
P1 F4 1.548(6) . ?
P1 F2 1.561(6) . ?
P1 F1 1.571(5) . ?
N1 C9 1.356(7) . ?
N1 C3 1.387(7) . ?
N1 C2 1.457(7) . ?
N2 C9 1.335(7) . ?
N2 C8 1.403(7) . ?
N2 C10 1.457(7) . ?
N3 C22 1.344(7) . ?
N3 C16 1.399(7) . ?
N3 C15 1.447(7) . ?
N4 C22 1.341(8) . ?
N4 C21 1.393(7) . ?
N4 C23 1.469(7) . ?
C1 C2 1.463(10) . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C2 H2A 0.9700 . ?
C2 H2B 0.9700 . ?
C3 C8 1.375(8) . ?
C3 C4 1.401(8) . ?
C4 C5 1.373(9) . ?
C4 H4 0.9300 . ?
C5 C6 1.375(9) . ?
C5 H5 0.9300 . ?
C6 C7 1.381(9) . ?
C6 H6 0.9300 . ?
C7 C8 1.395(8) . ?
C7 H7 0.9300 . ?
C10 C11 1.495(9) . ?
C10 H10A 0.9700 . ?
C10 H10B 0.9700 . ?
C11 O1 1.416(7) . ?
C11 H11A 0.9700 . ?
C11 H11B 0.9700 . ?
O1 C12 1.436(7) . ?
C12 C13 1.484(9) . ?
C12 H12A 0.9700 . ?
C12 H12B 0.9700 . ?
C13 O2 1.410(7) . ?
C13 H13A 0.9700 . ?
C13 H13B 0.9700 . ?
O2 C14 1.431(7) . ?
C14 C15 1.487(9) . ?
C14 H14A 0.9700 . ?
C14 H14B 0.9700 . ?
C15 H15A 0.9700 . ?
C15 H15B 0.9700 . ?
C16 C21 1.373(8) . ?
C16 C17 1.387(8) . ?
C17 C18 1.363(9) . ?
C17 H17 0.9300 . ?
C18 C19 1.383(10) . ?
C18 H18 0.9300 . ?
C19 C20 1.393(9) . ?
C19 H19 0.9300 . ?
C20 C21 1.388(8) . ?
C20 H20 0.9300 . ?
C23 C24 1.501(10) . ?
C23 H23A 0.9700 . ?
C23 H23B 0.9700 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C25 C26 1.457(8) . ?
C25 C27 1.460(13) 2_557 ?
C25 H25A 0.9700 . ?
C25 H25B 0.9700 . ?
C26 C27 1.440(8) . ?
C26 H26A 0.9700 . ?
C26 H26B 0.9700 . ?
C27 C25 1.460(13) 2_557 ?
C27 H27A 0.9700 . ?
C27 H27B 0.9700 . ?
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
C9 N1 C2 C1 97.5(8) . . . . ?
C3 N1 C2 C1 -85.5(8) . . . . ?
C9 N1 C3 C8 0.2(7) . . . . ?
C2 N1 C3 C8 -177.2(6) . . . . ?
C9 N1 C3 C4 179.1(6) . . . . ?
C2 N1 C3 C4 1.7(10) . . . . ?
C8 C3 C4 C5 0.0(9) . . . . ?
N1 C3 C4 C5 -178.8(6) . . . . ?
C3 C4 C5 C6 0.1(10) . . . . ?
C4 C5 C6 C7 0.3(11) . . . . ?
C5 C6 C7 C8 -0.8(10) . . . . ?
N1 C3 C8 C7 178.5(5) . . . . ?
C4 C3 C8 C7 -0.5(9) . . . . ?
N1 C3 C8 N2 0.0(6) . . . . ?
C4 C3 C8 N2 -179.1(5) . . . . ?
C6 C7 C8 C3 0.9(9) . . . . ?
C6 C7 C8 N2 179.1(6) . . . . ?
C9 N2 C8 C3 -0.1(6) . . . . ?
C10 N2 C8 C3 178.1(5) . . . . ?
C9 N2 C8 C7 -178.5(6) . . . . ?
C10 N2 C8 C7 -0.2(10) . . . . ?
C8 N2 C9 N1 0.2(7) . . . . ?
C10 N2 C9 N1 -178.0(5) . . . . ?
C8 N2 C9 Ag1 179.8(4) . . . . ?
C10 N2 C9 Ag1 1.7(9) . . . . ?
C3 N1 C9 N2 -0.2(7) . . . . ?
C2 N1 C9 N2 177.2(6) . . . . ?
C3 N1 C9 Ag1 -179.9(4) . . . . ?
C2 N1 C9 Ag1 -2.5(9) . . . . ?
C22 Ag1 C9 N2 95(5) . . . . ?
C22 Ag1 C9 N1 -85(5) . . . . ?
C9 N2 C10 C11 -99.6(7) . . . . ?
C8 N2 C10 C11 82.5(7) . . . . ?
N2 C10 C11 O1 68.9(7) . . . . ?
C10 C11 O1 C12 123.8(6) . . . . ?
C11 O1 C12 C13 -73.9(7) . . . . ?
O1 C12 C13 O2 -58.3(8) . . . . ?
C12 C13 O2 C14 -174.1(6) . . . . ?
C13 O2 C14 C15 -149.9(6) . . . . ?
C22 N3 C15 C14 97.2(7) . . . . ?
C16 N3 C15 C14 -81.1(7) . . . . ?
O2 C14 C15 N3 -63.0(7) . . . . ?
C22 N3 C16 C21 -1.2(6) . . . . ?
C15 N3 C16 C21 177.4(5) . . . . ?
C22 N3 C16 C17 -179.7(6) . . . . ?
C15 N3 C16 C17 -1.2(9) . . . . ?
C21 C16 C17 C18 -0.1(8) . . . . ?
N3 C16 C17 C18 178.3(6) . . . . ?
C16 C17 C18 C19 -1.3(9) . . . . ?
C17 C18 C19 C20 1.1(10) . . . . ?
C18 C19 C20 C21 0.5(9) . . . . ?
C17 C16 C21 C20 1.8(9) . . . . ?
N3 C16 C21 C20 -177.0(5) . . . . ?
C17 C16 C21 N4 179.7(5) . . . . ?
N3 C16 C21 N4 1.0(6) . . . . ?
C19 C20 C21 C16 -1.9(8) . . . . ?
C19 C20 C21 N4 -179.3(6) . . . . ?
C22 N4 C21 C16 -0.5(6) . . . . ?
C23 N4 C21 C16 178.8(5) . . . . ?
C22 N4 C21 C20 177.1(6) . . . . ?
C23 N4 C21 C20 -3.6(9) . . . . ?
C21 N4 C22 N3 -0.2(6) . . . . ?
C23 N4 C22 N3 -179.5(5) . . . . ?
C21 N4 C22 Ag1 -171.0(4) . . . . ?
C23 N4 C22 Ag1 9.7(8) . . . . ?
C16 N3 C22 N4 0.8(6) . . . . ?
C15 N3 C22 N4 -177.7(5) . . . . ?
C16 N3 C22 Ag1 171.8(4) . . . . ?
C15 N3 C22 Ag1 -6.7(8) . . . . ?
C9 Ag1 C22 N4 57(6) . . . . ?
C9 Ag1 C22 N3 -113(5) . . . . ?
C22 N4 C23 C24 97.6(8) . . . . ?
C21 N4 C23 C24 -81.6(9) . . . . ?
C27 C25 C26 C27 59.7(12) 2_557 . . . ?
C25 C26 C27 C25 -59.9(13) . . . 2_557 ?
