#------------------------------------------------------------------------------
#$Date: 2017-03-05 07:18:46 +0200 (Sun, 05 Mar 2017) $
#$Revision: 193839 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/20/7042017.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_7042017
loop_
_publ_author_name
'Gardiner, Michael G.'
'McGuinness, David S.'
'Vanston, Catriona R.'
_publ_section_title
;
 Chelated bis(NHC) complexes of saturated (imidazolin-2-ylidene) NHC
 ligands: structural authentication and facile ligand fragmentation.
;
_journal_issue                   9
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3051
_journal_page_last               3058
_journal_paper_doi               10.1039/c7dt00327g
_journal_volume                  46
_journal_year                    2017
_chemical_formula_moiety         '2(C27 H36 Ag N4), 2(F6 P), 2(C2 H3 N)'
_chemical_formula_sum            'C58 H78 Ag2 F12 N10 P2'
_chemical_formula_weight         1420.98
_chemical_name_systematic
;
 ? 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_date             2016-07-15
_audit_creation_method
;
Olex2 1.2
(compiled 2016.02.19 svn.r3266 for OlexSys, GUI svn.r5155)
;
_audit_update_record
;
2016-07-15 deposited with the CCDC.
2017-02-10 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 100.79(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.142(4)
_cell_length_b                   26.641(2)
_cell_length_c                   15.776(2)
_cell_measurement_reflns_used    69645
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.94
_cell_measurement_theta_min      1.52
_cell_volume                     6251.5(19)
_computing_cell_refinement       XDS
_computing_data_collection       BLU-ICE
_computing_data_reduction        XDS
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      173.15
_diffrn_detector_area_resol_mean 'ADSC Q210'
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  '3-BM1 Australian Synchrotron'
_diffrn_measurement_method       Rotation
_diffrn_radiation_monochromator  Si<111>
_diffrn_radiation_type           Synchrotron
_diffrn_radiation_wavelength     0.71080
_diffrn_reflns_av_R_equivalents  0.0505
_diffrn_reflns_av_unetI/netI     0.0256
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       35
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            103477
_diffrn_reflns_theta_full        27.94
_diffrn_reflns_theta_max         27.94
_diffrn_reflns_theta_min         1.52
_diffrn_source                   'Synchrotron BM'
_exptl_absorpt_coefficient_mu    0.759
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'light yellow'
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.510
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             2912
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.941
_refine_diff_density_min         -1.661
_refine_diff_density_rms         0.122
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.041
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     771
_refine_ls_number_reflns         14918
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.041
_refine_ls_R_factor_all          0.0560
_refine_ls_R_factor_gt           0.0460
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0688P)²+10.0380P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1123
_refine_ls_wR_factor_ref         0.1189
_reflns_number_gt                12688
_reflns_number_total             14918
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c7dt00327g1.cif
_cod_data_source_block           74cv79
_cod_depositor_comments
'Adding full bibliography for 7042016--7042022.cif.'
_cod_original_cell_volume        6252(2)
_cod_database_code               7042017
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B), C3(H3A,H3B), C13(H13A,H13B), C14(H14A,H14B), C15(H15A,H15B),
 C17(H17A,H17B), C18(H18A,H18B), C29(H29A,H29B), C30(H30A,H30B), C40(H40A,H40B),
  C41(H41A,H41B), C42(H42A,H42B), C44(H44A,H44B), C45(H45A,H45B)
2.b Aromatic/amide H refined with riding coordinates:
 C6(H6), C8(H8), C21(H21), C23(H23), C33(H33), C35(H35), C48(H48), C50(H50)
2.c Idealised Me refined as rotating group:
 C10(H10A,H10B,H10C), C11(H11A,H11B,H11C), C12(H12A,H12B,H12C), C25(H25A,H25B,
 H25C), C26(H26A,H26B,H26C), C27(H27A,H27B,H27C), C37(H37A,H37B,H37C), C38(H38A,
 H38B,H38C), C39(H39A,H39B,H39C), C52(H52A,H52B,H52C), C53(H53A,H53B,H53C),
 C54(H54A,H54B,H54C), C56(H56A,H56B,H56C), C58(H58A,H58B,H58C)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, y+1/2, -z+1/2'
3 '-x, -y, -z'
4 'x, -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_calc_flag
_atom_site_refinement_flags_posn
Ag1 Ag 0.407349(14) 0.561347(8) 0.356438(13) 0.01836(6) Uani 1 d .
N1 N 0.25343(17) 0.50221(9) 0.25101(16) 0.0221(5) Uani 1 d .
N2 N 0.30397(17) 0.46194(9) 0.36935(15) 0.0211(5) Uani 1 d .
N3 N 0.40951(16) 0.38399(9) 0.60871(15) 0.0198(5) Uani 1 d .
N4 N 0.52084(17) 0.33253(9) 0.60806(17) 0.0220(5) Uani 1 d .
C1 C 0.31387(19) 0.50270(10) 0.32429(18) 0.0189(5) Uani 1 d .
C2 C 0.2004(2) 0.45519(12) 0.2398(2) 0.0276(6) Uani 1 d .
H2A H 0.2162 0.4342 0.1930 0.033 Uiso 1 calc R
H2B H 0.1350 0.4622 0.2272 0.033 Uiso 1 calc R
C3 C 0.2284(2) 0.43014(13) 0.3273(2) 0.0327(7) Uani 1 d .
H3A H 0.1788 0.4303 0.3602 0.039 Uiso 1 calc R
H3B H 0.2481 0.3951 0.3212 0.039 Uiso 1 calc R
C4 C 0.2454(2) 0.53903(11) 0.18403(18) 0.0222(5) Uani 1 d .
C5 C 0.3074(2) 0.53846(12) 0.12783(19) 0.0239(6) Uani 1 d .
C6 C 0.2978(2) 0.57360(13) 0.0622(2) 0.0281(6) Uani 1 d .
H6 H 0.3397 0.5738 0.0243 0.034 Uiso 1 calc R
C7 C 0.2284(2) 0.60854(13) 0.0502(2) 0.0306(7) Uani 1 d .
C8 C 0.1665(2) 0.60720(12) 0.1045(2) 0.0297(7) Uani 1 d .
H8 H 0.1181 0.6304 0.0956 0.036 Uiso 1 calc R
C9 C 0.1732(2) 0.57252(12) 0.17209(19) 0.0252(6) Uani 1 d .
C10 C 0.3820(2) 0.50042(12) 0.1381(2) 0.0296(6) Uani 1 d .
H10A H 0.4235 0.5062 0.1928 0.044 Uiso 1 calc GR
H10B H 0.4145 0.5036 0.0902 0.044 Uiso 1 calc GR
H10C H 0.3567 0.4666 0.1381 0.044 Uiso 1 calc GR
C11 C 0.2204(3) 0.64676(16) -0.0219(3) 0.0470(10) Uani 1 d .
H11A H 0.2714 0.6699 -0.0102 0.071 Uiso 1 calc GR
H11B H 0.1642 0.6656 -0.0253 0.071 Uiso 1 calc GR
H11C H 0.2202 0.6295 -0.0767 0.071 Uiso 1 calc GR
C12 C 0.1027(2) 0.57150(15) 0.2279(2) 0.0342(7) Uani 1 d .
H12A H 0.1293 0.5588 0.2853 0.051 Uiso 1 calc GR
H12B H 0.0532 0.5495 0.2017 0.051 Uiso 1 calc GR
H12C H 0.0797 0.6055 0.2331 0.051 Uiso 1 calc GR
C13 C 0.3574(2) 0.44838(11) 0.45254(19) 0.0222(5) Uani 1 d .
H13A H 0.4042 0.4743 0.4700 0.027 Uiso 1 calc R
H13B H 0.3882 0.4161 0.4468 0.027 Uiso 1 calc R
C14 C 0.3013(2) 0.44334(11) 0.52285(19) 0.0224(6) Uani 1 d .
H14A H 0.2557 0.4167 0.5064 0.027 Uiso 1 calc R
H14B H 0.2692 0.4753 0.5277 0.027 Uiso 1 calc R
C15 C 0.35888(19) 0.43049(11) 0.61023(18) 0.0210(5) Uani 1 d .
H15A H 0.4015 0.4583 0.6285 0.025 Uiso 1 calc R
H15B H 0.3195 0.4274 0.6535 0.025 Uiso 1 calc R
C16 C 0.49783(19) 0.38022(10) 0.61711(18) 0.0197(5) Uani 1 d .
C17 C 0.3633(2) 0.33511(11) 0.5886(2) 0.0235(6) Uani 1 d .
H17A H 0.3272 0.3348 0.5294 0.028 Uiso 1 calc R
H17B H 0.3238 0.3272 0.6303 0.028 Uiso 1 calc R
C18 C 0.4422(2) 0.29837(11) 0.5973(2) 0.0231(6) Uani 1 d .
H18A H 0.4447 0.2763 0.6482 0.028 Uiso 1 calc R
H18B H 0.4383 0.2774 0.5449 0.028 Uiso 1 calc R
C19 C 0.6122(2) 0.31531(11) 0.6220(2) 0.0225(6) Uani 1 d .
C20 C 0.6627(2) 0.31470(11) 0.7059(2) 0.0249(6) Uani 1 d .
C21 C 0.7531(2) 0.30152(12) 0.7177(2) 0.0283(6) Uani 1 d .
H21 H 0.7884 0.3022 0.7742 0.034 Uiso 1 calc R
C22 C 0.7929(2) 0.28739(12) 0.6485(2) 0.0298(7) Uani 1 d .
C23 C 0.7398(2) 0.28595(12) 0.5667(2) 0.0294(7) Uani 1 d .
H23 H 0.7659 0.2752 0.5195 0.035 Uiso 1 calc R
C24 C 0.6493(2) 0.29976(11) 0.5516(2) 0.0244(6) Uani 1 d .
C25 C 0.6206(2) 0.32803(13) 0.7826(2) 0.0313(7) Uani 1 d .
H25A H 0.6597 0.3166 0.8357 0.047 Uiso 1 calc GR
H25B H 0.5618 0.3116 0.7769 0.047 Uiso 1 calc GR
H25C H 0.6129 0.3645 0.7849 0.047 Uiso 1 calc GR
C26 C 0.8915(2) 0.27438(15) 0.6619(3) 0.0405(8) Uani 1 d .
H26A H 0.9269 0.3018 0.6927 0.061 Uiso 1 calc GR
H26B H 0.9090 0.2694 0.6058 0.061 Uiso 1 calc GR
H26C H 0.9026 0.2435 0.6959 0.061 Uiso 1 calc GR
C27 C 0.5950(2) 0.29727(14) 0.4615(2) 0.0319(7) Uani 1 d .
H27A H 0.6352 0.2995 0.4197 0.048 Uiso 1 calc GR
H27B H 0.5522 0.3253 0.4525 0.048 Uiso 1 calc GR
H27C H 0.5620 0.2654 0.4536 0.048 Uiso 1 calc GR
Ag2 Ag 0.355000(14) -0.027920(8) 0.352988(13) 0.02015(6) Uani 1 d .
N5 N 0.19903(18) 0.04446(9) 0.32927(18) 0.0250(5) Uani 1 d .
N6 N 0.32284(17) 0.08730(9) 0.34295(16) 0.0229(5) Uani 1 d .
N7 N 0.52566(18) 0.12082(9) 0.58046(16) 0.0232(5) Uani 1 d .
N8 N 0.61148(18) 0.13222(9) 0.70567(16) 0.0224(5) Uani 1 d .
C28 C 0.2881(2) 0.04120(11) 0.34114(18) 0.0209(5) Uani 1 d .
C29 C 0.1659(2) 0.09696(11) 0.3238(2) 0.0281(6) Uani 1 d .
H29A H 0.1370 0.1055 0.3733 0.034 Uiso 1 calc R
H29B H 0.1228 0.1030 0.2694 0.034 Uiso 1 calc R
C30 C 0.2531(2) 0.12656(11) 0.3265(2) 0.0283(6) Uani 1 d .
H30A H 0.2534 0.1437 0.2710 0.034 Uiso 1 calc R
H30B H 0.2616 0.1518 0.3735 0.034 Uiso 1 calc R
C31 C 0.1393(2) 0.00199(11) 0.3229(2) 0.0254(6) Uani 1 d .
C32 C 0.1064(2) -0.01312(12) 0.3960(2) 0.0278(6) Uani 1 d .
C33 C 0.0519(2) -0.05557(13) 0.3885(2) 0.0329(7) Uani 1 d .
H33 H 0.0304 -0.0670 0.4379 0.039 Uiso 1 calc R
C34 C 0.0278(2) -0.08179(12) 0.3116(3) 0.0330(7) Uani 1 d .
C35 C 0.0585(2) -0.06413(12) 0.2393(3) 0.0338(7) Uani 1 d .
H35 H 0.0409 -0.0810 0.1858 0.041 Uiso 1 calc R
C36 C 0.1146(2) -0.02232(12) 0.2435(2) 0.0301(7) Uani 1 d .
C37 C 0.1284(3) 0.01575(14) 0.4794(2) 0.0368(8) Uani 1 d .
H37A H 0.0910 0.0460 0.4755 0.055 Uiso 1 calc GR
H37B H 0.1920 0.0254 0.4901 0.055 Uiso 1 calc GR
H37C H 0.1165 -0.0053 0.5269 0.055 Uiso 1 calc GR
C38 C -0.0279(3) -0.12901(14) 0.3074(3) 0.0456(10) Uani 1 d .
H38A H -0.0708 -0.1259 0.3465 0.068 Uiso 1 calc GR
H38B H 0.0116 -0.1578 0.3246 0.068 Uiso 1 calc GR
H38C H -0.0607 -0.1339 0.2482 0.068 Uiso 1 calc GR
C39 C 0.1477(3) -0.00447(15) 0.1643(2) 0.0420(9) Uani 1 d .
H39A H 0.1432 0.0322 0.1607 0.063 Uiso 1 calc GR
H39B H 0.1108 -0.0194 0.1128 0.063 Uiso 1 calc GR
H39C H 0.2105 -0.0146 0.1680 0.063 Uiso 1 calc GR
C40 C 0.4173(2) 0.09886(12) 0.34374(19) 0.0248(6) Uani 1 d .
H40A H 0.4213 0.1192 0.2921 0.030 Uiso 1 calc R
H40B H 0.4499 0.0670 0.3394 0.030 Uiso 1 calc R
C41 C 0.4641(2) 0.12711(11) 0.42349(19) 0.0242(6) Uani 1 d .
H41A H 0.5252 0.1368 0.4157 0.029 Uiso 1 calc R
H41B H 0.4303 0.1582 0.4298 0.029 Uiso 1 calc R
C42 C 0.4714(2) 0.09601(11) 0.50546(18) 0.0229(6) Uani 1 d .
H42A H 0.4104 0.0898 0.5171 0.027 Uiso 1 calc R
H42B H 0.4987 0.0631 0.4966 0.027 Uiso 1 calc R
C43 C 0.58551(19) 0.09934(10) 0.64141(18) 0.0194(5) Uani 1 d .
C44 C 0.5030(2) 0.17264(11) 0.6028(2) 0.0282(6) Uani 1 d .
H44A H 0.4386 0.1756 0.6064 0.034 Uiso 1 calc R
H44B H 0.5171 0.1971 0.5600 0.034 Uiso 1 calc R
C45 C 0.5633(3) 0.18056(12) 0.6912(2) 0.0314(7) Uani 1 d .
H45A H 0.6055 0.2088 0.6899 0.038 Uiso 1 calc R
H45B H 0.5272 0.1870 0.7363 0.038 Uiso 1 calc R
C46 C 0.6612(2) 0.11901(11) 0.78949(18) 0.0217(5) Uani 1 d .
C47 C 0.7483(2) 0.13715(11) 0.81661(19) 0.0246(6) Uani 1 d .
C48 C 0.7926(2) 0.12611(12) 0.9004(2) 0.0272(6) Uani 1 d .
H48 H 0.8518 0.1386 0.9196 0.033 Uiso 1 calc R
C49 C 0.7527(2) 0.09742(12) 0.9561(2) 0.0267(6) Uani 1 d .
C50 C 0.6652(2) 0.08001(11) 0.92702(19) 0.0242(6) Uani 1 d .
H50 H 0.6373 0.0603 0.9647 0.029 Uiso 1 calc R
C51 C 0.6179(2) 0.09061(11) 0.84468(19) 0.0232(6) Uani 1 d .
C52 C 0.7952(2) 0.16820(13) 0.7587(2) 0.0328(7) Uani 1 d .
H52A H 0.8481 0.1844 0.7933 0.049 Uiso 1 calc GR
H52B H 0.7540 0.1939 0.7299 0.049 Uiso 1 calc GR
H52C H 0.8142 0.1465 0.7153 0.049 Uiso 1 calc GR
C53 C 0.8018(2) 0.08570(14) 1.0459(2) 0.0339(7) Uani 1 d .
H53A H 0.8132 0.0495 1.0512 0.051 Uiso 1 calc GR
H53B H 0.7651 0.0961 1.0878 0.051 Uiso 1 calc GR
H53C H 0.8591 0.1038 1.0571 0.051 Uiso 1 calc GR
C54 C 0.5223(2) 0.07363(13) 0.8184(2) 0.0296(7) Uani 1 d .
H54A H 0.5065 0.0517 0.8632 0.044 Uiso 1 calc GR
H54B H 0.5155 0.0551 0.7639 0.044 Uiso 1 calc GR
H54C H 0.4825 0.1029 0.8108 0.044 Uiso 1 calc GR
P2 P 0.34277(6) 0.27745(3) 0.31639(6) 0.03024(18) Uani 1 d .
F7 F 0.43775(17) 0.24954(10) 0.32770(18) 0.0547(6) Uani 1 d .
F8 F 0.36531(18) 0.30589(10) 0.23379(16) 0.0531(6) Uani 1 d .
F9 F 0.38846(16) 0.32228(8) 0.37729(16) 0.0429(5) Uani 1 d .
F10 F 0.3220(2) 0.24901(10) 0.39906(15) 0.0528(6) Uani 1 d .
F11 F 0.29740(18) 0.23283(8) 0.25615(15) 0.0464(6) Uani 1 d .
F12 F 0.24874(15) 0.30563(9) 0.30267(17) 0.0480(6) Uani 1 d .
P1 P 0.08382(6) 0.14693(4) 0.05452(7) 0.0391(2) Uani 1 d .
F1 F 0.16813(15) 0.12118(9) 0.11453(15) 0.0421(5) Uani 1 d .
F2 F 0.0736(2) 0.09847(13) -0.0065(2) 0.0726(9) Uani 1 d .
F3 F 0.15076(16) 0.17101(12) -0.00238(18) 0.0589(7) Uani 1 d .
F4 F 0.09627(19) 0.19463(10) 0.1163(2) 0.0658(8) Uani 1 d .
F5 F 0.01909(17) 0.12265(11) 0.1120(2) 0.0610(7) Uani 1 d .
F6 F 0.00020(19) 0.17308(14) -0.0046(3) 0.0808(10) Uani 1 d .
N9 N 0.2603(3) 0.37782(14) 0.0575(3) 0.0510(9) Uani 1 d .
C55 C 0.2333(3) 0.33894(15) 0.0638(3) 0.0405(8) Uani 1 d .
C56 C 0.1987(4) 0.28827(17) 0.0721(3) 0.0612(14) Uani 1 d .
H56A H 0.1329 0.2888 0.0580 0.092 Uiso 1 calc GR
H56B H 0.2182 0.2764 0.1314 0.092 Uiso 1 calc GR
H56C H 0.2218 0.2657 0.0323 0.092 Uiso 1 calc GR
N10 N 0.0223(4) 0.1782(2) 0.4151(4) 0.0947(19) Uani 1 d .
C57 C 0.0457(4) 0.2119(2) 0.3792(4) 0.0663(14) Uani 1 d .
C58 C 0.0820(4) 0.2516(3) 0.3370(4) 0.0776(18) Uani 1 d .
H58A H 0.1394 0.2622 0.3719 0.116 Uiso 1 calc GR
H58B H 0.0400 0.2799 0.3292 0.116 Uiso 1 calc GR
H58C H 0.0918 0.2401 0.2804 0.116 Uiso 1 calc GR
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'
Ag Ag -0.8971 1.1015 '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'
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'
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_3
C1 Ag1 C16 177.39(11) 3_666
C1 N1 C2 112.4(2) .
C1 N1 C4 125.7(2) .
C4 N1 C2 121.5(2) .
C1 N2 C3 112.7(2) .
C1 N2 C13 126.2(2) .
C13 N2 C3 121.1(2) .
C15 N3 C17 121.4(2) .
C16 N3 C15 126.0(2) .
C16 N3 C17 112.4(2) .
C16 N4 C18 112.1(2) .
C16 N4 C19 123.5(2) .
C19 N4 C18 123.5(2) .
N1 C1 Ag1 122.5(2) .
N2 C1 Ag1 128.2(2) .
N2 C1 N1 109.2(2) .
N1 C2 H2A 111.4 .
N1 C2 H2B 111.4 .
N1 C2 C3 102.1(2) .
H2A C2 H2B 109.2 .
C3 C2 H2A 111.4 .
C3 C2 H2B 111.4 .
N2 C3 C2 102.5(2) .
N2 C3 H3A 111.3 .
N2 C3 H3B 111.3 .
C2 C3 H3A 111.3 .
C2 C3 H3B 111.3 .
H3A C3 H3B 109.2 .
C5 C4 N1 119.0(3) .
C9 C4 N1 119.6(3) .
C9 C4 C5 121.3(3) .
C4 C5 C10 121.0(3) .
C6 C5 C4 118.4(3) .
C6 C5 C10 120.5(3) .
C5 C6 H6 119.1 .
C5 C6 C7 121.7(3) .
C7 C6 H6 119.1 .
C6 C7 C11 120.4(3) .
C8 C7 C6 118.7(3) .
C8 C7 C11 120.9(3) .
C7 C8 H8 119.1 .
C7 C8 C9 121.8(3) .
C9 C8 H8 119.1 .
C4 C9 C8 117.9(3) .
C4 C9 C12 122.2(3) .
C8 C9 C12 119.9(3) .
C5 C10 H10A 109.5 .
C5 C10 H10B 109.5 .
C5 C10 H10C 109.5 .
H10A C10 H10B 109.5 .
H10A C10 H10C 109.5 .
H10B C10 H10C 109.5 .
C7 C11 H11A 109.5 .
C7 C11 H11B 109.5 .
C7 C11 H11C 109.5 .
H11A C11 H11B 109.5 .
H11A C11 H11C 109.5 .
H11B C11 H11C 109.5 .
C9 C12 H12A 109.5 .
C9 C12 H12B 109.5 .
C9 C12 H12C 109.5 .
H12A C12 H12B 109.5 .
H12A C12 H12C 109.5 .
H12B C12 H12C 109.5 .
N2 C13 H13A 109.0 .
N2 C13 H13B 109.0 .
N2 C13 C14 112.8(2) .
H13A C13 H13B 107.8 .
C14 C13 H13A 109.0 .
C14 C13 H13B 109.0 .
C13 C14 H14A 109.2 .
C13 C14 H14B 109.2 .
C13 C14 C15 112.0(2) .
H14A C14 H14B 107.9 .
C15 C14 H14A 109.2 .
C15 C14 H14B 109.2 .
N3 C15 C14 112.9(2) .
N3 C15 H15A 109.0 .
N3 C15 H15B 109.0 .
C14 C15 H15A 109.0 .
C14 C15 H15B 109.0 .
H15A C15 H15B 107.8 .
N3 C16 Ag1 127.1(2) 3_666
N3 C16 N4 110.0(2) .
N4 C16 Ag1 123.0(2) 3_666
N3 C17 H17A 111.3 .
N3 C17 H17B 111.3 .
N3 C17 C18 102.3(2) .
H17A C17 H17B 109.2 .
C18 C17 H17A 111.3 .
C18 C17 H17B 111.3 .
N4 C18 C17 102.4(2) .
N4 C18 H18A 111.3 .
N4 C18 H18B 111.3 .
C17 C18 H18A 111.3 .
C17 C18 H18B 111.3 .
H18A C18 H18B 109.2 .
C20 C19 N4 119.3(3) .
C24 C19 N4 119.5(3) .
C24 C19 C20 121.2(3) .
C19 C20 C25 121.0(3) .
C21 C20 C19 118.7(3) .
C21 C20 C25 120.3(3) .
C20 C21 H21 119.3 .
C20 C21 C22 121.5(3) .
C22 C21 H21 119.3 .
C21 C22 C26 121.0(3) .
C23 C22 C21 118.4(3) .
C23 C22 C26 120.6(3) .
C22 C23 H23 119.0 .
C22 C23 C24 122.0(3) .
C24 C23 H23 119.0 .
C19 C24 C27 122.2(3) .
C23 C24 C19 118.1(3) .
C23 C24 C27 119.7(3) .
C20 C25 H25A 109.5 .
C20 C25 H25B 109.5 .
C20 C25 H25C 109.5 .
H25A C25 H25B 109.5 .
H25A C25 H25C 109.5 .
H25B C25 H25C 109.5 .
C22 C26 H26A 109.5 .
C22 C26 H26B 109.5 .
C22 C26 H26C 109.5 .
H26A C26 H26B 109.5 .
H26A C26 H26C 109.5 .
H26B C26 H26C 109.5 .
C24 C27 H27A 109.5 .
C24 C27 H27B 109.5 .
C24 C27 H27C 109.5 .
H27A C27 H27B 109.5 .
H27A C27 H27C 109.5 .
H27B C27 H27C 109.5 .
C28 Ag2 C43 175.96(11) 3_656
C28 N5 C29 113.1(3) .
C28 N5 C31 124.4(3) .
C31 N5 C29 122.4(3) .
C28 N6 C30 112.5(3) .
C28 N6 C40 125.1(3) .
C40 N6 C30 121.3(3) .
C42 N7 C44 119.5(2) .
C43 N7 C42 126.6(2) .
C43 N7 C44 112.8(2) .
C43 N8 C45 112.7(2) .
C43 N8 C46 124.3(2) .
C46 N8 C45 120.9(2) .
N5 C28 Ag2 122.1(2) .
N5 C28 N6 109.2(3) .
N6 C28 Ag2 128.7(2) .
N5 C29 H29A 111.4 .
N5 C29 H29B 111.4 .
N5 C29 C30 101.8(2) .
H29A C29 H29B 109.3 .
C30 C29 H29A 111.4 .
C30 C29 H29B 111.4 .
N6 C30 C29 103.0(2) .
N6 C30 H30A 111.2 .
N6 C30 H30B 111.2 .
C29 C30 H30A 111.2 .
C29 C30 H30B 111.2 .
H30A C30 H30B 109.1 .
C32 C31 N5 119.0(3) .
C36 C31 N5 119.1(3) .
C36 C31 C32 121.9(3) .
C31 C32 C37 121.3(3) .
C33 C32 C31 117.5(3) .
C33 C32 C37 121.3(3) .
C32 C33 H33 118.7 .
C34 C33 C32 122.6(3) .
C34 C33 H33 118.7 .
C33 C34 C35 118.2(3) .
C33 C34 C38 120.8(4) .
C35 C34 C38 121.0(4) .
C34 C35 H35 119.2 .
C34 C35 C36 121.7(3) .
C36 C35 H35 119.2 .
C31 C36 C39 121.4(3) .
C35 C36 C31 118.1(3) .
C35 C36 C39 120.5(3) .
C32 C37 H37A 109.5 .
C32 C37 H37B 109.5 .
C32 C37 H37C 109.5 .
H37A C37 H37B 109.5 .
H37A C37 H37C 109.5 .
H37B C37 H37C 109.5 .
C34 C38 H38A 109.5 .
C34 C38 H38B 109.5 .
C34 C38 H38C 109.5 .
H38A C38 H38B 109.5 .
H38A C38 H38C 109.5 .
H38B C38 H38C 109.5 .
C36 C39 H39A 109.5 .
C36 C39 H39B 109.5 .
C36 C39 H39C 109.5 .
H39A C39 H39B 109.5 .
H39A C39 H39C 109.5 .
H39B C39 H39C 109.5 .
N6 C40 H40A 108.6 .
N6 C40 H40B 108.6 .
N6 C40 C41 114.5(2) .
H40A C40 H40B 107.6 .
C41 C40 H40A 108.6 .
C41 C40 H40B 108.6 .
C40 C41 H41A 109.1 .
C40 C41 H41B 109.1 .
H41A C41 H41B 107.8 .
C42 C41 C40 112.4(2) .
C42 C41 H41A 109.1 .
C42 C41 H41B 109.1 .
N7 C42 C41 112.4(2) .
N7 C42 H42A 109.1 .
N7 C42 H42B 109.1 .
C41 C42 H42A 109.1 .
C41 C42 H42B 109.1 .
H42A C42 H42B 107.9 .
N7 C43 Ag2 130.8(2) 3_656
N7 C43 N8 109.3(2) .
N8 C43 Ag2 119.8(2) 3_656
N7 C44 H44A 111.2 .
N7 C44 H44B 111.2 .
N7 C44 C45 102.7(2) .
H44A C44 H44B 109.1 .
C45 C44 H44A 111.2 .
C45 C44 H44B 111.2 .
N8 C45 C44 102.3(2) .
N8 C45 H45A 111.3 .
N8 C45 H45B 111.3 .
C44 C45 H45A 111.3 .
C44 C45 H45B 111.3 .
H45A C45 H45B 109.2 .
C47 C46 N8 120.0(3) .
C47 C46 C51 121.4(3) .
C51 C46 N8 118.5(3) .
C46 C47 C48 118.5(3) .
C46 C47 C52 122.1(3) .
C48 C47 C52 119.4(3) .
C47 C48 H48 119.1 .
C49 C48 C47 121.8(3) .
C49 C48 H48 119.1 .
C48 C49 C50 118.3(3) .
C48 C49 C53 120.9(3) .
C50 C49 C53 120.8(3) .
C49 C50 H50 119.0 .
C51 C50 C49 122.1(3) .
C51 C50 H50 119.0 .
C46 C51 C54 122.0(3) .
C50 C51 C46 118.0(3) .
C50 C51 C54 120.0(3) .
C47 C52 H52A 109.5 .
C47 C52 H52B 109.5 .
C47 C52 H52C 109.5 .
H52A C52 H52B 109.5 .
H52A C52 H52C 109.5 .
H52B C52 H52C 109.5 .
C49 C53 H53A 109.5 .
C49 C53 H53B 109.5 .
C49 C53 H53C 109.5 .
H53A C53 H53B 109.5 .
H53A C53 H53C 109.5 .
H53B C53 H53C 109.5 .
C51 C54 H54A 109.5 .
C51 C54 H54B 109.5 .
C51 C54 H54C 109.5 .
H54A C54 H54B 109.5 .
H54A C54 H54C 109.5 .
H54B C54 H54C 109.5 .
F7 P2 F9 90.08(14) .
F8 P2 F7 89.23(16) .
F8 P2 F9 90.08(14) .
F10 P2 F7 89.95(16) .
F10 P2 F8 179.12(17) .
F10 P2 F9 89.60(13) .
F10 P2 F11 90.24(13) .
F11 P2 F7 89.88(14) .
F11 P2 F8 90.09(14) .
F11 P2 F9 179.83(15) .
F12 P2 F7 178.48(16) .
F12 P2 F8 89.29(15) .
F12 P2 F9 90.28(13) .
F12 P2 F10 91.53(15) .
F12 P2 F11 89.77(14) .
F1 P1 F2 89.26(16) .
F1 P1 F3 89.13(13) .
F2 P1 F3 89.21(18) .
F4 P1 F1 89.42(16) .
F4 P1 F2 178.65(19) .
F4 P1 F3 90.50(17) .
F4 P1 F5 89.43(17) .
F5 P1 F1 89.81(14) .
F5 P1 F2 90.84(18) .
F5 P1 F3 178.94(16) .
F6 P1 F1 179.4(2) .
F6 P1 F2 91.4(2) .
F6 P1 F3 90.79(17) .
F6 P1 F4 90.0(2) .
F6 P1 F5 90.26(17) .
N9 C55 C56 179.7(5) .
C55 C56 H56A 109.5 .
C55 C56 H56B 109.5 .
C55 C56 H56C 109.5 .
H56A C56 H56B 109.5 .
H56A C56 H56C 109.5 .
H56B C56 H56C 109.5 .
N10 C57 C58 175.0(7) .
C57 C58 H58A 109.5 .
C57 C58 H58B 109.5 .
C57 C58 H58C 109.5 .
H58A C58 H58B 109.5 .
H58A C58 H58C 109.5 .
H58B C58 H58C 109.5 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 C1 2.105(3) .
Ag1 C16 2.106(3) 3_666
N1 C1 1.333(4) .
N1 C2 1.481(4) .
N1 C4 1.430(4) .
N2 C1 1.322(4) .
N2 C3 1.477(4) .
N2 C13 1.453(4) .
N3 C15 1.459(4) .
N3 C16 1.323(4) .
N3 C17 1.484(4) .
N4 C16 1.332(4) .
N4 C18 1.483(4) .
N4 C19 1.434(4) .
C2 H2A 0.9900 .
C2 H2B 0.9900 .
C2 C3 1.521(4) .
C3 H3A 0.9900 .
C3 H3B 0.9900 .
C4 C5 1.406(4) .
C4 C9 1.396(4) .
C5 C6 1.383(4) .
C5 C10 1.504(4) .
C6 H6 0.9500 .
C6 C7 1.390(5) .
C7 C8 1.384(5) .
C7 C11 1.514(5) .
C8 H8 0.9500 .
C8 C9 1.400(4) .
C9 C12 1.507(4) .
C10 H10A 0.9800 .
C10 H10B 0.9800 .
C10 H10C 0.9800 .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 H13A 0.9900 .
C13 H13B 0.9900 .
C13 C14 1.524(4) .
C14 H14A 0.9900 .
C14 H14B 0.9900 .
C14 C15 1.526(4) .
C15 H15A 0.9900 .
C15 H15B 0.9900 .
C16 Ag1 2.106(3) 3_666
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C17 C18 1.530(4) .
C18 H18A 0.9900 .
C18 H18B 0.9900 .
C19 C20 1.400(4) .
C19 C24 1.398(4) .
C20 C21 1.390(4) .
C20 C25 1.512(4) .
C21 H21 0.9500 .
C21 C22 1.393(5) .
C22 C23 1.388(5) .
C22 C26 1.509(4) .
C23 H23 0.9500 .
C23 C24 1.395(4) .
C24 C27 1.505(4) .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
C27 H27A 0.9800 .
C27 H27B 0.9800 .
C27 H27C 0.9800 .
Ag2 C28 2.093(3) .
Ag2 C43 2.100(3) 3_656
N5 C28 1.329(4) .
N5 C29 1.483(4) .
N5 C31 1.440(4) .
N6 C28 1.334(4) .
N6 C30 1.475(4) .
N6 C40 1.461(4) .
N7 C42 1.465(4) .
N7 C43 1.322(4) .
N7 C44 1.481(4) .
N8 C43 1.342(4) .
N8 C45 1.477(4) .
N8 C46 1.438(4) .
C29 H29A 0.9900 .
C29 H29B 0.9900 .
C29 C30 1.531(5) .
C30 H30A 0.9900 .
C30 H30B 0.9900 .
C31 C32 1.399(4) .
C31 C36 1.398(5) .
C32 C33 1.392(5) .
C32 C37 1.507(5) .
C33 H33 0.9500 .
C33 C34 1.388(5) .
C34 C35 1.393(5) .
C34 C38 1.509(5) .
C35 H35 0.9500 .
C35 C36 1.394(5) .
C36 C39 1.507(5) .
C37 H37A 0.9800 .
C37 H37B 0.9800 .
C37 H37C 0.9800 .
C38 H38A 0.9800 .
C38 H38B 0.9800 .
C38 H38C 0.9800 .
C39 H39A 0.9800 .
C39 H39B 0.9800 .
C39 H39C 0.9800 .
C40 H40A 0.9900 .
C40 H40B 0.9900 .
C40 C41 1.522(4) .
C41 H41A 0.9900 .
C41 H41B 0.9900 .
C41 C42 1.522(4) .
C42 H42A 0.9900 .
C42 H42B 0.9900 .
C43 Ag2 2.100(3) 3_656
C44 H44A 0.9900 .
C44 H44B 0.9900 .
C44 C45 1.532(4) .
C45 H45A 0.9900 .
C45 H45B 0.9900 .
C46 C47 1.394(4) .
C46 C51 1.406(4) .
C47 C48 1.397(4) .
C47 C52 1.505(4) .
C48 H48 0.9500 .
C48 C49 1.387(4) .
C49 C50 1.397(4) .
C49 C53 1.503(4) .
C50 H50 0.9500 .
C50 C51 1.390(4) .
C51 C54 1.498(4) .
C52 H52A 0.9800 .
C52 H52B 0.9800 .
C52 H52C 0.9800 .
C53 H53A 0.9800 .
C53 H53B 0.9800 .
C53 H53C 0.9800 .
C54 H54A 0.9800 .
C54 H54B 0.9800 .
C54 H54C 0.9800 .
P2 F7 1.599(3) .
P2 F8 1.598(2) .
P2 F9 1.606(2) .
P2 F10 1.590(2) .
P2 F11 1.595(2) .
P2 F12 1.588(2) .
P1 F1 1.595(2) .
P1 F2 1.601(3) .
P1 F3 1.608(3) .
P1 F4 1.592(3) .
P1 F5 1.592(3) .
P1 F6 1.586(3) .
N9 C55 1.125(5) .
C55 C56 1.463(6) .
C56 H56A 0.9800 .
C56 H56B 0.9800 .
C56 H56C 0.9800 .
N10 C57 1.152(8) .
C57 C58 1.415(8) .
C58 H58A 0.9800 .
C58 H58B 0.9800 .
C58 H58C 0.9800 .
