#------------------------------------------------------------------------------
#$Date: 2016-03-26 02:15:08 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180130 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/28/7102894.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_7102894
loop_
_publ_author_name
'Trokowski, Robert'
'Akine, Shigehisa'
'Nabeshima, Tatsuya'
_publ_section_title
;
 Synthesis, characterization and molecular recognition of a
 bis-platinum terpyridine dimer.
;
_journal_issue                   7
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              889
_journal_page_last               890
_journal_paper_doi               10.1039/b716459a
_journal_year                    2008
_chemical_formula_moiety         C86H98B4F16N8O13Pt2S6
_chemical_formula_sum            'C86 H98 B4 F16 N8 O13 Pt2 S6'
_chemical_formula_weight         2381.50
_chemical_name_common            C64H44N8Pt2(C10H8O2)(BF4)4(Me2SO)6(H2O)5
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                114.721(16)
_cell_angle_beta                 91.774(13)
_cell_angle_gamma                101.924(14)
_cell_formula_units_Z            1
_cell_length_a                   10.382(4)
_cell_length_b                   17.061(7)
_cell_length_c                   18.049(7)
_cell_measurement_reflns_used    22301
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      3.01
_cell_volume                     2816.3(19)
_computing_cell_refinement       'Rapid AUTO (Rigaku Corp.)'
_computing_data_collection       'Rapid AUTO (Rigaku Corp.)'
_computing_data_reduction        'Rapid AUTO (Rigaku Corp.)'
_computing_molecular_graphics    ORTEP-3
_computing_publication_material  ORTEP-3
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    SIR97
_diffrn_ambient_temperature      120(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Rigaku R-AXIS Rapid'
_diffrn_measurement_method       IP
_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  0.1062
_diffrn_reflns_av_sigmaI/netI    0.1335
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            22301
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         3.01
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.673
_exptl_absorpt_correction_T_max  0.8780
_exptl_absorpt_correction_T_min  0.3484
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Rapid AUTO (Rigaku Corp.)'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.404
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1190
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.602
_refine_diff_density_min         -2.066
_refine_diff_density_rms         0.178
_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     616
_refine_ls_number_reflns         9888
_refine_ls_number_restraints     79
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.1060
_refine_ls_R_factor_gt           0.0796
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1873
_refine_ls_wR_factor_ref         0.2052
_reflns_number_gt                6661
_reflns_number_total             9888
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b716459a.txt
_cod_data_source_block           1naphthalene26diol
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7102894
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.86870(4) 0.56897(3) 0.40244(3) 0.05038(17) Uani 1 d . . .
N1 N 0.8526(7) 0.6242(6) 0.5243(5) 0.046(2) Uani 1 d . . .
C1 C 0.8323(8) 0.5630(7) 0.5571(7) 0.044(2) Uani 1 d . . .
C2 C 0.8198(10) 0.5867(7) 0.6390(7) 0.051(3) Uani 1 d . . .
H1 H 0.8061 0.5437 0.6602 0.062 Uiso 1 calc R . .
C3 C 0.8279(10) 0.6758(8) 0.6894(8) 0.060(3) Uani 1 d . . .
H2 H 0.8202 0.6947 0.7463 0.072 Uiso 1 calc R . .
C4 C 0.8478(10) 0.7380(8) 0.6557(8) 0.057(3) Uani 1 d . . .
H3 H 0.8546 0.7992 0.6896 0.069 Uiso 1 calc R . .
C5 C 0.8570(9) 0.7089(7) 0.5738(7) 0.048(2) Uani 1 d . . .
H4 H 0.8669 0.7506 0.5511 0.058 Uiso 1 calc R . .
N2 N 0.8430(7) 0.4631(6) 0.4205(5) 0.046(2) Uani 1 d . . .
C6 C 0.8234(9) 0.4711(7) 0.4973(7) 0.049(2) Uani 1 d . . .
C7 C 0.8018(8) 0.3964(7) 0.5112(7) 0.046(2) Uani 1 d . . .
H5 H 0.7917 0.4015 0.5651 0.055 Uiso 1 calc R . .
C8 C 0.7946(9) 0.3110(7) 0.4451(7) 0.051(3) Uani 1 d . . .
C9 C 0.8174(9) 0.3073(7) 0.3667(7) 0.051(3) Uani 1 d . . .
H6 H 0.8150 0.2518 0.3216 0.062 Uiso 1 calc R . .
C10 C 0.8433(9) 0.3847(7) 0.3557(7) 0.049(2) Uani 1 d . . .
N3 N 0.8833(9) 0.4803(7) 0.2880(6) 0.063(3) Uani 1 d . . .
C11 C 0.8651(11) 0.3950(8) 0.2811(7) 0.057(3) Uani 1 d . . .
C12 C 0.8739(13) 0.3248(9) 0.2072(8) 0.076(4) Uani 1 d . . .
H7 H 0.8648 0.2668 0.2037 0.091 Uiso 1 calc R . .
C13 C 0.8968(16) 0.3411(11) 0.1368(9) 0.090(4) Uani 1 d . . .
H8 H 0.9029 0.2947 0.0854 0.107 Uiso 1 calc R . .
C14 C 0.910(2) 0.4281(12) 0.1466(9) 0.112(6) Uani 1 d . . .
H9 H 0.9247 0.4408 0.1007 0.134 Uiso 1 calc R . .
C15 C 0.9013(15) 0.4973(10) 0.2222(10) 0.086(4) Uani 1 d . . .
H10 H 0.9082 0.5556 0.2269 0.104 Uiso 1 calc R . .
C16 C 0.7621(9) 0.2318(7) 0.4594(7) 0.054(3) Uani 1 d . . .
C17 C 0.6703(9) 0.2253(7) 0.5110(7) 0.052(3) Uani 1 d . . .
H11 H 0.6290 0.2731 0.5364 0.063 Uiso 1 calc R . .
C18 C 0.6352(10) 0.1510(7) 0.5277(9) 0.063(3) Uani 1 d . . .
C19 C 0.6996(11) 0.0795(8) 0.4885(10) 0.075(4) Uani 1 d . . .
H12 H 0.6789 0.0281 0.4983 0.090 Uiso 1 calc R . .
C20 C 0.7914(10) 0.0864(8) 0.4366(9) 0.069(4) Uani 1 d . . .
H13 H 0.8357 0.0400 0.4120 0.083 Uiso 1 calc R . .
C21 C 0.8203(10) 0.1600(8) 0.4196(9) 0.064(3) Uani 1 d . . .
H14 H 0.8796 0.1618 0.3810 0.077 Uiso 1 calc R . .
C22 C 0.5340(10) 0.1468(8) 0.5846(8) 0.063(3) Uani 1 d . . .
C23 C 0.4210(9) 0.1767(7) 0.5821(8) 0.055(3) Uani 1 d . . .
H15 H 0.4061 0.1974 0.5419 0.066 Uiso 1 calc R . .
C24 C 0.3290(10) 0.1776(7) 0.6358(8) 0.056(3) Uani 1 d . . .
C25 C 0.3489(11) 0.1463(9) 0.6924(9) 0.070(3) Uani 1 d . . .
H16 H 0.2861 0.1462 0.7295 0.084 Uiso 1 calc R . .
C26 C 0.4611(12) 0.1143(10) 0.6960(10) 0.087(5) Uani 1 d . . .
H17 H 0.4731 0.0918 0.7351 0.104 Uiso 1 calc R . .
C27 C 0.5534(12) 0.1148(9) 0.6444(10) 0.079(4) Uani 1 d . . .
H18 H 0.6303 0.0939 0.6482 0.095 Uiso 1 calc R . .
C28 C 0.2040(10) 0.2081(8) 0.6315(7) 0.055(3) Uani 1 d . . .
C29 C 0.2167(10) 0.2848(8) 0.6188(7) 0.057(3) Uani 1 d . . .
H19 H 0.3006 0.3129 0.6108 0.069 Uiso 1 calc R . .
N4 N 0.1076(8) 0.3203(6) 0.6179(6) 0.053(2) Uani 1 d . . .
C30 C -0.0088(10) 0.2796(8) 0.6298(7) 0.060(3) Uani 1 d . . .
H20 H -0.0831 0.3043 0.6310 0.072 Uiso 1 calc R . .
C31 C -0.0246(11) 0.2036(8) 0.6405(8) 0.063(3) Uani 1 d . . .
H21 H -0.1087 0.1765 0.6491 0.076 Uiso 1 calc R . .
C32 C 0.0821(11) 0.1665(9) 0.6387(8) 0.065(3) Uani 1 d . . .
H22 H 0.0701 0.1116 0.6424 0.078 Uiso 1 calc R . .
O1 O 0.5344(17) 0.3747(14) 0.2657(13) 0.187(8) Uani 1 d . . .
H23 H 0.5278 0.3219 0.2583 0.281 Uiso 1 calc R . .
C33 C 0.5237(15) 0.4277(13) 0.3491(11) 0.149(10) Uani 1 d D . .
C34 C 0.5067(13) 0.3964(9) 0.4092(9) 0.111(6) Uani 1 d D . .
H24 H 0.5026 0.3357 0.3955 0.133 Uiso 1 calc R . .
C35 C 0.4956(12) 0.4550(5) 0.4901(6) 0.105(6) Uani 1 d D . .
C36 C 0.4838(13) 0.4246(10) 0.5511(10) 0.132(9) Uani 1 d D . .
H25 H 0.4850 0.3648 0.5382 0.159 Uiso 1 calc R . .
C37 C 0.4701(14) 0.4827(13) 0.6315(12) 0.140(10) Uani 1 d D . .
H26 H 0.4568 0.4615 0.6724 0.168 Uiso 1 calc R . .
B1 B 0.136(2) 0.0385(16) 0.3506(14) 0.1033(18) Uiso 0.364(8) d PD A 1
F1 F 0.144(2) 0.1121(13) 0.4209(11) 0.1033(18) Uiso 0.364(8) d PD A 1
F2 F 0.194(2) -0.0166(15) 0.3693(14) 0.1033(18) Uiso 0.364(8) d PD A 1
F3 F 0.0051(17) 0.0014(15) 0.3220(13) 0.1033(18) Uiso 0.364(8) d PD A 1
F4 F 0.187(2) 0.0569(15) 0.2908(12) 0.1033(18) Uiso 0.364(8) d PD A 1
B2 B 0.1641(18) 0.0497(12) 0.3750(12) 0.1033(18) Uiso 0.636(8) d PD A 2
F5 F 0.1262(13) 0.0402(9) 0.4446(7) 0.1033(18) Uiso 0.636(8) d PD A 2
F6 F 0.2566(12) 0.1249(8) 0.3978(8) 0.1033(18) Uiso 0.636(8) d PD A 2
F7 F 0.2006(14) -0.0270(8) 0.3309(8) 0.1033(18) Uiso 0.636(8) d PD A 2
F8 F 0.0533(12) 0.0521(10) 0.3356(8) 0.1033(18) Uiso 0.636(8) d PD A 2
B3 B 0.892(4) 0.799(3) 0.920(3) 0.333(9) Uiso 0.443(17) d PD B 1
F9 F 0.798(5) 0.846(4) 0.936(4) 0.333(9) Uiso 0.443(17) d PD B 1
F10 F 0.979(5) 0.826(5) 0.987(3) 0.333(9) Uiso 0.443(17) d PD B 1
F11 F 0.957(5) 0.810(4) 0.861(3) 0.333(9) Uiso 0.443(17) d PD B 1
F12 F 0.832(6) 0.713(3) 0.894(4) 0.333(9) Uiso 0.443(17) d PD B 1
B4 B 0.862(4) 0.778(3) 0.961(2) 0.333(9) Uiso 0.557(17) d PD B 2
F13 F 0.807(4) 0.758(3) 0.885(2) 0.333(9) Uiso 0.557(17) d PD B 2
F14 F 0.985(4) 0.830(4) 0.976(3) 0.333(9) Uiso 0.557(17) d PD B 2
F15 F 0.869(5) 0.704(3) 0.969(3) 0.333(9) Uiso 0.557(17) d PD B 2
F16 F 0.783(4) 0.819(3) 1.014(3) 0.333(9) Uiso 0.557(17) d PD B 2
O2 O 0.7873(10) 0.4205(7) 0.6951(6) 0.088(3) Uani 1 d . . .
C38 C 0.700(3) 0.5249(16) 0.8218(14) 0.172(10) Uani 1 d . . .
H27 H 0.6692 0.5641 0.8020 0.258 Uiso 0.569(14) calc PR C 1
H28 H 0.7961 0.5468 0.8398 0.258 Uiso 0.569(14) calc PR C 1
H29 H 0.6540 0.5241 0.8681 0.258 Uiso 0.569(14) calc PR C 1
H30 H 0.7622 0.5794 0.8272 0.258 Uiso 0.431(14) calc PR C 2
H31 H 0.6741 0.5329 0.8757 0.258 Uiso 0.431(14) calc PR C 2
H32 H 0.6212 0.5120 0.7836 0.258 Uiso 0.431(14) calc PR C 2
S1 S 0.6636(8) 0.4064(5) 0.7343(6) 0.091(3) Uani 0.569(14) d P C 1
C39 C 0.729(5) 0.353(3) 0.795(3) 0.151(12) Uiso 0.569(14) d P C 1
H33 H 0.7187 0.2893 0.7601 0.227 Uiso 0.569(14) calc PR C 1
H34 H 0.6791 0.3599 0.8421 0.227 Uiso 0.569(14) calc PR C 1
H35 H 0.8233 0.3813 0.8159 0.227 Uiso 0.569(14) calc PR C 1
S2 S 0.7766(16) 0.4370(8) 0.7842(7) 0.109(6) Uani 0.431(14) d P C 2
C40 C 0.620(6) 0.359(4) 0.782(3) 0.151(12) Uiso 0.431(14) d P C 2
H36 H 0.6334 0.2988 0.7624 0.227 Uiso 0.431(14) calc PR C 2
H37 H 0.5488 0.3594 0.7454 0.227 Uiso 0.431(14) calc PR C 2
H38 H 0.5947 0.3779 0.8379 0.227 Uiso 0.431(14) calc PR C 2
O3 O 0.557(2) 0.2252(17) 0.2393(16) 0.247(12) Uani 1 d D . .
C41 C 0.5001(19) 0.0871(17) 0.2783(14) 0.153(9) Uani 1 d D . .
H39 H 0.5874 0.0803 0.2932 0.229 Uiso 0.486(16) calc PR D 1
H40 H 0.4347 0.0300 0.2595 0.229 Uiso 0.486(16) calc PR D 1
H41 H 0.4734 0.1317 0.3265 0.229 Uiso 0.486(16) calc PR D 1
H42 H 0.5425 0.1204 0.3355 0.229 Uiso 0.514(16) calc PR D 2
H43 H 0.5661 0.0645 0.2427 0.229 Uiso 0.514(16) calc PR D 2
H44 H 0.4287 0.0370 0.2737 0.229 Uiso 0.514(16) calc PR D 2
S3 S 0.4324(8) 0.1587(8) 0.2474(8) 0.121(5) Uani 0.514(16) d P D 2
C42 C 0.366(7) 0.088(4) 0.133(5) 0.30(3) Uiso 0.514(16) d PD D 2
H45 H 0.3284 0.1240 0.1118 0.451 Uiso 0.514(16) calc PR D 2
H46 H 0.2978 0.0362 0.1266 0.451 Uiso 0.514(16) calc PR D 2
H47 H 0.4394 0.0691 0.1029 0.451 Uiso 0.514(16) calc PR D 2
S4 S 0.5093(14) 0.1242(16) 0.1928(11) 0.186(9) Uani 0.486(16) d P D 1
C43 C 0.317(5) 0.113(6) 0.183(6) 0.30(3) Uiso 0.486(16) d PD D 1
H48 H 0.2906 0.1293 0.1403 0.451 Uiso 0.486(16) calc PR D 1
H49 H 0.2939 0.1524 0.2359 0.451 Uiso 0.486(16) calc PR D 1
H50 H 0.2708 0.0513 0.1691 0.451 Uiso 0.486(16) calc PR D 1
O4 O 0.8493(16) 0.1383(9) 0.2173(8) 0.139(5) Uani 1 d . . .
C44 C 0.803(4) -0.028(2) 0.179(2) 0.243(17) Uani 1 d . . .
H51 H 0.7160 -0.0357 0.1978 0.365 Uiso 0.59(2) calc PR E 1
H52 H 0.8731 -0.0110 0.2241 0.365 Uiso 0.59(2) calc PR E 1
H53 H 0.8090 -0.0841 0.1334 0.365 Uiso 0.59(2) calc PR E 1
H54 H 0.8418 -0.0264 0.2297 0.365 Uiso 0.41(2) calc PR E 2
H55 H 0.8042 -0.0846 0.1324 0.365 Uiso 0.41(2) calc PR E 2
H56 H 0.7112 -0.0225 0.1832 0.365 Uiso 0.41(2) calc PR E 2
C45 C 0.993(3) 0.033(3) 0.127(2) 0.127(9) Uiso 0.59(2) d P E 1
H57 H 1.0325 0.0741 0.1046 0.190 Uiso 0.59(2) calc PR E 1
H58 H 0.9892 -0.0280 0.0880 0.190 Uiso 0.59(2) calc PR E 1
H59 H 1.0471 0.0473 0.1789 0.190 Uiso 0.59(2) calc PR E 1
S5 S 0.8204(13) 0.0452(9) 0.1486(9) 0.104(4) Uani 0.59(2) d P E 1
C46 C 0.786(5) 0.038(3) 0.060(3) 0.127(9) Uiso 0.41(2) d P E 2
H60 H 0.8228 0.0837 0.0415 0.190 Uiso 0.41(2) calc PR E 2
H61 H 0.6947 0.0397 0.0704 0.190 Uiso 0.41(2) calc PR E 2
H62 H 0.7873 -0.0207 0.0165 0.190 Uiso 0.41(2) calc PR E 2
S6 S 0.896(3) 0.0603(17) 0.1622(18) 0.142(8) Uani 0.41(2) d P E 2
O5 O 0.310(3) 0.4063(19) 0.8708(17) 0.124(8) Uiso 0.50 d P F 1
O6 O -0.176(2) 0.2032(18) 0.8450(16) 0.123(8) Uiso 0.50 d P G 1
O7 O 0.172(4) 0.374(3) 0.837(2) 0.089(11) Uiso 0.25 d P H 3
O8 O -0.102(5) 0.282(4) 0.823(3) 0.136(18) Uiso 0.25 d P I 2
O9 O 0.161(7) 0.318(5) 0.870(5) 0.19(3) Uiso 0.25 d P J 2
O10 O 0.479(9) 0.812(6) 1.038(5) 0.21(3) Uiso 0.25 d P K 1
O11 O 0.385(6) 0.498(5) 0.883(4) 0.15(2) Uiso 0.25 d P L 2
O12 O 0.367(5) 0.424(4) 0.810(4) 0.127(16) Uiso 0.25 d P M 3
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'
Pt Pt -1.7033 8.3905 '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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N2 Pt1 N3 80.9(4) . . ?
N2 Pt1 N1 81.2(3) . . ?
N3 Pt1 N1 161.9(3) . . ?
N2 Pt1 N4 178.9(3) . 2_666 ?
N3 Pt1 N4 98.8(4) . 2_666 ?
N1 Pt1 N4 99.2(3) . 2_666 ?
C5 N1 C1 118.4(9) . . ?
C5 N1 Pt1 128.5(6) . . ?
C1 N1 Pt1 113.1(7) . . ?
C2 C1 N1 122.5(9) . . ?
C2 C1 C6 123.0(9) . . ?
N1 C1 C6 114.5(9) . . ?
C1 C2 C3 117.7(9) . . ?
C1 C2 H1 121.1 . . ?
C3 C2 H1 121.1 . . ?
C2 C3 C4 119.6(11) . . ?
C2 C3 H2 120.2 . . ?
C4 C3 H2 120.2 . . ?
C5 C4 C3 119.0(11) . . ?
C5 C4 H3 120.5 . . ?
C3 C4 H3 120.5 . . ?
N1 C5 C4 122.7(9) . . ?
N1 C5 H4 118.7 . . ?
C4 C5 H4 118.7 . . ?
C10 N2 C6 123.7(9) . . ?
C10 N2 Pt1 118.4(7) . . ?
C6 N2 Pt1 117.9(7) . . ?
N2 C6 C7 119.0(10) . . ?
N2 C6 C1 113.2(9) . . ?
C7 C6 C1 127.7(10) . . ?
C6 C7 C8 120.4(9) . . ?
C6 C7 H5 119.8 . . ?
C8 C7 H5 119.8 . . ?
C9 C8 C7 117.8(9) . . ?
C9 C8 C16 122.4(10) . . ?
C7 C8 C16 119.7(10) . . ?
C10 C9 C8 120.0(10) . . ?
C10 C9 H6 120.0 . . ?
C8 C9 H6 120.0 . . ?
N2 C10 C9 119.0(10) . . ?
N2 C10 C11 112.2(9) . . ?
C9 C10 C11 128.7(11) . . ?
C15 N3 C11 121.0(12) . . ?
C15 N3 Pt1 126.3(10) . . ?
C11 N3 Pt1 112.6(7) . . ?
N3 C11 C12 121.1(11) . . ?
N3 C11 C10 115.9(11) . . ?
C12 C11 C10 123.0(11) . . ?
C11 C12 C13 119.2(13) . . ?
C11 C12 H7 120.4 . . ?
C13 C12 H7 120.4 . . ?
C14 C13 C12 117.3(14) . . ?
C14 C13 H8 121.4 . . ?
C12 C13 H8 121.4 . . ?
C13 C14 C15 122.0(14) . . ?
C13 C14 H9 119.0 . . ?
C15 C14 H9 119.0 . . ?
N3 C15 C14 119.3(13) . . ?
N3 C15 H10 120.3 . . ?
C14 C15 H10 120.3 . . ?
C17 C16 C21 118.9(10) . . ?
C17 C16 C8 119.8(9) . . ?
C21 C16 C8 121.3(10) . . ?
C16 C17 C18 122.6(10) . . ?
C16 C17 H11 118.7 . . ?
C18 C17 H11 118.7 . . ?
C17 C18 C19 117.6(11) . . ?
C17 C18 C22 120.8(9) . . ?
C19 C18 C22 121.6(10) . . ?
C20 C19 C18 119.4(11) . . ?
C20 C19 H12 120.3 . . ?
C18 C19 H12 120.3 . . ?
C19 C20 C21 121.1(11) . . ?
C19 C20 H13 119.4 . . ?
C21 C20 H13 119.4 . . ?
C20 C21 C16 120.2(11) . . ?
C20 C21 H14 119.9 . . ?
C16 C21 H14 119.9 . . ?
C23 C22 C27 117.9(11) . . ?
C23 C22 C18 120.6(9) . . ?
C27 C22 C18 121.4(9) . . ?
C22 C23 C24 122.3(10) . . ?
C22 C23 H15 118.9 . . ?
C24 C23 H15 118.9 . . ?
C25 C24 C23 119.0(9) . . ?
C25 C24 C28 118.8(10) . . ?
C23 C24 C28 122.2(9) . . ?
C24 C25 C26 120.4(11) . . ?
C24 C25 H16 119.8 . . ?
C26 C25 H16 119.8 . . ?
C27 C26 C25 121.0(11) . . ?
C27 C26 H17 119.5 . . ?
C25 C26 H17 119.5 . . ?
C26 C27 C22 119.5(10) . . ?
C26 C27 H18 120.3 . . ?
C22 C27 H18 120.3 . . ?
C32 C28 C29 118.7(9) . . ?
C32 C28 C24 124.7(9) . . ?
C29 C28 C24 116.7(9) . . ?
N4 C29 C28 120.7(9) . . ?
N4 C29 H19 119.7 . . ?
C28 C29 H19 119.7 . . ?
C30 N4 C29 118.3(9) . . ?
C30 N4 Pt1 122.7(7) . 2_666 ?
C29 N4 Pt1 119.0(6) . 2_666 ?
N4 C30 C31 122.2(9) . . ?
N4 C30 H20 118.9 . . ?
C31 C30 H20 118.9 . . ?
C30 C31 C32 119.7(10) . . ?
C30 C31 H21 120.1 . . ?
C32 C31 H21 120.1 . . ?
C28 C32 C31 120.2(10) . . ?
C28 C32 H22 119.9 . . ?
C31 C32 H22 119.9 . . ?
C33 O1 H23 109.5 . . ?
C34 C33 C37 120.7(10) . 2_666 ?
C34 C33 O1 124.8(17) . . ?
C37 C33 O1 114.6(17) 2_666 . ?
C33 C34 C35 119.8(9) . . ?
C33 C34 H24 120.1 . . ?
C35 C34 H24 120.1 . . ?
C36 C35 C35 120.4(10) . 2_666 ?
C36 C35 C34 119.9(8) . . ?
C35 C35 C34 119.6(9) 2_666 . ?
C35 C36 C37 119.9(9) . . ?
C35 C36 H25 120.0 . . ?
C37 C36 H25 120.0 . . ?
C33 C37 C36 119.4(10) 2_666 . ?
C33 C37 H26 120.3 2_666 . ?
C36 C37 H26 120.3 . . ?
F4 B1 F1 112.6(17) . . ?
F4 B1 F2 113.9(17) . . ?
F1 B1 F2 107.3(16) . . ?
F4 B1 F3 104.5(16) . . ?
F1 B1 F3 107.0(17) . . ?
F2 B1 F3 111.3(17) . . ?
F6 B2 F8 110.8(14) . . ?
F6 B2 F7 116.8(15) . . ?
F8 B2 F7 110.2(14) . . ?
F6 B2 F5 109.4(14) . . ?
F8 B2 F5 106.0(14) . . ?
F7 B2 F5 102.9(14) . . ?
F12 B3 F10 109.8(19) . . ?
F12 B3 F11 109.2(19) . . ?
F10 B3 F11 109.2(18) . . ?
F12 B3 F9 108.0(18) . . ?
F10 B3 F9 110.8(19) . . ?
F11 B3 F9 109.9(19) . . ?
F14 B4 F13 109.8(18) . . ?
F14 B4 F16 111.5(19) . . ?
F13 B4 F16 108.1(18) . . ?
F14 B4 F15 108.6(18) . . ?
F13 B4 F15 111.1(19) . . ?
F16 B4 F15 107.8(18) . . ?
S1 O2 S2 51.7(6) . . ?
S2 C38 S1 42.0(7) . . ?
S2 C38 H27 137.8 . . ?
S1 C38 H27 109.5 . . ?
S2 C38 H28 70.1 . . ?
S1 C38 H28 109.5 . . ?
H27 C38 H28 109.5 . . ?
S2 C38 H29 110.0 . . ?
S1 C38 H29 109.5 . . ?
H27 C38 H29 109.5 . . ?
H28 C38 H29 109.5 . . ?
S2 C38 H30 109.5 . . ?
S1 C38 H30 129.8 . . ?
H27 C38 H30 60.5 . . ?
H28 C38 H30 49.2 . . ?
H29 C38 H30 120.3 . . ?
S2 C38 H31 109.5 . . ?
S1 C38 H31 118.6 . . ?
H27 C38 H31 112.5 . . ?
H28 C38 H31 96.4 . . ?
H29 C38 H31 13.5 . . ?
H30 C38 H31 109.5 . . ?
S2 C38 H32 109.5 . . ?
S1 C38 H32 67.9 . . ?
H27 C38 H32 50.9 . . ?
H28 C38 H32 151.9 . . ?
H29 C38 H32 97.2 . . ?
H30 C38 H32 109.5 . . ?
H31 C38 H32 109.5 . . ?
O2 S1 C39 96.7(16) . . ?
O2 S1 C38 96.2(10) . . ?
C39 S1 C38 96.8(16) . . ?
S1 C39 H33 109.5 . . ?
S1 C39 H34 109.5 . . ?
H33 C39 H34 109.5 . . ?
S1 C39 H35 109.5 . . ?
H33 C39 H35 109.5 . . ?
H34 C39 H35 109.5 . . ?
O2 S2 C38 103.8(11) . . ?
O2 S2 C40 106(2) . . ?
C38 S2 C40 90(2) . . ?
S2 C40 H36 109.5 . . ?
S2 C40 H37 109.5 . . ?
H36 C40 H37 109.5 . . ?
S2 C40 H38 109.5 . . ?
H36 C40 H38 109.5 . . ?
H37 C40 H38 109.5 . . ?
S4 O3 S3 49.6(9) . . ?
S3 C41 S4 41.5(7) . . ?
S3 C41 H39 138.6 . . ?
S4 C41 H39 109.5 . . ?
S3 C41 H40 108.8 . . ?
S4 C41 H40 109.5 . . ?
H39 C41 H40 109.5 . . ?
S3 C41 H41 71.1 . . ?
S4 C41 H41 109.5 . . ?
H39 C41 H41 109.5 . . ?
H40 C41 H41 109.5 . . ?
S3 C41 H42 109.5 . . ?
S4 C41 H42 128.2 . . ?
H39 C41 H42 60.8 . . ?
H40 C41 H42 121.9 . . ?
H41 C41 H42 48.8 . . ?
S3 C41 H43 109.5 . . ?
S4 C41 H43 68.2 . . ?
H39 C41 H43 50.9 . . ?
H40 C41 H43 96.7 . . ?
H41 C41 H43 152.3 . . ?
H42 C41 H43 109.5 . . ?
S3 C41 H44 109.5 . . ?
S4 C41 H44 120.2 . . ?
H39 C41 H44 111.6 . . ?
H40 C41 H44 14.6 . . ?
H41 C41 H44 95.6 . . ?
H42 C41 H44 109.5 . . ?
H43 C41 H44 109.5 . . ?
O3 S3 C41 105.4(11) . . ?
O3 S3 C42 99(3) . . ?
C41 S3 C42 105(3) . . ?
S3 C42 H45 109.5 . . ?
S3 C42 H46 109.5 . . ?
H45 C42 H46 109.5 . . ?
S3 C42 H47 109.5 . . ?
H45 C42 H47 109.5 . . ?
H46 C42 H47 109.5 . . ?
O3 S4 C41 103.1(16) . . ?
O3 S4 C43 99(3) . . ?
C41 S4 C43 91(3) . . ?
S4 C43 H48 109.5 . . ?
S4 C43 H49 109.5 . . ?
H48 C43 H49 109.5 . . ?
S4 C43 H50 109.5 . . ?
H48 C43 H50 109.5 . . ?
H49 C43 H50 109.5 . . ?
S6 O4 S5 29.9(10) . . ?
S5 C44 S6 26.0(10) . . ?
S5 C44 H51 109.5 . . ?
S6 C44 H51 130.5 . . ?
S5 C44 H52 109.5 . . ?
S6 C44 H52 86.1 . . ?
H51 C44 H52 109.5 . . ?
S5 C44 H53 109.5 . . ?
S6 C44 H53 108.4 . . ?
H51 C44 H53 109.5 . . ?
H52 C44 H53 109.5 . . ?
S5 C44 H54 130.0 . . ?
S6 C44 H54 109.5 . . ?
H51 C44 H54 87.9 . . ?
H52 C44 H54 24.6 . . ?
H53 C44 H54 107.6 . . ?
S5 C44 H55 109.1 . . ?
S6 C44 H55 109.5 . . ?
H51 C44 H55 107.1 . . ?
H52 C44 H55 112.1 . . ?
H53 C44 H55 2.9 . . ?
H54 C44 H55 109.5 . . ?
S5 C44 H56 85.9 . . ?
S6 C44 H56 109.5 . . ?
H51 C44 H56 24.8 . . ?
H52 C44 H56 126.9 . . ?
H53 C44 H56 112.3 . . ?
H54 C44 H56 109.5 . . ?
H55 C44 H56 109.5 . . ?
S5 C45 H57 109.5 . . ?
S5 C45 H58 109.5 . . ?
H57 C45 H58 109.5 . . ?
S5 C45 H59 109.5 . . ?
H57 C45 H59 109.5 . . ?
H58 C45 H59 109.5 . . ?
O4 S5 C44 113.8(16) . . ?
O4 S5 C45 101.0(15) . . ?
C44 S5 C45 90(2) . . ?
S6 C46 H60 109.5 . . ?
S6 C46 H61 109.5 . . ?
H60 C46 H61 109.5 . . ?
S6 C46 H62 109.5 . . ?
H60 C46 H62 109.5 . . ?
H61 C46 H62 109.5 . . ?
O4 S6 C44 104(2) . . ?
O4 S6 C46 96(2) . . ?
C44 S6 C46 98(2) . . ?
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 N2 1.934(8) . ?
Pt1 N3 2.020(10) . ?
Pt1 N1 2.026(9) . ?
Pt1 N4 2.040(8) 2_666 ?
N1 C5 1.333(13) . ?
N1 C1 1.386(11) . ?
C1 C2 1.377(14) . ?
C1 C6 1.466(14) . ?
C2 C3 1.389(15) . ?
C2 H1 0.9500 . ?
C3 C4 1.413(15) . ?
C3 H2 0.9500 . ?
C4 C5 1.362(15) . ?
C4 H3 0.9500 . ?
C5 H4 0.9500 . ?
N2 C10 1.360(13) . ?
N2 C6 1.361(13) . ?
C6 C7 1.375(13) . ?
C7 C8 1.430(15) . ?
C7 H5 0.9500 . ?
C8 C9 1.419(15) . ?
C8 C16 1.456(14) . ?
C9 C10 1.390(14) . ?
C9 H6 0.9500 . ?
C10 C11 1.448(15) . ?
N3 C15 1.345(16) . ?
N3 C11 1.379(15) . ?
C11 C12 1.391(17) . ?
C12 C13 1.427(19) . ?
C12 H7 0.9500 . ?
C13 C14 1.39(2) . ?
C13 H8 0.9500 . ?
C14 C15 1.40(2) . ?
C14 H9 0.9500 . ?
C15 H10 0.9500 . ?
C16 C17 1.372(15) . ?
C16 C21 1.407(15) . ?
C17 C18 1.402(14) . ?
C17 H11 0.9500 . ?
C18 C19 1.443(16) . ?
C18 C22 1.504(16) . ?
C19 C20 1.379(18) . ?
C19 H12 0.9500 . ?
C20 C21 1.390(15) . ?
C20 H13 0.9500 . ?
C21 H14 0.9500 . ?
C22 C23 1.379(13) . ?
C22 C27 1.424(15) . ?
C23 C24 1.379(15) . ?
C23 H15 0.9500 . ?
C24 C25 1.365(15) . ?
C24 C28 1.505(13) . ?
C25 C26 1.396(15) . ?
C25 H16 0.9500 . ?
C26 C27 1.358(18) . ?
C26 H17 0.9500 . ?
C27 H18 0.9500 . ?
C28 C32 1.356(14) . ?
C28 C29 1.401(13) . ?
C29 N4 1.393(12) . ?
C29 H19 0.9500 . ?
N4 C30 1.336(13) . ?
N4 Pt1 2.040(8) 2_666 ?
C30 C31 1.366(15) . ?
C30 H20 0.9500 . ?
C31 C32 1.380(14) . ?
C31 H21 0.9500 . ?
C32 H22 0.9500 . ?
O1 C33 1.42(2) . ?
O1 H23 0.8400 . ?
C33 C34 1.396(13) . ?
C33 C37 1.406(13) 2_666 ?
C34 C35 1.408(12) . ?
C34 H24 0.9500 . ?
C35 C36 1.398(12) . ?
C35 C35 1.405(14) 2_666 ?
C36 C37 1.406(13) . ?
C36 H25 0.9500 . ?
C37 C33 1.406(13) 2_666 ?
C37 H26 0.9500 . ?
B1 F4 1.339(18) . ?
B1 F1 1.346(18) . ?
B1 F2 1.354(18) . ?
B1 F3 1.362(18) . ?
B2 F6 1.328(16) . ?
B2 F8 1.351(16) . ?
B2 F7 1.357(17) . ?
B2 F5 1.390(17) . ?
B3 F12 1.340(19) . ?
B3 F10 1.340(18) . ?
B3 F11 1.340(18) . ?
B3 F9 1.350(18) . ?
B4 F14 1.338(18) . ?
B4 F13 1.342(18) . ?
B4 F16 1.342(18) . ?
B4 F15 1.349(18) . ?
O2 S1 1.509(11) . ?
O2 S2 1.526(14) . ?
C38 S2 1.74(3) . ?
C38 S1 1.92(2) . ?
C38 H27 0.9800 . ?
C38 H28 0.9800 . ?
C38 H29 0.9800 . ?
C38 H30 0.9800 . ?
C38 H31 0.9800 . ?
C38 H32 0.9800 . ?
S1 C39 1.89(4) . ?
C39 H33 0.9800 . ?
C39 H34 0.9800 . ?
C39 H35 0.9800 . ?
S2 C40 1.87(6) . ?
C40 H36 0.9800 . ?
C40 H37 0.9800 . ?
C40 H38 0.9800 . ?
O3 S4 1.53(3) . ?
O3 S3 1.59(2) . ?
C41 S3 1.79(2) . ?
C41 S4 1.90(3) . ?
C41 H39 0.9800 . ?
C41 H40 0.9800 . ?
C41 H41 0.9800 . ?
C41 H42 0.9800 . ?
C41 H43 0.9800 . ?
C41 H44 0.9800 . ?
S3 C42 1.91(6) . ?
C42 H45 0.9800 . ?
C42 H46 0.9800 . ?
C42 H47 0.9800 . ?
S4 C43 1.96(7) . ?
C43 H48 0.9800 . ?
C43 H49 0.9800 . ?
C43 H50 0.9800 . ?
O4 S6 1.48(3) . ?
O4 S5 1.511(19) . ?
C44 S5 1.54(3) . ?
C44 S6 1.76(4) . ?
C44 H51 0.9800 . ?
C44 H52 0.9800 . ?
C44 H53 0.9800 . ?
C44 H54 0.9800 . ?
C44 H55 0.9800 . ?
C44 H56 0.9800 . ?
C45 S5 1.88(4) . ?
C45 H57 0.9800 . ?
C45 H58 0.9800 . ?
C45 H59 0.9800 . ?
C46 S6 1.99(5) . ?
C46 H60 0.9800 . ?
C46 H61 0.9800 . ?
C46 H62 0.9800 . ?
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
N2 Pt1 N1 C5 -179.0(8) . . . . ?
N3 Pt1 N1 C5 174.5(10) . . . . ?
N4 Pt1 N1 C5 0.0(8) 2_666 . . . ?
N2 Pt1 N1 C1 -0.2(6) . . . . ?
N3 Pt1 N1 C1 -6.8(14) . . . . ?
N4 Pt1 N1 C1 178.8(6) 2_666 . . . ?
C5 N1 C1 C2 -1.7(13) . . . . ?
Pt1 N1 C1 C2 179.4(7) . . . . ?
C5 N1 C1 C6 177.5(8) . . . . ?
Pt1 N1 C1 C6 -1.4(9) . . . . ?
N1 C1 C2 C3 0.2(14) . . . . ?
C6 C1 C2 C3 -179.0(9) . . . . ?
C1 C2 C3 C4 0.3(14) . . . . ?
C2 C3 C4 C5 0.8(15) . . . . ?
C1 N1 C5 C4 2.8(13) . . . . ?
Pt1 N1 C5 C4 -178.5(7) . . . . ?
C3 C4 C5 N1 -2.4(15) . . . . ?
N3 Pt1 N2 C10 -1.2(6) . . . . ?
N1 Pt1 N2 C10 -179.2(6) . . . . ?
N4 Pt1 N2 C10 69(20) 2_666 . . . ?
N3 Pt1 N2 C6 179.9(7) . . . . ?
N1 Pt1 N2 C6 2.0(6) . . . . ?
N4 Pt1 N2 C6 -109(20) 2_666 . . . ?
C10 N2 C6 C7 -0.3(13) . . . . ?
Pt1 N2 C6 C7 178.5(6) . . . . ?
C10 N2 C6 C1 178.0(7) . . . . ?
Pt1 N2 C6 C1 -3.2(9) . . . . ?
C2 C1 C6 N2 -177.9(8) . . . . ?
N1 C1 C6 N2 2.9(11) . . . . ?
C2 C1 C6 C7 0.2(14) . . . . ?
N1 C1 C6 C7 -179.0(8) . . . . ?
N2 C6 C7 C8 -2.7(13) . . . . ?
C1 C6 C7 C8 179.3(8) . . . . ?
C6 C7 C8 C9 3.4(13) . . . . ?
C6 C7 C8 C16 -175.5(8) . . . . ?
C7 C8 C9 C10 -1.2(13) . . . . ?
C16 C8 C9 C10 177.7(8) . . . . ?
C6 N2 C10 C9 2.5(13) . . . . ?
Pt1 N2 C10 C9 -176.3(6) . . . . ?
C6 N2 C10 C11 179.4(8) . . . . ?
Pt1 N2 C10 C11 0.6(10) . . . . ?
C8 C9 C10 N2 -1.6(13) . . . . ?
C8 C9 C10 C11 -178.0(9) . . . . ?
N2 Pt1 N3 C15 178.1(11) . . . . ?
N1 Pt1 N3 C15 -175.4(10) . . . . ?
N4 Pt1 N3 C15 -0.9(11) 2_666 . . . ?
N2 Pt1 N3 C11 1.6(7) . . . . ?
N1 Pt1 N3 C11 8.1(16) . . . . ?
N4 Pt1 N3 C11 -177.4(7) 2_666 . . . ?
C15 N3 C11 C12 4.5(17) . . . . ?
Pt1 N3 C11 C12 -178.8(9) . . . . ?
C15 N3 C11 C10 -178.5(11) . . . . ?
Pt1 N3 C11 C10 -1.8(12) . . . . ?
N2 C10 C11 N3 0.8(13) . . . . ?
C9 C10 C11 N3 177.4(9) . . . . ?
N2 C10 C11 C12 177.8(10) . . . . ?
C9 C10 C11 C12 -5.6(17) . . . . ?
N3 C11 C12 C13 -2.6(19) . . . . ?
C10 C11 C12 C13 -179.4(12) . . . . ?
C11 C12 C13 C14 0(2) . . . . ?
C12 C13 C14 C15 0(3) . . . . ?
C11 N3 C15 C14 -4(2) . . . . ?
Pt1 N3 C15 C14 179.9(12) . . . . ?
C13 C14 C15 N3 2(3) . . . . ?
C9 C8 C16 C17 -141.3(10) . . . . ?
C7 C8 C16 C17 37.6(14) . . . . ?
C9 C8 C16 C21 36.9(15) . . . . ?
C7 C8 C16 C21 -144.2(10) . . . . ?
C21 C16 C17 C18 2.1(17) . . . . ?
C8 C16 C17 C18 -179.7(10) . . . . ?
C16 C17 C18 C19 0.1(17) . . . . ?
C16 C17 C18 C22 -180.0(11) . . . . ?
C17 C18 C19 C20 -0.3(18) . . . . ?
C22 C18 C19 C20 179.8(12) . . . . ?
C18 C19 C20 C21 -2(2) . . . . ?
C19 C20 C21 C16 4.0(19) . . . . ?
C17 C16 C21 C20 -4.1(17) . . . . ?
C8 C16 C21 C20 177.7(11) . . . . ?
C17 C18 C22 C23 40.7(18) . . . . ?
C19 C18 C22 C23 -139.3(12) . . . . ?
C17 C18 C22 C27 -137.2(13) . . . . ?
C19 C18 C22 C27 42.7(19) . . . . ?
C27 C22 C23 C24 1.0(19) . . . . ?
C18 C22 C23 C24 -177.0(11) . . . . ?
C22 C23 C24 C25 -1.3(19) . . . . ?
C22 C23 C24 C28 -178.4(11) . . . . ?
C23 C24 C25 C26 0(2) . . . . ?
C28 C24 C25 C26 177.5(13) . . . . ?
C24 C25 C26 C27 1(2) . . . . ?
C25 C26 C27 C22 -1(2) . . . . ?
C23 C22 C27 C26 0(2) . . . . ?
C18 C22 C27 C26 178.3(14) . . . . ?
C25 C24 C28 C32 -40.2(19) . . . . ?
C23 C24 C28 C32 136.8(13) . . . . ?
C25 C24 C28 C29 140.0(12) . . . . ?
C23 C24 C28 C29 -42.9(17) . . . . ?
C32 C28 C29 N4 3.3(18) . . . . ?
C24 C28 C29 N4 -176.9(11) . . . . ?
C28 C29 N4 C30 0.4(17) . . . . ?
C28 C29 N4 Pt1 -179.1(9) . . . 2_666 ?
C29 N4 C30 C31 -1.9(18) . . . . ?
Pt1 N4 C30 C31 177.6(9) 2_666 . . . ?
N4 C30 C31 C32 0(2) . . . . ?
C29 C28 C32 C31 -5.5(19) . . . . ?
C24 C28 C32 C31 174.8(12) . . . . ?
C30 C31 C32 C28 4(2) . . . . ?
C37 C33 C34 C35 0(2) 2_666 . . . ?
O1 C33 C34 C35 -179.2(15) . . . . ?
C33 C34 C35 C36 -177.5(13) . . . . ?
C33 C34 C35 C35 -1(2) . . . 2_666 ?
C35 C35 C36 C37 5(2) 2_666 . . . ?
C34 C35 C36 C37 -178.7(13) . . . . ?
C35 C36 C37 C33 -4(2) . . . 2_666 ?
S2 O2 S1 C39 -43.4(15) . . . . ?
S2 O2 S1 C38 54.3(10) . . . . ?
S2 C38 S1 O2 -56.8(8) . . . . ?
S2 C38 S1 C39 40.7(16) . . . . ?
S1 O2 S2 C38 -67.1(12) . . . . ?
S1 O2 S2 C40 27(2) . . . . ?
S1 C38 S2 O2 58.0(9) . . . . ?
S1 C38 S2 C40 -48.8(18) . . . . ?
S4 O3 S3 C41 61.9(13) . . . . ?
S4 O3 S3 C42 -46(3) . . . . ?
S4 C41 S3 O3 -54.8(13) . . . . ?
S4 C41 S3 C42 49(3) . . . . ?
S3 O3 S4 C41 -55.5(11) . . . . ?
S3 O3 S4 C43 37(3) . . . . ?
S3 C41 S4 O3 57.4(14) . . . . ?
S3 C41 S4 C43 -42(3) . . . . ?
S6 O4 S5 C44 85(4) . . . . ?
S6 O4 S5 C45 -10(3) . . . . ?
S6 C44 S5 O4 -72(3) . . . . ?
S6 C44 S5 C45 30(3) . . . . ?
S5 O4 S6 C44 -56(3) . . . . ?
S5 O4 S6 C46 44(3) . . . . ?
S5 C44 S6 O4 67(2) . . . . ?
S5 C44 S6 C46 -32(3) . . . . ?
