#------------------------------------------------------------------------------
#$Date: 2019-12-25 22:03:09 +0200 (Wed, 25 Dec 2019) $
#$Revision: 245827 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/13/2311363.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_2311363
loop_
_publ_author_name
'Arman, Hadi D.'
'Poplaukhin, Pavel'
'Tiekink, Edward R. T.'
_publ_section_title
;
 A two-dimensional coordination polymer:
 poly[[bis-[μ₂-N-ethyl-N-(pyridin-4-ylmeth-yl)di-thio-carbamato-κ³N:S,S']cadmium(II)]
 3-methyl-pyridine monosolvate].
;
_journal_coeditor_code           HB7664
_journal_issue                   'Pt 4'
_journal_name_full
'Acta crystallographica. Section E, Crystallographic communications'
_journal_page_first              488
_journal_page_last               492
_journal_paper_doi               10.1107/S2056989017003516
_journal_volume                  73
_journal_year                    2017
_chemical_formula_iupac          '[Cd (C9 H11 N2 S2)2], C6 H7 N'
_chemical_formula_moiety         'C18 H22 Cd N4 S4, C6 H7 N'
_chemical_formula_sum            'C24 H29 Cd N5 S4'
_chemical_formula_weight         628.16
_chemical_name_systematic
;
Poly[[bis[μ₂-N-ethyl-N-(pyridin-4-ylmethyl)dithiocarbamato-\
κ³N:S,S']cadmium(II)] 3-methylpyridine monosolvate]
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 100.014(4)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.5842(15)
_cell_length_b                   11.0788(16)
_cell_length_c                   12.989(2)
_cell_measurement_reflns_used    6543
_cell_measurement_temperature    98(2)
_cell_measurement_theta_max      40.7
_cell_measurement_theta_min      2.4
_cell_volume                     1358.2(4)
_computing_cell_refinement
;
CrystalClear (Molecular Structure Corporation & Rigaku, 2005)
;
_computing_data_collection
;
CrystalClear (Molecular Structure Corporation & Rigaku, 2005)
;
_computing_data_reduction
;
CrystalClear (Molecular Structure Corporation & Rigaku, 2005)
;
_computing_molecular_graphics
;
ORTEP-3 for Windows (Farrugia, 2012) and DIAMOND (Brandenburg,
2006)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2014 (Sheldrick, 2015)
;
_computing_structure_solution
;
SHELXS97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      98(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  AFC12Κ/SATURN724
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0300
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            10508
_diffrn_reflns_theta_full        27.499
_diffrn_reflns_theta_max         27.499
_diffrn_reflns_theta_min         2.432
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.134
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.802
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(ABSCOR; Higashi, 1995)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.536
_exptl_crystal_description       block
_exptl_crystal_F_000             640
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.945
_refine_diff_density_min         -1.198
_refine_ls_abs_structure_details
;
Flack x determined using 2244 quotients
[(I⁺)-(I⁻)]/[(I⁺)+(I⁻)]
(Parsons et al.,  2013)
;
_refine_ls_abs_structure_Flack   0.035(15)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.075
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     310
_refine_ls_number_reflns         5618
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.075
_refine_ls_R_factor_all          0.0374
_refine_ls_R_factor_gt           0.0371
_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)+(0.0304P)²+3.8335P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0905
_refine_ls_wR_factor_ref         0.0907
_reflns_number_gt                5586
_reflns_number_total             5618
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            hb7664sup1.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               2311363
_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   0.780
_shelx_estimated_absorpt_t_max   0.895
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -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_occupancy
Cd Cd 0.07792(4) 0.11775(5) 0.28476(3) 0.01706(11) Uani d 1
S S1 0.23327(18) 0.29766(16) 0.23386(13) 0.0188(3) Uani d 1
S S2 -0.01802(17) 0.33065(15) 0.33697(13) 0.0208(3) Uani d 1
S S3 0.22627(17) 0.04779(16) 0.46716(12) 0.0215(3) Uani d 1
S S4 0.24814(18) -0.07121(16) 0.26516(13) 0.0198(3) Uani d 1
N N1 0.1324(5) 0.5121(5) 0.2772(4) 0.0171(10) Uani d 1
N N2 0.0426(5) 0.6032(7) -0.1044(4) 0.0216(12) Uani d 1
N N3 0.4308(5) -0.1054(5) 0.4433(4) 0.0182(10) Uani d 1
N N4 0.8778(5) 0.0113(5) 0.3160(4) 0.0163(10) Uani d 1
C C1 0.1167(6) 0.3905(6) 0.2819(4) 0.0160(11) Uani d 1
C C2 0.0472(7) 0.5963(6) 0.3283(5) 0.0242(15) Uani d 1
H H2A -0.0413 0.5561 0.3394 0.029 Uiso calc 1
H H2B 0.0213 0.6674 0.2829 0.029 Uiso calc 1
C C3 0.1312(8) 0.6364(8) 0.4323(5) 0.0316(18) Uani d 1
H H3A 0.0725 0.6894 0.4675 0.047 Uiso calc 1
H H3B 0.2159 0.6802 0.4206 0.047 Uiso calc 1
H H3C 0.1595 0.5655 0.4761 0.047 Uiso calc 1
C C4 0.2370(7) 0.5677(7) 0.2207(5) 0.0238(14) Uani d 1
H H4A 0.3221 0.5157 0.2271 0.029 Uiso calc 1
H H4B 0.2664 0.6472 0.2520 0.029 Uiso calc 1
C C5 0.1735(7) 0.5838(6) 0.1065(5) 0.0243(15) Uani d 1
C C6 0.1958(8) 0.4960(7) 0.0331(6) 0.0314(16) Uani d 1
H H6 0.2563 0.4289 0.0528 0.038 Uiso calc 1
C C7 0.1261(8) 0.5106(7) -0.0692(6) 0.0313(16) Uani d 1
H H7 0.1392 0.4496 -0.1181 0.038 Uiso calc 1
C C8 0.0322(9) 0.6904(7) -0.0345(6) 0.0357(18) Uani d 1
H H8 -0.0213 0.7607 -0.0571 0.043 Uiso calc 1
C C9 0.0971(10) 0.6820(8) 0.0704(6) 0.0378(19) Uani d 1
H H9 0.0872 0.7463 0.1169 0.045 Uiso calc 1
C C10 0.3130(6) -0.0482(6) 0.3960(5) 0.0158(11) Uani d 1
C C11 0.4862(6) -0.0914(7) 0.5560(5) 0.0239(14) Uani d 1
H H11A 0.4691 -0.0078 0.5778 0.029 Uiso calc 1
H H11B 0.5898 -0.1056 0.5694 0.029 Uiso calc 1
C C12 0.4151(8) -0.1797(9) 0.6200(6) 0.0344(19) Uani d 1
H H12A 0.4554 -0.1706 0.6942 0.052 Uiso calc 1
H H12B 0.4308 -0.2624 0.5977 0.052 Uiso calc 1
H H12C 0.3131 -0.1632 0.6092 0.052 Uiso calc 1
C C13 0.5156(6) -0.1836(6) 0.3869(5) 0.0216(13) Uani d 1
H H13A 0.4562 -0.2126 0.3216 0.026 Uiso calc 1
H H13B 0.5485 -0.2548 0.4305 0.026 Uiso calc 1
C C14 0.6427(7) -0.1156(6) 0.3609(5) 0.0216(13) Uani d 1
C C15 0.7786(6) -0.1612(6) 0.3879(5) 0.0225(13) Uani d 1
H H15 0.7938 -0.2369 0.4224 0.027 Uiso calc 1
C C16 0.8927(7) -0.0960(6) 0.3645(5) 0.0243(14) Uani d 1
H H16 0.9852 -0.1288 0.3836 0.029 Uiso calc 1
C C17 0.7450(7) 0.0563(6) 0.2896(5) 0.0214(13) Uani d 1
H H17 0.7326 0.1319 0.2547 0.026 Uiso calc 1
C C18 0.6265(7) -0.0034(6) 0.3115(5) 0.0218(13) Uani d 1
H H18 0.5351 0.0318 0.2930 0.026 Uiso calc 1
N N5 0.4417(12) 0.1672(11) 0.8221(11) 0.084(4) Uani d 1
C C19 0.3520(10) 0.0783(11) 0.8364(9) 0.059(3) Uani d 1
H H19 0.3143 0.0284 0.7787 0.071 Uiso calc 1
C C20 0.3115(11) 0.0565(10) 0.9343(8) 0.052(2) Uani d 1
C C21 0.3647(10) 0.1275(16) 1.0165(8) 0.060(3) Uani d 1
H H21 0.3389 0.1126 1.0827 0.072 Uiso calc 1
C C22 0.4575(14) 0.2230(14) 1.0056(12) 0.081(4) Uani d 1
H H22 0.4972 0.2730 1.0627 0.097 Uiso calc 1
C C23 0.4878(15) 0.2396(15) 0.9037(12) 0.081(4) Uani d 1
H H23 0.5448 0.3068 0.8923 0.097 Uiso calc 1
C C24 0.2137(11) -0.0448(12) 0.9431(9) 0.063(3) Uani d 1
H H24A 0.2640 -0.1078 0.9879 0.094 Uiso calc 1
H H24B 0.1789 -0.0782 0.8735 0.094 Uiso calc 1
H H24C 0.1335 -0.0156 0.9736 0.094 Uiso calc 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'
Cd Cd -0.8075 1.2024 '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'
S S 0.1246 0.1234 '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
S1 Cd S2 . . 68.26(5) y
S1 Cd S3 . . 101.88(6) y
S1 Cd S4 . . 100.71(5) y
S1 Cd N2 . 2_545 90.18(16) y
S1 Cd N4 . 1_455 159.47(13) y
S2 Cd S3 . . 100.73(5) y
S2 Cd S4 . . 162.67(5) y
S2 Cd N2 . 2_545 100.20(17) y
S2 Cd N4 . 1_455 94.15(14) y
S3 Cd S4 . . 67.58(5) y
S3 Cd N2 . 2_545 158.55(18) y
S3 Cd N4 . 1_455 91.47(13) y
S4 Cd N2 . 2_545 92.95(16) y
S4 Cd N4 . 1_455 98.77(14) y
N2 Cd N4 2_545 1_455 82.40(18) y
C1 S1 Cd . . 86.0(2) ?
C1 S2 Cd . . 85.3(2) ?
C10 S3 Cd . . 86.3(2) ?
C10 S4 Cd . . 85.0(2) ?
C1 N1 C4 . . 121.8(5) ?
C1 N1 C2 . . 122.3(5) ?
C4 N1 C2 . . 115.9(5) ?
C8 N2 C7 . . 115.6(6) ?
C8 N2 Cd . 2 121.7(5) ?
C7 N2 Cd . 2 122.6(5) ?
C10 N3 C13 . . 123.0(5) ?
C10 N3 C11 . . 122.1(5) ?
C13 N3 C11 . . 115.0(5) ?
C16 N4 C17 . . 117.6(5) ?
C16 N4 Cd . 1_655 120.2(4) ?
C17 N4 Cd . 1_655 122.1(4) ?
N1 C1 S1 . . 119.7(5) ?
N1 C1 S2 . . 120.0(5) ?
S1 C1 S2 . . 120.3(4) ?
N1 C2 C3 . . 109.8(5) ?
N1 C2 H2A . . 109.7 ?
C3 C2 H2A . . 109.7 ?
N1 C2 H2B . . 109.7 ?
C3 C2 H2B . . 109.7 ?
H2A C2 H2B . . 108.2 ?
C2 C3 H3A . . 109.5 ?
C2 C3 H3B . . 109.5 ?
H3A C3 H3B . . 109.5 ?
C2 C3 H3C . . 109.5 ?
H3A C3 H3C . . 109.5 ?
H3B C3 H3C . . 109.5 ?
N1 C4 C5 . . 110.1(5) ?
N1 C4 H4A . . 109.6 ?
C5 C4 H4A . . 109.6 ?
N1 C4 H4B . . 109.6 ?
C5 C4 H4B . . 109.6 ?
H4A C4 H4B . . 108.2 ?
C9 C5 C6 . . 117.4(7) ?
C9 C5 C4 . . 122.5(7) ?
C6 C5 C4 . . 120.1(6) ?
C7 C6 C5 . . 117.7(7) ?
C7 C6 H6 . . 121.2 ?
C5 C6 H6 . . 121.2 ?
N2 C7 C6 . . 125.3(7) ?
N2 C7 H7 . . 117.3 ?
C6 C7 H7 . . 117.3 ?
N2 C8 C9 . . 122.6(7) ?
N2 C8 H8 . . 118.7 ?
C9 C8 H8 . . 118.7 ?
C5 C9 C8 . . 121.0(8) ?
C5 C9 H9 . . 119.5 ?
C8 C9 H9 . . 119.5 ?
N3 C10 S3 . . 119.5(5) ?
N3 C10 S4 . . 120.6(5) ?
S3 C10 S4 . . 119.8(3) ?
N3 C11 C12 . . 110.8(6) ?
N3 C11 H11A . . 109.5 ?
C12 C11 H11A . . 109.5 ?
N3 C11 H11B . . 109.5 ?
C12 C11 H11B . . 109.5 ?
H11A C11 H11B . . 108.1 ?
C11 C12 H12A . . 109.5 ?
C11 C12 H12B . . 109.5 ?
H12A C12 H12B . . 109.5 ?
C11 C12 H12C . . 109.5 ?
H12A C12 H12C . . 109.5 ?
H12B C12 H12C . . 109.5 ?
N3 C13 C14 . . 110.7(6) ?
N3 C13 H13A . . 109.5 ?
C14 C13 H13A . . 109.5 ?
N3 C13 H13B . . 109.5 ?
C14 C13 H13B . . 109.5 ?
H13A C13 H13B . . 108.1 ?
C15 C14 C18 . . 117.8(6) ?
C15 C14 C13 . . 121.2(6) ?
C18 C14 C13 . . 121.0(6) ?
C14 C15 C16 . . 119.8(6) ?
C14 C15 H15 . . 120.1 ?
C16 C15 H15 . . 120.1 ?
N4 C16 C15 . . 122.7(6) ?
N4 C16 H16 . . 118.6 ?
C15 C16 H16 . . 118.6 ?
N4 C17 C18 . . 122.7(6) ?
N4 C17 H17 . . 118.6 ?
C18 C17 H17 . . 118.6 ?
C17 C18 C14 . . 119.3(6) ?
C17 C18 H18 . . 120.3 ?
C14 C18 H18 . . 120.3 ?
C23 N5 C19 . . 117.4(11) ?
N5 C19 C20 . . 122.2(12) ?
N5 C19 H19 . . 118.9 ?
C20 C19 H19 . . 118.9 ?
C21 C20 C19 . . 119.0(11) ?
C21 C20 C24 . . 122.5(10) ?
C19 C20 C24 . . 118.5(10) ?
C20 C21 C22 . . 121.2(11) ?
C20 C21 H21 . . 119.4 ?
C22 C21 H21 . . 119.4 ?
C23 C22 C21 . . 115.3(14) ?
C23 C22 H22 . . 122.3 ?
C21 C22 H22 . . 122.3 ?
N5 C23 C22 . . 124.6(14) ?
N5 C23 H23 . . 117.7 ?
C22 C23 H23 . . 117.7 ?
C20 C24 H24A . . 109.5 ?
C20 C24 H24B . . 109.5 ?
H24A C24 H24B . . 109.5 ?
C20 C24 H24C . . 109.5 ?
H24A C24 H24C . . 109.5 ?
H24B C24 H24C . . 109.5 ?
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
Cd S1 . 2.6399(19) y
Cd S2 . 2.6618(17) y
Cd S3 . 2.6578(16) y
Cd S4 . 2.6932(18) y
Cd N2 2_545 2.430(5) y
Cd N4 1_455 2.346(5) y
S1 C1 . 1.714(6) y
S2 C1 . 1.715(6) y
S3 C10 . 1.715(6) y
S4 C10 . 1.724(6) y
N1 C1 . 1.357(8) ?
N1 C4 . 1.477(8) ?
N1 C2 . 1.471(8) ?
N2 C8 . 1.342(10) ?
N2 C7 . 1.332(10) ?
N2 Cd 2 2.430(5) ?
N3 C10 . 1.347(8) ?
N3 C13 . 1.467(8) ?
N3 C11 . 1.477(8) ?
N4 C16 . 1.341(9) ?
N4 C17 . 1.354(8) ?
N4 Cd 1_655 2.346(5) ?
C2 C3 . 1.514(9) ?
C2 H2A . 0.9900 ?
C2 H2B . 0.9900 ?
C3 H3A . 0.9800 ?
C3 H3B . 0.9800 ?
C3 H3C . 0.9800 ?
C4 C5 . 1.513(9) ?
C4 H4A . 0.9900 ?
C4 H4B . 0.9900 ?
C5 C9 . 1.349(11) ?
C5 C6 . 1.403(10) ?
C6 C7 . 1.389(10) ?
C6 H6 . 0.9500 ?
C7 H7 . 0.9500 ?
C8 C9 . 1.398(11) ?
C8 H8 . 0.9500 ?
C9 H9 . 0.9500 ?
C11 C12 . 1.520(9) ?
C11 H11A . 0.9900 ?
C11 H11B . 0.9900 ?
C12 H12A . 0.9800 ?
C12 H12B . 0.9800 ?
C12 H12C . 0.9800 ?
C13 C14 . 1.519(9) ?
C13 H13A . 0.9900 ?
C13 H13B . 0.9900 ?
C14 C15 . 1.385(9) ?
C14 C18 . 1.396(9) ?
C15 C16 . 1.388(9) ?
C15 H15 . 0.9500 ?
C16 H16 . 0.9500 ?
C17 C18 . 1.386(9) ?
C17 H17 . 0.9500 ?
C18 H18 . 0.9500 ?
N5 C23 . 1.341(19) ?
N5 C19 . 1.341(15) ?
C19 C20 . 1.413(13) ?
C19 H19 . 0.9500 ?
C20 C21 . 1.353(16) ?
C20 C24 . 1.479(15) ?
C21 C22 . 1.40(2) ?
C21 H21 . 0.9500 ?
C22 C23 . 1.415(18) ?
C22 H22 . 0.9500 ?
C23 H23 . 0.9500 ?
C24 H24A . 0.9800 ?
C24 H24B . 0.9800 ?
C24 H24C . 0.9800 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
C13 H13A N5 2_646 0.99 2.62 3.264(15) 123
C24 H24C Cg1 2_546 0.98 2.72 3.662(12) 163
C15 H15 S3 2_646 0.95 2.81 3.738(7) 167
C3 H3C Cg2 2_656 0.98 2.73 3.633(8) 154
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
C4 N1 C1 S1 . 7.3(7)
C2 N1 C1 S1 . -172.3(4)
C4 N1 C1 S2 . -173.4(4)
C2 N1 C1 S2 . 7.0(8)
Cd S1 C1 N1 . -177.9(5)
Cd S1 C1 S2 . 2.8(3)
Cd S2 C1 N1 . 177.9(5)
Cd S2 C1 S1 . -2.8(3)
C1 N1 C2 C3 . 98.4(7)
C4 N1 C2 C3 . -81.3(7)
C1 N1 C4 C5 . 86.5(7)
C2 N1 C4 C5 . -93.9(6)
N1 C4 C5 C9 . 86.4(8)
N1 C4 C5 C6 . -95.1(8)
C9 C5 C6 C7 . -6.3(11)
C4 C5 C6 C7 . 175.2(7)
C8 N2 C7 C6 . 3.1(12)
Cd N2 C7 C6 2 -178.8(6)
C5 C6 C7 N2 . 2.0(12)
C7 N2 C8 C9 . -4.0(12)
Cd N2 C8 C9 2 177.9(6)
C6 C5 C9 C8 . 5.6(12)
C4 C5 C9 C8 . -175.9(7)
N2 C8 C9 C5 . -0.4(14)
C13 N3 C10 S3 . -176.5(5)
C11 N3 C10 S3 . 2.0(8)
C13 N3 C10 S4 . 3.9(8)
C11 N3 C10 S4 . -177.7(5)
Cd S3 C10 N3 . 168.9(5)
Cd S3 C10 S4 . -11.5(3)
Cd S4 C10 N3 . -169.0(5)
Cd S4 C10 S3 . 11.3(3)
C10 N3 C11 C12 . 85.9(8)
C13 N3 C11 C12 . -95.6(7)
C10 N3 C13 C14 . 98.4(7)
C11 N3 C13 C14 . -80.2(7)
N3 C13 C14 C15 . 127.2(7)
N3 C13 C14 C18 . -50.9(8)
C18 C14 C15 C16 . -0.7(10)
C13 C14 C15 C16 . -179.0(6)
C17 N4 C16 C15 . 0.0(10)
Cd N4 C16 C15 1_655 178.0(5)
C14 C15 C16 N4 . 0.1(11)
C16 N4 C17 C18 . 0.6(10)
Cd N4 C17 C18 1_655 -177.3(5)
N4 C17 C18 C14 . -1.3(10)
C15 C14 C18 C17 . 1.3(10)
C13 C14 C18 C17 . 179.5(6)
C23 N5 C19 C20 . -3.1(17)
N5 C19 C20 C21 . 0.1(16)
N5 C19 C20 C24 . -179.1(10)
C19 C20 C21 C22 . 0.8(19)
C24 C20 C21 C22 . 180.0(12)
C20 C21 C22 C23 . 1(2)
C19 N5 C23 C22 . 5(2)
C21 C22 C23 N5 . -4(2)
