#------------------------------------------------------------------------------
#$Date: 2016-02-20 18:35:30 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176787 $
#$URL: svn://www.crystallography.net/cod/cif/2/21/74/2217438.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_2217438
loop_
_publ_author_name
'Zhen Ma'
'Jianhua Sun'
'Baoqing Liu'
'Miao Hu'
'Yanpeng Xing'
_publ_section_title
;Bis[μ-bis(diphenylphosphino)methane-κ²P:P']bis[(4-toluenesulfonato-κO)silver(I)]
 monohydrate
;
_journal_coeditor_code           CF2162
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m269
_journal_page_last               m269
_journal_paper_doi               10.1107/S1600536807067311
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac          '[Ag2 (C7 H7 O3 S)2 (C25 H22 P2)2], H2 O'
_chemical_formula_moiety         'C64 H58 Ag2 O6 P4 S2, H2 O'
_chemical_formula_sum            'C64 H60 Ag2 O7 P4 S2'
_chemical_formula_weight         1344.86
_chemical_name_systematic
;
Bis[μ-bis(diphenylphosphino)methane-κ²P:P']bis[(4-toluenesulfonato-\
\kO)silver(I)] monohydrate
;
_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                103.86(3)
_cell_angle_beta                 93.79(3)
_cell_angle_gamma                91.95(3)
_cell_formula_units_Z            2
_cell_length_a                   11.239(2)
_cell_length_b                   11.802(2)
_cell_length_c                   23.363(5)
_cell_measurement_reflns_used    27870
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      0.90
_cell_volume                     2998.1(11)
_computing_cell_refinement       'CrystalClear (Rigaku, 2000)'
_computing_data_collection       'CrystalClear (Rigaku, 2000)'
_computing_data_reduction        'CrystalClear (Rigaku, 2000)'
_computing_molecular_graphics    'SHELXTL/PC (Sheldrick, 1993)'
_computing_publication_material  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.974
_diffrn_measured_fraction_theta_max 0.974
_diffrn_measurement_device_type  'Rigaku Weissenberg IP'
_diffrn_measurement_method       ω
_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  0.0290
_diffrn_reflns_av_sigmaI/netI    0.0220
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            27870
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         0.90
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.882
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   none
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.490
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             1372
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.31
_exptl_crystal_size_min          0.28
_refine_diff_density_max         0.708
_refine_diff_density_min         -1.858
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     721
_refine_ls_number_reflns         13424
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.0530
_refine_ls_R_factor_gt           0.0415
_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)+(0.0589P)²+6.0201P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1183
_refine_ls_wR_factor_ref         0.1309
_reflns_number_gt                11383
_reflns_number_total             13424
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            cf2162.cif
_cod_data_source_block           I
_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 1527 2010-12-29 10:47:43Z saulius 

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_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        2998.1(10)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               2217438
_cod_database_fobs_code          2217438
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
Ag Ag1 0.11622(2) 0.48402(2) 0.475474(11) 0.03703(8) Uani d . 1
Ag Ag2 0.52075(3) -0.12811(4) -0.005498(15) 0.05974(11) Uani d . 1
S S1 0.17891(10) 0.82300(8) 0.53039(5) 0.0482(2) Uani d . 1
S S2 0.32006(9) -0.14579(10) 0.12284(4) 0.0468(2) Uani d . 1
P P1 0.20944(7) 0.48870(7) 0.57271(4) 0.02923(16) Uani d . 1
P P2 0.02266(7) 0.42514(8) 0.37653(4) 0.03273(18) Uani d . 1
P P3 0.33812(8) -0.17322(7) -0.06908(4) 0.03266(17) Uani d . 1
P P4 0.72861(7) -0.07571(7) 0.02262(4) 0.03080(17) Uani d . 1
O O1 0.2033(3) -0.1768(3) 0.09323(16) 0.0647(9) Uani d . 1
O O2 0.3227(4) -0.0401(3) 0.16896(17) 0.0817(11) Uani d . 1
O O3 0.4092(3) -0.1455(4) 0.08136(16) 0.0742(11) Uani d . 1
O O4 0.2356(3) 0.8514(3) 0.58977(13) 0.0560(7) Uani d . 1
O O5 0.0663(3) 0.8772(3) 0.52626(17) 0.0671(9) Uani d . 1
O O6 0.1714(4) 0.6974(3) 0.50571(16) 0.0792(12) Uani d . 1
O O7 0.5206(6) -0.4429(5) -0.0011(4) 0.088(2) Uani d P 0.60
O O7' 0.5506(10) -0.3613(10) -0.0078(6) 0.089(3) Uani d P 0.40
C C2 0.3684(3) 0.5306(3) 0.58370(14) 0.0331(7) Uani d . 1
C C6 0.7859(3) -0.1123(3) 0.08989(15) 0.0333(7) Uani d . 1
C C7 0.0743(3) 0.2859(3) 0.33560(15) 0.0378(7) Uani d . 1
C C8 0.3349(3) -0.1564(3) -0.14428(15) 0.0376(7) Uani d . 1
C C9 0.2753(3) -0.3222(3) -0.07880(17) 0.0393(7) Uani d . 1
C C12 0.0512(3) 0.5273(3) 0.33133(16) 0.0383(7) Uani d . 1
C C13 0.8185(3) -0.1551(3) -0.03427(15) 0.0357(7) Uani d . 1
C C14 0.1999(3) 0.3577(3) 0.60008(16) 0.0367(7) Uani d . 1
C C15 0.2273(4) -0.1704(4) -0.17894(17) 0.0478(9) Uani d . 1
H H15A 0.1569 -0.1888 -0.1636 0.057 Uiso calc R 1
C C17 0.8550(4) -0.1080(4) -0.07943(17) 0.0467(9) Uani d . 1
H H17A 0.8406 -0.0307 -0.0791 0.056 Uiso calc R 1
C C19 0.7052(3) -0.1347(3) 0.12909(16) 0.0400(8) Uani d . 1
H H19A 0.6235 -0.1371 0.1193 0.048 Uiso calc R 1
C C20 0.7485(4) -0.1536(4) 0.18303(18) 0.0496(9) Uani d . 1
H H20A 0.6952 -0.1674 0.2097 0.060 Uiso calc R 1
C C21 0.3563(4) -0.2598(4) 0.15795(17) 0.0463(9) Uani d . 1
C C22 0.2751(4) 0.8784(3) 0.48523(18) 0.0473(9) Uani d . 1
C C23 0.4493(3) 0.4454(4) 0.5664(2) 0.0512(10) Uani d . 1
H H23A 0.4219 0.3681 0.5512 0.061 Uiso calc R 1
C C24 0.1552(4) 0.2805(4) 0.29251(19) 0.0538(10) Uani d . 1
H H24A 0.1796 0.3479 0.2816 0.065 Uiso calc R 1
C C26 0.9490(4) -0.1326(4) 0.15803(19) 0.0517(10) Uani d . 1
H H26A 1.0306 -0.1331 0.1676 0.062 Uiso calc R 1
C C27 0.9081(3) -0.1125(3) 0.10436(17) 0.0417(8) Uani d . 1
H H27A 0.9622 -0.0992 0.0779 0.050 Uiso calc R 1
C C29 0.8692(4) -0.1519(4) 0.19723(18) 0.0534(10) Uani d . 1
H H29A 0.8971 -0.1639 0.2336 0.064 Uiso calc R 1
C C30 0.4389(4) -0.1289(4) -0.16758(18) 0.0478(9) Uani d . 1
H H30A 0.5112 -0.1184 -0.1447 0.057 Uiso calc R 1
C C31 0.2081(4) -0.3538(4) -0.0374(2) 0.0537(10) Uani d . 1
H H31A 0.1895 -0.2975 -0.0044 0.064 Uiso calc R 1
C C32 0.0403(4) 0.1840(4) 0.3511(2) 0.0542(10) Uani d . 1
H H32A -0.0120 0.1870 0.3806 0.065 Uiso calc R 1
C C33 0.0006(4) 0.5106(4) 0.27401(18) 0.0517(10) Uani d . 1
H H33A -0.0534 0.4476 0.2583 0.062 Uiso calc R 1
C C38 0.4246(4) 0.9528(4) 0.4089(2) 0.0553(10) Uani d . 1
C C39 0.1301(4) 0.6226(4) 0.3540(2) 0.0530(10) Uani d . 1
H H39A 0.1643 0.6357 0.3925 0.064 Uiso calc R 1
C C40 0.8402(4) -0.2709(4) -0.0359(2) 0.0565(11) Uani d . 1
H H40A 0.8163 -0.3039 -0.0059 0.068 Uiso calc R 1
C C41 0.1347(4) 0.2598(3) 0.5671(2) 0.0506(9) Uani d . 1
H H41A 0.0956 0.2610 0.5309 0.061 Uiso calc R 1
C C42 0.9330(5) -0.2888(4) -0.1265(2) 0.0646(13) Uani d . 1
H H42A 0.9712 -0.3339 -0.1576 0.078 Uiso calc R 1
C C43 0.3292(6) -0.3750(5) 0.1302(2) 0.0782(16) Uani d . 1
H H43A 0.2921 -0.3946 0.0921 0.094 Uiso calc R 1
C C45 0.4113(3) 0.6444(4) 0.6055(2) 0.0571(12) Uani d . 1
H H45A 0.3586 0.7035 0.6163 0.069 Uiso calc R 1
C C46 0.2370(4) 0.9589(5) 0.4548(2) 0.0614(12) Uani d . 1
H H46A 0.1614 0.9881 0.4592 0.074 Uiso calc R 1
C C48 0.0302(5) 0.5871(5) 0.2401(2) 0.0638(12) Uani d . 1
H H48A -0.0040 0.5750 0.2016 0.077 Uiso calc R 1
C C49 0.3296(5) -0.1306(4) -0.25938(19) 0.0649(13) Uani d . 1
H H49A 0.3280 -0.1222 -0.2980 0.078 Uiso calc R 1
C C50 0.9128(4) -0.1759(4) -0.12514(19) 0.0577(11) Uani d . 1
H H50A 0.9380 -0.1435 -0.1551 0.069 Uiso calc R 1
C C51 0.2566(4) 0.3543(4) 0.6541(2) 0.0566(11) Uani d . 1
H H51A 0.2993 0.4203 0.6772 0.068 Uiso calc R 1
C C53 0.4351(5) -0.1169(5) -0.2258(2) 0.0630(12) Uani d . 1
H H53A 0.5052 -0.0994 -0.2416 0.076 Uiso calc R 1
C C54 0.8970(5) -0.3371(4) -0.0820(3) 0.0697(14) Uani d . 1
H H54A 0.9111 -0.4147 -0.0830 0.084 Uiso calc R 1
C C55 0.2253(5) -0.1568(4) -0.23639(19) 0.0595(11) Uani d . 1
H H55A 0.1533 -0.1655 -0.2594 0.071 Uiso calc R 1
C C56 0.1858(5) 0.1565(4) 0.6406(3) 0.0690(14) Uani d . 1
H H56A 0.1819 0.0885 0.6539 0.083 Uiso calc R 1
C C57 0.1992(5) 0.1740(5) 0.2660(2) 0.0671(14) Uani d . 1
H H57A 0.2545 0.1707 0.2379 0.081 Uiso calc R 1
C C58 0.6119(4) 0.5862(5) 0.5946(2) 0.0620(12) Uani d . 1
H H58A 0.6935 0.6051 0.5992 0.074 Uiso calc R 1
C C59 0.5332(4) 0.6708(4) 0.6112(3) 0.0713(15) Uani d . 1
H H59A 0.5618 0.7477 0.6266 0.086 Uiso calc R 1
C C60 0.1949(6) -0.5531(4) -0.0928(3) 0.0740(15) Uani d . 1
H H60A 0.1672 -0.6303 -0.0979 0.089 Uiso calc R 1
C C61 0.2631(7) -0.5224(4) -0.1333(3) 0.092(2) Uani d . 1
H H61A 0.2832 -0.5794 -0.1657 0.110 Uiso calc R 1
C C62 0.1624(5) 0.0729(5) 0.2808(2) 0.0672(14) Uani d . 1
H H62A 0.1913 0.0016 0.2621 0.081 Uiso calc R 1
C C64 0.3126(5) 0.9959(5) 0.4174(2) 0.0660(13) Uani d . 1
H H64A 0.2872 1.0514 0.3975 0.079 Uiso calc R 1
C C66 0.3889(5) 0.8387(4) 0.4794(2) 0.0590(11) Uani d . 1
H H66A 0.4163 0.7873 0.5014 0.071 Uiso calc R 1
C C67 0.5707(4) 0.4744(5) 0.5714(2) 0.0624(12) Uani d . 1
H H67A 0.6242 0.4168 0.5589 0.075 Uiso calc R 1
C C68 0.1278(5) 0.1597(4) 0.5881(3) 0.0678(13) Uani d . 1
H H68A 0.0830 0.0941 0.5661 0.081 Uiso calc R 1
C C70 0.1094(5) 0.6806(5) 0.2626(3) 0.0705(14) Uani d . 1
H H70A 0.1296 0.7313 0.2394 0.085 Uiso calc R 1
C C73 0.1676(5) -0.4697(4) -0.0447(3) 0.0663(13) Uani d . 1
H H73A 0.1219 -0.4903 -0.0167 0.080 Uiso calc R 1
C C78 0.4108(5) -0.2348(5) 0.2141(2) 0.0680(13) Uani d . 1
H H78A 0.4303 -0.1574 0.2337 0.082 Uiso calc R 1
C C81 0.4107(5) -0.4374(5) 0.2148(3) 0.0704(14) Uani d . 1
C C83 0.0827(5) 0.0782(4) 0.3233(3) 0.0674(13) Uani d . 1
H H83A 0.0573 0.0102 0.3335 0.081 Uiso calc R 1
C C84 0.1582(5) 0.6988(5) 0.3191(3) 0.0723(14) Uani d . 1
H H84A 0.2110 0.7628 0.3346 0.087 Uiso calc R 1
C C85 0.4626(5) 0.8747(4) 0.4412(2) 0.0632(12) Uani d . 1
H H85A 0.5385 0.8461 0.4372 0.076 Uiso calc R 1
C C87 0.3025(6) -0.4082(4) -0.1268(2) 0.0752(16) Uani d . 1
H H87A 0.3481 -0.3887 -0.1551 0.090 Uiso calc R 1
C C88 0.2498(5) 0.2531(5) 0.6737(3) 0.0716(14) Uani d . 1
H H88A 0.2891 0.2506 0.7096 0.086 Uiso calc R 1
C C90 0.4370(6) -0.3222(6) 0.2419(3) 0.0800(17) Uani d . 1
H H90A 0.4736 -0.3025 0.2801 0.096 Uiso calc R 1
C C96 0.1402(3) 0.5998(3) 0.62743(14) 0.0318(6) Uani d . 1
H H96A 0.1589 0.6763 0.6209 0.038 Uiso calc R 1
H H96B 0.1735 0.5990 0.6667 0.038 Uiso calc R 1
C C97 0.7757(3) 0.0787(3) 0.03314(15) 0.0337(7) Uani d . 1
H H97A 0.7883 0.0948 -0.0049 0.040 Uiso calc R 1
H H97B 0.8507 0.0954 0.0573 0.040 Uiso calc R 1
C C98 0.5038(5) 0.9900(5) 0.3662(2) 0.0739(15) Uani d . 1
H H98A 0.5768 0.9500 0.3656 0.111 Uiso calc R 1
H H98B 0.5214 1.0728 0.3786 0.111 Uiso calc R 1
H H98C 0.4636 0.9709 0.3273 0.111 Uiso calc R 1
C C99 0.4362(7) -0.5352(7) 0.2452(4) 0.107(2) Uani d . 1
H H99A 0.4112 -0.6090 0.2187 0.161 Uiso calc R 1
H H99B 0.3933 -0.5244 0.2801 0.161 Uiso calc R 1
H H99C 0.5203 -0.5340 0.2559 0.161 Uiso calc R 1
C C101 0.3570(7) -0.4622(5) 0.1587(3) 0.0879(19) Uani d . 1
H H10A 0.3385 -0.5398 0.1391 0.105 Uiso calc R 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'
O O 0.0106 0.0060 '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
_geom_angle_publ_flag
P2 Ag1 P1 . . 164.99(3) yes
P2 Ag1 O6 . . 112.29(10) yes
P1 Ag1 O6 . . 82.57(10) yes
P2 Ag1 Ag1 . 2_566 91.08(3) ?
P1 Ag1 Ag1 . 2_566 90.23(3) ?
O6 Ag1 Ag1 . 2_566 92.55(11) ?
P4 Ag2 P3 . . 158.11(3) yes
P4 Ag2 O3 . . 111.55(9) yes
P3 Ag2 O3 . . 90.29(9) yes
P4 Ag2 Ag2 . 2_655 88.54(4) ?
P3 Ag2 Ag2 . 2_655 87.92(4) ?
O3 Ag2 Ag2 . 2_655 95.78(10) ?
O5 S1 O4 . . 112.8(2) ?
O5 S1 O6 . . 113.6(2) ?
O4 S1 O6 . . 110.8(2) ?
O5 S1 C22 . . 107.0(2) ?
O4 S1 C22 . . 107.45(19) ?
O6 S1 C22 . . 104.5(2) ?
O1 S2 O2 . . 112.5(2) ?
O1 S2 O3 . . 111.5(2) ?
O2 S2 O3 . . 113.8(3) ?
O1 S2 C21 . . 106.5(2) ?
O2 S2 C21 . . 106.5(2) ?
O3 S2 C21 . . 105.5(2) ?
C14 P1 C2 . . 103.14(16) ?
C14 P1 C96 . . 104.78(16) ?
C2 P1 C96 . . 104.75(15) ?
C14 P1 Ag1 . . 118.76(12) ?
C2 P1 Ag1 . . 115.51(11) ?
C96 P1 Ag1 . . 108.56(11) ?
C12 P2 C7 . . 105.20(17) ?
C12 P2 C96 . 2_566 106.36(16) ?
C7 P2 C96 . 2_566 103.85(16) ?
C12 P2 Ag1 . . 114.08(12) ?
C7 P2 Ag1 . . 112.04(12) ?
C96 P2 Ag1 2_566 . 114.38(11) ?
C8 P3 C9 . . 102.78(17) ?
C8 P3 C97 . 2_655 105.92(16) ?
C9 P3 C97 . 2_655 104.90(16) ?
C8 P3 Ag2 . . 120.08(13) ?
C9 P3 Ag2 . . 114.48(12) ?
C97 P3 Ag2 2_655 . 107.44(11) ?
C6 P4 C13 . . 104.61(16) ?
C6 P4 C97 . . 104.25(16) ?
C13 P4 C97 . . 105.29(16) ?
C6 P4 Ag2 . . 115.22(11) ?
C13 P4 Ag2 . . 109.60(11) ?
C97 P4 Ag2 . . 116.76(12) ?
S2 O3 Ag2 . . 165.2(2) ?
S1 O6 Ag1 . . 167.0(3) ?
O7' O7 O7 . 2_645 173.8(14) ?
C45 C2 C23 . . 118.5(3) ?
C45 C2 P1 . . 122.7(3) ?
C23 C2 P1 . . 118.7(3) ?
C19 C6 C27 . . 119.8(3) ?
C19 C6 P4 . . 118.7(3) ?
C27 C6 P4 . . 121.4(3) ?
C32 C7 C24 . . 118.8(4) ?
C32 C7 P2 . . 119.4(3) ?
C24 C7 P2 . . 121.6(3) ?
C30 C8 C15 . . 119.4(4) ?
C30 C8 P3 . . 120.4(3) ?
C15 C8 P3 . . 120.2(3) ?
C31 C9 C87 . . 118.2(4) ?
C31 C9 P3 . . 122.1(3) ?
C87 C9 P3 . . 119.6(3) ?
C39 C12 C33 . . 118.8(4) ?
C39 C12 P2 . . 118.9(3) ?
C33 C12 P2 . . 122.3(3) ?
C17 C13 C40 . . 118.9(4) ?
C17 C13 P4 . . 122.0(3) ?
C40 C13 P4 . . 118.7(3) ?
C41 C14 C51 . . 119.3(4) ?
C41 C14 P1 . . 119.9(3) ?
C51 C14 P1 . . 120.8(3) ?
C55 C15 C8 . . 119.9(4) ?
C55 C15 H15A . . 120.0 ?
C8 C15 H15A . . 120.0 ?
C13 C17 C50 . . 120.0(4) ?
C13 C17 H17A . . 120.0 ?
C50 C17 H17A . . 120.0 ?
C20 C19 C6 . . 119.2(4) ?
C20 C19 H19A . . 120.4 ?
C6 C19 H19A . . 120.4 ?
C29 C20 C19 . . 120.6(4) ?
C29 C20 H20A . . 119.7 ?
C19 C20 H20A . . 119.7 ?
C78 C21 C43 . . 117.9(5) ?
C78 C21 S2 . . 120.8(4) ?
C43 C21 S2 . . 121.3(4) ?
C46 C22 C66 . . 119.5(4) ?
C46 C22 S1 . . 120.9(4) ?
C66 C22 S1 . . 119.6(3) ?
C2 C23 C67 . . 120.6(4) ?
C2 C23 H23A . . 119.7 ?
C67 C23 H23A . . 119.7 ?
C57 C24 C7 . . 119.5(5) ?
C57 C24 H24A . . 120.2 ?
C7 C24 H24A . . 120.2 ?
C29 C26 C27 . . 120.1(4) ?
C29 C26 H26A . . 119.9 ?
C27 C26 H26A . . 119.9 ?
C26 C27 C6 . . 120.0(4) ?
C26 C27 H27A . . 120.0 ?
C6 C27 H27A . . 120.0 ?
C20 C29 C26 . . 120.4(4) ?
C20 C29 H29A . . 119.8 ?
C26 C29 H29A . . 119.8 ?
C8 C30 C53 . . 119.7(4) ?
C8 C30 H30A . . 120.2 ?
C53 C30 H30A . . 120.2 ?
C9 C31 C73 . . 120.4(4) ?
C9 C31 H31A . . 119.8 ?
C73 C31 H31A . . 119.8 ?
C83 C32 C7 . . 121.0(4) ?
C83 C32 H32A . . 119.5 ?
C7 C32 H32A . . 119.5 ?
C48 C33 C12 . . 120.3(4) ?
C48 C33 H33A . . 119.9 ?
C12 C33 H33A . . 119.9 ?
C64 C38 C85 . . 117.9(4) ?
C64 C38 C98 . . 121.3(5) ?
C85 C38 C98 . . 120.8(5) ?
C12 C39 C84 . . 119.9(4) ?
C12 C39 H39A . . 120.0 ?
C84 C39 H39A . . 120.0 ?
C54 C40 C13 . . 120.1(4) ?
C54 C40 H40A . . 119.9 ?
C13 C40 H40A . . 119.9 ?
C14 C41 C68 . . 119.7(4) ?
C14 C41 H41A . . 120.1 ?
C68 C41 H41A . . 120.1 ?
C50 C42 C54 . . 120.0(4) ?
C50 C42 H42A . . 120.0 ?
C54 C42 H42A . . 120.0 ?
C21 C43 C101 . . 120.3(5) ?
C21 C43 H43A . . 119.8 ?
C101 C43 H43A . . 119.8 ?
C2 C45 C59 . . 119.8(4) ?
C2 C45 H45A . . 120.1 ?
C59 C45 H45A . . 120.1 ?
C22 C46 C64 . . 119.3(5) ?
C22 C46 H46A . . 120.3 ?
C64 C46 H46A . . 120.3 ?
C70 C48 C33 . . 120.7(5) ?
C70 C48 H48A . . 119.7 ?
C33 C48 H48A . . 119.7 ?
C53 C49 C55 . . 120.2(4) ?
C53 C49 H49A . . 119.9 ?
C55 C49 H49A . . 119.9 ?
C42 C50 C17 . . 120.7(4) ?
C42 C50 H50A . . 119.7 ?
C17 C50 H50A . . 119.7 ?
C88 C51 C14 . . 119.9(4) ?
C88 C51 H51A . . 120.1 ?
C14 C51 H51A . . 120.1 ?
C49 C53 C30 . . 120.6(5) ?
C49 C53 H53A . . 119.7 ?
C30 C53 H53A . . 119.7 ?
C42 C54 C40 . . 120.3(5) ?
C42 C54 H54A . . 119.8 ?
C40 C54 H54A . . 119.8 ?
C49 C55 C15 . . 120.2(4) ?
C49 C55 H55A . . 119.9 ?
C15 C55 H55A . . 119.9 ?
C68 C56 C88 . . 120.1(4) ?
C68 C56 H56A . . 119.9 ?
C88 C56 H56A . . 119.9 ?
C62 C57 C24 . . 121.1(5) ?
C62 C57 H57A . . 119.5 ?
C24 C57 H57A . . 119.5 ?
C67 C58 C59 . . 119.6(4) ?
C67 C58 H58A . . 120.2 ?
C59 C58 H58A . . 120.2 ?
C58 C59 C45 . . 121.1(4) ?
C58 C59 H59A . . 119.4 ?
C45 C59 H59A . . 119.4 ?
C61 C60 C73 . . 119.4(4) ?
C61 C60 H60A . . 120.3 ?
C73 C60 H60A . . 120.3 ?
C60 C61 C87 . . 120.7(5) ?
C60 C61 H61A . . 119.6 ?
C87 C61 H61A . . 119.6 ?
C83 C62 C57 . . 119.4(5) ?
C83 C62 H62A . . 120.3 ?
C57 C62 H62A . . 120.3 ?
C38 C64 C46 . . 121.9(4) ?
C38 C64 H64A . . 119.1 ?
C46 C64 H64A . . 119.1 ?
C22 C66 C85 . . 120.5(4) ?
C22 C66 H66A . . 119.7 ?
C85 C66 H66A . . 119.7 ?
C58 C67 C23 . . 120.3(4) ?
C58 C67 H67A . . 119.9 ?
C23 C67 H67A . . 119.9 ?
C56 C68 C41 . . 120.6(5) ?
C56 C68 H68A . . 119.7 ?
C41 C68 H68A . . 119.7 ?
C84 C70 C48 . . 119.5(5) ?
C84 C70 H70A . . 120.2 ?
C48 C70 H70A . . 120.2 ?
C60 C73 C31 . . 120.3(5) ?
C60 C73 H73A . . 119.8 ?
C31 C73 H73A . . 119.8 ?
C21 C78 C90 . . 121.2(5) ?
C21 C78 H78A . . 119.4 ?
C90 C78 H78A . . 119.4 ?
C101 C81 C90 . . 117.2(5) ?
C101 C81 C99 . . 120.2(6) ?
C90 C81 C99 . . 122.6(6) ?
C62 C83 C32 . . 120.1(5) ?
C62 C83 H83A . . 119.9 ?
C32 C83 H83A . . 119.9 ?
C70 C84 C39 . . 120.8(5) ?
C70 C84 H84A . . 119.6 ?
C39 C84 H84A . . 119.6 ?
C38 C85 C66 . . 120.8(5) ?
C38 C85 H85A . . 119.6 ?
C66 C85 H85A . . 119.6 ?
C61 C87 C9 . . 120.9(5) ?
C61 C87 H87A . . 119.5 ?
C9 C87 H87A . . 119.5 ?
C56 C88 C51 . . 120.4(5) ?
C56 C88 H88A . . 119.8 ?
C51 C88 H88A . . 119.8 ?
C81 C90 C78 . . 121.6(5) ?
C81 C90 H90A . . 119.2 ?
C78 C90 H90A . . 119.2 ?
P1 C96 P2 . 2_566 112.06(17) ?
P1 C96 H96A . . 109.2 ?
P2 C96 H96A 2_566 . 109.2 ?
P1 C96 H96B . . 109.2 ?
P2 C96 H96B 2_566 . 109.2 ?
H96A C96 H96B . . 107.9 ?
P4 C97 P3 . 2_655 110.50(18) ?
P4 C97 H97A . . 109.6 ?
P3 C97 H97A 2_655 . 109.6 ?
P4 C97 H97B . . 109.6 ?
P3 C97 H97B 2_655 . 109.6 ?
H97A C97 H97B . . 108.1 ?
C38 C98 H98A . . 109.5 ?
C38 C98 H98B . . 109.5 ?
H98A C98 H98B . . 109.5 ?
C38 C98 H98C . . 109.5 ?
H98A C98 H98C . . 109.5 ?
H98B C98 H98C . . 109.5 ?
C81 C99 H99A . . 109.5 ?
C81 C99 H99B . . 109.5 ?
H99A C99 H99B . . 109.5 ?
C81 C99 H99C . . 109.5 ?
H99A C99 H99C . . 109.5 ?
H99B C99 H99C . . 109.5 ?
C81 C101 C43 . . 121.9(6) ?
C81 C101 H10A . . 119.1 ?
C43 C101 H10A . . 119.1 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 P2 . 2.4067(11) yes
Ag1 P1 . 2.4255(11) yes
Ag1 O6 . 2.491(3) yes
Ag1 Ag1 2_566 2.9215(9) ?
Ag2 P4 . 2.4033(11) yes
Ag2 P3 . 2.4181(12) yes
Ag2 O3 . 2.500(3) yes
Ag2 Ag2 2_655 3.0278(11) ?
S1 O5 . 1.445(4) ?
S1 O4 . 1.446(3) ?
S1 O6 . 1.454(3) ?
S1 C22 . 1.773(4) ?
S2 O1 . 1.436(3) ?
S2 O2 . 1.438(4) ?
S2 O3 . 1.439(3) ?
S2 C21 . 1.781(4) ?
P1 C14 . 1.812(4) ?
P1 C2 . 1.823(3) ?
P1 C96 . 1.832(3) ?
P2 C12 . 1.817(4) ?
P2 C7 . 1.827(4) ?
P2 C96 2_566 1.837(3) ?
P3 C8 . 1.813(4) ?
P3 C9 . 1.828(4) ?
P3 C97 2_655 1.837(3) ?
P4 C6 . 1.811(3) ?
P4 C13 . 1.820(4) ?
P4 C97 . 1.835(3) ?
O7 O7' . 1.060(12) ?
O7 O7 2_645 1.423(12) ?
C2 C45 . 1.375(5) ?
C2 C23 . 1.384(5) ?
C6 C19 . 1.393(5) ?
C6 C27 . 1.393(5) ?
C7 C32 . 1.385(6) ?
C7 C24 . 1.393(5) ?
C8 C30 . 1.383(5) ?
C8 C15 . 1.392(5) ?
C9 C31 . 1.377(6) ?
C9 C87 . 1.379(6) ?
C12 C39 . 1.385(5) ?
C12 C33 . 1.386(5) ?
C13 C17 . 1.383(5) ?
C13 C40 . 1.388(5) ?
C14 C41 . 1.381(5) ?
C14 C51 . 1.386(5) ?
C15 C55 . 1.388(6) ?
C15 H15A . 0.930 ?
C17 C50 . 1.387(6) ?
C17 H17A . 0.930 ?
C19 C20 . 1.391(5) ?
C19 H19A . 0.930 ?
C20 C29 . 1.374(6) ?
C20 H20A . 0.930 ?
C21 C78 . 1.370(6) ?
C21 C43 . 1.373(7) ?
C22 C46 . 1.380(6) ?
C22 C66 . 1.381(7) ?
C23 C67 . 1.386(6) ?
C23 H23A . 0.930 ?
C24 C57 . 1.384(6) ?
C24 H24A . 0.930 ?
C26 C29 . 1.374(6) ?
C26 C27 . 1.383(5) ?
C26 H26A . 0.930 ?
C27 H27A . 0.930 ?
C29 H29A . 0.930 ?
C30 C53 . 1.399(6) ?
C30 H30A . 0.930 ?
C31 C73 . 1.394(6) ?
C31 H31A . 0.930 ?
C32 C83 . 1.379(6) ?
C32 H32A . 0.930 ?
C33 C48 . 1.382(6) ?
C33 H33A . 0.930 ?
C38 C64 . 1.382(7) ?
C38 C85 . 1.385(7) ?
C38 C98 . 1.510(7) ?
C39 C84 . 1.392(7) ?
C39 H39A . 0.930 ?
C40 C54 . 1.378(6) ?
C40 H40A . 0.930 ?
C41 C68 . 1.384(6) ?
C41 H41A . 0.930 ?
C42 C50 . 1.353(7) ?
C42 C54 . 1.376(8) ?
C42 H42A . 0.930 ?
C43 C101 . 1.387(8) ?
C43 H43A . 0.930 ?
C45 C59 . 1.386(6) ?
C45 H45A . 0.930 ?
C46 C64 . 1.390(7) ?
C46 H46A . 0.930 ?
C48 C70 . 1.371(8) ?
C48 H48A . 0.930 ?
C49 C53 . 1.360(7) ?
C49 C55 . 1.378(8) ?
C49 H49A . 0.930 ?
C50 H50A . 0.930 ?
C51 C88 . 1.379(6) ?
C51 H51A . 0.930 ?
C53 H53A . 0.930 ?
C54 H54A . 0.930 ?
C55 H55A . 0.930 ?
C56 C68 . 1.360(8) ?
C56 C88 . 1.365(8) ?
C56 H56A . 0.930 ?
C57 C62 . 1.376(8) ?
C57 H57A . 0.930 ?
C58 C67 . 1.354(7) ?
C58 C59 . 1.359(7) ?
C58 H58A . 0.930 ?
C59 H59A . 0.930 ?
C60 C61 . 1.360(9) ?
C60 C73 . 1.365(8) ?
C60 H60A . 0.930 ?
C61 C87 . 1.374(7) ?
C61 H61A . 0.930 ?
C62 C83 . 1.374(8) ?
C62 H62A . 0.930 ?
C64 H64A . 0.930 ?
C66 C85 . 1.386(7) ?
C66 H66A . 0.930 ?
C67 H67A . 0.930 ?
C68 H68A . 0.930 ?
C70 C84 . 1.361(8) ?
C70 H70A . 0.930 ?
C73 H73A . 0.930 ?
C78 C90 . 1.375(8) ?
C78 H78A . 0.930 ?
C81 C101 . 1.367(8) ?
C81 C90 . 1.369(8) ?
C81 C99 . 1.518(8) ?
C83 H83A . 0.930 ?
C84 H84A . 0.930 ?
C85 H85A . 0.930 ?
C87 H87A . 0.930 ?
C88 H88A . 0.930 ?
C90 H90A . 0.930 ?
C96 P2 2_566 1.837(3) ?
C96 H96A . 0.970 ?
C96 H96B . 0.970 ?
C97 P3 2_655 1.837(3) ?
C97 H97A . 0.970 ?
C97 H97B . 0.970 ?
C98 H98A . 0.960 ?
C98 H98B . 0.960 ?
C98 H98C . 0.960 ?
C99 H99A . 0.960 ?
C99 H99B . 0.960 ?
C99 H99C . 0.960 ?
C101 H10A . 0.930 ?
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 P1 C14 . . -14.84(19)
O6 Ag1 P1 C14 . . 172.73(17)
Ag1 Ag1 P1 C14 2_566 . 80.19(13)
P2 Ag1 P1 C2 . . 108.48(17)
O6 Ag1 P1 C2 . . -63.95(17)
Ag1 Ag1 P1 C2 2_566 . -156.49(13)
P2 Ag1 P1 C96 . . -134.27(15)
O6 Ag1 P1 C96 . . 53.30(16)
Ag1 Ag1 P1 C96 2_566 . -39.24(12)
P1 Ag1 P2 C12 . . -152.08(15)
O6 Ag1 P2 C12 . . 19.80(18)
Ag1 Ag1 P2 C12 2_566 . 113.00(13)
P1 Ag1 P2 C7 . . -32.69(19)
O6 Ag1 P2 C7 . . 139.19(18)
Ag1 Ag1 P2 C7 2_566 . -127.61(13)
P1 Ag1 P2 C96 . 2_566 85.16(17)
O6 Ag1 P2 C96 . 2_566 -102.97(17)
Ag1 Ag1 P2 C96 2_566 2_566 -9.77(12)
P4 Ag2 P3 C8 . . -6.50(18)
O3 Ag2 P3 C8 . . 170.12(17)
Ag2 Ag2 P3 C8 2_655 . 74.34(14)
P4 Ag2 P3 C9 . . 116.50(16)
O3 Ag2 P3 C9 . . -66.88(17)
Ag2 Ag2 P3 C9 2_655 . -162.66(14)
P4 Ag2 P3 C97 . 2_655 -127.45(14)
O3 Ag2 P3 C97 . 2_655 49.17(15)
Ag2 Ag2 P3 C97 2_655 2_655 -46.60(12)
P3 Ag2 P4 C6 . . -160.23(14)
O3 Ag2 P4 C6 . . 23.41(17)
Ag2 Ag2 P4 C6 2_655 . 119.05(13)
P3 Ag2 P4 C13 . . -42.60(16)
O3 Ag2 P4 C13 . . 141.04(16)
Ag2 Ag2 P4 C13 2_655 . -123.32(13)
P3 Ag2 P4 C97 . . 76.94(16)
O3 Ag2 P4 C97 . . -99.42(16)
Ag2 Ag2 P4 C97 2_655 . -3.79(12)
O1 S2 O3 Ag2 . . 33.0(12)
O2 S2 O3 Ag2 . . -95.4(11)
C21 S2 O3 Ag2 . . 148.2(11)
P4 Ag2 O3 S2 . . 149.2(11)
P3 Ag2 O3 S2 . . -29.5(11)
Ag2 Ag2 O3 S2 2_655 . 58.5(11)
O5 S1 O6 Ag1 . . -43.5(12)
O4 S1 O6 Ag1 . . 84.8(12)
C22 S1 O6 Ag1 . . -159.8(11)
P2 Ag1 O6 S1 . . 100.6(11)
P1 Ag1 O6 S1 . . -81.5(11)
Ag1 Ag1 O6 S1 2_566 . 8.4(12)
C14 P1 C2 C45 . . -137.3(4)
C96 P1 C2 C45 . . -27.9(4)
Ag1 P1 C2 C45 . . 91.4(4)
C14 P1 C2 C23 . . 46.4(3)
C96 P1 C2 C23 . . 155.8(3)
Ag1 P1 C2 C23 . . -84.9(3)
C13 P4 C6 C19 . . -138.7(3)
C97 P4 C6 C19 . . 111.0(3)
Ag2 P4 C6 C19 . . -18.3(3)
C13 P4 C6 C27 . . 44.5(3)
C97 P4 C6 C27 . . -65.8(3)
Ag2 P4 C6 C27 . . 164.9(3)
C12 P2 C7 C32 . . -165.1(3)
C96 P2 C7 C32 2_566 . -53.5(3)
Ag1 P2 C7 C32 . . 70.5(3)
C12 P2 C7 C24 . . 20.4(4)
C96 P2 C7 C24 2_566 . 132.0(3)
Ag1 P2 C7 C24 . . -104.0(3)
C9 P3 C8 C30 . . -122.1(3)
C97 P3 C8 C30 2_655 . 128.1(3)
Ag2 P3 C8 C30 . . 6.4(4)
C9 P3 C8 C15 . . 58.3(3)
C97 P3 C8 C15 2_655 . -51.6(3)
Ag2 P3 C8 C15 . . -173.2(3)
C8 P3 C9 C31 . . -147.3(3)
C97 P3 C9 C31 2_655 . -36.7(4)
Ag2 P3 C9 C31 . . 80.8(4)
C8 P3 C9 C87 . . 37.4(4)
C97 P3 C9 C87 2_655 . 148.0(4)
Ag2 P3 C9 C87 . . -94.5(4)
C7 P2 C12 C39 . . -117.6(3)
C96 P2 C12 C39 2_566 . 132.6(3)
Ag1 P2 C12 C39 . . 5.6(4)
C7 P2 C12 C33 . . 59.6(4)
C96 P2 C12 C33 2_566 . -50.1(4)
Ag1 P2 C12 C33 . . -177.2(3)
C6 P4 C13 C17 . . -142.1(3)
C97 P4 C13 C17 . . -32.5(4)
Ag2 P4 C13 C17 . . 93.8(3)
C6 P4 C13 C40 . . 45.0(4)
C97 P4 C13 C40 . . 154.5(3)
Ag2 P4 C13 C40 . . -79.1(3)
C2 P1 C14 C41 . . -132.8(3)
C96 P1 C14 C41 . . 117.8(3)
Ag1 P1 C14 C41 . . -3.6(4)
C2 P1 C14 C51 . . 47.6(4)
C96 P1 C14 C51 . . -61.8(4)
Ag1 P1 C14 C51 . . 176.8(3)
C30 C8 C15 C55 . . 0.1(6)
P3 C8 C15 C55 . . 179.7(3)
C40 C13 C17 C50 . . -0.5(6)
P4 C13 C17 C50 . . -173.4(3)
C27 C6 C19 C20 . . 2.0(6)
P4 C6 C19 C20 . . -174.9(3)
C6 C19 C20 C29 . . -1.0(6)
O1 S2 C21 C78 . . -138.1(4)
O2 S2 C21 C78 . . -17.9(5)
O3 S2 C21 C78 . . 103.3(4)
O1 S2 C21 C43 . . 40.9(5)
O2 S2 C21 C43 . . 161.1(5)
O3 S2 C21 C43 . . -77.6(5)
O5 S1 C22 C46 . . 0.5(4)
O4 S1 C22 C46 . . -120.9(4)
O6 S1 C22 C46 . . 121.3(4)
O5 S1 C22 C66 . . -178.1(4)
O4 S1 C22 C66 . . 60.5(4)
O6 S1 C22 C66 . . -57.3(4)
C45 C2 C23 C67 . . 0.6(7)
P1 C2 C23 C67 . . 177.0(4)
C32 C7 C24 C57 . . 0.3(6)
P2 C7 C24 C57 . . 174.8(3)
C29 C26 C27 C6 . . -0.2(6)
C19 C6 C27 C26 . . -1.4(6)
P4 C6 C27 C26 . . 175.4(3)
C19 C20 C29 C26 . . -0.6(7)
C27 C26 C29 C20 . . 1.2(7)
C15 C8 C30 C53 . . -0.8(6)
P3 C8 C30 C53 . . 179.6(3)
C87 C9 C31 C73 . . -0.8(7)
P3 C9 C31 C73 . . -176.2(4)
C24 C7 C32 C83 . . -1.8(6)
P2 C7 C32 C83 . . -176.4(4)
C39 C12 C33 C48 . . 0.9(6)
P2 C12 C33 C48 . . -176.3(4)
C33 C12 C39 C84 . . -0.7(7)
P2 C12 C39 C84 . . 176.7(4)
C17 C13 C40 C54 . . 0.0(7)
P4 C13 C40 C54 . . 173.1(4)
C51 C14 C41 C68 . . -0.6(7)
P1 C14 C41 C68 . . 179.9(4)
C78 C21 C43 C101 . . -0.1(9)
S2 C21 C43 C101 . . -179.2(5)
C23 C2 C45 C59 . . -1.9(7)
P1 C2 C45 C59 . . -178.2(4)
C66 C22 C46 C64 . . 1.9(7)
S1 C22 C46 C64 . . -176.7(4)
C12 C33 C48 C70 . . -0.2(8)
C54 C42 C50 C17 . . -0.6(8)
C13 C17 C50 C42 . . 0.8(7)
C41 C14 C51 C88 . . 1.5(7)
P1 C14 C51 C88 . . -178.9(4)
C55 C49 C53 C30 . . -0.2(8)
C8 C30 C53 C49 . . 0.8(7)
C50 C42 C54 C40 . . 0.1(9)
C13 C40 C54 C42 . . 0.2(8)
C53 C49 C55 C15 . . -0.5(7)
C8 C15 C55 C49 . . 0.6(7)
C7 C24 C57 C62 . . 1.3(7)
C67 C58 C59 C45 . . 0.8(9)
C2 C45 C59 C58 . . 1.2(9)
C73 C60 C61 C87 . . -1.3(11)
C24 C57 C62 C83 . . -1.4(8)
C85 C38 C64 C46 . . -3.1(8)
C98 C38 C64 C46 . . 177.4(5)
C22 C46 C64 C38 . . 1.3(8)
C46 C22 C66 C85 . . -3.1(7)
S1 C22 C66 C85 . . 175.5(4)
C59 C58 C67 C23 . . -2.1(9)
C2 C23 C67 C58 . . 1.5(8)
C88 C56 C68 C41 . . 1.2(8)
C14 C41 C68 C56 . . -0.8(8)
C33 C48 C70 C84 . . -0.7(8)
C61 C60 C73 C31 . . 0.7(9)
C9 C31 C73 C60 . . 0.4(8)
C43 C21 C78 C90 . . -0.3(8)
S2 C21 C78 C90 . . 178.8(5)
C57 C62 C83 C32 . . -0.1(8)
C7 C32 C83 C62 . . 1.7(7)
C48 C70 C84 C39 . . 1.0(9)
C12 C39 C84 C70 . . -0.3(8)
C64 C38 C85 C66 . . 1.9(7)
C98 C38 C85 C66 . . -178.7(5)
C22 C66 C85 C38 . . 1.2(8)
C60 C61 C87 C9 . . 0.8(11)
C31 C9 C87 C61 . . 0.3(9)
P3 C9 C87 C61 . . 175.7(5)
C68 C56 C88 C51 . . -0.3(9)
C14 C51 C88 C56 . . -1.1(8)
C101 C81 C90 C78 . . -0.1(10)
C99 C81 C90 C78 . . -178.5(6)
C21 C78 C90 C81 . . 0.4(9)
C14 P1 C96 P2 . 2_566 -72.4(2)
C2 P1 C96 P2 . 2_566 179.37(17)
Ag1 P1 C96 P2 . 2_566 55.44(19)
C6 P4 C97 P3 . 2_655 -89.6(2)
C13 P4 C97 P3 . 2_655 160.60(17)
Ag2 P4 C97 P3 . 2_655 38.8(2)
C90 C81 C101 C43 . . -0.4(10)
C99 C81 C101 C43 . . 178.2(7)
C21 C43 C101 C81 . . 0.5(11)
