#------------------------------------------------------------------------------
#$Date: 2020-02-11 22:31:29 +0200 (Tue, 11 Feb 2020) $
#$Revision: 248033 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/51/73/4517399.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_4517399
loop_
_publ_author_name
'Alice Heskia'
'Thierry Maris'
'James D. Wuest'
_publ_section_title
;
 Bis(phosphangulene)iminium Salts. Holding on to Fullerenes with Phangs
;
_journal_name_full               'Cryst. Growth & Design'
_journal_page_first              1319
_journal_page_last               1327
_journal_paper_doi               10.1021/acs.cgd.9b01568
_journal_volume                  20
_journal_year                    2020
_chemical_formula_moiety         'C68 H4 Ag7 F24 O26 S8, C36 H18 N O6 P2'
_chemical_formula_sum            'C104 H22 Ag7 F24 N O32 P2 S8'
_chemical_formula_weight         3326.73
_space_group_crystal_system      monoclinic
_space_group_IT_number           11
_space_group_name_Hall           '-P 2yb'
_space_group_name_H-M_alt        'P 1 21/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2019-08-16
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_cell_angle_alpha                90
_cell_angle_beta                 119.080(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   13.8832(6)
_cell_length_b                   35.9157(17)
_cell_length_c                   14.1516(6)
_cell_measurement_reflns_used    9874
_cell_measurement_temperature    150
_cell_measurement_theta_max      60.544
_cell_measurement_theta_min      3.183
_cell_volume                     6166.8(5)
_computing_cell_refinement
;
SAINT (2013) V8.38A; Integration Software for Single Crystal Data. 
Bruker AXS Inc., Madison, WI 53719-1173.'
;
_computing_data_collection
;
APEX 2 (2013) Bruker AXS Inc., Madison, WI 53719-1173.
;
_computing_data_reduction
;
SAINT (2013) V8.38A; Integration Software for Single Crystal Data. 
Bruker AXS Inc., Madison, WI 53719-1173.'
;
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'XT (Sheldrick, 2015)'
_diffrn_ambient_temperature      150
_diffrn_detector                 'CMOS Area detector'
_diffrn_detector_area_resol_mean 10.24
_diffrn_detector_type            'Bruker Photon 100 CMOS Detector'
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device       'k-geometry diffractometer'
_diffrn_measurement_device_type  'Bruker Venture Metaljet'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_collimation    'Focusing mirrors'
_diffrn_radiation_monochromator  'Helios MX Mirror Optics'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           GaK\a
_diffrn_radiation_wavelength     1.34139
_diffrn_reflns_av_R_equivalents  0.0602
_diffrn_reflns_av_unetI/netI     0.0360
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       46
_diffrn_reflns_limit_k_min       -45
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            89811
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        53.594
_diffrn_reflns_theta_max         60.741
_diffrn_reflns_theta_min         3.109
_diffrn_source                   'Metal Jet'
_diffrn_source_target            Ga
_diffrn_source_type              'Gallium Liquid Metal Jet Source'
_exptl_absorpt_coefficient_mu    7.588
_exptl_absorpt_correction_T_max  0.7519
_exptl_absorpt_correction_T_min  0.4786
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;   
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. 
wR2(int) was 0.1370 before and 0.0868 after correction. 
The Ratio of minimum to maximum transmission is 0.6365. 
The λ/2 correction factor is Not present.'
;
_exptl_crystal_colour            'clear light brown'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    brown
_exptl_crystal_density_diffrn    1.792
_exptl_crystal_description       plate
_exptl_crystal_F_000             3224
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.03
_refine_diff_density_max         1.572
_refine_diff_density_min         -1.476
_refine_diff_density_rms         0.129
_refine_ls_extinction_coef       0.00014(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.044
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     809
_refine_ls_number_reflns         14410
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.044
_refine_ls_R_factor_all          0.0723
_refine_ls_R_factor_gt           0.0624
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0693P)²+32.5976P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1680
_refine_ls_wR_factor_ref         0.1747
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                11791
_reflns_number_total             14410
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            jw2088__Phang_2N_Ag7OTf8_H2O_C60.cif
_cod_data_source_block           jw2088
_cod_database_code               4517399
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, y+1/2, -z'
3 '-x, -y, -z'
4 'x, -y-1/2, 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
Ag2 Ag 0.82206(4) 0.50535(2) 0.30806(4) 0.05626(16) Uani 1 1 d . . . . .
Ag3 Ag 0.46938(3) 0.49673(2) 0.28569(3) 0.04387(13) Uani 1 1 d . . . . .
Ag4 Ag 0.26746(4) 0.45789(2) 0.48784(4) 0.05942(16) Uani 1 1 d . . . . .
S1 S 0.60187(11) 0.55855(4) 0.21408(11) 0.0419(3) Uani 1 1 d . . . . .
S2 S 0.60992(12) 0.44328(4) 0.20146(13) 0.0456(3) Uani 1 1 d . . . . .
S3 S 0.51418(11) 0.44296(4) 0.50238(10) 0.0419(3) Uani 1 1 d . . . . .
S4 S 0.02235(11) 0.43160(4) 0.49416(10) 0.0415(3) Uani 1 1 d . . . . .
F1 F 0.7577(3) 0.39447(12) 0.2183(4) 0.0678(11) Uani 1 1 d . . . . .
F2 F 0.6127(4) 0.39540(13) 0.0644(3) 0.0763(13) Uani 1 1 d . . . . .
F3 F 0.6071(3) 0.37091(11) 0.1997(4) 0.0704(12) Uani 1 1 d . . . . .
F4 F 0.5713(4) 0.63008(11) 0.1778(4) 0.0726(12) Uani 1 1 d . . . . .
F5 F 0.6316(4) 0.61357(13) 0.3444(4) 0.0750(12) Uani 1 1 d . . . . .
F6 F 0.4628(3) 0.60463(12) 0.2273(4) 0.0672(11) Uani 1 1 d . . . . .
F7 F 0.6754(3) 0.39801(14) 0.5365(4) 0.0779(13) Uani 1 1 d . . . . .
F8 F 0.5291(4) 0.38843(14) 0.3888(4) 0.0743(12) Uani 1 1 d . . . . .
F9 F 0.5398(4) 0.37197(13) 0.5382(4) 0.0794(13) Uani 1 1 d . . . . .
F10 F 0.0460(6) 0.37799(17) 0.6279(5) 0.110(2) Uani 1 1 d . . . . .
F11 F -0.0328(5) 0.36160(14) 0.4594(5) 0.0971(17) Uani 1 1 d . . . . .
F12 F -0.1198(5) 0.39282(14) 0.5219(5) 0.0890(16) Uani 1 1 d . . . . .
O1 O 0.6635(3) 0.47028(12) 0.1671(3) 0.0453(9) Uani 1 1 d . . . . .
O2 O 0.6537(6) 0.44117(17) 0.3170(4) 0.0831(19) Uani 1 1 d . . . . .
O3 O 0.4920(4) 0.44390(15) 0.1383(6) 0.0804(18) Uani 1 1 d . . . . .
O4 O 0.8027(4) 0.48913(15) 0.4671(4) 0.0579(11) Uani 1 1 d . . . . .
H4A H 0.751551 0.467852 0.450251 0.069 Uiso 1 1 calc R . . . .
H4B H 0.875094 0.482081 0.528450 0.069 Uiso 1 1 calc R . . . .
O5 O 0.5097(4) 0.54851(14) 0.1108(3) 0.0561(11) Uani 1 1 d . . . . .
O6 O 0.7053(4) 0.56454(13) 0.2160(4) 0.0530(10) Uani 1 1 d . . . . .
O7 O 0.6113(3) 0.53579(12) 0.3033(3) 0.0447(9) Uani 1 1 d . . . . .
O8 O 0.5591(3) 0.46865(13) 0.4549(3) 0.0499(10) Uani 1 1 d . . . . .
O9 O 0.5567(3) 0.44755(13) 0.6157(3) 0.0509(10) Uani 1 1 d . . . . .
O10 O 0.3960(3) 0.43807(14) 0.4403(3) 0.0523(11) Uani 1 1 d . . . . .
O11 O 0.1301(4) 0.42302(14) 0.5096(4) 0.0577(11) Uani 1 1 d . . . . .
O12 O 0.0201(3) 0.45752(13) 0.5716(3) 0.0500(10) Uani 1 1 d . . . . .
O13 O -0.0602(4) 0.43939(14) 0.3853(3) 0.0553(11) Uani 1 1 d . . . . .
C1 C -0.2086(4) 0.45551(15) 0.0352(4) 0.0349(11) Uani 1 1 d . . . . .
C2 C -0.1955(4) 0.42988(15) -0.0376(4) 0.0372(11) Uani 1 1 d . . . . .
C3 C -0.1000(4) 0.40885(14) -0.0013(5) 0.0388(11) Uani 1 1 d . . . . .
C4 C -0.0494(4) 0.40472(15) -0.0694(5) 0.0388(11) Uani 1 1 d . . . . .
C5 C -0.0954(4) 0.42066(15) -0.1692(4) 0.0376(11) Uani 1 1 d . . . . .
C6 C -0.0250(5) 0.43865(16) -0.2060(4) 0.0414(12) Uani 1 1 d . . . . .
C7 C -0.0839(4) 0.47160(17) -0.2687(4) 0.0380(11) Uani 1 1 d . . . . .
C8 C -0.0247(4) 0.50356(17) -0.2606(4) 0.0381(12) Uani 1 1 d . . . . .
C9 C 0.0957(4) 0.50448(17) -0.1911(4) 0.0400(12) Uani 1 1 d . . . . .
C10 C 0.1491(4) 0.47284(17) -0.1324(4) 0.0392(11) Uani 1 1 d . . . . .
C11 C 0.0863(4) 0.43969(16) -0.1416(4) 0.0375(11) Uani 1 1 d . . . . .
C12 C 0.1360(5) 0.42264(15) -0.0341(5) 0.0402(12) Uani 1 1 d . . . . .
C13 C 0.0699(4) 0.40534(14) 0.0004(5) 0.0388(11) Uani 1 1 d . . . . .
C14 C 0.0931(5) 0.41046(14) 0.1124(5) 0.0397(12) Uani 1 1 d . . . . .
C15 C -0.0122(5) 0.41282(15) 0.1097(4) 0.0383(11) Uani 1 1 d . . . . .
C16 C -0.0248(4) 0.43723(15) 0.1802(4) 0.0371(11) Uani 1 1 d . . . . .
C17 C -0.1247(4) 0.45879(16) 0.1414(4) 0.0389(12) Uani 1 1 d . . . . .
C18 C 0.0670(5) 0.46046(17) 0.2531(4) 0.0416(12) Uani 1 1 d . . . . .
C19 C 0.1687(4) 0.45789(17) 0.2566(4) 0.0389(12) Uani 1 1 d . . . . .
C20 C 0.1809(4) 0.43222(15) 0.1816(4) 0.0372(11) Uani 1 1 d . . . . .
C21 C 0.2495(4) 0.44993(15) 0.1441(4) 0.0356(11) Uani 1 1 d . . . . .
C22 C 0.2275(4) 0.44525(16) 0.0383(5) 0.0389(11) Uani 1 1 d . . . . .
C23 C 0.2371(4) 0.47675(15) -0.0209(4) 0.0359(11) Uani 1 1 d . . . . .
C24 C 0.2659(4) 0.51162(17) 0.0263(4) 0.0367(11) Uani 1 1 d . . . . .
C25 C 0.2894(4) 0.51686(15) 0.1372(4) 0.0344(10) Uani 1 1 d . . . . .
C26 C 0.2452(4) 0.55281(15) 0.1436(4) 0.0339(10) Uani 1 1 d . . . . .
C27 C 0.1957(4) 0.55752(15) 0.2085(4) 0.0378(11) Uani 1 1 d . . . . .
C28 C 0.1884(4) 0.52610(16) 0.2690(4) 0.0364(11) Uani 1 1 d . . . . .
C29 C 0.2287(4) 0.49166(17) 0.2621(4) 0.0381(12) Uani 1 1 d . . . . .
C30 C 0.2823(4) 0.48662(16) 0.1956(4) 0.0352(11) Uani 1 1 d . . . . .
C31 C 0.6489(5) 0.39808(18) 0.1681(5) 0.0472(13) Uani 1 1 d . . . . .
C32 C 0.5651(6) 0.60421(19) 0.2440(5) 0.0510(14) Uani 1 1 d . . . . .
C33 C 0.5682(5) 0.3973(2) 0.4922(5) 0.0525(15) Uani 1 1 d . . . . .
C34 C -0.0233(7) 0.3887(2) 0.5281(7) 0.0658(19) Uani 1 1 d . . . . .
Ag1 Ag 0.54766(12) 0.50317(3) 0.00015(8) 0.0730(4) Uani 0.5 1 d . . . A -1
P1A P 0.10638(13) 0.29169(4) 0.05178(14) 0.0444(3) Uani 1 1 d . . . . .
O1A O -0.0899(4) 0.30673(14) 0.0753(5) 0.0687(14) Uani 1 1 d . . . . .
O2A O 0.0620(4) 0.31802(14) -0.1648(4) 0.0586(11) Uani 1 1 d . . . . .
O3A O 0.2935(4) 0.33513(12) 0.2181(3) 0.0504(10) Uani 1 1 d . . . . .
N1 N 0.1428(9) 0.250000 0.0651(9) 0.069(2) Uani 1 2 d S T P . .
C1A C -0.0221(6) 0.30548(17) -0.0530(6) 0.0560(16) Uani 1 1 d . . . . .
C2A C -0.1086(7) 0.3110(2) -0.0283(8) 0.068(2) Uani 1 1 d . . . . .
C3A C -0.2110(6) 0.3216(2) -0.1153(10) 0.085(3) Uani 1 1 d . . . . .
H3A H -0.273562 0.324080 -0.105362 0.103 Uiso 1 1 calc R . . . .
C4A C -0.2198(8) 0.3284(3) -0.2151(9) 0.089(3) Uani 1 1 d . . . . .
H4AA H -0.290575 0.334025 -0.273911 0.107 Uiso 1 1 calc R . . . .
C5A C -0.1317(7) 0.3276(3) -0.2340(8) 0.082(3) Uani 1 1 d . . . . .
H5A H -0.139679 0.334417 -0.302303 0.099 Uiso 1 1 calc R . . . .
C6A C -0.0307(6) 0.3164(2) -0.1499(6) 0.0591(17) Uani 1 1 d . . . . .
C7A C 0.1897(5) 0.32082(16) 0.0261(5) 0.0427(12) Uani 1 1 d . . . . .
C8A C 0.1616(6) 0.33001(17) -0.0791(5) 0.0499(14) Uani 1 1 d . . . . .
C9A C 0.2330(6) 0.35205(18) -0.0978(6) 0.0530(15) Uani 1 1 d . . . . .
H9A H 0.217734 0.357186 -0.169604 0.064 Uiso 1 1 calc R . . . .
C10A C 0.3250(5) 0.36617(19) -0.0123(6) 0.0510(15) Uani 1 1 d . . . . .
H10A H 0.375795 0.379870 -0.025471 0.061 Uiso 1 1 calc R . . . .
C11A C 0.3473(5) 0.36117(19) 0.0948(6) 0.0521(15) Uani 1 1 d . . . . .
H11A H 0.408465 0.373085 0.152959 0.063 Uiso 1 1 calc R . . . .
C12A C 0.2779(5) 0.33845(15) 0.1133(5) 0.0433(12) Uani 1 1 d . . . . .
C13A C 0.1077(6) 0.31455(15) 0.1595(5) 0.0456(13) Uani 1 1 d . . . . .
C14A C 0.0098(7) 0.31899(19) 0.1629(7) 0.067(2) Uani 1 1 d . . . . .
C15A C 0.0112(9) 0.3368(2) 0.2507(8) 0.074(3) Uani 1 1 d . . . . .
H15A H -0.053644 0.338884 0.256992 0.089 Uiso 1 1 calc R . . . .
C16A C 0.1097(8) 0.3513(2) 0.3281(7) 0.069(2) Uani 1 1 d . . . . .
H16A H 0.111963 0.362369 0.390087 0.083 Uiso 1 1 calc R . . . .
C17A C 0.2042(8) 0.3507(2) 0.3215(6) 0.066(2) Uani 1 1 d . . . . .
H17A H 0.269320 0.362197 0.375848 0.079 Uiso 1 1 calc R . . . .
C18A C 0.2040(6) 0.33317(17) 0.2343(5) 0.0525(15) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0137 0.0067 '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 0.0782 3.3822 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0583 0.0400 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0241 0.0134 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0389 0.0241 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2543 0.3332 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.2925 0.4295 '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
O4 Ag2 O1 99.58(15) . .
O12 Ag2 O1 173.22(14) 3_666 .
O12 Ag2 O4 87.18(15) 3_666 .
O12 Ag2 C9 89.71(16) 3_666 3_665
C9 Ag2 O1 84.64(16) 3_665 .
C9 Ag2 O4 151.27(18) 3_665 .
O7 Ag3 O9 78.92(15) . 3_666
O7 Ag3 C25 111.62(16) . .
O8 Ag3 O7 98.56(15) . .
O8 Ag3 O9 85.69(15) . 3_666
O8 Ag3 C25 145.00(16) . .
C25 Ag3 O9 83.24(15) . 3_666
C30 Ag3 O7 145.36(17) . .
C30 Ag3 O8 113.46(17) . .
C30 Ag3 O9 90.27(17) . 3_666
C30 Ag3 C25 33.88(18) . .
O4 Ag4 O11 85.92(17) 3_666 .
O10 Ag4 O4 143.80(18) . 3_666
O10 Ag4 O11 130.27(17) . .
O5 S1 O7 113.5(3) . .
O5 S1 C32 104.4(3) . .
O6 S1 O5 116.3(3) . .
O6 S1 O7 113.5(3) . .
O6 S1 C32 104.5(3) . .
O7 S1 C32 102.8(3) . .
O1 S2 O2 114.5(3) . .
O1 S2 C31 104.0(3) . .
O2 S2 C31 103.3(3) . .
O3 S2 O1 113.5(3) . .
O3 S2 O2 115.5(4) . .
O3 S2 C31 104.0(3) . .
O8 S3 C33 104.4(3) . .
O9 S3 O8 114.4(3) . .
O9 S3 O10 115.1(3) . .
O9 S3 C33 103.3(3) . .
O10 S3 O8 114.4(3) . .
O10 S3 C33 103.2(3) . .
O11 S4 O12 115.2(3) . .
O11 S4 C34 104.4(3) . .
O12 S4 C34 101.9(3) . .
O13 S4 O11 115.8(3) . .
O13 S4 O12 112.8(3) . .
O13 S4 C34 104.5(4) . .
S2 O1 Ag2 118.2(2) . .
S2 O1 Ag1 116.8(2) . .
Ag1 O1 Ag2 116.48(17) . .
Ag4 O4 Ag2 107.4(2) 3_666 .
S1 O5 Ag1 116.5(3) . .
S1 O7 Ag3 122.0(2) . .
S3 O8 Ag3 128.2(2) . .
S3 O9 Ag3 127.8(3) . 3_666
S3 O10 Ag4 126.6(3) . .
S4 O11 Ag4 134.1(3) . .
S4 O12 Ag2 122.8(2) . 3_666
C17 C1 C2 119.4(5) . .
C17 C1 C24 120.4(5) . 3_565
C24 C1 C2 108.0(4) 3_565 .
C3 C2 C1 120.5(5) . .
C3 C2 C26 120.2(5) . 3_565
C26 C2 C1 107.5(5) 3_565 .
C2 C3 C4 119.6(5) . .
C2 C3 C15 119.6(5) . .
C4 C3 C15 107.8(5) . .
C3 C4 C13 107.8(5) . .
C5 C4 C3 120.8(5) . .
C5 C4 C13 120.1(5) . .
C4 C5 C6 119.8(5) . .
C4 C5 C27 120.2(5) . 3_565
C27 C5 C6 107.9(5) 3_565 .
C5 C6 C7 107.4(5) . .
C11 C6 C5 120.8(5) . .
C11 C6 C7 120.1(5) . .
C8 C7 C6 119.0(5) . .
C8 C7 C28 120.4(5) . 3_565
C28 C7 C6 108.1(5) 3_565 .
C7 C8 C9 120.7(5) . .
C7 C8 C18 120.1(5) . 3_565
C18 C8 C9 107.5(5) 3_565 .
C8 C9 Ag2 107.2(3) . 3_665
C10 C9 Ag2 89.8(3) . 3_665
C10 C9 C8 119.0(5) . .
C10 C9 C17 120.7(5) . 3_565
C17 C9 Ag2 110.2(3) 3_565 3_665
C17 C9 C8 107.5(5) 3_565 .
C9 C10 C11 119.8(5) . .
C9 C10 C23 119.4(5) . .
C11 C10 C23 109.1(5) . .
C6 C11 C10 121.5(5) . .
C6 C11 C12 119.5(5) . .
C10 C11 C12 107.0(5) . .
C13 C12 C11 119.8(5) . .
C13 C12 C22 120.9(5) . .
C22 C12 C11 108.2(5) . .
C4 C13 C14 108.3(5) . .
C12 C13 C4 119.9(5) . .
C12 C13 C14 119.5(5) . .
C15 C14 C13 106.9(5) . .
C20 C14 C13 119.5(5) . .
C20 C14 C15 121.3(5) . .
C14 C15 C3 109.2(5) . .
C16 C15 C3 120.1(5) . .
C16 C15 C14 119.5(5) . .
C15 C16 C17 119.6(5) . .
C15 C16 C18 119.7(5) . .
C17 C16 C18 108.1(5) . .
C1 C17 C9 119.3(5) . 3_565
C1 C17 C16 120.8(5) . .
C16 C17 C9 108.2(5) . 3_565
C8 C18 C16 108.6(5) 3_565 .
C19 C18 C8 119.9(5) . 3_565
C19 C18 C16 120.8(5) . .
C18 C19 C20 119.0(5) . .
C18 C19 C29 119.5(5) . .
C29 C19 C20 107.4(5) . .
C14 C20 C19 119.7(5) . .
C14 C20 C21 120.2(5) . .
C21 C20 C19 108.4(5) . .
C20 C21 C30 108.3(5) . .
C22 C21 C20 120.4(5) . .
C22 C21 C30 119.9(5) . .
C12 C22 C23 109.1(5) . .
C21 C22 C12 119.6(5) . .
C21 C22 C23 119.7(5) . .
C22 C23 C10 106.6(5) . .
C24 C23 C10 120.2(5) . .
C24 C23 C22 120.8(5) . .
C23 C24 C1 120.0(5) . 3_565
C23 C24 C25 120.0(5) . .
C25 C24 C1 108.2(5) . 3_565
C24 C25 Ag3 119.1(3) . .
C26 C25 Ag3 119.5(3) . .
C26 C25 C24 107.6(4) . .
C30 C25 Ag3 66.5(3) . .
C30 C25 C24 119.7(5) . .
C30 C25 C26 120.1(5) . .
C25 C26 C2 108.6(4) . 3_565
C27 C26 C2 119.2(5) . 3_565
C27 C26 C25 120.4(5) . .
C26 C27 C5 120.0(5) . 3_565
C26 C27 C28 119.4(5) . .
C28 C27 C5 108.5(5) . 3_565
C27 C28 C7 108.1(5) . 3_565
C29 C28 C7 119.3(5) . 3_565
C29 C28 C27 120.6(5) . .
C19 C29 C30 108.6(5) . .
C28 C29 C19 120.8(5) . .
C28 C29 C30 120.3(5) . .
C21 C30 Ag3 114.3(3) . .
C25 C30 Ag3 79.6(3) . .
C25 C30 C21 119.9(5) . .
C25 C30 C29 119.2(5) . .
C29 C30 Ag3 114.4(3) . .
C29 C30 C21 107.4(5) . .
F1 C31 S2 110.4(4) . .
F2 C31 S2 110.7(5) . .
F2 C31 F1 108.1(5) . .
F2 C31 F3 109.5(5) . .
F3 C31 S2 109.4(4) . .
F3 C31 F1 108.7(5) . .
F4 C32 S1 109.8(4) . .
F5 C32 S1 110.7(5) . .
F5 C32 F4 109.1(6) . .
F5 C32 F6 108.7(5) . .
F6 C32 S1 111.4(5) . .
F6 C32 F4 107.1(6) . .
F7 C33 S3 110.9(5) . .
F7 C33 F8 107.1(5) . .
F8 C33 S3 109.6(5) . .
F9 C33 S3 110.7(4) . .
F9 C33 F7 109.3(6) . .
F9 C33 F8 109.1(6) . .
F10 C34 S4 111.3(6) . .
F10 C34 F11 109.2(7) . .
F11 C34 S4 110.4(5) . .
F12 C34 S4 111.3(6) . .
F12 C34 F10 107.2(7) . .
F12 C34 F11 107.4(7) . .
O1 Ag1 O5 87.04(15) . .
N1 P1A C1A 120.7(4) . .
N1 P1A C7A 113.3(4) . .
N1 P1A C13A 119.1(4) . .
C7A P1A C1A 99.3(3) . .
C13A P1A C1A 100.5(3) . .
C13A P1A C7A 100.2(3) . .
C2A O1A C14A 120.2(5) . .
C8A O2A C6A 118.6(5) . .
C18A O3A C12A 119.8(5) . .
P1A N1 P1A 146.9(7) 4_565 .
C2A C1A P1A 117.9(6) . .
C6A C1A P1A 119.0(6) . .
C6A C1A C2A 122.2(7) . .
O1A C2A C1A 120.4(8) . .
O1A C2A C3A 123.6(8) . .
C3A C2A C1A 116.0(9) . .
C4A C3A C2A 119.6(9) . .
C5A C4A C3A 123.4(9) . .
C4A C5A C6A 117.7(10) . .
C1A C6A O2A 121.4(7) . .
C1A C6A C5A 120.0(8) . .
C5A C6A O2A 118.6(7) . .
C8A C7A P1A 120.3(5) . .
C8A C7A C12A 120.7(6) . .
C12A C7A P1A 118.5(4) . .
C7A C8A O2A 120.3(6) . .
C7A C8A C9A 119.1(6) . .
C9A C8A O2A 120.6(6) . .
C10A C9A C8A 119.4(6) . .
C9A C10A C11A 122.2(6) . .
C12A C11A C10A 118.2(6) . .
O3A C12A C7A 121.1(5) . .
C11A C12A O3A 119.3(6) . .
C11A C12A C7A 119.5(6) . .
C14A C13A P1A 119.6(6) . .
C14A C13A C18A 120.4(6) . .
C18A C13A P1A 119.3(5) . .
C13A C14A O1A 119.5(7) . .
C15A C14A O1A 120.9(7) . .
C15A C14A C13A 119.6(9) . .
C16A C15A C14A 117.7(8) . .
C17A C16A C15A 124.0(7) . .
C16A C17A C18A 118.9(8) . .
O3A C18A C13A 120.3(6) . .
O3A C18A C17A 121.1(7) . .
C17A C18A C13A 118.5(7) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag2 O1 2.479(4) .
Ag2 O4 2.463(5) .
Ag2 O12 2.420(4) 3_666
Ag2 C9 2.451(5) 3_665
Ag3 O7 2.331(4) .
Ag3 O8 2.324(4) .
Ag3 O9 2.564(5) 3_666
Ag3 C25 2.465(5) .
Ag3 C30 2.299(5) .
Ag4 O4 2.362(5) 3_666
Ag4 O10 2.305(4) .
Ag4 O11 2.424(5) .
S1 O5 1.444(4) .
S1 O6 1.439(4) .
S1 O7 1.456(4) .
S1 C32 1.827(7) .
S2 O1 1.442(4) .
S2 O2 1.443(5) .
S2 O3 1.434(5) .
S2 C31 1.844(7) .
S3 O8 1.449(5) .
S3 O9 1.423(4) .
S3 O10 1.447(4) .
S3 C33 1.839(7) .
S4 O11 1.436(5) .
S4 O12 1.449(4) .
S4 O13 1.432(4) .
S4 C34 1.818(8) .
F1 C31 1.326(7) .
F2 C31 1.303(8) .
F3 C31 1.320(7) .
F4 C32 1.351(7) .
F5 C32 1.308(8) .
F6 C32 1.322(8) .
F7 C33 1.305(8) .
F8 C33 1.329(8) .
F9 C33 1.286(8) .
F10 C34 1.322(10) .
F11 C34 1.336(9) .
F12 C34 1.307(9) .
O1 Ag1 2.423(4) .
O5 Ag1 2.487(5) .
C1 C2 1.458(8) .
C1 C17 1.388(8) .
C1 C24 1.453(8) 3_565
C2 C3 1.389(8) .
C2 C26 1.452(7) 3_565
C3 C4 1.449(8) .
C3 C15 1.454(8) .
C4 C5 1.362(8) .
C4 C13 1.459(8) .
C5 C6 1.463(8) .
C5 C27 1.453(7) 3_565
C6 C7 1.467(8) .
C6 C11 1.361(8) .
C7 C8 1.384(8) .
C7 C28 1.452(7) 3_565
C8 C9 1.470(7) .
C8 C18 1.444(9) 3_565
C9 C10 1.390(8) .
C9 C17 1.457(8) 3_565
C10 C11 1.444(8) .
C10 C23 1.459(7) .
C11 C12 1.465(8) .
C12 C13 1.379(8) .
C12 C22 1.434(8) .
C13 C14 1.468(8) .
C14 C15 1.446(8) .
C14 C20 1.377(8) .
C15 C16 1.401(8) .
C16 C17 1.444(8) .
C16 C18 1.451(8) .
C18 C19 1.393(8) .
C19 C20 1.476(8) .
C19 C29 1.451(8) .
C20 C21 1.444(7) .
C21 C22 1.385(8) .
C21 C30 1.467(8) .
C22 C23 1.452(8) .
C23 C24 1.384(8) .
C24 C25 1.452(7) .
C25 C26 1.451(8) .
C25 C30 1.397(7) .
C26 C27 1.399(7) .
C27 C28 1.450(8) .
C28 C29 1.380(8) .
C29 C30 1.467(7) .
P1A N1 1.562(3) .
P1A C1A 1.748(8) .
P1A C7A 1.725(6) .
P1A C13A 1.724(6) .
O1A C2A 1.367(10) .
O1A C14A 1.407(11) .
O2A C6A 1.402(9) .
O2A C8A 1.392(8) .
O3A C12A 1.395(7) .
O3A C18A 1.372(8) .
C1A C2A 1.417(10) .
C1A C6A 1.375(10) .
C2A C3A 1.407(12) .
C3A C4A 1.379(15) .
C4A C5A 1.374(15) .
C5A C6A 1.386(11) .
C7A C8A 1.383(8) .
C7A C12A 1.398(9) .
C8A C9A 1.391(9) .
C9A C10A 1.360(10) .
C10A C11A 1.402(9) .
C11A C12A 1.382(9) .
C13A C14A 1.393(10) .
C13A C18A 1.407(10) .
C14A C15A 1.389(11) .
C15A C16A 1.372(13) .
C16A C17A 1.360(12) .
C17A C18A 1.384(10) .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
_geom_hbond_publ_flag
O4 H4A O2 0.99 1.96 2.737(8) 133.7 . yes
O4 H4B S4 0.99 2.94 3.547(5) 120.3 1_655 yes
O4 H4B O12 0.99 2.00 2.872(6) 145.3 1_655 yes
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
Ag2 C9 C10 C11 -108.9(4) 3_665 . . .
Ag2 C9 C10 C23 112.0(4) 3_665 . . .
Ag3 C25 C26 C2 139.3(3) . . . 3_565
Ag3 C25 C26 C27 -78.1(5) . . . .
Ag3 C25 C30 C21 -112.1(5) . . . .
Ag3 C25 C30 C29 112.2(4) . . . .
O1 S2 C31 F1 58.3(5) . . . .
O1 S2 C31 F2 -61.3(5) . . . .
O1 S2 C31 F3 177.9(4) . . . .
O2 S2 O1 Ag2 2.7(4) . . . .
O2 S2 O1 Ag1 -144.1(3) . . . .
O2 S2 C31 F1 -61.6(5) . . . .
O2 S2 C31 F2 178.8(5) . . . .
O2 S2 C31 F3 58.0(5) . . . .
O3 S2 O1 Ag2 138.3(3) . . . .
O3 S2 O1 Ag1 -8.4(4) . . . .
O3 S2 C31 F1 177.4(5) . . . .
O3 S2 C31 F2 57.7(5) . . . .
O3 S2 C31 F3 -63.0(5) . . . .
O5 S1 O7 Ag3 -13.0(4) . . . .
O5 S1 C32 F4 -71.5(5) . . . .
O5 S1 C32 F5 168.0(5) . . . .
O5 S1 C32 F6 46.9(5) . . . .
O6 S1 O5 Ag1 41.4(4) . . . .
O6 S1 O7 Ag3 -148.7(3) . . . .
O6 S1 C32 F4 51.0(5) . . . .
O6 S1 C32 F5 -69.5(5) . . . .
O6 S1 C32 F6 169.5(4) . . . .
O7 S1 O5 Ag1 -93.0(3) . . . .
O7 S1 C32 F4 169.8(4) . . . .
O7 S1 C32 F5 49.3(5) . . . .
O7 S1 C32 F6 -71.8(5) . . . .
O8 S3 O9 Ag3 66.2(4) . . . 3_666
O8 S3 O10 Ag4 -111.0(3) . . . .
O8 S3 C33 F7 54.3(5) . . . .
O8 S3 C33 F8 -63.7(5) . . . .
O8 S3 C33 F9 175.9(5) . . . .
O9 S3 O8 Ag3 -143.6(3) . . . .
O9 S3 O10 Ag4 24.5(5) . . . .
O9 S3 C33 F7 -65.5(5) . . . .
O9 S3 C33 F8 176.5(4) . . . .
O9 S3 C33 F9 56.0(5) . . . .
O10 S3 O8 Ag3 -7.7(4) . . . .
O10 S3 O9 Ag3 -69.3(4) . . . 3_666
O10 S3 C33 F7 174.2(5) . . . .
O10 S3 C33 F8 56.2(5) . . . .
O10 S3 C33 F9 -64.2(5) . . . .
O11 S4 O12 Ag2 13.5(4) . . . 3_666
O11 S4 C34 F10 58.0(6) . . . .
O11 S4 C34 F11 -63.4(7) . . . .
O11 S4 C34 F12 177.4(6) . . . .
O12 S4 O11 Ag4 -69.7(4) . . . .
O12 S4 C34 F10 -62.3(6) . . . .
O12 S4 C34 F11 176.3(6) . . . .
O12 S4 C34 F12 57.1(6) . . . .
O13 S4 O11 Ag4 65.0(5) . . . .
O13 S4 O12 Ag2 -122.6(3) . . . 3_666
O13 S4 C34 F10 -180.0(5) . . . .
O13 S4 C34 F11 58.6(7) . . . .
O13 S4 C34 F12 -60.5(6) . . . .
C1 C2 C3 C4 -137.3(5) . . . .
C1 C2 C3 C15 -0.7(7) . . . .
C1 C24 C25 Ag3 -139.3(4) 3_565 . . .
C1 C24 C25 C26 0.8(6) 3_565 . . .
C1 C24 C25 C30 142.6(5) 3_565 . . .
C2 C1 C17 C9 138.9(5) . . . 3_565
C2 C1 C17 C16 0.2(7) . . . .
C2 C3 C4 C5 -1.2(8) . . . .
C2 C3 C4 C13 142.4(5) . . . .
C2 C3 C15 C14 -142.4(5) . . . .
C2 C3 C15 C16 1.1(8) . . . .
C2 C26 C27 C5 0.3(7) 3_565 . . 3_565
C2 C26 C27 C28 138.5(5) 3_565 . . .
C3 C4 C5 C6 138.8(5) . . . .
C3 C4 C5 C27 0.7(8) . . . 3_565
C3 C4 C13 C12 -142.8(5) . . . .
C3 C4 C13 C14 -0.8(6) . . . .
C3 C15 C16 C17 -0.9(7) . . . .
C3 C15 C16 C18 -138.3(5) . . . .
C4 C3 C15 C14 -1.2(6) . . . .
C4 C3 C15 C16 142.3(5) . . . .
C4 C5 C6 C7 -142.9(5) . . . .
C4 C5 C6 C11 0.0(8) . . . .
C4 C13 C14 C15 0.1(6) . . . .
C4 C13 C14 C20 -142.7(5) . . . .
C5 C4 C13 C12 1.1(8) . . . .
C5 C4 C13 C14 143.1(5) . . . .
C5 C6 C7 C8 142.8(5) . . . .
C5 C6 C7 C28 0.6(6) . . . 3_565
C5 C6 C11 C10 -137.9(5) . . . .
C5 C6 C11 C12 -0.1(8) . . . .
C5 C27 C28 C7 -0.6(6) 3_565 . . 3_565
C5 C27 C28 C29 141.8(5) 3_565 . . .
C6 C7 C8 C9 0.5(7) . . . .
C6 C7 C8 C18 -137.9(5) . . . 3_565
C6 C11 C12 C13 0.8(8) . . . .
C6 C11 C12 C22 -143.4(5) . . . .
C7 C6 C11 C10 0.4(7) . . . .
C7 C6 C11 C12 138.2(5) . . . .
C7 C8 C9 Ag2 98.9(5) . . . 3_665
C7 C8 C9 C10 -0.7(7) . . . .
C7 C8 C9 C17 -142.6(5) . . . 3_565
C7 C28 C29 C19 -1.1(7) 3_565 . . .
C7 C28 C29 C30 139.9(5) 3_565 . . .
C8 C9 C10 C11 0.7(7) . . . .
C8 C9 C10 C23 -138.4(5) . . . .
C8 C18 C19 C20 -137.9(5) 3_565 . . .
C8 C18 C19 C29 -3.1(7) 3_565 . . .
C9 C10 C11 C6 -0.6(8) . . . .
C9 C10 C11 C12 -142.9(5) . . . .
C9 C10 C23 C22 143.2(5) . . . .
C9 C10 C23 C24 0.9(7) . . . .
C10 C11 C12 C13 144.0(5) . . . .
C10 C11 C12 C22 -0.2(6) . . . .
C10 C23 C24 C1 -0.1(7) . . . 3_565
C10 C23 C24 C25 138.5(5) . . . .
C11 C6 C7 C8 -0.4(7) . . . .
C11 C6 C7 C28 -142.6(5) . . . 3_565
C11 C10 C23 C22 0.2(6) . . . .
C11 C10 C23 C24 -142.1(5) . . . .
C11 C12 C13 C4 -1.2(8) . . . .
C11 C12 C13 C14 -139.0(5) . . . .
C11 C12 C22 C21 143.4(5) . . . .
C11 C12 C22 C23 0.3(6) . . . .
C12 C13 C14 C15 142.3(5) . . . .
C12 C13 C14 C20 -0.5(7) . . . .
C12 C22 C23 C10 -0.3(6) . . . .
C12 C22 C23 C24 141.8(5) . . . .
C13 C4 C5 C6 -0.4(8) . . . .
C13 C4 C5 C27 -138.5(5) . . . 3_565
C13 C12 C22 C21 -0.3(8) . . . .
C13 C12 C22 C23 -143.4(5) . . . .
C13 C14 C15 C3 0.7(6) . . . .
C13 C14 C15 C16 -143.1(5) . . . .
C13 C14 C20 C19 138.8(5) . . . .
C13 C14 C20 C21 0.1(7) . . . .
C14 C15 C16 C17 138.9(5) . . . .
C14 C15 C16 C18 1.4(7) . . . .
C14 C20 C21 C22 0.1(7) . . . .
C14 C20 C21 C30 143.4(5) . . . .
C15 C3 C4 C5 -142.4(5) . . . .
C15 C3 C4 C13 1.2(6) . . . .
C15 C14 C20 C19 1.4(7) . . . .
C15 C14 C20 C21 -137.2(5) . . . .
C15 C16 C17 C1 0.2(7) . . . .
C15 C16 C17 C9 -142.5(5) . . . 3_565
C15 C16 C18 C8 142.1(5) . . . 3_565
C15 C16 C18 C19 -2.2(8) . . . .
C16 C18 C19 C20 2.5(7) . . . .
C16 C18 C19 C29 137.3(5) . . . .
C17 C1 C2 C3 0.0(7) . . . .
C17 C1 C2 C26 -142.9(5) . . . 3_565
C17 C9 C10 C11 137.5(5) 3_565 . . .
C17 C9 C10 C23 -1.6(8) 3_565 . . .
C17 C16 C18 C8 0.3(6) . . . 3_565
C17 C16 C18 C19 -144.0(5) . . . .
C18 C8 C9 Ag2 -118.1(4) 3_565 . . 3_665
C18 C8 C9 C10 142.3(5) 3_565 . . .
C18 C8 C9 C17 0.4(5) 3_565 . . 3_565
C18 C16 C17 C1 142.1(5) . . . .
C18 C16 C17 C9 -0.6(5) . . . 3_565
C18 C19 C20 C14 -2.1(7) . . . .
C18 C19 C20 C21 140.9(5) . . . .
C18 C19 C29 C28 3.0(7) . . . .
C18 C19 C29 C30 -142.1(5) . . . .
C19 C20 C21 C22 -142.7(5) . . . .
C19 C20 C21 C30 0.6(5) . . . .
C19 C29 C30 Ag3 -124.9(4) . . . .
C19 C29 C30 C21 3.0(5) . . . .
C19 C29 C30 C25 143.6(5) . . . .
C20 C14 C15 C3 142.6(5) . . . .
C20 C14 C15 C16 -1.1(8) . . . .
C20 C19 C29 C28 142.4(5) . . . .
C20 C19 C29 C30 -2.6(5) . . . .
C20 C21 C22 C12 0.0(8) . . . .
C20 C21 C22 C23 139.1(5) . . . .
C20 C21 C30 Ag3 125.8(4) . . . .
C20 C21 C30 C25 -142.5(5) . . . .
C20 C21 C30 C29 -2.2(5) . . . .
C21 C22 C23 C10 -143.4(5) . . . .
C21 C22 C23 C24 -1.3(8) . . . .
C22 C12 C13 C4 138.4(5) . . . .
C22 C12 C13 C14 0.6(8) . . . .
C22 C21 C30 Ag3 -90.7(5) . . . .
C22 C21 C30 C25 1.0(7) . . . .
C22 C21 C30 C29 141.3(5) . . . .
C22 C23 C24 C1 -137.2(5) . . . 3_565
C22 C23 C24 C25 1.5(7) . . . .
C23 C10 C11 C6 142.3(5) . . . .
C23 C10 C11 C12 0.0(6) . . . .
C23 C24 C25 Ag3 77.6(5) . . . .
C23 C24 C25 C26 -142.2(5) . . . .
C23 C24 C25 C30 -0.4(7) . . . .
C24 C1 C2 C3 142.7(5) 3_565 . . .
C24 C1 C2 C26 -0.2(6) 3_565 . . 3_565
C24 C1 C17 C9 0.9(7) 3_565 . . 3_565
C24 C1 C17 C16 -137.8(5) 3_565 . . .
C24 C25 C26 C2 -0.7(6) . . . 3_565
C24 C25 C26 C27 142.0(5) . . . .
C24 C25 C30 Ag3 111.3(4) . . . .
C24 C25 C30 C21 -0.9(7) . . . .
C24 C25 C30 C29 -136.5(5) . . . .
C25 C26 C27 C5 -138.5(5) . . . 3_565
C25 C26 C27 C28 -0.3(7) . . . .
C26 C2 C3 C4 0.9(8) 3_565 . . .
C26 C2 C3 C15 137.5(5) 3_565 . . .
C26 C25 C30 Ag3 -111.6(4) . . . .
C26 C25 C30 C21 136.2(5) . . . .
C26 C25 C30 C29 0.6(7) . . . .
C26 C27 C28 C7 -143.0(5) . . . 3_565
C26 C27 C28 C29 -0.7(7) . . . .
C27 C5 C6 C7 -0.3(6) 3_565 . . .
C27 C5 C6 C11 142.6(5) 3_565 . . .
C27 C28 C29 C19 -139.3(5) . . . .
C27 C28 C29 C30 1.7(7) . . . .
C28 C7 C8 C9 138.1(5) 3_565 . . .
C28 C7 C8 C18 -0.4(7) 3_565 . . 3_565
C28 C29 C30 Ag3 89.9(5) . . . .
C28 C29 C30 C21 -142.2(5) . . . .
C28 C29 C30 C25 -1.6(7) . . . .
C29 C19 C20 C14 -141.8(5) . . . .
C29 C19 C20 C21 1.3(5) . . . .
C30 C21 C22 C12 -139.2(5) . . . .
C30 C21 C22 C23 0.0(7) . . . .
C30 C25 C26 C2 -142.3(5) . . . 3_565
C30 C25 C26 C27 0.3(7) . . . .
C31 S2 O1 Ag2 -109.3(3) . . . .
C31 S2 O1 Ag1 104.0(3) . . . .
C32 S1 O5 Ag1 155.8(3) . . . .
C32 S1 O7 Ag3 99.1(3) . . . .
C33 S3 O8 Ag3 104.3(4) . . . .
C33 S3 O9 Ag3 179.0(3) . . . 3_666
C33 S3 O10 Ag4 136.3(3) . . . .
C34 S4 O11 Ag4 179.4(4) . . . .
C34 S4 O12 Ag2 125.9(4) . . . 3_666
P1A C1A C2A O1A 2.1(9) . . . .
P1A C1A C2A C3A -179.2(5) . . . .
P1A C1A C6A O2A -2.5(9) . . . .
P1A C1A C6A C5A -179.7(6) . . . .
P1A C7A C8A O2A 4.6(8) . . . .
P1A C7A C8A C9A -176.8(5) . . . .
P1A C7A C12A O3A -5.1(7) . . . .
P1A C7A C12A C11A 178.4(4) . . . .
P1A C13A C14A O1A -3.8(8) . . . .
P1A C13A C14A C15A 178.8(5) . . . .
P1A C13A C18A O3A 4.1(7) . . . .
P1A C13A C18A C17A -178.7(5) . . . .
O1A C2A C3A C4A 174.3(8) . . . .
O1A C14A C15A C16A -173.7(6) . . . .
O2A C8A C9A C10A 174.1(6) . . . .
N1 P1A C1A C2A 99.7(7) . . . .
N1 P1A C1A C6A -90.9(7) . . . .
N1 P1A C7A C8A 94.7(7) . . . .
N1 P1A C7A C12A -93.2(6) . . . .
N1 P1A C13A C14A -99.8(6) . . . .
N1 P1A C13A C18A 89.5(6) . . . .
C1A P1A N1 P1A -32.6(15) . . . 4_565
C1A P1A C7A C8A -34.7(5) . . . .
C1A P1A C7A C12A 137.4(5) . . . .
C1A P1A C13A C14A 34.5(5) . . . .
C1A P1A C13A C18A -136.2(5) . . . .
C1A C2A C3A C4A -4.3(11) . . . .
C2A O1A C14A C13A -38.1(9) . . . .
C2A O1A C14A C15A 139.3(7) . . . .
C2A C1A C6A O2A 166.4(6) . . . .
C2A C1A C6A C5A -10.8(11) . . . .
C2A C3A C4A C5A -4.0(14) . . . .
C3A C4A C5A C6A 5.2(14) . . . .
C4A C5A C6A O2A -175.2(7) . . . .
C4A C5A C6A C1A 2.1(12) . . . .
C6A O2A C8A C7A 36.0(9) . . . .
C6A O2A C8A C9A -142.5(6) . . . .
C6A C1A C2A O1A -167.0(6) . . . .
C6A C1A C2A C3A 11.7(10) . . . .
C7A P1A N1 P1A -150.1(11) . . . 4_565
C7A P1A C1A C2A -136.0(5) . . . .
C7A P1A C1A C6A 33.5(6) . . . .
C7A P1A C13A C14A 136.1(5) . . . .
C7A P1A C13A C18A -34.6(5) . . . .
C7A C8A C9A C10A -4.5(9) . . . .
C8A O2A C6A C1A -37.2(9) . . . .
C8A O2A C6A C5A 140.1(7) . . . .
C8A C7A C12A O3A 167.0(5) . . . .
C8A C7A C12A C11A -9.5(9) . . . .
C8A C9A C10A C11A -4.0(10) . . . .
C9A C10A C11A C12A 5.6(10) . . . .
C10A C11A C12A O3A -175.5(5) . . . .
C10A C11A C12A C7A 1.1(9) . . . .
C12A O3A C18A C13A 35.4(8) . . . .
C12A O3A C18A C17A -141.7(6) . . . .
C12A C7A C8A O2A -167.3(5) . . . .
C12A C7A C8A C9A 11.2(9) . . . .
C13A P1A N1 P1A 92.4(13) . . . 4_565
C13A P1A C1A C2A -33.6(6) . . . .
C13A P1A C1A C6A 135.8(5) . . . .
C13A P1A C7A C8A -137.3(5) . . . .
C13A P1A C7A C12A 34.8(5) . . . .
C13A C14A C15A C16A 3.7(10) . . . .
C14A O1A C2A C1A 38.7(9) . . . .
C14A O1A C2A C3A -139.9(7) . . . .
C14A C13A C18A O3A -166.5(5) . . . .
C14A C13A C18A C17A 10.7(9) . . . .
C14A C15A C16A C17A 3.1(11) . . . .
C15A C16A C17A C18A -3.0(11) . . . .
C16A C17A C18A O3A 173.2(6) . . . .
C16A C17A C18A C13A -3.9(9) . . . .
C18A O3A C12A C7A -35.1(8) . . . .
C18A O3A C12A C11A 141.4(6) . . . .
C18A C13A C14A O1A 166.8(5) . . . .
C18A C13A C14A C15A -10.6(9) . . . .

_cod_database_fobs_code 4517399
