#------------------------------------------------------------------------------
#$Date: 2024-07-05 19:03:51 +0300 (Fri, 05 Jul 2024) $
#$Revision: 293019 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/59/7715968.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_7715968
loop_
_publ_author_name
'Ziółkowska, Aleksandra'
'Prześniak-Welenc, Marta'
'Kruczyński, Tomasz'
'Gamer, Michael'
'Ponikiewski, Łukasz'
_publ_section_title
;
 From phosphanylphosphaalkenes to coordination copper and silver polymers
 containing P-P bonds.
;
_journal_issue                   22
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9350
_journal_page_last               9357
_journal_paper_doi               10.1039/d4dt00987h
_journal_volume                  53
_journal_year                    2024
_chemical_formula_moiety         'C23 H33 Ag Cl P2 S'
_chemical_formula_sum            'C23 H33 Ag Cl P2 S'
_chemical_formula_weight         546.81
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.4.5
_audit_creation_date             2023-10-16T22:24:06-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_audit_update_record
;
2024-04-02 deposited with the CCDC.	2024-05-07 downloaded from the CCDC.
;
_cell_angle_alpha                90.826(4)
_cell_angle_beta                 103.141(3)
_cell_angle_gamma                115.892(3)
_cell_formula_units_Z            2
_cell_length_a                   8.6692(4)
_cell_length_b                   9.7343(4)
_cell_length_c                   16.9516(8)
_cell_measurement_reflns_used    28653
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      67.92
_cell_measurement_theta_min      2.70
_cell_measurement_wavelength     1.54186
_cell_volume                     1242.63(11)
_computing_cell_refinement
;
X-Area Recipe 1.34.0.0 (STOE, 2019)
;
_computing_data_collection
;
X-Area WinXpose 2.0.22.0 (STOE, 2016)
;
_computing_data_reduction
;
X-Area Integrate 1.77.0.0 (STOE, 2019)
X-Area X-Red32 1.65.0.0 (STOE, 2018) 
;
_computing_molecular_graphics    'Ortep for Windows (Farrugia, 2012)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_diffrn_ambient_temperature      120(2)
_diffrn_detector                 'image plate (34 cm diameter)'
_diffrn_detector_area_resol_mean 6.67
_diffrn_detector_type            'STOE Imaging Plate'
_diffrn_measured_fraction_theta_full 0.95
_diffrn_measured_fraction_theta_max 0.95
_diffrn_measurement_details      ' 1062 frames, detector distance = 45 mm'
_diffrn_measurement_device       '2-circle diffractometer'
_diffrn_measurement_device_type  'STOE IPDS 2T'
_diffrn_measurement_method       'rotation method, ω scans'
_diffrn_radiation_collimation    '0.6 mm diameter'
_diffrn_radiation_monochromator  'parabolic x-ray mirror'
_diffrn_radiation_polarisn_norm  270
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54186
_diffrn_reflns_av_R_equivalents  0.0426
_diffrn_reflns_av_unetI/netI     0.0291
_diffrn_reflns_Laue_measured_fraction_full 0.95
_diffrn_reflns_Laue_measured_fraction_max 0.95
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            12171
_diffrn_reflns_point_group_measured_fraction_full 0.95
_diffrn_reflns_point_group_measured_fraction_max 0.95
_diffrn_reflns_theta_full        65.984
_diffrn_reflns_theta_max         65.984
_diffrn_reflns_theta_min         2.7
_diffrn_source                   'GeniX Cu, 0.05 x 0.05 mm2 microfocus'
_diffrn_source_current           0.600
_diffrn_source_power             0.030
_diffrn_source_voltage           50
_exptl_absorpt_coefficient_mu    9.538
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.461
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             562
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.13
_refine_diff_density_max         2.113
_refine_diff_density_min         -1.677
_refine_diff_density_rms         0.15
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.089
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     259
_refine_ls_number_reflns         4128
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.089
_refine_ls_R_factor_all          0.0668
_refine_ls_R_factor_gt           0.0632
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0838P)²+9.2502P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1693
_refine_ls_wR_factor_ref         0.173
_reflns_Friedel_coverage         0
_reflns_number_gt                3837
_reflns_number_total             4128
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d4dt00987h2.cif
_cod_data_source_block           poly_3a_Ag
_cod_depositor_comments
'Adding full bibliography for 7715966--7715972.cif.'
_cod_original_cell_volume        1242.62(10)
_cod_database_code               7715968
_shelx_estimated_absorpt_t_min   0.349
_shelx_estimated_absorpt_t_max   0.37
_shelx_shelxl_version_number     2018/3
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -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
C1 C 0.3229(9) 0.4874(7) 0.7630(4) 0.0288(14) Uani 1 1 d . . . . .
H1 H 0.430722 0.474267 0.781387 0.035 Uiso 1 1 calc R U . . .
C2 C 0.2254(8) 0.4023(7) 0.6781(4) 0.0272(13) Uani 1 1 d . . . . .
C3 C 0.2700(9) 0.2909(9) 0.6504(5) 0.0396(17) Uani 1 1 d . . . . .
H3 H 0.358762 0.272916 0.683736 0.047 Uiso 1 1 calc R U . . .
C4 C 0.1801(10) 0.2069(9) 0.5722(5) 0.0433(19) Uani 1 1 d . . . . .
H4 H 0.207982 0.131631 0.554525 0.052 Uiso 1 1 calc R U . . .
C5 C 0.0532(10) 0.2344(9) 0.5221(5) 0.0430(18) Uani 1 1 d . . . . .
H5 H -0.004196 0.178919 0.470246 0.052 Uiso 1 1 calc R U . . .
C6 C 0.0097(10) 0.3420(9) 0.5474(5) 0.0427(18) Uani 1 1 d . . . . .
H6 H -0.080135 0.358116 0.513609 0.051 Uiso 1 1 calc R U . . .
C7 C 0.0988(9) 0.4282(8) 0.6235(4) 0.0318(15) Uani 1 1 d . . . . .
H7 H 0.072713 0.506335 0.638364 0.038 Uiso 1 1 calc R U . . .
C8 C 0.2124(9) 0.4317(8) 0.8252(4) 0.0325(15) Uani 1 1 d . . . . .
C9 C 0.2877(11) 0.3945(9) 0.8980(5) 0.0418(18) Uani 1 1 d . . . . .
H9 H 0.399495 0.398653 0.90639 0.05 Uiso 1 1 calc R U . . .
C10 C 0.1964(12) 0.3510(10) 0.9586(5) 0.0469(19) Uani 1 1 d . . . . .
H10 H 0.247059 0.324398 1.006558 0.056 Uiso 1 1 calc R U . . .
C11 C 0.0334(11) 0.3470(9) 0.9481(5) 0.0438(18) Uani 1 1 d . . . . .
H11 H -0.025574 0.320412 0.989235 0.053 Uiso 1 1 calc R U . . .
C12 C -0.0429(10) 0.3831(8) 0.8756(5) 0.0396(17) Uani 1 1 d . . . . .
H12 H -0.154682 0.37898 0.867488 0.048 Uiso 1 1 calc R U . . .
C13 C 0.0468(10) 0.4254(8) 0.8152(4) 0.0345(16) Uani 1 1 d . . . . .
H13 H -0.005588 0.449957 0.766901 0.041 Uiso 1 1 calc R U . . .
C14 C 0.5822(9) 0.9641(8) 0.6690(4) 0.0309(14) Uani 1 1 d . . . . .
C15 C 0.4074(10) 0.9131(9) 0.6038(5) 0.0437(18) Uani 1 1 d . . . . .
H15A H 0.310021 0.857538 0.627186 0.066 Uiso 1 1 calc R U . . .
H15B H 0.403123 0.847707 0.559609 0.066 Uiso 1 1 calc R U . . .
H15C H 0.399169 1.002001 0.583712 0.066 Uiso 1 1 calc R U . . .
C16 C 0.5917(10) 1.0699(8) 0.7396(5) 0.0403(17) Uani 1 1 d . . . . .
H16A H 0.599543 1.164802 0.720879 0.06 Uiso 1 1 calc R U . . .
H16B H 0.694613 1.090905 0.783235 0.06 Uiso 1 1 calc R U . . .
H16C H 0.486933 1.020371 0.758866 0.06 Uiso 1 1 calc R U . . .
C17 C 0.7339(11) 1.0569(9) 0.6287(5) 0.0460(19) Uani 1 1 d . . . . .
H17A H 0.714289 1.138236 0.604363 0.069 Uiso 1 1 calc R U . . .
H17B H 0.73595 0.98974 0.587347 0.069 Uiso 1 1 calc R U . . .
H17C H 0.845416 1.100093 0.669451 0.069 Uiso 1 1 calc R U . . .
C18 C 0.8243(9) 0.8212(8) 0.7602(4) 0.0306(14) Uani 1 1 d . . . . .
C19 C 0.9219(9) 0.9620(9) 0.8260(5) 0.0389(17) Uani 1 1 d . . . . .
H19A H 0.85079 0.953211 0.863319 0.058 Uiso 1 1 calc R U . . .
H19B H 0.942647 1.053728 0.80057 0.058 Uiso 1 1 calc R U . . .
H19C H 1.033456 0.967139 0.855173 0.058 Uiso 1 1 calc R U . . .
C20 C 0.9383(10) 0.8334(9) 0.7002(5) 0.0426(18) Uani 1 1 d . . . . .
H20A H 0.967597 0.928802 0.677647 0.064 Uiso 1 1 calc R U . . .
H20B H 0.872753 0.748985 0.656867 0.064 Uiso 1 1 calc R U . . .
H20C H 1.045524 0.829879 0.728646 0.064 Uiso 1 1 calc R U . . .
C21 C 0.8004(10) 0.6756(8) 0.8003(5) 0.0382(17) Uani 1 1 d . . . . .
H21A H 0.914709 0.682517 0.826002 0.057 Uiso 1 1 calc R U . . .
H21B H 0.735832 0.587097 0.759411 0.057 Uiso 1 1 calc R U . . .
H21C H 0.735562 0.666075 0.840597 0.057 Uiso 1 1 calc R U . . .
C22 C 0.3565(12) 0.8074(10) 0.9270(6) 0.055(2) Uani 1 1 d . . . . .
H22A H 0.291872 0.846751 0.887103 0.066 Uiso 1 1 calc R U . . .
H22B H 0.272885 0.707383 0.936501 0.066 Uiso 1 1 calc R U . . .
C23 C 0.4431(13) 0.9171(9) 1.0066(6) 0.054(2) Uani 1 1 d . . . . .
H23A H 0.517065 0.882447 1.04423 0.065 Uiso 1 1 calc R U . . .
H23B H 0.351435 0.914648 1.031164 0.065 Uiso 1 1 calc R U . . .
Cl1 Cl 0.3528(2) 0.5787(2) 0.43208(11) 0.0394(4) Uani 1 1 d . . . . .
P1 P 0.3881(2) 0.69975(19) 0.76471(11) 0.0291(4) Uani 1 1 d . . . . .
P2 P 0.5954(2) 0.78334(17) 0.69843(10) 0.0240(4) Uani 1 1 d . . . . .
S1 S 0.5260(2) 0.7880(2) 0.88782(11) 0.0361(4) Uani 1 1 d . . . . .
Ag1 Ag 0.50210(7) 0.60015(6) 0.58072(3) 0.0369(2) 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 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.282 '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
C2 C1 C8 113.3(5) . . ?
C2 C1 P1 111.2(4) . . ?
C8 C1 P1 106.0(4) . . ?
C2 C1 H1 108.7 . . ?
C8 C1 H1 108.7 . . ?
P1 C1 H1 108.7 . . ?
C7 C2 C3 116.6(6) . . ?
C7 C2 C1 125.3(6) . . ?
C3 C2 C1 118.0(6) . . ?
C4 C3 C2 119.9(7) . . ?
C4 C3 H3 120.1 . . ?
C2 C3 H3 120.1 . . ?
C5 C4 C3 120.7(7) . . ?
C5 C4 H4 119.6 . . ?
C3 C4 H4 119.6 . . ?
C6 C5 C4 120.3(8) . . ?
C6 C5 H5 119.9 . . ?
C4 C5 H5 119.9 . . ?
C5 C6 C7 120.0(7) . . ?
C5 C6 H6 120 . . ?
C7 C6 H6 120 . . ?
C6 C7 C2 122.4(7) . . ?
C6 C7 H7 118.8 . . ?
C2 C7 H7 118.8 . . ?
C13 C8 C9 118.2(7) . . ?
C13 C8 C1 123.6(6) . . ?
C9 C8 C1 118.1(7) . . ?
C8 C9 C10 120.4(8) . . ?
C8 C9 H9 119.8 . . ?
C10 C9 H9 119.8 . . ?
C11 C10 C9 120.8(7) . . ?
C11 C10 H10 119.6 . . ?
C9 C10 H10 119.6 . . ?
C10 C11 C12 119.2(7) . . ?
C10 C11 H11 120.4 . . ?
C12 C11 H11 120.4 . . ?
C11 C12 C13 120.2(7) . . ?
C11 C12 H12 119.9 . . ?
C13 C12 H12 119.9 . . ?
C8 C13 C12 121.3(7) . . ?
C8 C13 H13 119.4 . . ?
C12 C13 H13 119.4 . . ?
C15 C14 C16 110.0(6) . . ?
C15 C14 C17 107.2(6) . . ?
C16 C14 C17 108.5(6) . . ?
C15 C14 P2 106.5(5) . . ?
C16 C14 P2 114.9(5) . . ?
C17 C14 P2 109.4(5) . . ?
C14 C15 H15A 109.5 . . ?
C14 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C14 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C14 C16 H16A 109.5 . . ?
C14 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C14 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C14 C17 H17A 109.5 . . ?
C14 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C14 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C21 C18 C19 109.5(6) . . ?
C21 C18 C20 106.3(6) . . ?
C19 C18 C20 109.9(6) . . ?
C21 C18 P2 106.0(5) . . ?
C19 C18 P2 116.6(5) . . ?
C20 C18 P2 108.0(5) . . ?
C18 C19 H19A 109.5 . . ?
C18 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C18 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C18 C20 H20A 109.5 . . ?
C18 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C18 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C18 C21 H21A 109.5 . . ?
C18 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C18 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 S1 109.8(6) . . ?
C23 C22 H22A 109.7 . . ?
S1 C22 H22A 109.7 . . ?
C23 C22 H22B 109.7 . . ?
S1 C22 H22B 109.7 . . ?
H22A C22 H22B 108.2 . . ?
C22 C23 C23 112.2(10) . 2_677 ?
C22 C23 H23A 109.2 . . ?
C23 C23 H23A 109.2 2_677 . ?
C22 C23 H23B 109.2 . . ?
C23 C23 H23B 109.2 2_677 . ?
H23A C23 H23B 107.9 . . ?
Ag1 Cl1 Ag1 81.20(5) . 2_666 ?
C1 P1 S1 102.8(2) . . ?
C1 P1 P2 104.1(2) . . ?
S1 P1 P2 104.44(9) . . ?
C14 P2 C18 112.8(3) . . ?
C14 P2 P1 99.1(2) . . ?
C18 P2 P1 115.2(2) . . ?
C14 P2 Ag1 111.2(2) . . ?
C18 P2 Ag1 110.0(2) . . ?
P1 P2 Ag1 108.06(8) . . ?
C22 S1 P1 101.2(3) . . ?
P2 Ag1 Cl1 134.83(6) . . ?
P2 Ag1 Cl1 122.91(6) . 2_666 ?
Cl1 Ag1 Cl1 98.80(5) . 2_666 ?
P2 Ag1 Ag1 163.20(5) . 2_666 ?
Cl1 Ag1 Ag1 50.31(4) . 2_666 ?
Cl1 Ag1 Ag1 48.49(4) 2_666 2_666 ?
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
C1 C2 1.508(9) . ?
C1 C8 1.531(10) . ?
C1 P1 1.888(7) . ?
C1 H1 0.98 . ?
C2 C7 1.383(9) . ?
C2 C3 1.408(10) . ?
C3 C4 1.406(11) . ?
C3 H3 0.93 . ?
C4 C5 1.357(11) . ?
C4 H4 0.93 . ?
C5 C6 1.353(12) . ?
C5 H5 0.93 . ?
C6 C7 1.383(10) . ?
C6 H6 0.93 . ?
C7 H7 0.93 . ?
C8 C13 1.380(10) . ?
C8 C9 1.390(10) . ?
C9 C10 1.396(12) . ?
C9 H9 0.93 . ?
C10 C11 1.367(12) . ?
C10 H10 0.93 . ?
C11 C12 1.385(12) . ?
C11 H11 0.93 . ?
C12 C13 1.385(11) . ?
C12 H12 0.93 . ?
C13 H13 0.93 . ?
C14 C15 1.526(9) . ?
C14 C16 1.531(10) . ?
C14 C17 1.549(10) . ?
C14 P2 1.880(7) . ?
C15 H15A 0.96 . ?
C15 H15B 0.96 . ?
C15 H15C 0.96 . ?
C16 H16A 0.96 . ?
C16 H16B 0.96 . ?
C16 H16C 0.96 . ?
C17 H17A 0.96 . ?
C17 H17B 0.96 . ?
C17 H17C 0.96 . ?
C18 C21 1.532(9) . ?
C18 C19 1.533(10) . ?
C18 C20 1.545(10) . ?
C18 P2 1.892(7) . ?
C19 H19A 0.96 . ?
C19 H19B 0.96 . ?
C19 H19C 0.96 . ?
C20 H20A 0.96 . ?
C20 H20B 0.96 . ?
C20 H20C 0.96 . ?
C21 H21A 0.96 . ?
C21 H21B 0.96 . ?
C21 H21C 0.96 . ?
C22 C23 1.523(12) . ?
C22 S1 1.821(8) . ?
C22 H22A 0.97 . ?
C22 H22B 0.97 . ?
C23 C23 1.532(16) 2_677 ?
C23 H23A 0.97 . ?
C23 H23B 0.97 . ?
Cl1 Ag1 2.5167(18) . ?
Cl1 Ag1 2.5861(17) 2_666 ?
P1 S1 2.107(2) . ?
P1 P2 2.196(2) . ?
P2 Ag1 2.3916(16) . ?
Ag1 Ag1 3.3212(10) 2_666 ?
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
_geom_torsion_publ_flag
C8 C1 C2 C7 78.5(8) . . . . ?
P1 C1 C2 C7 -40.8(8) . . . . ?
C8 C1 C2 C3 -104.0(7) . . . . ?
P1 C1 C2 C3 136.8(6) . . . . ?
C7 C2 C3 C4 -3.4(10) . . . . ?
C1 C2 C3 C4 178.9(7) . . . . ?
C2 C3 C4 C5 1.5(12) . . . . ?
C3 C4 C5 C6 -0.9(12) . . . . ?
C4 C5 C6 C7 2.1(12) . . . . ?
C5 C6 C7 C2 -4.2(11) . . . . ?
C3 C2 C7 C6 4.8(10) . . . . ?
C1 C2 C7 C6 -177.6(7) . . . . ?
C2 C1 C8 C13 -54.8(9) . . . . ?
P1 C1 C8 C13 67.4(7) . . . . ?
C2 C1 C8 C9 129.4(7) . . . . ?
P1 C1 C8 C9 -108.4(6) . . . . ?
C13 C8 C9 C10 0.5(11) . . . . ?
C1 C8 C9 C10 176.6(7) . . . . ?
C8 C9 C10 C11 -1.3(13) . . . . ?
C9 C10 C11 C12 1.6(12) . . . . ?
C10 C11 C12 C13 -1.2(11) . . . . ?
C9 C8 C13 C12 -0.1(10) . . . . ?
C1 C8 C13 C12 -175.9(6) . . . . ?
C11 C12 C13 C8 0.4(11) . . . . ?
S1 C22 C23 C23 67.4(12) . . . 2_677 ?
C2 C1 P1 S1 -178.4(4) . . . . ?
C8 C1 P1 S1 58.1(4) . . . . ?
C2 C1 P1 P2 -69.6(5) . . . . ?
C8 C1 P1 P2 166.8(4) . . . . ?
C15 C14 P2 C18 166.8(5) . . . . ?
C16 C14 P2 C18 -71.1(6) . . . . ?
C17 C14 P2 C18 51.2(6) . . . . ?
C15 C14 P2 P1 -70.9(5) . . . . ?
C16 C14 P2 P1 51.2(5) . . . . ?
C17 C14 P2 P1 173.6(5) . . . . ?
C15 C14 P2 Ag1 42.6(6) . . . . ?
C16 C14 P2 Ag1 164.7(4) . . . . ?
C17 C14 P2 Ag1 -72.9(5) . . . . ?
C21 C18 P2 C14 163.4(5) . . . . ?
C19 C18 P2 C14 41.3(6) . . . . ?
C20 C18 P2 C14 -83.0(5) . . . . ?
C21 C18 P2 P1 50.5(5) . . . . ?
C19 C18 P2 P1 -71.5(6) . . . . ?
C20 C18 P2 P1 164.2(4) . . . . ?
C21 C18 P2 Ag1 -71.9(5) . . . . ?
C19 C18 P2 Ag1 166.1(5) . . . . ?
C20 C18 P2 Ag1 41.8(5) . . . . ?
C1 P1 P2 C14 158.8(3) . . . . ?
S1 P1 P2 C14 -93.7(2) . . . . ?
C1 P1 P2 C18 -80.5(3) . . . . ?
S1 P1 P2 C18 27.0(3) . . . . ?
C1 P1 P2 Ag1 42.9(2) . . . . ?
S1 P1 P2 Ag1 150.41(8) . . . . ?
C23 C22 S1 P1 -161.4(6) . . . . ?
C1 P1 S1 C22 -100.8(4) . . . . ?
P2 P1 S1 C22 150.8(3) . . . . ?
C14 P2 Ag1 Cl1 -10.5(3) . . . . ?
C18 P2 Ag1 Cl1 -136.2(2) . . . . ?
P1 P2 Ag1 Cl1 97.33(10) . . . . ?
C14 P2 Ag1 Cl1 143.8(2) . . . 2_666 ?
C18 P2 Ag1 Cl1 18.0(2) . . . 2_666 ?
P1 P2 Ag1 Cl1 -108.47(9) . . . 2_666 ?
C14 P2 Ag1 Ag1 89.8(3) . . . 2_666 ?
C18 P2 Ag1 Ag1 -36.0(3) . . . 2_666 ?
P1 P2 Ag1 Ag1 -162.47(13) . . . 2_666 ?
Ag1 Cl1 Ag1 P2 158.30(7) 2_666 . . . ?
Ag1 Cl1 Ag1 Cl1 0 2_666 . . 2_666 ?
