#------------------------------------------------------------------------------
#$Date: 2016-02-21 02:03:34 +0200 (Sun, 21 Feb 2016) $
#$Revision: 176798 $
#$URL: svn://www.crystallography.net/cod/cif/2/23/57/2235762.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2235762
loop_
_publ_author_name
'Huang, Xu'
'Li, Jing'
'Qiu, Qi-Ming'
'Liu, Min'
'Jin, Qiong-Hua'
_publ_section_title
;
 Bis[μ-bis(diphenylphosphanyl)methane-κ²P:P']bis[(isoquinoline-κN)silver(I)]
 bis(trifluoromethanesulfonate)--isoquinoline (1/1)
;
_journal_coeditor_code           BV2206
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1022
_journal_page_last               m1023
_journal_paper_doi               10.1107/S1600536812029236
_journal_volume                  68
_journal_year                    2012
_chemical_formula_iupac
'[Ag2 (C25 H22 P2)2 (C9 H7 N)2] (C F3 O3 S)2, C9 H7 N'
_chemical_formula_moiety
'C68 H58 Ag2 N2 P4 2+, 2(C F3 O3 S -), C9 H7 N'
_chemical_formula_sum            'C79 H65 Ag2 F6 N3 O6 P4 S2'
_chemical_formula_weight         1670.08
_chemical_name_systematic
;
Bis[μ-bis(diphenylphosphanyl)methane-
κ²P:P']bis[(isoquinoline-κN)silver(I)]
bis(trifluoromethanesulfonate)--isoquinoline (1/1)
;
_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                106.6960(10)
_cell_angle_beta                 100.3820(10)
_cell_angle_gamma                110.289(2)
_cell_formula_units_Z            1
_cell_length_a                   11.7730(11)
_cell_length_b                   11.9269(12)
_cell_length_c                   15.4151(17)
_cell_measurement_reflns_used    4635
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      28.049
_cell_measurement_theta_min      2.471
_cell_volume                     1847.9(3)
_computing_cell_refinement       'SAINT-Plus (Bruker, 2007)'
_computing_data_collection       'SMART (Bruker, 2007)'
_computing_data_reduction        'SAINT-Plus (Bruker, 2007)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker SMART 1000 CCD'
_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  0.0262
_diffrn_reflns_av_sigmaI/netI    0.0523
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            9230
_diffrn_reflns_theta_full        25.02
_diffrn_reflns_theta_max         25.02
_diffrn_reflns_theta_min         2.47
_exptl_absorpt_coefficient_mu    0.743
_exptl_absorpt_correction_T_max  0.7809
_exptl_absorpt_correction_T_min  0.7167
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2007)'
_exptl_crystal_colour            white
_exptl_crystal_density_diffrn    1.501
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             848
_exptl_crystal_size_max          0.48
_exptl_crystal_size_mid          0.39
_exptl_crystal_size_min          0.35
_refine_diff_density_max         0.632
_refine_diff_density_min         -0.570
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     497
_refine_ls_number_reflns         6407
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.030
_refine_ls_R_factor_all          0.0563
_refine_ls_R_factor_gt           0.0377
_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)+(0.0425P)²+1.3004P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0893
_refine_ls_wR_factor_ref         0.1030
_reflns_number_gt                4969
_reflns_number_total             6407
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            bv2206.cif
_cod_data_source_block           I
_cod_database_code               2235762
_cod_database_fobs_code          2235762
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag Ag1 0.52538(2) 0.63477(3) 0.59947(2) 0.04145(11) Uani d . 1 1 . .
F F1 0.401(2) 0.509(5) 0.1002(15) 0.115(8) Uani d P 0.57(12) 1 A 1
F F2 0.194(4) 0.430(4) 0.0409(18) 0.099(6) Uani d P 0.57(12) 1 A 1
F F3 0.283(8) 0.305(4) 0.0602(16) 0.114(11) Uani d P 0.57(12) 1 A 1
F F1' 0.225(5) 0.290(3) 0.061(2) 0.101(7) Uani d P 0.43(12) 1 A 2
F F2' 0.406(3) 0.450(9) 0.0954(18) 0.123(12) Uani d P 0.43(12) 1 A 2
F F3' 0.233(7) 0.462(6) 0.037(2) 0.095(9) Uani d P 0.43(12) 1 A 2
N N1 0.5661(3) 0.8428(3) 0.7245(2) 0.0493(8) Uani d . 1 1 . .
N N2 0.641(11) 0.001(13) 0.139(8) 0.12(12) Uani d P 0.50 1 . 1
O O1 0.3089(4) 0.6036(3) 0.2444(2) 0.0848(11) Uani d . 1 1 . .
O O2 0.3653(4) 0.4369(4) 0.2676(2) 0.0887(11) Uani d . 1 1 . .
O O3 0.1465(4) 0.3951(4) 0.2050(3) 0.1093(15) Uani d . 1 1 . .
P P1 0.73017(8) 0.71398(8) 0.57100(6) 0.0300(2) Uani d . 1 1 . .
P P2 0.70533(8) 0.45711(8) 0.44043(6) 0.0304(2) Uani d . 1 1 . .
S S1 0.27513(11) 0.46881(11) 0.21639(7) 0.0556(3) Uani d . 1 1 A .
C C1 0.6518(4) 0.8795(4) 0.8064(3) 0.0489(10) Uani d . 1 1 . .
H H1 0.6667 0.8162 0.8238 0.059 Uiso calc R 1 1 . .
C C2 0.5452(4) 0.9371(4) 0.7002(3) 0.0606(12) Uani d . 1 1 . .
H H2 0.4847 0.9123 0.6423 0.073 Uiso calc R 1 1 . .
C C3 0.6075(4) 1.0645(4) 0.7555(3) 0.0618(12) Uani d . 1 1 . .
H H3 0.5892 1.1247 0.7357 0.074 Uiso calc R 1 1 . .
C C4 0.7006(4) 1.1052(4) 0.8437(3) 0.0551(11) Uani d . 1 1 . .
C C5 0.7229(4) 1.0103(4) 0.8701(3) 0.0499(10) Uani d . 1 1 . .
C C6 0.8170(5) 1.0448(5) 0.9551(3) 0.0677(13) Uani d . 1 1 . .
H H6 0.8317 0.9814 0.9725 0.081 Uiso calc R 1 1 . .
C C7 0.8866(5) 1.1717(6) 1.0119(4) 0.0865(18) Uani d . 1 1 . .
H H7 0.9491 1.1948 1.0683 0.104 Uiso calc R 1 1 . .
C C8 0.8658(6) 1.2661(6) 0.9871(4) 0.0915(19) Uani d . 1 1 . .
H H8 0.9150 1.3523 1.0269 0.110 Uiso calc R 1 1 . .
C C9 0.7745(5) 1.2365(5) 0.9052(4) 0.0777(16) Uani d . 1 1 . .
H H9 0.7609 1.3018 0.8899 0.093 Uiso calc R 1 1 . .
C C10 0.8032(3) 0.5997(3) 0.5509(2) 0.0325(8) Uani d . 1 1 . .
H H10A 0.8122 0.5727 0.6044 0.039 Uiso calc R 1 1 . .
H H10B 0.8876 0.6419 0.5465 0.039 Uiso calc R 1 1 . .
C C11 0.8524(3) 0.8601(3) 0.6680(2) 0.0356(8) Uani d . 1 1 . .
C C12 0.8431(4) 0.9755(4) 0.6772(3) 0.0443(9) Uani d . 1 1 . .
H H12 0.7779 0.9761 0.6334 0.053 Uiso calc R 1 1 . .
C C13 0.9295(4) 1.0896(4) 0.7509(3) 0.0587(12) Uani d . 1 1 . .
H H13 0.9222 1.1664 0.7565 0.070 Uiso calc R 1 1 . .
C C14 1.0252(5) 1.0893(5) 0.8153(3) 0.0699(15) Uani d . 1 1 . .
H H14 1.0841 1.1662 0.8644 0.084 Uiso calc R 1 1 . .
C C15 1.0349(4) 0.9760(5) 0.8078(3) 0.0684(14) Uani d . 1 1 . .
H H15 1.0999 0.9766 0.8525 0.082 Uiso calc R 1 1 . .
C C16 0.9488(4) 0.8598(4) 0.7342(3) 0.0509(10) Uani d . 1 1 . .
H H16 0.9560 0.7833 0.7296 0.061 Uiso calc R 1 1 . .
C C17 0.7319(3) 0.7611(3) 0.4689(2) 0.0335(8) Uani d . 1 1 . .
C C18 0.8460(3) 0.8180(4) 0.4524(3) 0.0412(9) Uani d . 1 1 . .
H H18 0.9223 0.8355 0.4953 0.049 Uiso calc R 1 1 . .
C C19 0.8473(4) 0.8488(4) 0.3733(3) 0.0530(11) Uani d . 1 1 . .
H H19 0.9244 0.8875 0.3630 0.064 Uiso calc R 1 1 . .
C C20 0.7351(5) 0.8226(4) 0.3095(3) 0.0579(12) Uani d . 1 1 . .
H H20 0.7362 0.8430 0.2557 0.069 Uiso calc R 1 1 . .
C C21 0.6221(5) 0.7669(4) 0.3246(3) 0.0588(12) Uani d . 1 1 . .
H H21 0.5462 0.7488 0.2808 0.071 Uiso calc R 1 1 . .
C C22 0.6197(4) 0.7370(4) 0.4048(3) 0.0439(9) Uani d . 1 1 . .
H H22 0.5425 0.7007 0.4156 0.053 Uiso calc R 1 1 . .
C C23 0.7693(3) 0.4931(3) 0.3477(2) 0.0335(8) Uani d . 1 1 . .
C C24 0.8969(4) 0.5276(4) 0.3545(3) 0.0482(10) Uani d . 1 1 . .
H H24 0.9537 0.5361 0.4090 0.058 Uiso calc R 1 1 . .
C C25 0.9397(4) 0.5496(4) 0.2798(3) 0.0609(12) Uani d . 1 1 . .
H H25 1.0247 0.5706 0.2837 0.073 Uiso calc R 1 1 . .
C C26 0.8566(5) 0.5401(4) 0.2009(3) 0.0664(14) Uani d . 1 1 . .
H H26 0.8857 0.5556 0.1514 0.080 Uiso calc R 1 1 . .
C C27 0.7308(5) 0.5080(4) 0.1941(3) 0.0601(12) Uani d . 1 1 . .
H H27 0.6752 0.5028 0.1403 0.072 Uiso calc R 1 1 . .
C C28 0.6864(4) 0.4834(4) 0.2666(3) 0.0440(9) Uani d . 1 1 . .
H H28 0.6007 0.4602 0.2612 0.053 Uiso calc R 1 1 . .
C C29 0.7519(3) 0.3338(3) 0.4608(2) 0.0341(8) Uani d . 1 1 . .
C C30 0.7968(3) 0.2631(4) 0.3987(3) 0.0419(9) Uani d . 1 1 . .
H H30 0.8126 0.2836 0.3470 0.050 Uiso calc R 1 1 . .
C C31 0.8182(4) 0.1615(4) 0.4140(3) 0.0517(10) Uani d . 1 1 . .
H H31 0.8483 0.1145 0.3723 0.062 Uiso calc R 1 1 . .
C C32 0.7953(4) 0.1303(4) 0.4895(3) 0.0565(11) Uani d . 1 1 . .
H H32 0.8093 0.0620 0.4990 0.068 Uiso calc R 1 1 . .
C C33 0.7515(4) 0.1998(4) 0.5517(3) 0.0553(11) Uani d . 1 1 . .
H H33 0.7370 0.1791 0.6036 0.066 Uiso calc R 1 1 . .
C C34 0.7290(4) 0.3006(4) 0.5373(3) 0.0433(9) Uani d . 1 1 . .
H H34 0.6982 0.3465 0.5791 0.052 Uiso calc R 1 1 . .
C C35 0.2884(7) 0.4224(6) 0.0981(4) 0.0783(16) Uani d . 1 1 . .
C C36 0.641(14) 0.001(15) 0.139(10) 0.12(14) Uani d P 0.50 1 . 2
H H36 0.7001 0.0233 0.1969 0.144 Uiso calc PR 0.50 1 . 2
C C37 0.6164(7) 0.0911(10) 0.1179(5) 0.118(3) Uani d . 1 1 . .
H H37 0.6571 0.1756 0.1623 0.142 Uiso calc R 1 1 . 1
C C38 0.5330(5) 0.0643(6) 0.0327(4) 0.0837(18) Uani d . 1 1 . .
C C39 0.5054(8) 0.1618(8) 0.0075(6) 0.115(2) Uani d . 1 1 . .
H H39 0.5456 0.2481 0.0487 0.137 Uiso calc R 1 1 . .
C C40 0.4179(8) 0.1228(10) -0.0790(7) 0.115(3) Uani d . 1 1 . .
H H40 0.3988 0.1841 -0.0966 0.138 Uiso calc R 1 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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
P2 Ag1 P1 2_666 . 156.44(3)
P2 Ag1 N1 2_666 . 96.13(8)
P1 Ag1 N1 . . 95.55(8)
C1 N1 C2 . . 117.3(4)
C1 N1 Ag1 . . 116.6(3)
C2 N1 Ag1 . . 120.8(3)
C37 N2 C40 . 2_655 122(8)
C17 P1 C11 . . 101.96(16)
C17 P1 C10 . . 102.83(16)
C11 P1 C10 . . 104.74(16)
C17 P1 Ag1 . . 116.50(12)
C11 P1 Ag1 . . 114.01(11)
C10 P1 Ag1 . . 115.11(12)
C23 P2 C29 . . 105.89(16)
C23 P2 C10 . . 105.53(16)
C29 P2 C10 . . 102.69(16)
C23 P2 Ag1 . 2_666 115.97(12)
C29 P2 Ag1 . 2_666 105.64(11)
C10 P2 Ag1 . 2_666 119.53(11)
O3 S1 O1 . . 113.6(3)
O3 S1 O2 . . 115.2(3)
O1 S1 O2 . . 114.5(2)
O3 S1 C35 . . 104.9(3)
O1 S1 C35 . . 103.5(3)
O2 S1 C35 . . 103.2(3)
N1 C1 C5 . . 123.8(4)
N1 C1 H1 . . 118.1
C5 C1 H1 . . 118.1
C3 C2 N1 . . 123.8(4)
C3 C2 H2 . . 118.1
N1 C2 H2 . . 118.1
C2 C3 C4 . . 119.4(4)
C2 C3 H3 . . 120.3
C4 C3 H3 . . 120.3
C5 C4 C3 . . 117.7(4)
C5 C4 C9 . . 118.4(5)
C3 C4 C9 . . 123.8(5)
C4 C5 C6 . . 120.4(4)
C4 C5 C1 . . 118.0(4)
C6 C5 C1 . . 121.5(4)
C7 C6 C5 . . 119.5(5)
C7 C6 H6 . . 120.2
C5 C6 H6 . . 120.2
C6 C7 C8 . . 120.8(6)
C6 C7 H7 . . 119.6
C8 C7 H7 . . 119.6
C9 C8 C7 . . 121.5(5)
C9 C8 H8 . . 119.3
C7 C8 H8 . . 119.3
C8 C9 C4 . . 119.3(5)
C8 C9 H9 . . 120.3
C4 C9 H9 . . 120.3
P1 C10 P2 . . 110.79(17)
P1 C10 H10A . . 109.5
P2 C10 H10A . . 109.5
P1 C10 H10B . . 109.5
P2 C10 H10B . . 109.5
H10A C10 H10B . . 108.1
C16 C11 C12 . . 119.2(3)
C16 C11 P1 . . 123.3(3)
C12 C11 P1 . . 117.3(3)
C13 C12 C11 . . 120.8(4)
C13 C12 H12 . . 119.6
C11 C12 H12 . . 119.6
C14 C13 C12 . . 119.8(5)
C14 C13 H13 . . 120.1
C12 C13 H13 . . 120.1
C13 C14 C15 . . 120.1(4)
C13 C14 H14 . . 120.0
C15 C14 H14 . . 120.0
C14 C15 C16 . . 121.0(5)
C14 C15 H15 . . 119.5
C16 C15 H15 . . 119.5
C11 C16 C15 . . 119.0(4)
C11 C16 H16 . . 120.5
C15 C16 H16 . . 120.5
C22 C17 C18 . . 118.8(3)
C22 C17 P1 . . 120.8(3)
C18 C17 P1 . . 120.3(3)
C19 C18 C17 . . 120.6(4)
C19 C18 H18 . . 119.7
C17 C18 H18 . . 119.7
C20 C19 C18 . . 120.0(4)
C20 C19 H19 . . 120.0
C18 C19 H19 . . 120.0
C21 C20 C19 . . 120.3(4)
C21 C20 H20 . . 119.9
C19 C20 H20 . . 119.9
C20 C21 C22 . . 120.2(4)
C20 C21 H21 . . 119.9
C22 C21 H21 . . 119.9
C17 C22 C21 . . 120.1(4)
C17 C22 H22 . . 119.9
C21 C22 H22 . . 119.9
C24 C23 C28 . . 119.1(3)
C24 C23 P2 . . 122.4(3)
C28 C23 P2 . . 118.4(3)
C23 C24 C25 . . 120.0(4)
C23 C24 H24 . . 120.0
C25 C24 H24 . . 120.0
C26 C25 C24 . . 119.9(4)
C26 C25 H25 . . 120.0
C24 C25 H25 . . 120.0
C25 C26 C27 . . 120.6(4)
C25 C26 H26 . . 119.7
C27 C26 H26 . . 119.7
C26 C27 C28 . . 120.2(4)
C26 C27 H27 . . 119.9
C28 C27 H27 . . 119.9
C27 C28 C23 . . 120.2(4)
C27 C28 H28 . . 119.9
C23 C28 H28 . . 119.9
C34 C29 C30 . . 118.6(3)
C34 C29 P2 . . 117.6(3)
C30 C29 P2 . . 123.4(3)
C29 C30 C31 . . 120.1(4)
C29 C30 H30 . . 120.0
C31 C30 H30 . . 120.0
C32 C31 C30 . . 120.5(4)
C32 C31 H31 . . 119.7
C30 C31 H31 . . 119.7
C31 C32 C33 . . 120.0(4)
C31 C32 H32 . . 120.0
C33 C32 H32 . . 120.0
C32 C33 C34 . . 120.2(4)
C32 C33 H33 . . 119.9
C34 C33 H33 . . 119.9
C33 C34 C29 . . 120.5(4)
C33 C34 H34 . . 119.7
C29 C34 H34 . . 119.7
F2' C35 F3 . . 78.7(12)
F2' C35 F3' . . 107.9(18)
F3 C35 F3' . . 115.2(17)
F2' C35 F2 . . 128.4(16)
F3 C35 F2 . . 108(2)
F3' C35 F2 . . 22(2)
F2' C35 F1 . . 31.0(17)
F3 C35 F1 . . 108.1(12)
F3' C35 F1 . . 86(2)
F2 C35 F1 . . 108.4(12)
F2' C35 F1' . . 106.4(17)
F3 C35 F1' . . 27.7(13)
F3' C35 F1' . . 106(2)
F2 C35 F1' . . 90.4(14)
F1 C35 F1' . . 135.2(10)
F2' C35 S1 . . 114.4(11)
F3 C35 S1 . . 116.3(13)
F3' C35 S1 . . 117.7(18)
F2 C35 S1 . . 107.8(17)
F1 C35 S1 . . 108.0(13)
F1' C35 S1 . . 104(2)
C37 C36 C40 . 2_655 122(10)
C37 C36 H36 . . 119.2
C40 C36 H36 2_655 . 119.2
C36 C37 N2 . . 0(10)
C36 C37 C38 . . 122(6)
N2 C37 C38 . . 122(5)
C36 C37 H37 . . 119.0
N2 C37 H37 . . 119.1
C38 C37 H37 . . 119.1
C37 C38 C38 . 2_655 119.1(9)
C37 C38 C39 . . 123.0(7)
C38 C38 C39 2_655 . 117.9(8)
C40 C39 C38 . . 117.7(7)
C40 C39 H39 . . 121.2
C38 C39 H39 . . 121.2
N2 C40 C36 2_655 2_655 0(10)
N2 C40 C39 2_655 . 122(5)
C36 C40 C39 2_655 . 122(6)
N2 C40 H40 2_655 . 119.0
C36 C40 H40 2_655 . 119.1
C39 C40 H40 . . 119.0
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Ag1 P2 2_666 2.4296(9)
Ag1 P1 . 2.4368(9)
Ag1 N1 . 2.489(3)
F1 C35 . 1.35(2)
F2 C35 . 1.34(3)
F3 C35 . 1.33(2)
F1' C35 . 1.37(3)
F2' C35 . 1.32(3)
F3' C35 . 1.33(4)
N1 C1 . 1.312(5)
N1 C2 . 1.366(6)
N2 C37 . 1.32(13)
N2 C40 2_655 1.33(13)
O1 S1 . 1.423(4)
O2 S1 . 1.430(3)
O3 S1 . 1.411(4)
P1 C17 . 1.818(4)
P1 C11 . 1.825(3)
P1 C10 . 1.833(3)
P2 C23 . 1.820(4)
P2 C29 . 1.823(4)
P2 C10 . 1.841(3)
P2 Ag1 2_666 2.4296(9)
S1 C35 . 1.800(5)
C1 C5 . 1.420(5)
C1 H1 . 0.9300
C2 C3 . 1.353(6)
C2 H2 . 0.9300
C3 C4 . 1.414(6)
C3 H3 . 0.9300
C4 C5 . 1.396(6)
C4 C9 . 1.420(6)
C5 C6 . 1.401(6)
C6 C7 . 1.360(7)
C6 H6 . 0.9300
C7 C8 . 1.371(8)
C7 H7 . 0.9300
C8 C9 . 1.365(8)
C8 H8 . 0.9300
C9 H9 . 0.9300
C10 H10A . 0.9700
C10 H10B . 0.9700
C11 C16 . 1.384(5)
C11 C12 . 1.387(5)
C12 C13 . 1.383(5)
C12 H12 . 0.9300
C13 C14 . 1.363(7)
C13 H13 . 0.9300
C14 C15 . 1.369(7)
C14 H14 . 0.9300
C15 C16 . 1.394(6)
C15 H15 . 0.9300
C16 H16 . 0.9300
C17 C22 . 1.381(5)
C17 C18 . 1.386(5)
C18 C19 . 1.371(6)
C18 H18 . 0.9300
C19 C20 . 1.371(6)
C19 H19 . 0.9300
C20 C21 . 1.361(6)
C20 H20 . 0.9300
C21 C22 . 1.385(6)
C21 H21 . 0.9300
C22 H22 . 0.9300
C23 C24 . 1.388(5)
C23 C28 . 1.388(5)
C24 C25 . 1.392(6)
C24 H24 . 0.9300
C25 C26 . 1.366(7)
C25 H25 . 0.9300
C26 C27 . 1.371(7)
C26 H26 . 0.9300
C27 C28 . 1.380(6)
C27 H27 . 0.9300
C28 H28 . 0.9300
C29 C34 . 1.388(5)
C29 C30 . 1.391(5)
C30 C31 . 1.393(5)
C30 H30 . 0.9300
C31 C32 . 1.364(6)
C31 H31 . 0.9300
C32 C33 . 1.374(6)
C32 H32 . 0.9300
C33 C34 . 1.386(5)
C33 H33 . 0.9300
C34 H34 . 0.9300
C36 C37 . 1.32(15)
C36 C40 2_655 1.33(15)
C36 H36 . 0.9300
C37 C38 . 1.367(9)
C37 H37 . 0.9300
C38 C38 2_655 1.406(12)
C38 C39 . 1.443(10)
C39 C40 . 1.369(10)
C39 H39 . 0.9300
C40 N2 2_655 1.33(13)
C40 C36 2_655 1.33(15)
C40 H40 . 0.9300
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_site_symmetry_1
_geom_torsion_site_symmetry_4
_geom_torsion
P2 Ag1 N1 C1 2_666 . 130.6(3)
P1 Ag1 N1 C1 . . -69.9(3)
P2 Ag1 N1 C2 2_666 . -76.1(3)
P1 Ag1 N1 C2 . . 83.4(3)
P2 Ag1 P1 C17 2_666 . 20.80(16)
N1 Ag1 P1 C17 . . -98.62(15)
P2 Ag1 P1 C11 2_666 . 139.21(15)
N1 Ag1 P1 C11 . . 19.79(16)
P2 Ag1 P1 C10 2_666 . -99.70(14)
N1 Ag1 P1 C10 . . 140.87(15)
C2 N1 C1 C5 . . -0.1(6)
Ag1 N1 C1 C5 . . 154.2(3)
C1 N1 C2 C3 . . 0.0(6)
Ag1 N1 C2 C3 . . -153.2(4)
N1 C2 C3 C4 . . 0.4(7)
C2 C3 C4 C5 . . -0.7(7)
C2 C3 C4 C9 . . 177.5(4)
C3 C4 C5 C6 . . 177.8(4)
C9 C4 C5 C6 . . -0.5(6)
C3 C4 C5 C1 . . 0.6(6)
C9 C4 C5 C1 . . -177.7(4)
N1 C1 C5 C4 . . -0.2(6)
N1 C1 C5 C6 . . -177.4(4)
C4 C5 C6 C7 . . 0.0(7)
C1 C5 C6 C7 . . 177.1(4)
C5 C6 C7 C8 . . 0.1(8)
C6 C7 C8 C9 . . 0.4(9)
C7 C8 C9 C4 . . -0.9(9)
C5 C4 C9 C8 . . 0.9(7)
C3 C4 C9 C8 . . -177.3(5)
C17 P1 C10 P2 . . -63.0(2)
C11 P1 C10 P2 . . -169.23(18)
Ag1 P1 C10 P2 . . 64.76(19)
C23 P2 C10 P1 . . 93.0(2)
C29 P2 C10 P1 . . -156.24(18)
Ag1 P2 C10 P1 2_666 . -39.8(2)
C17 P1 C11 C16 . . -131.7(3)
C10 P1 C11 C16 . . -24.8(3)
Ag1 P1 C11 C16 . . 101.9(3)
C17 P1 C11 C12 . . 51.4(3)
C10 P1 C11 C12 . . 158.3(3)
Ag1 P1 C11 C12 . . -75.0(3)
C16 C11 C12 C13 . . 0.7(5)
P1 C11 C12 C13 . . 177.7(3)
C11 C12 C13 C14 . . 0.1(6)
C12 C13 C14 C15 . . -0.9(7)
C13 C14 C15 C16 . . 0.8(7)
C12 C11 C16 C15 . . -0.8(6)
P1 C11 C16 C15 . . -177.6(3)
C14 C15 C16 C11 . . 0.0(7)
C11 P1 C17 C22 . . -132.8(3)
C10 P1 C17 C22 . . 118.8(3)
Ag1 P1 C17 C22 . . -8.0(3)
C11 P1 C17 C18 . . 49.4(3)
C10 P1 C17 C18 . . -59.0(3)
Ag1 P1 C17 C18 . . 174.2(2)
C22 C17 C18 C19 . . -0.6(5)
P1 C17 C18 C19 . . 177.3(3)
C17 C18 C19 C20 . . -0.4(6)
C18 C19 C20 C21 . . 0.5(7)
C19 C20 C21 C22 . . 0.4(7)
C18 C17 C22 C21 . . 1.5(6)
P1 C17 C22 C21 . . -176.4(3)
C20 C21 C22 C17 . . -1.4(6)
C29 P2 C23 C24 . . -53.5(3)
C10 P2 C23 C24 . . 55.0(3)
Ag1 P2 C23 C24 2_666 . -170.2(3)
C29 P2 C23 C28 . . 125.5(3)
C10 P2 C23 C28 . . -126.1(3)
Ag1 P2 C23 C28 2_666 . 8.7(3)
C28 C23 C24 C25 . . -1.2(6)
P2 C23 C24 C25 . . 177.7(3)
C23 C24 C25 C26 . . 1.6(6)
C24 C25 C26 C27 . . -0.6(7)
C25 C26 C27 C28 . . -0.8(7)
C26 C27 C28 C23 . . 1.1(6)
C24 C23 C28 C27 . . -0.1(6)
P2 C23 C28 C27 . . -179.1(3)
C23 P2 C29 C34 . . 171.9(3)
C10 P2 C29 C34 . . 61.4(3)
Ag1 P2 C29 C34 2_666 . -64.5(3)
C23 P2 C29 C30 . . -14.8(3)
C10 P2 C29 C30 . . -125.2(3)
Ag1 P2 C29 C30 2_666 . 108.8(3)
C34 C29 C30 C31 . . -0.1(5)
P2 C29 C30 C31 . . -173.4(3)
C29 C30 C31 C32 . . 0.1(6)
C30 C31 C32 C33 . . -0.4(7)
C31 C32 C33 C34 . . 0.8(7)
C32 C33 C34 C29 . . -0.9(6)
C30 C29 C34 C33 . . 0.6(5)
P2 C29 C34 C33 . . 174.2(3)
O3 S1 C35 F2' . . -161(5)
O1 S1 C35 F2' . . 80(5)
O2 S1 C35 F2' . . -40(5)
O3 S1 C35 F3 . . -72(4)
O1 S1 C35 F3 . . 169(4)
O2 S1 C35 F3 . . 49(4)
O3 S1 C35 F3' . . 71(4)
O1 S1 C35 F3' . . -48(4)
O2 S1 C35 F3' . . -168(4)
O3 S1 C35 F2 . . 50(2)
O1 S1 C35 F2 . . -70(2)
O2 S1 C35 F2 . . 171(2)
O3 S1 C35 F1 . . 167(3)
O1 S1 C35 F1 . . 47(3)
O2 S1 C35 F1 . . -72(3)
O3 S1 C35 F1' . . -45(2)
O1 S1 C35 F1' . . -165(2)
O2 S1 C35 F1' . . 76(2)
C40 C36 C37 N2 2_655 . -4E1(10)
C40 C36 C37 C38 2_655 . -2(16)
C40 N2 C37 C36 2_655 . 14E1(10)
C40 N2 C37 C38 2_655 . -2(13)
C36 C37 C38 C38 . 2_655 3(8)
N2 C37 C38 C38 . 2_655 3(7)
C36 C37 C38 C39 . . -180(8)
N2 C37 C38 C39 . . -179(6)
C37 C38 C39 C40 . . -178.5(7)
C38 C38 C39 C40 2_655 . -0.9(10)
C38 C39 C40 N2 . 2_655 0(6)
C38 C39 C40 C36 . 2_655 0(8)
