#------------------------------------------------------------------------------
#$Date: 2021-06-05 21:18:30 +0200 (Sat 05 de Jun de 2021) $
#$Revision: 266122 $
#$URL: svn://www.crystallography.net/cod/cif/7/06/04/7060494.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_7060494
loop_
_publ_author_name
'Han, Chu-Xia'
'Shao, Zi-Mo'
'Li, Li'
'Zhou, Kun'
'Xue, Chun-Hui'
'Chen, Bao-Kuan'
'Ji, Jiu-Yu'
'Bi, Yan-Feng'
_publ_section_title
;
 Trinuclear cationic silver nanoclusters based-on bis-(phosphine) ligands
 and stabilized by CF3SO3− anions
;
_journal_issue                   17
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              7555
_journal_page_last               7563
_journal_paper_doi               10.1039/D1NJ00873K
_journal_volume                  45
_journal_year                    2021
_chemical_formula_moiety         'C76 H66 Ag3 O3 P6, C F3 O3 S, C H4 O, O'
_chemical_formula_sum            'C78 H72 Ag3 F3 O8 P6 S'
_chemical_formula_weight         1735.84
_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   mixed
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2021-03-23 deposited with the CCDC.	2021-03-25 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 114.9290(10)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   13.0670(6)
_cell_length_b                   22.5859(11)
_cell_length_c                   14.0988(6)
_cell_measurement_reflns_used    9947
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.0285
_cell_measurement_theta_min      2.4063
_cell_volume                     3773.3(3)
_computing_cell_refinement       'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_data_collection       'Bruker Instrument Service vV6.2.9'
_computing_data_reduction        'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_molecular_graphics    'DIAMOND, Vers. 3.2h (Brandenburg, 2012)'
_computing_publication_material  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker D8 QUEST'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0269
_diffrn_reflns_av_unetI/netI     0.0217
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            32189
_diffrn_reflns_point_group_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.078
_diffrn_reflns_theta_max         25.078
_diffrn_reflns_theta_min         2.406
_exptl_absorpt_coefficient_mu    0.987
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.6707
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.528
_exptl_crystal_description       block
_exptl_crystal_F_000             1756
_exptl_crystal_size_max          0.150
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.130
_refine_diff_density_max         1.138
_refine_diff_density_min         -1.204
_refine_diff_density_rms         0.079
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.094
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     509
_refine_ls_number_reflns         6853
_refine_ls_number_restraints     42
_refine_ls_restrained_S_all      1.117
_refine_ls_R_factor_all          0.0461
_refine_ls_R_factor_gt           0.0366
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0276P)²+8.4134P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0806
_refine_ls_wR_factor_ref         0.0882
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5904
_reflns_number_total             6853
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1nj00873k2.cif
_cod_data_source_block           Ag3_2
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-Scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 7060493--7060495.cif.
;
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_database_code               7060494
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.866
_shelx_estimated_absorpt_t_max   0.882
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'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
Ag1 Ag 0.49611(3) 0.2500 0.33036(3) 0.03686(11) Uani 1 2 d S T P . .
Ag2 Ag 0.28720(2) 0.31966(2) 0.22206(2) 0.03459(9) Uani 1 1 d . . . . .
C1 C -0.0130(3) 0.33329(16) 0.1078(3) 0.0373(8) Uani 1 1 d . . . . .
C2 C -0.1258(3) 0.3226(2) 0.0439(3) 0.0539(11) Uani 1 1 d . . . . .
H2 H -0.1467 0.3079 -0.0233 0.065 Uiso 1 1 calc R U . . .
C3 C -0.2068(4) 0.3337(2) 0.0798(4) 0.0691(14) Uani 1 1 d . . . . .
H3 H -0.2820 0.3251 0.0377 0.083 Uiso 1 1 calc R U . . .
C4 C -0.1770(4) 0.3575(3) 0.1777(4) 0.0739(15) Uani 1 1 d . . . . .
H4 H -0.2323 0.3655 0.2011 0.089 Uiso 1 1 calc R U . . .
C5 C -0.0666(4) 0.3695(3) 0.2404(4) 0.0748(15) Uani 1 1 d . . . . .
H5 H -0.0466 0.3861 0.3062 0.090 Uiso 1 1 calc R U . . .
C6 C 0.0154(4) 0.3569(2) 0.2060(3) 0.0540(11) Uani 1 1 d . . . . .
H6 H 0.0907 0.3644 0.2495 0.065 Uiso 1 1 calc R U . . .
C7 C 0.0886(3) 0.37425(15) -0.0280(3) 0.0370(8) Uani 1 1 d . . . . .
C8 C 0.1684(4) 0.37282(19) -0.0689(3) 0.0529(10) Uani 1 1 d . . . . .
H8 H 0.2214 0.3425 -0.0503 0.064 Uiso 1 1 calc R U . . .
C9 C 0.1689(5) 0.4165(2) -0.1372(4) 0.0736(15) Uani 1 1 d . . . . .
H9 H 0.2212 0.4148 -0.1658 0.088 Uiso 1 1 calc R U . . .
C10 C 0.0931(6) 0.4624(2) -0.1632(4) 0.0825(18) Uani 1 1 d . . . . .
H10 H 0.0950 0.4921 -0.2082 0.099 Uiso 1 1 calc R U . . .
C11 C 0.0154(5) 0.4643(2) -0.1230(4) 0.0737(15) Uani 1 1 d . . . . .
H11 H -0.0358 0.4955 -0.1407 0.088 Uiso 1 1 calc R U . . .
C12 C 0.0112(4) 0.42022(18) -0.0558(3) 0.0529(10) Uani 1 1 d . . . . .
H12 H -0.0432 0.4216 -0.0296 0.063 Uiso 1 1 calc R U . . .
C13 C 0.0665(4) 0.2500 -0.0071(4) 0.0337(11) Uani 1 2 d S T P . .
H13A H -0.0137 0.2500 -0.0523 0.040 Uiso 1 2 calc R U P . .
H13B H 0.1063 0.2500 -0.0516 0.040 Uiso 1 2 calc R U P . .
C14 C 0.7348(3) 0.34723(16) 0.4820(3) 0.0419(9) Uani 1 1 d . . . . .
C15 C 0.7593(4) 0.3539(3) 0.5860(4) 0.0712(14) Uani 1 1 d . . . . .
H15 H 0.7022 0.3615 0.6074 0.085 Uiso 1 1 calc R U . . .
C16 C 0.8722(5) 0.3490(3) 0.6600(5) 0.099(2) Uani 1 1 d . . . . .
H16 H 0.8894 0.3532 0.7307 0.119 Uiso 1 1 calc R U . . .
C17 C 0.9556(5) 0.3384(3) 0.6304(6) 0.099(2) Uani 1 1 d . . . . .
H17 H 1.0298 0.3355 0.6803 0.119 Uiso 1 1 calc R U . . .
C18 C 0.9317(4) 0.3321(4) 0.5292(6) 0.110(2) Uani 1 1 d . . . . .
H18 H 0.9894 0.3250 0.5085 0.132 Uiso 1 1 calc R U . . .
C19 C 0.8209(4) 0.3362(3) 0.4545(4) 0.0802(17) Uani 1 1 d . . . . .
H19 H 0.8053 0.3312 0.3842 0.096 Uiso 1 1 calc R U . . .
C20 C 0.5939(3) 0.38873(17) 0.2746(3) 0.0402(8) Uani 1 1 d . . . . .
C21 C 0.6439(4) 0.44383(19) 0.2923(4) 0.0643(13) Uani 1 1 d . . . . .
H21 H 0.6790 0.4580 0.3605 0.077 Uiso 1 1 calc R U . . .
C22 C 0.6434(6) 0.4780(3) 0.2131(6) 0.094(2) Uani 1 1 d . . . . .
H22 H 0.6791 0.5146 0.2272 0.113 Uiso 1 1 calc R U . . .
C23 C 0.5910(6) 0.4586(4) 0.1137(7) 0.102(3) Uani 1 1 d . . . . .
H23 H 0.5905 0.4823 0.0595 0.123 Uiso 1 1 calc R U . . .
C24 C 0.5382(5) 0.4041(4) 0.0908(4) 0.088(2) Uani 1 1 d . . . . .
H24 H 0.5021 0.3911 0.0219 0.106 Uiso 1 1 calc R U . . .
C25 C 0.5398(3) 0.3685(2) 0.1737(3) 0.0573(12) Uani 1 1 d . . . . .
H25 H 0.5046 0.3317 0.1601 0.069 Uiso 1 1 calc R U . . .
C26 C 0.5127(3) 0.39397(15) 0.4330(3) 0.0330(7) Uani 1 1 d . . . . .
H26A H 0.5514 0.4317 0.4531 0.040 Uiso 1 1 calc R U . . .
H26B H 0.5112 0.3761 0.4949 0.040 Uiso 1 1 calc R U . . .
C27 C 0.3725(3) 0.47413(15) 0.2676(3) 0.0360(8) Uani 1 1 d . . . . .
C28 C 0.3086(3) 0.47787(18) 0.1608(3) 0.0482(10) Uani 1 1 d . . . . .
H28 H 0.2669 0.4453 0.1244 0.058 Uiso 1 1 calc R U . . .
C29 C 0.3065(4) 0.5298(2) 0.1077(4) 0.0665(13) Uani 1 1 d . . . . .
H29 H 0.2620 0.5322 0.0361 0.080 Uiso 1 1 calc R U . . .
C30 C 0.3691(5) 0.5773(2) 0.1597(4) 0.0690(13) Uani 1 1 d . . . . .
H30 H 0.3676 0.6120 0.1237 0.083 Uiso 1 1 calc R U . . .
C31 C 0.4348(4) 0.57391(19) 0.2660(4) 0.0647(13) Uani 1 1 d . . . . .
H31 H 0.4785 0.6061 0.3016 0.078 Uiso 1 1 calc R U . . .
C32 C 0.4355(4) 0.52297(17) 0.3190(3) 0.0498(10) Uani 1 1 d . . . . .
H32 H 0.4791 0.5212 0.3908 0.060 Uiso 1 1 calc R U . . .
C33 C 0.2916(3) 0.42809(16) 0.4131(3) 0.0375(8) Uani 1 1 d . . . . .
C34 C 0.2940(4) 0.39162(19) 0.4924(3) 0.0521(10) Uani 1 1 d . . . . .
H34 H 0.3403 0.3584 0.5109 0.062 Uiso 1 1 calc R U . . .
C35 C 0.2277(5) 0.4044(2) 0.5448(4) 0.0713(14) Uani 1 1 d . . . . .
H35 H 0.2305 0.3801 0.5991 0.086 Uiso 1 1 calc R U . . .
C36 C 0.1579(4) 0.4528(3) 0.5169(5) 0.0730(15) Uani 1 1 d . . . . .
H36 H 0.1124 0.4607 0.5514 0.088 Uiso 1 1 calc R U . . .
C37 C 0.1548(4) 0.4892(2) 0.4390(4) 0.0691(14) Uani 1 1 d . . . . .
H37 H 0.1077 0.5221 0.4208 0.083 Uiso 1 1 calc R U . . .
C38 C 0.2215(3) 0.4774(2) 0.3868(3) 0.0536(10) Uani 1 1 d . . . . .
H38 H 0.2194 0.5027 0.3338 0.064 Uiso 1 1 calc R U . . .
P1 P 0.10127(7) 0.31866(4) 0.07028(7) 0.02998(19) Uani 1 1 d . . . . .
P2 P 0.58998(7) 0.34568(4) 0.38167(7) 0.03068(19) Uani 1 1 d . . . . .
P3 P 0.36781(7) 0.40639(4) 0.33559(7) 0.0321(2) Uani 1 1 d . . . . .
O6 O 0.2189(5) 0.2500 0.3589(4) 0.0837(15) Uani 1 2 d S T P . .
H6A H 0.2845 0.2500 0.4030 0.126 Uiso 1 2 d R U P . .
C42 C 0.1452(8) 0.2500 0.4099(7) 0.093(3) Uani 1 2 d S T P . .
H42A H 0.1776 0.2265 0.4724 0.139 Uiso 0.5 1 calc R U P A -1
H42B H 0.0736 0.2336 0.3640 0.139 Uiso 0.5 1 calc R U P A -1
H42C H 0.1349 0.2899 0.4278 0.139 Uiso 0.5 1 calc R U P A -1
C40 C 0.3213(16) 0.2626(8) -0.2155(16) 0.129(8) Uani 0.5 1 d . . P B -2
F1 F 0.2258(9) 0.2316(15) -0.2497(12) 0.218(19) Uani 0.5 1 d . . P B -2
F2 F 0.322(3) 0.3163(11) -0.2174(16) 0.276(15) Uani 0.5 1 d . . P B -2
F3 F 0.3621(10) 0.263(2) -0.2915(8) 0.199(16) Uani 0.5 1 d . . P B -2
S1 S 0.4097(4) 0.2380(8) -0.0968(4) 0.168(6) Uani 0.5 1 d . . P B -2
O3 O 0.390(3) 0.1690(9) -0.133(2) 0.238(13) Uani 0.5 1 d . . P B -2
O4 O 0.3544(10) 0.256(3) -0.0345(8) 0.157(10) Uani 0.5 1 d . . P B -2
O5 O 0.5120(9) 0.2710(11) -0.0787(11) 0.214(15) Uani 0.5 1 d . . P B -2
O1 O 0.4239(16) 0.2500 0.4747(13) 0.078(2) Uani 0.5 2 d S TU P C 1
O2 O 0.5099(7) 0.3020(4) 0.6068(7) 0.0754(18) Uani 0.5 1 d . U P C 1
C39 C 0.5065(6) 0.2500 0.5795(5) 0.0533(13) Uani 1 2 d S TU P C 1
O1' O 0.4441(17) 0.2500 0.4972(15) 0.079(2) Uani 0.5 2 d S TU P D 2
O2' O 0.5640(7) 0.2914(4) 0.6349(7) 0.0763(19) Uani 0.5 1 d . U P E 2
O1W O -0.319(2) 0.2500 -0.161(3) 0.229(8) Uiso 0.58(3) 2 d S . P F 1
O1W' O 0.673(3) 0.2500 0.757(4) 0.229(8) Uiso 0.42(3) 2 d S . P F 2
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'
Ag Ag -0.8971 1.1015 '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'
O O 0.0106 0.0060 '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'
F F 0.0171 0.0103 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
P2 Ag1 P2 124.74(4) 4_565 . ?
P2 Ag1 O1 94.10(17) 4_565 . ?
P2 Ag1 O1 94.10(17) . . ?
P2 Ag1 Ag2 85.48(2) 4_565 4_565 ?
P2 Ag1 Ag2 149.75(2) . 4_565 ?
O1 Ag1 Ag2 80.9(3) . 4_565 ?
P2 Ag1 Ag2 149.75(2) 4_565 . ?
P2 Ag1 Ag2 85.48(2) . . ?
O1 Ag1 Ag2 80.9(3) . . ?
Ag2 Ag1 Ag2 64.284(13) 4_565 . ?
P3 Ag2 P1 124.37(3) . . ?
P3 Ag2 Ag1 92.21(2) . . ?
P1 Ag2 Ag1 143.07(2) . . ?
P3 Ag2 Ag2 142.55(2) . 4_565 ?
P1 Ag2 Ag2 89.47(2) . 4_565 ?
Ag1 Ag2 Ag2 57.858(6) . 4_565 ?
C6 C1 C2 118.8(4) . . ?
C6 C1 P1 117.2(3) . . ?
C2 C1 P1 124.0(3) . . ?
C3 C2 C1 120.1(4) . . ?
C3 C2 H2 120.0 . . ?
C1 C2 H2 120.0 . . ?
C4 C3 C2 120.3(4) . . ?
C4 C3 H3 119.8 . . ?
C2 C3 H3 119.8 . . ?
C5 C4 C3 120.1(4) . . ?
C5 C4 H4 119.9 . . ?
C3 C4 H4 119.9 . . ?
C4 C5 C6 119.8(5) . . ?
C4 C5 H5 120.1 . . ?
C6 C5 H5 120.1 . . ?
C5 C6 C1 120.8(4) . . ?
C5 C6 H6 119.6 . . ?
C1 C6 H6 119.6 . . ?
C12 C7 C8 119.1(4) . . ?
C12 C7 P1 123.5(3) . . ?
C8 C7 P1 117.1(3) . . ?
C9 C8 C7 119.9(4) . . ?
C9 C8 H8 120.1 . . ?
C7 C8 H8 120.1 . . ?
C10 C9 C8 120.7(5) . . ?
C10 C9 H9 119.6 . . ?
C8 C9 H9 119.6 . . ?
C11 C10 C9 119.7(5) . . ?
C11 C10 H10 120.2 . . ?
C9 C10 H10 120.2 . . ?
C10 C11 C12 120.9(5) . . ?
C10 C11 H11 119.6 . . ?
C12 C11 H11 119.6 . . ?
C7 C12 C11 119.7(5) . . ?
C7 C12 H12 120.2 . . ?
C11 C12 H12 120.2 . . ?
P1 C13 P1 114.9(3) 4_565 . ?
P1 C13 H13A 108.5 4_565 . ?
P1 C13 H13A 108.5 . . ?
P1 C13 H13B 108.5 4_565 . ?
P1 C13 H13B 108.5 . . ?
H13A C13 H13B 107.5 . . ?
C19 C14 C15 118.5(4) . . ?
C19 C14 P2 119.3(3) . . ?
C15 C14 P2 122.0(3) . . ?
C14 C15 C16 118.9(5) . . ?
C14 C15 H15 120.6 . . ?
C16 C15 H15 120.6 . . ?
C17 C16 C15 121.3(6) . . ?
C17 C16 H16 119.4 . . ?
C15 C16 H16 119.4 . . ?
C18 C17 C16 119.8(5) . . ?
C18 C17 H17 120.1 . . ?
C16 C17 H17 120.1 . . ?
C17 C18 C19 120.2(6) . . ?
C17 C18 H18 119.9 . . ?
C19 C18 H18 119.9 . . ?
C14 C19 C18 121.3(6) . . ?
C14 C19 H19 119.3 . . ?
C18 C19 H19 119.3 . . ?
C25 C20 C21 119.0(4) . . ?
C25 C20 P2 120.0(3) . . ?
C21 C20 P2 120.8(3) . . ?
C22 C21 C20 121.9(6) . . ?
C22 C21 H21 119.1 . . ?
C20 C21 H21 119.1 . . ?
C23 C22 C21 119.7(6) . . ?
C23 C22 H22 120.1 . . ?
C21 C22 H22 120.1 . . ?
C22 C23 C24 121.2(5) . . ?
C22 C23 H23 119.4 . . ?
C24 C23 H23 119.4 . . ?
C23 C24 C25 118.9(6) . . ?
C23 C24 H24 120.6 . . ?
C25 C24 H24 120.6 . . ?
C20 C25 C24 119.3(5) . . ?
C20 C25 H25 120.4 . . ?
C24 C25 H25 120.4 . . ?
P2 C26 P3 111.28(17) . . ?
P2 C26 H26A 109.4 . . ?
P3 C26 H26A 109.4 . . ?
P2 C26 H26B 109.4 . . ?
P3 C26 H26B 109.4 . . ?
H26A C26 H26B 108.0 . . ?
C28 C27 C32 118.3(4) . . ?
C28 C27 P3 119.1(3) . . ?
C32 C27 P3 122.6(3) . . ?
C27 C28 C29 120.4(4) . . ?
C27 C28 H28 119.8 . . ?
C29 C28 H28 119.8 . . ?
C30 C29 C28 120.4(4) . . ?
C30 C29 H29 119.8 . . ?
C28 C29 H29 119.8 . . ?
C29 C30 C31 119.9(4) . . ?
C29 C30 H30 120.0 . . ?
C31 C30 H30 120.0 . . ?
C32 C31 C30 119.8(4) . . ?
C32 C31 H31 120.1 . . ?
C30 C31 H31 120.1 . . ?
C31 C32 C27 121.2(4) . . ?
C31 C32 H32 119.4 . . ?
C27 C32 H32 119.4 . . ?
C34 C33 C38 118.8(4) . . ?
C34 C33 P3 119.5(3) . . ?
C38 C33 P3 121.3(3) . . ?
C33 C34 C35 120.2(4) . . ?
C33 C34 H34 119.9 . . ?
C35 C34 H34 119.9 . . ?
C36 C35 C34 120.2(5) . . ?
C36 C35 H35 119.9 . . ?
C34 C35 H35 119.9 . . ?
C37 C36 C35 120.3(4) . . ?
C37 C36 H36 119.9 . . ?
C35 C36 H36 119.9 . . ?
C36 C37 C38 120.2(5) . . ?
C36 C37 H37 119.9 . . ?
C38 C37 H37 119.9 . . ?
C37 C38 C33 120.3(4) . . ?
C37 C38 H38 119.9 . . ?
C33 C38 H38 119.9 . . ?
C1 P1 C7 105.89(17) . . ?
C1 P1 C13 107.4(2) . . ?
C7 P1 C13 102.08(17) . . ?
C1 P1 Ag2 112.10(12) . . ?
C7 P1 Ag2 113.12(12) . . ?
C13 P1 Ag2 115.38(14) . . ?
C20 P2 C14 104.51(18) . . ?
C20 P2 C26 102.92(16) . . ?
C14 P2 C26 104.31(16) . . ?
C20 P2 Ag1 114.54(13) . . ?
C14 P2 Ag1 118.34(12) . . ?
C26 P2 Ag1 110.66(11) . . ?
C27 P3 C33 103.72(16) . . ?
C27 P3 C26 105.65(16) . . ?
C33 P3 C26 104.13(16) . . ?
C27 P3 Ag2 115.19(11) . . ?
C33 P3 Ag2 114.17(11) . . ?
C26 P3 Ag2 112.86(11) . . ?
C42 O6 H6A 109.2 . . ?
O6 C42 H42A 109.5 . . ?
O6 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
O6 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
F2 C40 F1 122(3) . . ?
F2 C40 F3 88(3) . . ?
F1 C40 F3 109(2) . . ?
F2 C40 S1 110(2) . . ?
F1 C40 S1 109.4(17) . . ?
F3 C40 S1 116.5(15) . . ?
O4 S1 O5 115(3) . . ?
O4 S1 O3 114(3) . . ?
O5 S1 O3 124.0(16) . . ?
O4 S1 C40 102.1(14) . . ?
O5 S1 C40 101.5(12) . . ?
O3 S1 C40 92.8(13) . . ?
C39 O1 Ag1 116.9(12) . . ?
O2 C39 O2 145.1(10) 4_565 . ?
O2 C39 O1 103.8(5) 4_565 . ?
O2 C39 O1 103.8(5) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 P2 2.4392(8) 4_565 ?
Ag1 P2 2.4392(9) . ?
Ag1 O1 2.58(2) . ?
Ag1 Ag2 2.9572(4) 4_565 ?
Ag1 Ag2 2.9572(4) . ?
Ag2 P3 2.4673(9) . ?
Ag2 P1 2.4697(9) . ?
Ag2 Ag2 3.1466(5) 4_565 ?
C1 C6 1.381(5) . ?
C1 C2 1.386(5) . ?
C1 P1 1.812(4) . ?
C2 C3 1.376(6) . ?
C2 H2 0.9300 . ?
C3 C4 1.375(7) . ?
C3 H3 0.9300 . ?
C4 C5 1.365(7) . ?
C4 H4 0.9300 . ?
C5 C6 1.378(6) . ?
C5 H5 0.9300 . ?
C6 H6 0.9300 . ?
C7 C12 1.386(5) . ?
C7 C8 1.388(6) . ?
C7 P1 1.825(4) . ?
C8 C9 1.381(6) . ?
C8 H8 0.9300 . ?
C9 C10 1.373(8) . ?
C9 H9 0.9300 . ?
C10 C11 1.356(8) . ?
C10 H10 0.9300 . ?
C11 C12 1.392(6) . ?
C11 H11 0.9300 . ?
C12 H12 0.9300 . ?
C13 P1 1.839(3) 4_565 ?
C13 P1 1.839(3) . ?
C13 H13A 0.9700 . ?
C13 H13B 0.9700 . ?
C14 C19 1.358(6) . ?
C14 C15 1.372(6) . ?
C14 P2 1.824(4) . ?
C15 C16 1.407(7) . ?
C15 H15 0.9300 . ?
C16 C17 1.342(9) . ?
C16 H16 0.9300 . ?
C17 C18 1.334(9) . ?
C17 H17 0.9300 . ?
C18 C19 1.389(7) . ?
C18 H18 0.9300 . ?
C19 H19 0.9300 . ?
C20 C25 1.374(6) . ?
C20 C21 1.378(6) . ?
C20 P2 1.814(4) . ?
C21 C22 1.355(7) . ?
C21 H21 0.9300 . ?
C22 C23 1.348(10) . ?
C22 H22 0.9300 . ?
C23 C24 1.381(10) . ?
C23 H23 0.9300 . ?
C24 C25 1.412(7) . ?
C24 H24 0.9300 . ?
C25 H25 0.9300 . ?
C26 P2 1.830(3) . ?
C26 P3 1.832(3) . ?
C26 H26A 0.9700 . ?
C26 H26B 0.9700 . ?
C27 C28 1.383(5) . ?
C27 C32 1.384(5) . ?
C27 P3 1.820(4) . ?
C28 C29 1.385(6) . ?
C28 H28 0.9300 . ?
C29 C30 1.362(7) . ?
C29 H29 0.9300 . ?
C30 C31 1.380(7) . ?
C30 H30 0.9300 . ?
C31 C32 1.369(6) . ?
C31 H31 0.9300 . ?
C32 H32 0.9300 . ?
C33 C34 1.380(6) . ?
C33 C38 1.390(5) . ?
C33 P3 1.828(4) . ?
C34 C35 1.385(6) . ?
C34 H34 0.9300 . ?
C35 C36 1.370(7) . ?
C35 H35 0.9300 . ?
C36 C37 1.359(7) . ?
C36 H36 0.9300 . ?
C37 C38 1.383(6) . ?
C37 H37 0.9300 . ?
C38 H38 0.9300 . ?
O6 C42 1.424(9) . ?
O6 H6A 0.8200 . ?
C42 H42A 0.9600 . ?
C42 H42B 0.9600 . ?
C42 H42C 0.9600 . ?
C40 F2 1.21(3) . ?
C40 F1 1.33(3) . ?
C40 F3 1.38(2) . ?
C40 S1 1.68(2) . ?
S1 O4 1.41(2) . ?
S1 O5 1.456(18) . ?
S1 O3 1.63(3) . ?
O1 C39 1.416(16) . ?
O2 C39 1.230(9) . ?
C39 O2 1.230(9) 4_565 ?
