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#$Date: 2023-05-05 05:51:50 +0300 (Fri, 05 May 2023) $
#$Revision: 283375 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/06/22/7062271.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_7062271
loop_
_publ_author_name
'Das, Akash'
'Saha, Moumita'
'Mandal, Subrata'
'Das, Sanjib'
'Das Saha, Krishna'
'Mondal, Tapan K.'
_publ_section_title
;
 New palladium(ii) and platinum(ii) complexes with an ONS donor
 azo-thioether pincer ligand: synthesis, characterization, protein binding
 study and in vitro cytotoxicity
;
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              4931
_journal_page_last               4943
_journal_paper_doi               10.1039/D3NJ00334E
_journal_volume                  47
_journal_year                    2023
_chemical_formula_sum            'C14 H12 Cl2 N2 O Pt S'
_chemical_formula_weight         522.31
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2022-06-13 deposited with the CCDC.	2023-02-06 downloaded from the CCDC.
;
_cell_angle_alpha                109.453(3)
_cell_angle_beta                 95.228(3)
_cell_angle_gamma                96.489(3)
_cell_formula_units_Z            4
_cell_length_a                   10.1219(11)
_cell_length_b                   12.2233(13)
_cell_length_c                   13.6071(15)
_cell_measurement_reflns_used    5244
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      21.00
_cell_measurement_theta_min      2.50
_cell_volume                     1562.3(3)
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker AXS D8 Quest CMOS diffractometer'
_diffrn_measurement_method       'omega and phi scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0603
_diffrn_reflns_av_unetI/netI     0.0320
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            54663
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.542
_diffrn_reflns_theta_min         1.943
_diffrn_source                   'sealed tube X-ray source'
_exptl_absorpt_coefficient_mu    9.455
_exptl_absorpt_correction_T_max  0.4215
_exptl_absorpt_correction_T_min  0.3122
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   Sadabs
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    2.221
_exptl_crystal_description       block
_exptl_crystal_F_000             984
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.08
_refine_diff_density_max         1.366
_refine_diff_density_min         -1.097
_refine_diff_density_rms         0.110
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     379
_refine_ls_number_reflns         7167
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.0324
_refine_ls_R_factor_gt           0.0249
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0271P)²+1.7311P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0595
_refine_ls_wR_factor_ref         0.0638
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6163
_reflns_number_total             7167
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3nj00334e2.cif
_cod_data_source_block           shelx_CCDC1
_cod_depositor_comments
'Adding full bibliography for 7062270--7062271.cif.'
_cod_database_code               7062271
_shelx_shelxl_version_number     2018/3
_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.
;
loop_
_space_group_symop_operation_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
Pt1 Pt 0.86522(2) 0.64808(2) 0.31784(2) 0.03530(5) Uani 1 1 d . . . . .
Pt2 Pt 0.52135(2) 0.63230(2) 0.32051(2) 0.03621(5) Uani 1 1 d . . . . .
Cl1 Cl 0.86813(12) 0.64900(11) 0.48825(9) 0.0482(3) Uani 1 1 d . . . . .
Cl2 Cl 1.07323(17) 1.12206(12) 0.13393(11) 0.0702(4) Uani 1 1 d . . . . .
Cl3 Cl 0.43452(13) 0.43458(10) 0.25615(10) 0.0545(3) Uani 1 1 d . . . . .
Cl4 Cl 0.68036(17) 1.01754(14) 0.03236(14) 0.0794(4) Uani 1 1 d . . . . .
S1 S 0.80166(11) 0.45392(10) 0.25657(9) 0.0421(2) Uani 1 1 d . . . . .
S2 S 0.51831(11) 0.63863(10) 0.48640(9) 0.0415(2) Uani 1 1 d . . . . .
O1 O 0.9151(3) 0.8228(3) 0.3749(2) 0.0448(7) Uani 1 1 d . . . . .
O2 O 0.5315(3) 0.6220(3) 0.1717(2) 0.0448(7) Uani 1 1 d . . . . .
N1 N 0.8701(3) 0.6389(3) 0.1713(3) 0.0353(7) Uani 1 1 d . . . . .
N2 N 0.9086(3) 0.7218(3) 0.1373(3) 0.0398(8) Uani 1 1 d . . . . .
N3 N 0.5890(3) 0.8013(3) 0.3786(3) 0.0351(7) Uani 1 1 d . . . . .
N4 N 0.6160(3) 0.8708(3) 0.3284(3) 0.0415(8) Uani 1 1 d . . . . .
C1 C 0.9429(4) 0.8833(4) 0.3143(3) 0.0392(9) Uani 1 1 d . . . . .
C2 C 0.9753(5) 1.0078(4) 0.3628(4) 0.0477(11) Uani 1 1 d . . . . .
H2 H 0.970748 1.042101 0.434329 0.057 Uiso 1 1 calc R U . . .
C3 C 1.0126(5) 1.0774(4) 0.3072(4) 0.0517(11) Uani 1 1 d . . . . .
H3 H 1.034141 1.158165 0.341060 0.062 Uiso 1 1 calc R U . . .
C4 C 1.0189(5) 1.0284(4) 0.1998(4) 0.0470(10) Uani 1 1 d . . . . .
C5 C 0.9843(5) 0.9115(4) 0.1483(3) 0.0453(10) Uani 1 1 d . . . . .
H5 H 0.987138 0.880422 0.076246 0.054 Uiso 1 1 calc R U . . .
C6 C 0.9440(4) 0.8360(4) 0.2033(3) 0.0397(9) Uani 1 1 d . . . . .
C7 C 0.8332(4) 0.5253(4) 0.0895(3) 0.0390(9) Uani 1 1 d . . . . .
C8 C 0.8240(5) 0.5106(4) -0.0166(4) 0.0500(11) Uani 1 1 d . . . . .
H8 H 0.838898 0.575243 -0.037896 0.060 Uiso 1 1 calc R U . . .
C9 C 0.7925(5) 0.3985(5) -0.0904(4) 0.0557(12) Uani 1 1 d . . . . .
H9 H 0.786204 0.387864 -0.161724 0.067 Uiso 1 1 calc R U . . .
C10 C 0.7702(5) 0.3025(5) -0.0590(4) 0.0633(14) Uani 1 1 d . . . . .
H10 H 0.751630 0.227380 -0.109219 0.076 Uiso 1 1 calc R U . . .
C11 C 0.7752(5) 0.3169(4) 0.0448(4) 0.0566(12) Uani 1 1 d . . . . .
H11 H 0.758506 0.251772 0.065154 0.068 Uiso 1 1 calc R U . . .
C12 C 0.8054(4) 0.4290(4) 0.1208(4) 0.0432(10) Uani 1 1 d . . . . .
C13 C 0.9411(5) 0.3851(4) 0.2908(4) 0.0503(11) Uani 1 1 d . . . . .
H13A H 0.948742 0.398016 0.365546 0.060 Uiso 1 1 calc R U . . .
H13B H 0.919733 0.301068 0.253660 0.060 Uiso 1 1 calc R U . . .
C14 C 1.0740(5) 0.4274(5) 0.2667(5) 0.0628(14) Uani 1 1 d . . . . .
H14A H 1.140744 0.386412 0.287278 0.094 Uiso 1 1 calc R U . . .
H14B H 1.068892 0.412929 0.192511 0.094 Uiso 1 1 calc R U . . .
H14C H 1.097967 0.510097 0.304649 0.094 Uiso 1 1 calc R U . . .
C15 C 0.5674(4) 0.7149(4) 0.1471(3) 0.0418(9) Uani 1 1 d . . . . .
C16 C 0.5691(5) 0.6979(5) 0.0390(4) 0.0495(11) Uani 1 1 d . . . . .
H16 H 0.545844 0.622528 -0.010205 0.059 Uiso 1 1 calc R U . . .
C17 C 0.6040(5) 0.7891(5) 0.0052(4) 0.0544(12) Uani 1 1 d . . . . .
H17 H 0.605843 0.775239 -0.066104 0.065 Uiso 1 1 calc R U . . .
C18 C 0.6370(5) 0.9033(5) 0.0777(4) 0.0528(12) Uani 1 1 d . . . . .
C19 C 0.6384(5) 0.9251(4) 0.1820(4) 0.0481(11) Uani 1 1 d . . . . .
H19 H 0.661821 1.001650 0.229021 0.058 Uiso 1 1 calc R U . . .
C20 C 0.6044(4) 0.8320(4) 0.2208(4) 0.0429(10) Uani 1 1 d . . . . .
C21 C 0.6115(4) 0.8587(4) 0.4916(3) 0.0373(9) Uani 1 1 d . . . . .
C22 C 0.6634(4) 0.9766(4) 0.5407(4) 0.0479(10) Uani 1 1 d . . . . .
H22 H 0.687360 1.022769 0.500976 0.057 Uiso 1 1 calc R U . . .
C23 C 0.6792(5) 1.0250(4) 0.6495(4) 0.0557(12) Uani 1 1 d . . . . .
H23 H 0.713430 1.104144 0.682586 0.067 Uiso 1 1 calc R U . . .
C24 C 0.6449(5) 0.9574(5) 0.7098(4) 0.0544(12) Uani 1 1 d . . . . .
H24 H 0.654505 0.991197 0.782704 0.065 Uiso 1 1 calc R U . . .
C25 C 0.5965(5) 0.8403(5) 0.6612(4) 0.0513(11) Uani 1 1 d . . . . .
H25 H 0.575966 0.793969 0.701462 0.062 Uiso 1 1 calc R U . . .
C26 C 0.5781(4) 0.7905(4) 0.5526(3) 0.0397(9) Uani 1 1 d . . . . .
C27 C 0.3455(5) 0.6280(4) 0.5139(4) 0.0550(12) Uani 1 1 d . . . . .
H27A H 0.299069 0.550063 0.472072 0.066 Uiso 1 1 calc R U . . .
H27B H 0.346241 0.636161 0.587329 0.066 Uiso 1 1 calc R U . . .
C28 C 0.2662(5) 0.7168(5) 0.4924(5) 0.0708(16) Uani 1 1 d . . . . .
H28A H 0.176922 0.704202 0.509144 0.106 Uiso 1 1 calc R U . . .
H28B H 0.309202 0.794547 0.534885 0.106 Uiso 1 1 calc R U . . .
H28C H 0.261916 0.708241 0.419349 0.106 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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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 Pt1 O1 93.37(13) . . ?
N1 Pt1 S1 87.64(10) . . ?
O1 Pt1 S1 177.71(9) . . ?
N1 Pt1 Cl1 176.21(10) . . ?
O1 Pt1 Cl1 89.14(9) . . ?
S1 Pt1 Cl1 89.96(4) . . ?
N3 Pt2 O2 93.75(13) . . ?
N3 Pt2 S2 87.25(10) . . ?
O2 Pt2 S2 177.17(9) . . ?
N3 Pt2 Cl3 177.68(10) . . ?
O2 Pt2 Cl3 87.75(9) . . ?
S2 Pt2 Cl3 91.33(4) . . ?
C12 S1 C13 103.1(2) . . ?
C12 S1 Pt1 98.38(15) . . ?
C13 S1 Pt1 108.44(16) . . ?
C26 S2 C27 101.7(2) . . ?
C26 S2 Pt2 98.96(15) . . ?
C27 S2 Pt2 109.38(18) . . ?
C1 O1 Pt1 122.0(3) . . ?
C15 O2 Pt2 122.0(3) . . ?
N2 N1 C7 113.9(3) . . ?
N2 N1 Pt1 128.1(3) . . ?
C7 N1 Pt1 118.0(3) . . ?
N1 N2 C6 122.0(4) . . ?
N4 N3 C21 113.4(3) . . ?
N4 N3 Pt2 128.0(3) . . ?
C21 N3 Pt2 118.6(3) . . ?
N3 N4 C20 122.0(4) . . ?
O1 C1 C2 117.5(4) . . ?
O1 C1 C6 125.8(4) . . ?
C2 C1 C6 116.7(4) . . ?
C3 C2 C1 121.7(4) . . ?
C3 C2 H2 119.2 . . ?
C1 C2 H2 119.2 . . ?
C2 C3 C4 120.4(4) . . ?
C2 C3 H3 119.8 . . ?
C4 C3 H3 119.8 . . ?
C5 C4 C3 120.8(4) . . ?
C5 C4 Cl2 121.0(4) . . ?
C3 C4 Cl2 118.1(4) . . ?
C4 C5 C6 120.5(4) . . ?
C4 C5 H5 119.8 . . ?
C6 C5 H5 119.8 . . ?
N2 C6 C5 111.9(4) . . ?
N2 C6 C1 128.3(4) . . ?
C5 C6 C1 119.8(4) . . ?
C8 C7 C12 120.2(4) . . ?
C8 C7 N1 122.5(4) . . ?
C12 C7 N1 117.4(4) . . ?
C9 C8 C7 119.2(5) . . ?
C9 C8 H8 120.4 . . ?
C7 C8 H8 120.4 . . ?
C10 C9 C8 120.5(5) . . ?
C10 C9 H9 119.8 . . ?
C8 C9 H9 119.8 . . ?
C11 C10 C9 120.5(5) . . ?
C11 C10 H10 119.8 . . ?
C9 C10 H10 119.8 . . ?
C10 C11 C12 120.3(5) . . ?
C10 C11 H11 119.9 . . ?
C12 C11 H11 119.9 . . ?
C7 C12 C11 119.4(4) . . ?
C7 C12 S1 118.4(3) . . ?
C11 C12 S1 122.2(4) . . ?
C14 C13 S1 115.5(3) . . ?
C14 C13 H13A 108.4 . . ?
S1 C13 H13A 108.4 . . ?
C14 C13 H13B 108.4 . . ?
S1 C13 H13B 108.4 . . ?
H13A C13 H13B 107.5 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
O2 C15 C16 117.3(4) . . ?
O2 C15 C20 125.1(4) . . ?
C16 C15 C20 117.6(4) . . ?
C17 C16 C15 121.8(5) . . ?
C17 C16 H16 119.1 . . ?
C15 C16 H16 119.1 . . ?
C16 C17 C18 119.9(5) . . ?
C16 C17 H17 120.0 . . ?
C18 C17 H17 120.0 . . ?
C19 C18 C17 121.0(5) . . ?
C19 C18 Cl4 120.0(4) . . ?
C17 C18 Cl4 118.9(4) . . ?
C18 C19 C20 120.8(5) . . ?
C18 C19 H19 119.6 . . ?
C20 C19 H19 119.6 . . ?
N4 C20 C19 112.2(4) . . ?
N4 C20 C15 129.1(4) . . ?
C19 C20 C15 118.8(4) . . ?
C22 C21 C26 119.5(4) . . ?
C22 C21 N3 123.2(4) . . ?
C26 C21 N3 117.3(4) . . ?
C21 C22 C23 119.3(5) . . ?
C21 C22 H22 120.3 . . ?
C23 C22 H22 120.3 . . ?
C24 C23 C22 121.1(5) . . ?
C24 C23 H23 119.5 . . ?
C22 C23 H23 119.5 . . ?
C25 C24 C23 119.5(5) . . ?
C25 C24 H24 120.3 . . ?
C23 C24 H24 120.3 . . ?
C24 C25 C26 120.4(5) . . ?
C24 C25 H25 119.8 . . ?
C26 C25 H25 119.8 . . ?
C25 C26 C21 120.2(4) . . ?
C25 C26 S2 121.9(4) . . ?
C21 C26 S2 117.8(3) . . ?
C28 C27 S2 115.7(3) . . ?
C28 C27 H27A 108.4 . . ?
S2 C27 H27A 108.4 . . ?
C28 C27 H27B 108.4 . . ?
S2 C27 H27B 108.4 . . ?
H27A C27 H27B 107.4 . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
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
Pt1 N1 1.966(3) . ?
Pt1 O1 2.000(3) . ?
Pt1 S1 2.2316(12) . ?
Pt1 Cl1 2.3126(11) . ?
Pt2 N3 1.964(3) . ?
Pt2 O2 2.000(3) . ?
Pt2 S2 2.2358(12) . ?
Pt2 Cl3 2.3130(12) . ?
Cl2 C4 1.745(5) . ?
Cl4 C18 1.735(5) . ?
S1 C12 1.774(5) . ?
S1 C13 1.824(5) . ?
S2 C26 1.777(4) . ?
S2 C27 1.821(5) . ?
O1 C1 1.306(5) . ?
O2 C15 1.310(5) . ?
N1 N2 1.283(5) . ?
N1 C7 1.444(5) . ?
N2 C6 1.370(5) . ?
N3 N4 1.276(5) . ?
N3 C21 1.446(5) . ?
N4 C20 1.370(6) . ?
C1 C2 1.427(6) . ?
C1 C6 1.428(6) . ?
C2 C3 1.360(7) . ?
C2 H2 0.9300 . ?
C3 C4 1.393(6) . ?
C3 H3 0.9300 . ?
C4 C5 1.354(6) . ?
C5 C6 1.417(6) . ?
C5 H5 0.9300 . ?
C7 C8 1.388(6) . ?
C7 C12 1.388(6) . ?
C8 C9 1.383(6) . ?
C8 H8 0.9300 . ?
C9 C10 1.380(8) . ?
C9 H9 0.9300 . ?
C10 C11 1.359(8) . ?
C10 H10 0.9300 . ?
C11 C12 1.394(6) . ?
C11 H11 0.9300 . ?
C13 C14 1.491(7) . ?
C13 H13A 0.9700 . ?
C13 H13B 0.9700 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 C16 1.417(6) . ?
C15 C20 1.431(6) . ?
C16 C17 1.364(7) . ?
C16 H16 0.9300 . ?
C17 C18 1.397(7) . ?
C17 H17 0.9300 . ?
C18 C19 1.352(7) . ?
C19 C20 1.427(6) . ?
C19 H19 0.9300 . ?
C21 C22 1.386(6) . ?
C21 C26 1.396(6) . ?
C22 C23 1.386(7) . ?
C22 H22 0.9300 . ?
C23 C24 1.383(7) . ?
C23 H23 0.9300 . ?
C24 C25 1.371(7) . ?
C24 H24 0.9300 . ?
C25 C26 1.383(6) . ?
C25 H25 0.9300 . ?
C27 C28 1.508(7) . ?
C27 H27A 0.9700 . ?
C27 H27B 0.9700 . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
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
C7 N1 N2 C6 178.2(3) . . . . ?
Pt1 N1 N2 C6 -5.2(6) . . . . ?
C21 N3 N4 C20 178.2(3) . . . . ?
Pt2 N3 N4 C20 -2.5(5) . . . . ?
Pt1 O1 C1 C2 179.1(3) . . . . ?
Pt1 O1 C1 C6 -1.0(6) . . . . ?
O1 C1 C2 C3 176.4(4) . . . . ?
C6 C1 C2 C3 -3.5(7) . . . . ?
C1 C2 C3 C4 0.7(8) . . . . ?
C2 C3 C4 C5 1.9(8) . . . . ?
C2 C3 C4 Cl2 -177.8(4) . . . . ?
C3 C4 C5 C6 -1.4(7) . . . . ?
Cl2 C4 C5 C6 178.2(4) . . . . ?
N1 N2 C6 C5 179.3(4) . . . . ?
N1 N2 C6 C1 -1.4(7) . . . . ?
C4 C5 C6 N2 177.8(4) . . . . ?
C4 C5 C6 C1 -1.5(7) . . . . ?
O1 C1 C6 N2 4.8(7) . . . . ?
C2 C1 C6 N2 -175.3(4) . . . . ?
O1 C1 C6 C5 -176.0(4) . . . . ?
C2 C1 C6 C5 3.9(6) . . . . ?
N2 N1 C7 C8 -7.8(5) . . . . ?
Pt1 N1 C7 C8 175.3(3) . . . . ?
N2 N1 C7 C12 172.7(3) . . . . ?
Pt1 N1 C7 C12 -4.2(5) . . . . ?
C12 C7 C8 C9 -2.7(6) . . . . ?
N1 C7 C8 C9 177.8(4) . . . . ?
C7 C8 C9 C10 0.1(7) . . . . ?
C8 C9 C10 C11 1.9(8) . . . . ?
C9 C10 C11 C12 -1.2(8) . . . . ?
C8 C7 C12 C11 3.4(6) . . . . ?
N1 C7 C12 C11 -177.1(4) . . . . ?
C8 C7 C12 S1 -173.6(3) . . . . ?
N1 C7 C12 S1 5.9(5) . . . . ?
C10 C11 C12 C7 -1.4(7) . . . . ?
C10 C11 C12 S1 175.4(4) . . . . ?
C13 S1 C12 C7 -115.7(3) . . . . ?
Pt1 S1 C12 C7 -4.4(3) . . . . ?
C13 S1 C12 C11 67.4(4) . . . . ?
Pt1 S1 C12 C11 178.7(4) . . . . ?
C12 S1 C13 C14 55.6(4) . . . . ?
Pt1 S1 C13 C14 -48.0(4) . . . . ?
Pt2 O2 C15 C16 -179.0(3) . . . . ?
Pt2 O2 C15 C20 0.8(6) . . . . ?
O2 C15 C16 C17 179.5(4) . . . . ?
C20 C15 C16 C17 -0.3(7) . . . . ?
C15 C16 C17 C18 -1.2(7) . . . . ?
C16 C17 C18 C19 1.7(7) . . . . ?
C16 C17 C18 Cl4 -179.8(4) . . . . ?
C17 C18 C19 C20 -0.8(7) . . . . ?
Cl4 C18 C19 C20 -179.3(3) . . . . ?
N3 N4 C20 C19 179.4(4) . . . . ?
N3 N4 C20 C15 -2.2(7) . . . . ?
C18 C19 C20 N4 178.0(4) . . . . ?
C18 C19 C20 C15 -0.6(7) . . . . ?
O2 C15 C20 N4 3.1(7) . . . . ?
C16 C15 C20 N4 -177.2(4) . . . . ?
O2 C15 C20 C19 -178.6(4) . . . . ?
C16 C15 C20 C19 1.2(6) . . . . ?
N4 N3 C21 C22 -2.9(5) . . . . ?
Pt2 N3 C21 C22 177.7(3) . . . . ?
N4 N3 C21 C26 176.8(3) . . . . ?
Pt2 N3 C21 C26 -2.6(4) . . . . ?
C26 C21 C22 C23 -1.0(6) . . . . ?
N3 C21 C22 C23 178.8(4) . . . . ?
C21 C22 C23 C24 0.4(7) . . . . ?
C22 C23 C24 C25 1.1(8) . . . . ?
C23 C24 C25 C26 -2.0(7) . . . . ?
C24 C25 C26 C21 1.5(7) . . . . ?
C24 C25 C26 S2 178.9(4) . . . . ?
C22 C21 C26 C25 0.1(6) . . . . ?
N3 C21 C26 C25 -179.7(4) . . . . ?
C22 C21 C26 S2 -177.5(3) . . . . ?
N3 C21 C26 S2 2.8(5) . . . . ?
C27 S2 C26 C25 68.8(4) . . . . ?
Pt2 S2 C26 C25 -179.1(3) . . . . ?
C27 S2 C26 C21 -113.7(3) . . . . ?
Pt2 S2 C26 C21 -1.6(3) . . . . ?
C26 S2 C27 C28 49.6(5) . . . . ?
Pt2 S2 C27 C28 -54.4(5) . . . . ?
