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#$Date: 2022-06-24 10:39:29 +0300 (Fri, 24 Jun 2022) $
#$Revision: 276230 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/54/8105499.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_8105499
loop_
_publ_author_name
'Yeo, Chien Ing'
'Liew, Li Yuan'
'Chew, Jactty'
'Teow, Sin-Yeang'
'Tiekink, Edward R.T.'
_publ_section_title
;
 Crystal structure of chlorido-(O-ethyl
 phenylcarbamothioamide-\kS)-bis(triphenylphosphane-\kP)-silver(I),
 C45H41AgClNOP2S
;
_journal_issue                   6
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              1477
_journal_page_last               1480
_journal_paper_doi               10.1515/ncrs-2020-0363
_journal_volume                  235
_journal_year                    2020
_chemical_formula_moiety         'C45 H41 Ag Cl N O P2 S'
_chemical_formula_sum            'C45 H41 Ag Cl N O P2 S'
_chemical_formula_weight         849.11
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 94.516(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.1930(3)
_cell_length_b                   18.3087(6)
_cell_length_c                   21.3088(6)
_cell_measurement_reflns_used    7148
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      27.5015
_cell_measurement_theta_min      2.2872
_cell_volume                     3964.3(2)
_computing_cell_refinement       'CrysAlis PRO [1]'
_computing_data_collection       'CrysAlis PRO [1]'
_computing_data_reduction        'CrysAlis PRO [1]'
_computing_molecular_graphics    'ORTEP-3 for Windows [4]'
_computing_publication_material  'SHELXL2014/7 [3]'
_computing_structure_refinement  'SHELXL2014/7 [3]'
_computing_structure_solution    'SHELXS97 [2]'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 10.4041
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type
'Agilent SuperNova Dual diffractometer with Atlas detector'
_diffrn_measurement_method       'ω scan'
_diffrn_radiation_monochromator  Mirror
_diffrn_radiation_source         'SuperNova (Mo) X-ray Source'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0316
_diffrn_reflns_av_unetI/netI     0.0563
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.990
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            16706
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.990
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.567
_diffrn_reflns_theta_min         2.423
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.745
_exptl_absorpt_correction_T_max  0.9630
_exptl_absorpt_correction_T_min  0.9279
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrysAlis PRO [1]'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.423
_exptl_crystal_description       prism
_exptl_crystal_F_000             1744
_exptl_crystal_size_max          0.600
_exptl_crystal_size_mid          0.110
_exptl_crystal_size_min          0.050
_refine_diff_density_max         0.901
_refine_diff_density_min         -0.431
_refine_diff_density_rms         0.091
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.016
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     473
_refine_ls_number_reflns         9086
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.016
_refine_ls_R_factor_all          0.0509
_refine_ls_R_factor_gt           0.0353
_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)+(0.0300P)²+1.0104P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0710
_refine_ls_wR_factor_ref         0.0810
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                7332
_reflns_number_total             9086
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            suppl_ncrs-2020-0363_suppl.cif
_cod_data_source_block           shelx
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8105499
_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   0.663
_shelx_estimated_absorpt_t_max   0.964
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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
Ag Ag 0.26060(2) 0.23307(2) 0.35902(2) 0.01466(6) Uani 1 1 d . . . . .
Cl1 Cl 0.26896(6) 0.17084(3) 0.25057(3) 0.01943(13) Uani 1 1 d . . . . .
S1 S 0.52011(6) 0.24032(3) 0.39628(3) 0.01764(14) Uani 1 1 d . . . . .
P1 P 0.23070(6) 0.36667(3) 0.36172(3) 0.01239(13) Uani 1 1 d . . . . .
P2 P 0.17069(6) 0.13700(3) 0.42419(3) 0.01308(13) Uani 1 1 d . . . . .
O1 O 0.73790(16) 0.26845(9) 0.33888(9) 0.0219(4) Uani 1 1 d . . . . .
N1 N 0.5725(2) 0.22098(11) 0.27719(10) 0.0183(5) Uani 1 1 d D . . . .
H1N H 0.4899(12) 0.2077(14) 0.2739(13) 0.022 Uiso 1 1 d D U . . .
C1 C 0.6146(2) 0.24362(12) 0.33502(13) 0.0172(5) Uani 1 1 d . . . . .
C2 C 0.6370(3) 0.22109(13) 0.22008(13) 0.0219(6) Uani 1 1 d . . . . .
C3 C 0.7728(3) 0.21608(13) 0.21751(14) 0.0267(6) Uani 1 1 d . . . . .
H3 H 0.8292 0.2156 0.2552 0.032 Uiso 1 1 calc R U . . .
C4 C 0.8250(3) 0.21181(15) 0.15912(16) 0.0364(8) Uani 1 1 d . . . . .
H4 H 0.9176 0.2086 0.1573 0.044 Uiso 1 1 calc R U . . .
C5 C 0.7446(4) 0.21216(15) 0.10380(15) 0.0398(8) Uani 1 1 d . . . . .
H5 H 0.7815 0.2088 0.0643 0.048 Uiso 1 1 calc R U . . .
C6 C 0.6091(3) 0.21753(15) 0.10665(15) 0.0372(8) Uani 1 1 d . . . . .
H6 H 0.5529 0.2179 0.0689 0.045 Uiso 1 1 calc R U . . .
C7 C 0.5559(3) 0.22228(14) 0.16412(14) 0.0284(6) Uani 1 1 d . . . . .
H7 H 0.4633 0.2264 0.1656 0.034 Uiso 1 1 calc R U . . .
C8 C 0.7959(2) 0.29628(14) 0.39905(13) 0.0230(6) Uani 1 1 d . . . . .
H8A H 0.8927 0.2909 0.4009 0.028 Uiso 1 1 calc R U . . .
H8B H 0.7631 0.2674 0.4338 0.028 Uiso 1 1 calc R U . . .
C9 C 0.7612(3) 0.37532(14) 0.40696(14) 0.0284(6) Uani 1 1 d . . . . .
H9A H 0.7958 0.3921 0.4487 0.043 Uiso 1 1 calc R U . . .
H9B H 0.6653 0.3810 0.4028 0.043 Uiso 1 1 calc R U . . .
H9C H 0.7999 0.4044 0.3745 0.043 Uiso 1 1 calc R U . . .
C11 C 0.3544(2) 0.41694(12) 0.32189(11) 0.0132(5) Uani 1 1 d . . . . .
C12 C 0.4062(2) 0.38266(13) 0.27071(12) 0.0174(5) Uani 1 1 d . . . . .
H12 H 0.3841 0.3333 0.2611 0.021 Uiso 1 1 calc R U . . .
C13 C 0.4897(2) 0.42037(15) 0.23387(13) 0.0246(6) Uani 1 1 d . . . . .
H13 H 0.5250 0.3967 0.1993 0.030 Uiso 1 1 calc R U . . .
C14 C 0.5216(2) 0.49251(15) 0.24745(13) 0.0240(6) Uani 1 1 d . . . . .
H14 H 0.5769 0.5186 0.2214 0.029 Uiso 1 1 calc R U . . .
C15 C 0.4733(2) 0.52651(13) 0.29863(13) 0.0214(6) Uani 1 1 d . . . . .
H15 H 0.4972 0.5756 0.3084 0.026 Uiso 1 1 calc R U . . .
C16 C 0.3897(2) 0.48901(13) 0.33590(12) 0.0183(5) Uani 1 1 d . . . . .
H16 H 0.3564 0.5126 0.3710 0.022 Uiso 1 1 calc R U . . .
C21 C 0.0811(2) 0.40822(13) 0.32497(11) 0.0149(5) Uani 1 1 d . . . . .
C22 C 0.0016(2) 0.36693(14) 0.28270(12) 0.0192(5) Uani 1 1 d . . . . .
H22 H 0.0196 0.3165 0.2775 0.023 Uiso 1 1 calc R U . . .
C23 C -0.1049(3) 0.39909(15) 0.24767(13) 0.0258(6) Uani 1 1 d . . . . .
H23 H -0.1587 0.3708 0.2185 0.031 Uiso 1 1 calc R U . . .
C24 C -0.1316(2) 0.47260(16) 0.25584(13) 0.0263(6) Uani 1 1 d . . . . .
H24 H -0.2033 0.4947 0.2318 0.032 Uiso 1 1 calc R U . . .
C25 C -0.0546(2) 0.51393(14) 0.29878(12) 0.0225(6) Uani 1 1 d . . . . .
H25 H -0.0750 0.5639 0.3049 0.027 Uiso 1 1 calc R U . . .
C26 C 0.0523(2) 0.48239(13) 0.33293(12) 0.0173(5) Uani 1 1 d . . . . .
H26 H 0.1061 0.5111 0.3618 0.021 Uiso 1 1 calc R U . . .
C31 C 0.2443(2) 0.40207(12) 0.44189(11) 0.0141(5) Uani 1 1 d . . . . .
C32 C 0.3681(2) 0.40655(13) 0.47514(12) 0.0193(5) Uani 1 1 d . . . . .
H32 H 0.4451 0.3967 0.4542 0.023 Uiso 1 1 calc R U . . .
C33 C 0.3790(3) 0.42526(14) 0.53846(13) 0.0222(6) Uani 1 1 d . . . . .
H33 H 0.4636 0.4284 0.5604 0.027 Uiso 1 1 calc R U . . .
C34 C 0.2682(3) 0.43933(14) 0.56994(13) 0.0233(6) Uani 1 1 d . . . . .
H34 H 0.2764 0.4520 0.6133 0.028 Uiso 1 1 calc R U . . .
C35 C 0.1444(3) 0.43469(14) 0.53740(12) 0.0229(6) Uani 1 1 d . . . . .
H35 H 0.0678 0.4442 0.5587 0.027 Uiso 1 1 calc R U . . .
C36 C 0.1325(2) 0.41622(13) 0.47406(12) 0.0187(5) Uani 1 1 d . . . . .
H36 H 0.0476 0.4131 0.4523 0.022 Uiso 1 1 calc R U . . .
C41 C 0.1762(2) 0.15424(12) 0.50868(11) 0.0143(5) Uani 1 1 d . . . . .
C42 C 0.1888(3) 0.22594(13) 0.53028(12) 0.0216(6) Uani 1 1 d . . . . .
H42 H 0.1972 0.2645 0.5011 0.026 Uiso 1 1 calc R U . . .
C43 C 0.1890(3) 0.24162(14) 0.59411(13) 0.0260(6) Uani 1 1 d . . . . .
H43 H 0.1974 0.2907 0.6082 0.031 Uiso 1 1 calc R U . . .
C44 C 0.1770(2) 0.18604(14) 0.63708(12) 0.0218(6) Uani 1 1 d . . . . .
H44 H 0.1765 0.1969 0.6807 0.026 Uiso 1 1 calc R U . . .
C45 C 0.1657(3) 0.11417(14) 0.61638(12) 0.0222(6) Uani 1 1 d . . . . .
H45 H 0.1584 0.0758 0.6459 0.027 Uiso 1 1 calc R U . . .
C46 C 0.1651(2) 0.09833(13) 0.55262(12) 0.0176(5) Uani 1 1 d . . . . .
H46 H 0.1571 0.0491 0.5388 0.021 Uiso 1 1 calc R U . . .
C51 C 0.2510(2) 0.04768(12) 0.41970(11) 0.0146(5) Uani 1 1 d . . . . .
C52 C 0.3885(2) 0.04606(13) 0.42407(12) 0.0197(5) Uani 1 1 d . . . . .
H52 H 0.4365 0.0906 0.4272 0.024 Uiso 1 1 calc R U . . .
C53 C 0.4556(3) -0.01980(14) 0.42392(13) 0.0254(6) Uani 1 1 d . . . . .
H53 H 0.5491 -0.0203 0.4276 0.030 Uiso 1 1 calc R U . . .
C54 C 0.3861(3) -0.08489(14) 0.41848(12) 0.0226(6) Uani 1 1 d . . . . .
H54 H 0.4319 -0.1301 0.4186 0.027 Uiso 1 1 calc R U . . .
C55 C 0.2498(3) -0.08394(13) 0.41281(12) 0.0204(6) Uani 1 1 d . . . . .
H55 H 0.2022 -0.1285 0.4083 0.024 Uiso 1 1 calc R U . . .
C56 C 0.1824(2) -0.01811(13) 0.41364(12) 0.0177(5) Uani 1 1 d . . . . .
H56 H 0.0889 -0.0179 0.4100 0.021 Uiso 1 1 calc R U . . .
C61 C -0.0017(2) 0.11610(12) 0.40149(11) 0.0135(5) Uani 1 1 d . . . . .
C62 C -0.0339(2) 0.09880(13) 0.33824(12) 0.0181(5) Uani 1 1 d . . . . .
H62 H 0.0318 0.1006 0.3090 0.022 Uiso 1 1 calc R U . . .
C63 C -0.1624(2) 0.07896(13) 0.31807(12) 0.0200(5) Uani 1 1 d . . . . .
H63 H -0.1831 0.0654 0.2754 0.024 Uiso 1 1 calc R U . . .
C64 C -0.2597(2) 0.07883(13) 0.35966(12) 0.0192(5) Uani 1 1 d . . . . .
H64 H -0.3474 0.0660 0.3454 0.023 Uiso 1 1 calc R U . . .
C65 C -0.2292(2) 0.09739(13) 0.42214(12) 0.0183(5) Uani 1 1 d . . . . .
H65 H -0.2963 0.0980 0.4507 0.022 Uiso 1 1 calc R U . . .
C66 C -0.1000(2) 0.11527(12) 0.44331(12) 0.0171(5) Uani 1 1 d . . . . .
H66 H -0.0792 0.1269 0.4864 0.021 Uiso 1 1 calc R U . . .
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'
S S 0.1246 0.1234 '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'
Cl Cl 0.1484 0.1585 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
P2 Ag P1 130.03(2) . .
P2 Ag Cl1 103.26(2) . .
P1 Ag Cl1 118.10(2) . .
P2 Ag S1 105.56(2) . .
P1 Ag S1 93.69(2) . .
Cl1 Ag S1 100.59(2) . .
C1 S1 Ag 112.35(9) . .
C31 P1 C11 104.62(11) . .
C31 P1 C21 104.68(11) . .
C11 P1 C21 100.08(10) . .
C31 P1 Ag 111.98(7) . .
C11 P1 Ag 113.48(8) . .
C21 P1 Ag 120.28(8) . .
C61 P2 C41 104.59(11) . .
C61 P2 C51 102.92(11) . .
C41 P2 C51 103.08(11) . .
C61 P2 Ag 113.17(8) . .
C41 P2 Ag 116.69(8) . .
C51 P2 Ag 114.82(8) . .
C1 O1 C8 119.2(2) . .
C1 N1 C2 130.4(2) . .
C1 N1 H1N 113.4(19) . .
C2 N1 H1N 116.0(19) . .
O1 C1 N1 113.3(2) . .
O1 C1 S1 124.0(2) . .
N1 C1 S1 122.75(19) . .
C3 C2 C7 119.4(3) . .
C3 C2 N1 124.0(2) . .
C7 C2 N1 116.5(2) . .
C2 C3 C4 119.3(3) . .
C2 C3 H3 120.3 . .
C4 C3 H3 120.3 . .
C5 C4 C3 121.3(3) . .
C5 C4 H4 119.4 . .
C3 C4 H4 119.4 . .
C4 C5 C6 119.1(3) . .
C4 C5 H5 120.4 . .
C6 C5 H5 120.4 . .
C7 C6 C5 120.3(3) . .
C7 C6 H6 119.9 . .
C5 C6 H6 119.9 . .
C6 C7 C2 120.6(3) . .
C6 C7 H7 119.7 . .
C2 C7 H7 119.7 . .
O1 C8 C9 110.6(2) . .
O1 C8 H8A 109.5 . .
C9 C8 H8A 109.5 . .
O1 C8 H8B 109.5 . .
C9 C8 H8B 109.5 . .
H8A C8 H8B 108.1 . .
C8 C9 H9A 109.5 . .
C8 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C8 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C16 C11 C12 119.1(2) . .
C16 C11 P1 123.63(19) . .
C12 C11 P1 117.01(17) . .
C13 C12 C11 120.3(2) . .
C13 C12 H12 119.8 . .
C11 C12 H12 119.8 . .
C12 C13 C14 120.1(3) . .
C12 C13 H13 120.0 . .
C14 C13 H13 120.0 . .
C15 C14 C13 120.2(2) . .
C15 C14 H14 119.9 . .
C13 C14 H14 119.9 . .
C14 C15 C16 120.1(2) . .
C14 C15 H15 120.0 . .
C16 C15 H15 120.0 . .
C11 C16 C15 120.3(2) . .
C11 C16 H16 119.9 . .
C15 C16 H16 119.9 . .
C22 C21 C26 119.3(2) . .
C22 C21 P1 118.50(18) . .
C26 C21 P1 121.84(18) . .
C21 C22 C23 120.4(2) . .
C21 C22 H22 119.8 . .
C23 C22 H22 119.8 . .
C24 C23 C22 119.6(2) . .
C24 C23 H23 120.2 . .
C22 C23 H23 120.2 . .
C25 C24 C23 120.5(2) . .
C25 C24 H24 119.7 . .
C23 C24 H24 119.7 . .
C24 C25 C26 120.0(2) . .
C24 C25 H25 120.0 . .
C26 C25 H25 120.0 . .
C25 C26 C21 120.2(2) . .
C25 C26 H26 119.9 . .
C21 C26 H26 119.9 . .
C36 C31 C32 118.5(2) . .
C36 C31 P1 121.33(18) . .
C32 C31 P1 119.64(18) . .
C33 C32 C31 120.4(2) . .
C33 C32 H32 119.8 . .
C31 C32 H32 119.8 . .
C34 C33 C32 120.8(2) . .
C34 C33 H33 119.6 . .
C32 C33 H33 119.6 . .
C33 C34 C35 119.3(2) . .
C33 C34 H34 120.3 . .
C35 C34 H34 120.3 . .
C36 C35 C34 120.4(2) . .
C36 C35 H35 119.8 . .
C34 C35 H35 119.8 . .
C35 C36 C31 120.6(2) . .
C35 C36 H36 119.7 . .
C31 C36 H36 119.7 . .
C46 C41 C42 118.6(2) . .
C46 C41 P2 122.45(18) . .
C42 C41 P2 118.93(19) . .
C43 C42 C41 120.7(2) . .
C43 C42 H42 119.6 . .
C41 C42 H42 119.6 . .
C44 C43 C42 120.2(2) . .
C44 C43 H43 119.9 . .
C42 C43 H43 119.9 . .
C43 C44 C45 119.8(2) . .
C43 C44 H44 120.1 . .
C45 C44 H44 120.1 . .
C44 C45 C46 120.1(2) . .
C44 C45 H45 119.9 . .
C46 C45 H45 119.9 . .
C45 C46 C41 120.5(2) . .
C45 C46 H46 119.7 . .
C41 C46 H46 119.7 . .
C56 C51 C52 118.8(2) . .
C56 C51 P2 123.51(18) . .
C52 C51 P2 117.70(18) . .
C53 C52 C51 120.7(2) . .
C53 C52 H52 119.7 . .
C51 C52 H52 119.7 . .
C52 C53 C54 119.9(2) . .
C52 C53 H53 120.0 . .
C54 C53 H53 120.0 . .
C55 C54 C53 119.9(2) . .
C55 C54 H54 120.0 . .
C53 C54 H54 120.0 . .
C54 C55 C56 120.2(2) . .
C54 C55 H55 119.9 . .
C56 C55 H55 119.9 . .
C55 C56 C51 120.4(2) . .
C55 C56 H56 119.8 . .
C51 C56 H56 119.8 . .
C66 C61 C62 119.2(2) . .
C66 C61 P2 123.98(19) . .
C62 C61 P2 116.78(18) . .
C63 C62 C61 120.0(2) . .
C63 C62 H62 120.0 . .
C61 C62 H62 120.0 . .
C64 C63 C62 120.5(2) . .
C64 C63 H63 119.8 . .
C62 C63 H63 119.8 . .
C63 C64 C65 119.9(2) . .
C63 C64 H64 120.1 . .
C65 C64 H64 120.1 . .
C64 C65 C66 120.1(2) . .
C64 C65 H65 119.9 . .
C66 C65 H65 119.9 . .
C61 C66 C65 120.2(2) . .
C61 C66 H66 119.9 . .
C65 C66 H66 119.9 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag P2 2.4622(6) .
Ag P1 2.4661(6) .
Ag Cl1 2.5841(6) .
Ag S1 2.7046(6) .
S1 C1 1.684(3) .
P1 C31 1.822(2) .
P1 C11 1.824(2) .
P1 C21 1.825(2) .
P2 C61 1.826(2) .
P2 C41 1.824(3) .
P2 C51 1.835(2) .
O1 C1 1.333(3) .
O1 C8 1.460(3) .
N1 C1 1.338(3) .
N1 C2 1.428(3) .
N1 H1N 0.874(10) .
C2 C3 1.392(4) .
C2 C7 1.397(4) .
C3 C4 1.393(4) .
C3 H3 0.9500 .
C4 C5 1.381(5) .
C4 H4 0.9500 .
C5 C6 1.391(5) .
C5 H5 0.9500 .
C6 C7 1.381(4) .
C6 H6 0.9500 .
C7 H7 0.9500 .
C8 C9 1.502(4) .
C8 H8A 0.9900 .
C8 H8B 0.9900 .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C11 C16 1.394(3) .
C11 C12 1.397(3) .
C12 C13 1.386(3) .
C12 H12 0.9500 .
C13 C14 1.385(4) .
C13 H13 0.9500 .
C14 C15 1.380(4) .
C14 H14 0.9500 .
C15 C16 1.391(3) .
C15 H15 0.9500 .
C16 H16 0.9500 .
C21 C22 1.387(3) .
C21 C26 1.402(3) .
C22 C23 1.398(3) .
C22 H22 0.9500 .
C23 C24 1.387(4) .
C23 H23 0.9500 .
C24 C25 1.383(4) .
C24 H24 0.9500 .
C25 C26 1.388(3) .
C25 H25 0.9500 .
C26 H26 0.9500 .
C31 C36 1.400(3) .
C31 C32 1.400(3) .
C32 C33 1.388(3) .
C32 H32 0.9500 .
C33 C34 1.383(4) .
C33 H33 0.9500 .
C34 C35 1.394(4) .
C34 H34 0.9500 .
C35 C36 1.387(3) .
C35 H35 0.9500 .
C36 H36 0.9500 .
C41 C46 1.398(3) .
C41 C42 1.394(3) .
C42 C43 1.390(4) .
C42 H42 0.9500 .
C43 C44 1.381(4) .
C43 H43 0.9500 .
C44 C45 1.390(3) .
C44 H44 0.9500 .
C45 C46 1.389(3) .
C45 H45 0.9500 .
C46 H46 0.9500 .
C51 C56 1.394(3) .
C51 C52 1.397(3) .
C52 C53 1.386(3) .
C52 H52 0.9500 .
C53 C54 1.387(4) .
C53 H53 0.9500 .
C54 C55 1.386(4) .
C54 H54 0.9500 .
C55 C56 1.388(3) .
C55 H55 0.9500 .
C56 H56 0.9500 .
C61 C66 1.393(3) .
C61 C62 1.398(3) .
C62 C63 1.394(3) .
C62 H62 0.9500 .
C63 C64 1.381(4) .
C63 H63 0.9500 .
C64 C65 1.386(4) .
C64 H64 0.9500 .
C65 C66 1.397(3) .
C65 H65 0.9500 .
C66 H66 0.9500 .
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
C8 O1 C1 N1 178.8(2) . . . .
C8 O1 C1 S1 -1.4(3) . . . .
C2 N1 C1 O1 -1.7(4) . . . .
C2 N1 C1 S1 178.54(19) . . . .
Ag S1 C1 O1 159.41(17) . . . .
Ag S1 C1 N1 -20.9(2) . . . .
C1 N1 C2 C3 28.7(4) . . . .
C1 N1 C2 C7 -155.0(3) . . . .
C7 C2 C3 C4 -0.5(4) . . . .
N1 C2 C3 C4 175.8(2) . . . .
C2 C3 C4 C5 -0.3(4) . . . .
C3 C4 C5 C6 0.6(4) . . . .
C4 C5 C6 C7 -0.1(4) . . . .
C5 C6 C7 C2 -0.6(4) . . . .
C3 C2 C7 C6 0.9(4) . . . .
N1 C2 C7 C6 -175.6(2) . . . .
C1 O1 C8 C9 -85.4(3) . . . .
C31 P1 C11 C16 -32.9(2) . . . .
C21 P1 C11 C16 75.3(2) . . . .
Ag P1 C11 C16 -155.19(18) . . . .
C31 P1 C11 C12 153.47(18) . . . .
C21 P1 C11 C12 -98.3(2) . . . .
Ag P1 C11 C12 31.1(2) . . . .
C16 C11 C12 C13 -1.1(4) . . . .
P1 C11 C12 C13 172.92(19) . . . .
C11 C12 C13 C14 -0.4(4) . . . .
C12 C13 C14 C15 1.7(4) . . . .
C13 C14 C15 C16 -1.6(4) . . . .
C12 C11 C16 C15 1.2(3) . . . .
P1 C11 C16 C15 -172.39(18) . . . .
C14 C15 C16 C11 0.2(4) . . . .
C31 P1 C21 C22 -143.02(19) . . . .
C11 P1 C21 C22 108.8(2) . . . .
Ag P1 C21 C22 -16.1(2) . . . .
C31 P1 C21 C26 44.1(2) . . . .
C11 P1 C21 C26 -64.1(2) . . . .
Ag P1 C21 C26 171.01(17) . . . .
C26 C21 C22 C23 1.0(4) . . . .
P1 C21 C22 C23 -172.1(2) . . . .
C21 C22 C23 C24 -0.6(4) . . . .
C22 C23 C24 C25 -0.7(4) . . . .
C23 C24 C25 C26 1.7(4) . . . .
C24 C25 C26 C21 -1.3(4) . . . .
C22 C21 C26 C25 0.0(4) . . . .
P1 C21 C26 C25 172.81(19) . . . .
C11 P1 C31 C36 138.9(2) . . . .
C21 P1 C31 C36 34.1(2) . . . .
Ag P1 C31 C36 -97.78(19) . . . .
C11 P1 C31 C32 -49.4(2) . . . .
C21 P1 C31 C32 -154.18(19) . . . .
Ag P1 C31 C32 73.9(2) . . . .
C36 C31 C32 C33 -0.6(4) . . . .
P1 C31 C32 C33 -172.48(19) . . . .
C31 C32 C33 C34 0.4(4) . . . .
C32 C33 C34 C35 -0.1(4) . . . .
C33 C34 C35 C36 -0.1(4) . . . .
C34 C35 C36 C31 -0.1(4) . . . .
C32 C31 C36 C35 0.4(4) . . . .
P1 C31 C36 C35 172.18(19) . . . .
C61 P2 C41 C46 73.1(2) . . . .
C51 P2 C41 C46 -34.3(2) . . . .
Ag P2 C41 C46 -161.08(17) . . . .
C61 P2 C41 C42 -105.4(2) . . . .
C51 P2 C41 C42 147.3(2) . . . .
Ag P2 C41 C42 20.5(2) . . . .
C46 C41 C42 C43 -0.6(4) . . . .
P2 C41 C42 C43 177.9(2) . . . .
C41 C42 C43 C44 0.1(4) . . . .
C42 C43 C44 C45 0.5(4) . . . .
C43 C44 C45 C46 -0.6(4) . . . .
C44 C45 C46 C41 0.2(4) . . . .
C42 C41 C46 C45 0.4(4) . . . .
P2 C41 C46 C45 -177.98(19) . . . .
C61 P2 C51 C56 -12.1(2) . . . .
C41 P2 C51 C56 96.5(2) . . . .
Ag P2 C51 C56 -135.49(19) . . . .
C61 P2 C51 C52 169.4(2) . . . .
C41 P2 C51 C52 -82.0(2) . . . .
Ag P2 C51 C52 46.0(2) . . . .
C56 C51 C52 C53 -1.6(4) . . . .
P2 C51 C52 C53 177.0(2) . . . .
C51 C52 C53 C54 1.0(4) . . . .
C52 C53 C54 C55 0.4(4) . . . .
C53 C54 C55 C56 -1.1(4) . . . .
C54 C55 C56 C51 0.5(4) . . . .
C52 C51 C56 C55 0.8(4) . . . .
P2 C51 C56 C55 -177.66(19) . . . .
C41 P2 C61 C66 0.2(2) . . . .
C51 P2 C61 C66 107.7(2) . . . .
Ag P2 C61 C66 -127.80(19) . . . .
C41 P2 C61 C62 -178.60(18) . . . .
C51 P2 C61 C62 -71.2(2) . . . .
Ag P2 C61 C62 53.36(19) . . . .
C66 C61 C62 C63 -1.9(3) . . . .
P2 C61 C62 C63 177.04(18) . . . .
C61 C62 C63 C64 2.4(4) . . . .
C62 C63 C64 C65 -1.1(4) . . . .
C63 C64 C65 C66 -0.8(4) . . . .
C62 C61 C66 C65 0.0(3) . . . .
P2 C61 C66 C65 -178.84(18) . . . .
C64 C65 C66 C61 1.4(4) . . . .
