#------------------------------------------------------------------------------
#$Date: 2016-03-23 02:44:31 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179202 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/37/4313770.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_4313770
loop_
_publ_author_name
'Chun-Long Chen'
'Cheng-Yong Su'
'Yue-Peng Cai'
'Hua-Xin Zhang'
'An-Wu Xu'
'Bei-Sheng Kang'
'Hans-Conrad zur Loye'
_publ_section_title
;
 Multidimensional Frameworks Assembled from Silver(I) Coordination
 Polymers Containing Flexible Bis(thioquinolyl) Ligands: Role of the
 Intra- and Intermolecular Aromatic Stacking Interactions
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3738
_journal_page_last               3750
_journal_paper_doi               10.1021/ic0341035
_journal_volume                  42
_journal_year                    2003
_chemical_formula_sum            'C21 H18 Ag Cl N2 O4 S2'
_chemical_formula_weight         569.81
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 107.378(9)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.243(7)
_cell_length_b                   8.080(4)
_cell_length_c                   21.019(11)
_cell_measurement_temperature    293(2)
_cell_volume                     2146.4(19)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.986
_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  0.0186
_diffrn_reflns_av_sigmaI/netI    0.0222
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -5
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            12278
_diffrn_reflns_theta_full        27.10
_diffrn_reflns_theta_max         27.10
_diffrn_reflns_theta_min         2.03
_exptl_absorpt_coefficient_mu    1.290
_exptl_crystal_density_diffrn    1.763
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1144
_refine_diff_density_max         0.969
_refine_diff_density_min         -0.700
_refine_diff_density_rms         0.091
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     280
_refine_ls_number_reflns         4668
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0555
_refine_ls_R_factor_gt           0.0425
_refine_ls_shift/su_max          0.128
_refine_ls_shift/su_mean         0.006
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0633P)²+4.0908P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1157
_refine_ls_wR_factor_ref         0.1289
_reflns_number_gt                3737
_reflns_number_total             4668
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic0341035si20030130_053547_1.cif
_cod_data_source_block           1
_cod_original_cell_volume        2146(2)
_cod_original_sg_symbol_H-M      'P 1 21/n 1'
_cod_database_code               4313770
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.47978(2) 1.41989(4) 0.684717(18) 0.05295(14) Uani 1 1 d . . .
Cl1 Cl 0.22466(10) 1.38296(18) 0.90607(7) 0.0657(3) Uani 1 1 d . . .
S1 S 0.53633(7) 1.59935(12) 0.80499(5) 0.0431(2) Uani 1 1 d . . .
S2 S 0.41622(8) 1.52583(14) 0.55798(6) 0.0514(3) Uani 1 1 d . . .
O1 O 0.1756(10) 1.5208(12) 0.8770(4) 0.239(6) Uani 1 1 d . . .
O2 O 0.1565(8) 1.2987(15) 0.9287(5) 0.236(5) Uani 1 1 d . . .
O3 O 0.3079(5) 1.4290(14) 0.9585(4) 0.204(5) Uani 1 1 d . . .
O4 O 0.2626(4) 1.3023(8) 0.8587(2) 0.1154(17) Uani 1 1 d . . .
N1 N 0.6636(3) 1.4636(5) 0.71842(18) 0.0538(9) Uani 1 1 d . . .
N2 N 0.3014(3) 1.4942(5) 0.66618(17) 0.0475(8) Uani 1 1 d . . .
C1 C 0.7118(4) 1.4100(9) 0.6765(3) 0.0803(18) Uani 1 1 d . . .
H1A H 0.6709 1.3788 0.6341 0.096 Uiso 1 1 calc R . .
C2 C 0.8231(5) 1.3971(10) 0.6924(3) 0.094(2) Uani 1 1 d . . .
H2A H 0.8542 1.3607 0.6607 0.113 Uiso 1 1 calc R . .
C3 C 0.8821(4) 1.4378(8) 0.7530(3) 0.0795(17) Uani 1 1 d . . .
H3A H 0.9553 1.4283 0.7642 0.095 Uiso 1 1 calc R . .
C4 C 0.8356(3) 1.4953(6) 0.8006(2) 0.0566(11) Uani 1 1 d . . .
C5 C 0.8953(4) 1.5374(7) 0.8654(3) 0.0706(14) Uani 1 1 d . . .
H5A H 0.9686 1.5275 0.8782 0.085 Uiso 1 1 calc R . .
C6 C 0.8467(4) 1.5927(7) 0.9097(3) 0.0719(15) Uani 1 1 d . . .
H6A H 0.8868 1.6180 0.9530 0.086 Uiso 1 1 calc R . .
C7 C 0.7375(4) 1.6119(6) 0.8907(2) 0.0582(11) Uani 1 1 d . . .
H7A H 0.7055 1.6538 0.9211 0.070 Uiso 1 1 calc R . .
C8 C 0.6764(3) 1.5700(5) 0.8279(2) 0.0446(9) Uani 1 1 d . . .
C9 C 0.7232(3) 1.5087(5) 0.7805(2) 0.0450(9) Uani 1 1 d . . .
C10 C 0.5051(3) 1.5023(6) 0.8743(2) 0.0530(10) Uani 1 1 d . . .
H10A H 0.5475 1.5510 0.9159 0.064 Uiso 1 1 calc R . .
H10B H 0.4310 1.5199 0.8705 0.064 Uiso 1 1 calc R . .
C11 C 0.5282(4) 1.3146(6) 0.8738(2) 0.0543(10) Uani 1 1 d . . .
H11A H 0.4754 1.2634 0.8368 0.065 Uiso 1 1 calc R . .
H11B H 0.5967 1.2988 0.8668 0.065 Uiso 1 1 calc R . .
C12 C 0.4720(4) 1.7299(6) 0.5630(2) 0.0583(11) Uani 1 1 d . . .
H12A H 0.5441 1.7223 0.5609 0.070 Uiso 1 1 calc R . .
H12B H 0.4315 1.7950 0.5252 0.070 Uiso 1 1 calc R . .
C13 C 0.2406(3) 1.5533(5) 0.6067(2) 0.0427(8) Uani 1 1 d . . .
C14 C 0.2835(3) 1.5775(5) 0.5531(2) 0.0461(9) Uani 1 1 d . . .
C15 C 0.2218(4) 1.6434(8) 0.4949(2) 0.0684(14) Uani 1 1 d . . .
H15A H 0.2503 1.6594 0.4599 0.082 Uiso 1 1 calc R . .
C16 C 0.1156(4) 1.6878(9) 0.4864(3) 0.0806(17) Uani 1 1 d . . .
H16A H 0.0754 1.7349 0.4465 0.097 Uiso 1 1 calc R . .
C17 C 0.0726(4) 1.6624(7) 0.5358(3) 0.0679(13) Uani 1 1 d . . .
H17A H 0.0021 1.6898 0.5296 0.082 Uiso 1 1 calc R . .
C18 C 0.1329(3) 1.5949(5) 0.5964(2) 0.0514(10) Uani 1 1 d . . .
C19 C 0.0900(4) 1.5674(7) 0.6492(3) 0.0684(14) Uani 1 1 d . . .
H19A H 0.0195 1.5928 0.6440 0.082 Uiso 1 1 calc R . .
C20 C 0.1509(4) 1.5046(9) 0.7068(3) 0.0752(15) Uani 1 1 d . . .
H20A H 0.1231 1.4836 0.7418 0.090 Uiso 1 1 calc R . .
C21 C 0.2570(4) 1.4710(7) 0.7136(2) 0.0646(13) Uani 1 1 d . . .
H21A H 0.2988 1.4297 0.7542 0.078 Uiso 1 1 calc R . .
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'
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
_geom_angle_publ_flag
N1 Ag1 N2 155.42(14) . . ?
N1 Ag1 S1 103.11(11) . 2_646 ?
N2 Ag1 S1 99.43(10) . 2_646 ?
N1 Ag1 S2 103.94(10) . . ?
N2 Ag1 S2 75.68(9) . . ?
S1 Ag1 S2 112.91(4) 2_646 . ?
N1 Ag1 S1 71.22(9) . . ?
N2 Ag1 S1 90.11(9) . . ?
S1 Ag1 S1 116.27(3) 2_646 . ?
S2 Ag1 S1 130.38(5) . . ?
O2 Cl1 O1 107.5(8) . . ?
O2 Cl1 O3 108.9(6) . . ?
O1 Cl1 O3 107.9(7) . . ?
O2 Cl1 O4 116.3(5) . . ?
O1 Cl1 O4 106.9(5) . . ?
O3 Cl1 O4 109.1(4) . . ?
C8 S1 C10 101.2(2) . . ?
C8 S1 Ag1 102.31(13) . 2_656 ?
C10 S1 Ag1 108.60(16) . 2_656 ?
C8 S1 Ag1 98.63(14) . . ?
C10 S1 Ag1 115.91(16) . . ?
Ag1 S1 Ag1 125.35(4) 2_656 . ?
C14 S2 C12 99.8(2) . . ?
C14 S2 Ag1 98.23(14) . . ?
C12 S2 Ag1 103.50(17) . . ?
C1 N1 C9 118.4(4) . . ?
C1 N1 Ag1 114.7(3) . . ?
C9 N1 Ag1 125.7(3) . . ?
C21 N2 C13 118.2(4) . . ?
C21 N2 Ag1 119.5(3) . . ?
C13 N2 Ag1 122.2(3) . . ?
N1 C1 C2 123.4(5) . . ?
N1 C1 H1A 118.3 . . ?
C2 C1 H1A 118.3 . . ?
C3 C2 C1 118.9(5) . . ?
C3 C2 H2A 120.6 . . ?
C1 C2 H2A 120.6 . . ?
C2 C3 C4 120.8(5) . . ?
C2 C3 H3A 119.6 . . ?
C4 C3 H3A 119.6 . . ?
C5 C4 C3 122.3(4) . . ?
C5 C4 C9 120.6(4) . . ?
C3 C4 C9 117.1(4) . . ?
C6 C5 C4 120.2(4) . . ?
C6 C5 H5A 119.9 . . ?
C4 C5 H5A 119.9 . . ?
C5 C6 C7 120.4(5) . . ?
C5 C6 H6A 119.8 . . ?
C7 C6 H6A 119.8 . . ?
C8 C7 C6 121.0(5) . . ?
C8 C7 H7A 119.5 . . ?
C6 C7 H7A 119.5 . . ?
C7 C8 C9 120.6(4) . . ?
C7 C8 S1 119.6(3) . . ?
C9 C8 S1 119.7(3) . . ?
N1 C9 C8 121.4(3) . . ?
N1 C9 C4 121.4(4) . . ?
C8 C9 C4 117.2(4) . . ?
C11 C10 S1 109.0(3) . . ?
C11 C10 H10A 109.9 . . ?
S1 C10 H10A 109.9 . . ?
C11 C10 H10B 109.9 . . ?
S1 C10 H10B 109.9 . . ?
H10A C10 H10B 108.3 . . ?
C12 C11 C10 112.9(4) 2_646 . ?
C12 C11 H11A 109.0 2_646 . ?
C10 C11 H11A 109.0 . . ?
C12 C11 H11B 109.0 2_646 . ?
C10 C11 H11B 109.0 . . ?
H11A C11 H11B 107.8 . . ?
C11 C12 S2 111.2(3) 2_656 . ?
C11 C12 H12A 109.4 2_656 . ?
S2 C12 H12A 109.4 . . ?
C11 C12 H12B 109.4 2_656 . ?
S2 C12 H12B 109.4 . . ?
H12A C12 H12B 108.0 . . ?
N2 C13 C14 120.9(4) . . ?
N2 C13 C18 121.1(4) . . ?
C14 C13 C18 118.0(4) . . ?
C15 C14 C13 119.6(4) . . ?
C15 C14 S2 117.4(3) . . ?
C13 C14 S2 123.0(3) . . ?
C14 C15 C16 121.4(5) . . ?
C14 C15 H15A 119.3 . . ?
C16 C15 H15A 119.3 . . ?
C17 C16 C15 120.1(5) . . ?
C17 C16 H16A 119.9 . . ?
C15 C16 H16A 119.9 . . ?
C16 C17 C18 120.5(4) . . ?
C16 C17 H17A 119.7 . . ?
C18 C17 H17A 119.7 . . ?
C17 C18 C19 121.8(4) . . ?
C17 C18 C13 120.4(4) . . ?
C19 C18 C13 117.9(4) . . ?
C20 C19 C18 119.8(4) . . ?
C20 C19 H19A 120.1 . . ?
C18 C19 H19A 120.1 . . ?
C19 C20 C21 118.8(5) . . ?
C19 C20 H20A 120.6 . . ?
C21 C20 H20A 120.6 . . ?
N2 C21 C20 124.1(5) . . ?
N2 C21 H21A 117.9 . . ?
C20 C21 H21A 117.9 . . ?
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 N1 2.350(4) . ?
Ag1 N2 2.355(4) . ?
Ag1 S1 2.6129(17) 2_646 ?
Ag1 S2 2.6828(18) . ?
Ag1 S1 2.8149(16) . ?
Cl1 O2 1.327(7) . ?
Cl1 O1 1.341(8) . ?
Cl1 O3 1.358(7) . ?
Cl1 O4 1.404(5) . ?
S1 C8 1.787(4) . ?
S1 C10 1.808(4) . ?
S1 Ag1 2.6129(17) 2_656 ?
S2 C14 1.780(4) . ?
S2 C12 1.797(5) . ?
N1 C1 1.307(6) . ?
N1 C9 1.358(5) . ?
N2 C21 1.313(6) . ?
N2 C13 1.356(5) . ?
C1 C2 1.414(8) . ?
C1 H1A 0.9300 . ?
C2 C3 1.322(9) . ?
C2 H2A 0.9300 . ?
C3 C4 1.402(7) . ?
C3 H3A 0.9300 . ?
C4 C5 1.397(7) . ?
C4 C9 1.424(6) . ?
C5 C6 1.356(8) . ?
C5 H5A 0.9300 . ?
C6 C7 1.389(7) . ?
C6 H6A 0.9300 . ?
C7 C8 1.369(6) . ?
C7 H7A 0.9300 . ?
C8 C9 1.412(6) . ?
C10 C11 1.549(7) . ?
C10 H10A 0.9700 . ?
C10 H10B 0.9700 . ?
C11 C12 1.495(6) 2_646 ?
C11 H11A 0.9700 . ?
C11 H11B 0.9700 . ?
C12 C11 1.495(6) 2_656 ?
C12 H12A 0.9700 . ?
C12 H12B 0.9700 . ?
C13 C14 1.417(6) . ?
C13 C18 1.419(6) . ?
C14 C15 1.361(6) . ?
C15 C16 1.410(7) . ?
C15 H15A 0.9300 . ?
C16 C17 1.340(8) . ?
C16 H16A 0.9300 . ?
C17 C18 1.398(7) . ?
C17 H17A 0.9300 . ?
C18 C19 1.406(7) . ?
C19 C20 1.339(8) . ?
C19 H19A 0.9300 . ?
C20 C21 1.395(7) . ?
C20 H20A 0.9300 . ?
C21 H21A 0.9300 . ?
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
N1 Ag1 S1 C8 -13.26(17) . . . . ?
N2 Ag1 S1 C8 -176.98(16) . . . . ?
S1 Ag1 S1 C8 82.44(13) 2_646 . . . ?
S2 Ag1 S1 C8 -105.83(14) . . . . ?
N1 Ag1 S1 C10 -120.24(19) . . . . ?
N2 Ag1 S1 C10 76.05(19) . . . . ?
S1 Ag1 S1 C10 -24.54(16) 2_646 . . . ?
S2 Ag1 S1 C10 147.19(16) . . . . ?
N1 Ag1 S1 Ag1 98.58(11) . . . 2_656 ?
N2 Ag1 S1 Ag1 -65.14(10) . . . 2_656 ?
S1 Ag1 S1 Ag1 -165.72(6) 2_646 . . 2_656 ?
S2 Ag1 S1 Ag1 6.01(6) . . . 2_656 ?
N1 Ag1 S2 C14 -154.09(17) . . . . ?
N2 Ag1 S2 C14 0.55(16) . . . . ?
S1 Ag1 S2 C14 94.90(14) 2_646 . . . ?
S1 Ag1 S2 C14 -77.05(14) . . . . ?
N1 Ag1 S2 C12 -51.89(19) . . . . ?
N2 Ag1 S2 C12 102.75(18) . . . . ?
S1 Ag1 S2 C12 -162.90(16) 2_646 . . . ?
S1 Ag1 S2 C12 25.15(16) . . . . ?
N2 Ag1 N1 C1 -133.7(4) . . . . ?
S1 Ag1 N1 C1 70.3(4) 2_646 . . . ?
S2 Ag1 N1 C1 -47.8(4) . . . . ?
S1 Ag1 N1 C1 -176.1(4) . . . . ?
N2 Ag1 N1 C9 59.3(5) . . . . ?
S1 Ag1 N1 C9 -96.7(4) 2_646 . . . ?
S2 Ag1 N1 C9 145.2(3) . . . . ?
S1 Ag1 N1 C9 16.9(3) . . . . ?
N1 Ag1 N2 C21 -90.5(5) . . . . ?
S1 Ag1 N2 C21 65.8(4) 2_646 . . . ?
S2 Ag1 N2 C21 177.2(4) . . . . ?
S1 Ag1 N2 C21 -50.8(4) . . . . ?
N1 Ag1 N2 C13 92.8(4) . . . . ?
S1 Ag1 N2 C13 -110.8(3) 2_646 . . . ?
S2 Ag1 N2 C13 0.5(3) . . . . ?
S1 Ag1 N2 C13 132.5(3) . . . . ?
C9 N1 C1 C2 -0.2(9) . . . . ?
Ag1 N1 C1 C2 -168.2(6) . . . . ?
N1 C1 C2 C3 1.4(12) . . . . ?
C1 C2 C3 C4 -1.0(11) . . . . ?
C2 C3 C4 C5 179.2(7) . . . . ?
C2 C3 C4 C9 -0.5(9) . . . . ?
C3 C4 C5 C6 179.9(6) . . . . ?
C9 C4 C5 C6 -0.4(9) . . . . ?
C4 C5 C6 C7 -1.6(9) . . . . ?
C5 C6 C7 C8 2.4(9) . . . . ?
C6 C7 C8 C9 -1.1(7) . . . . ?
C6 C7 C8 S1 -179.1(4) . . . . ?
C10 S1 C8 C7 -49.5(4) . . . . ?
Ag1 S1 C8 C7 62.6(4) 2_656 . . . ?
Ag1 S1 C8 C7 -168.2(3) . . . . ?
C10 S1 C8 C9 132.5(3) . . . . ?
Ag1 S1 C8 C9 -115.4(3) 2_656 . . . ?
Ag1 S1 C8 C9 13.8(3) . . . . ?
C1 N1 C9 C8 179.1(5) . . . . ?
Ag1 N1 C9 C8 -14.4(6) . . . . ?
C1 N1 C9 C4 -1.4(7) . . . . ?
Ag1 N1 C9 C4 165.2(3) . . . . ?
C7 C8 C9 N1 178.7(4) . . . . ?
S1 C8 C9 N1 -3.3(6) . . . . ?
C7 C8 C9 C4 -0.8(6) . . . . ?
S1 C8 C9 C4 177.1(3) . . . . ?
C5 C4 C9 N1 -178.0(5) . . . . ?
C3 C4 C9 N1 1.8(7) . . . . ?
C5 C4 C9 C8 1.6(7) . . . . ?
C3 C4 C9 C8 -178.7(5) . . . . ?
C8 S1 C10 C11 -65.6(3) . . . . ?
Ag1 S1 C10 C11 -172.8(3) 2_656 . . . ?
Ag1 S1 C10 C11 39.9(3) . . . . ?
S1 C10 C11 C12 167.2(3) . . . 2_646 ?
C14 S2 C12 C11 65.4(4) . . . 2_656 ?
Ag1 S2 C12 C11 -35.6(4) . . . 2_656 ?
C21 N2 C13 C14 -178.6(4) . . . . ?
Ag1 N2 C13 C14 -1.9(5) . . . . ?
C21 N2 C13 C18 2.3(6) . . . . ?
Ag1 N2 C13 C18 179.1(3) . . . . ?
N2 C13 C14 C15 -177.3(4) . . . . ?
C18 C13 C14 C15 1.8(6) . . . . ?
N2 C13 C14 S2 2.6(6) . . . . ?
C18 C13 C14 S2 -178.3(3) . . . . ?
C12 S2 C14 C15 72.8(4) . . . . ?
Ag1 S2 C14 C15 178.1(4) . . . . ?
C12 S2 C14 C13 -107.1(4) . . . . ?
Ag1 S2 C14 C13 -1.8(4) . . . . ?
C13 C14 C15 C16 -0.2(8) . . . . ?
S2 C14 C15 C16 179.9(5) . . . . ?
C14 C15 C16 C17 -1.4(10) . . . . ?
C15 C16 C17 C18 1.3(10) . . . . ?
C16 C17 C18 C19 179.8(6) . . . . ?
C16 C17 C18 C13 0.3(8) . . . . ?
N2 C13 C18 C17 177.2(4) . . . . ?
C14 C13 C18 C17 -1.9(6) . . . . ?
N2 C13 C18 C19 -2.3(6) . . . . ?
C14 C13 C18 C19 178.7(4) . . . . ?
C17 C18 C19 C20 -179.1(6) . . . . ?
C13 C18 C19 C20 0.3(8) . . . . ?
C18 C19 C20 C21 1.4(10) . . . . ?
C13 N2 C21 C20 -0.5(8) . . . . ?
Ag1 N2 C21 C20 -177.3(5) . . . . ?
C19 C20 C21 N2 -1.4(10) . . . . ?
