#------------------------------------------------------------------------------
#$Date: 2024-10-06 03:26:48 +0300 (Sun, 06 Oct 2024) $
#$Revision: 295082 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/94/7249443.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_7249443
loop_
_publ_author_name
'Yabune, Natsuki'
'Nakajima, Hiroshi'
'Nishioka, Takanori'
_publ_section_title
;
 Restriction of reaction sites on metal-sulfide cores induced by steric
 repulsion of bis-N-heterocyclic carbene ligands in trinuclear complexes
 bearing triply bridging sulfide ligands.
;
_journal_issue                   40
_journal_name_full               'RSC advances'
_journal_page_first              29355
_journal_page_last               29367
_journal_paper_doi               10.1039/d4ra01671h
_journal_volume                  14
_journal_year                    2024
_chemical_formula_moiety         'C72 H102 Ag3 F42 N30 P7 Pt6 S4'
_chemical_formula_sum            'C72 H102 Ag3 F42 N30 P7 Pt6 S4'
_chemical_formula_weight         4024.93
_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
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2024-06-26 deposited with the CCDC.	2024-08-30 downloaded from the CCDC.
;
_cell_angle_alpha                101.846(7)
_cell_angle_beta                 92.738(12)
_cell_angle_gamma                92.657(5)
_cell_formula_units_Z            2
_cell_length_a                   16.814(7)
_cell_length_b                   17.820(7)
_cell_length_c                   22.082(9)
_cell_measurement_reflns_used    4498
_cell_measurement_temperature    193
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      3.02
_cell_volume                     6457(5)
_computing_cell_refinement       CrystalClear
_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
_computing_data_reduction        CrystalClear
_computing_molecular_graphics    'CrystalStructure 4.3'
_computing_publication_material  'CrystalStructure 4.3 (Rigaku, 2019)'
_computing_structure_refinement  'SHELXL Version 2018/3 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS Version 2013/1 (Sheldrick, 2008)'
_diffrn_ambient_temperature      193
_diffrn_detector_area_resol_mean 14.222
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Rigaku Saturn724'
_diffrn_measurement_method       ω
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0486
_diffrn_reflns_av_unetI/netI     0.0639
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            66567
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.478
_diffrn_reflns_theta_min         3.016
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    7.149
_exptl_absorpt_correction_T_max  0.931
_exptl_absorpt_correction_T_min  0.628
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB (Rigaku, 1998)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.070
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             3800.00
_exptl_crystal_size_max          0.196
_exptl_crystal_size_mid          0.063
_exptl_crystal_size_min          0.010
_refine_diff_density_max         3.22
_refine_diff_density_min         -2.40
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.016
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     1483
_refine_ls_number_reflns         29011
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0766
_refine_ls_R_factor_gt           0.0625
_refine_ls_shift/su_max          0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[σ²(Fo²)+(0.0683P)²+40.7372P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1521
_refine_ls_wR_factor_ref         0.1643
_reflns_Friedel_coverage         0.000
_reflns_number_gt                23665
_reflns_number_total             29011
_reflns_threshold_expression     F²>2.0σ(F²)
_cod_data_source_file            d4ra01671h2.cif
_cod_data_source_block           Pt3AgPt3-C2-PF6-Nov23
_cod_original_cell_volume        6458(5)
_cod_original_formula_sum        '(C72 H102 Ag3 N30 Pt6 S4) 7(F6 P) '
_cod_database_code               7249443
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 -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 0.21898(2) 0.23296(2) 0.37471(2) 0.04343(10) Uani 1 1 d . . . . .
Pt2 Pt 0.20759(2) 0.11550(2) 0.23474(2) 0.04094(10) Uani 1 1 d . . . . .
Pt3 Pt 0.10552(2) 0.08175(2) 0.34487(2) 0.04502(10) Uani 1 1 d . . . . .
Pt4 Pt -0.20189(2) 0.26490(2) 0.14511(2) 0.04698(10) Uani 1 1 d . . . . .
Pt5 Pt -0.18904(2) 0.39885(2) 0.26183(2) 0.03960(9) Uani 1 1 d . . . . .
Pt6 Pt -0.07467(2) 0.41307(2) 0.14917(2) 0.04038(9) Uani 1 1 d . . . . .
Ag1 Ag 0.01071(4) 0.25588(4) 0.25660(3) 0.04467(17) Uani 1 1 d . . . . .
Ag2 Ag 0.35067(6) 0.02252(6) 0.36603(5) 0.0706(3) Uani 1 1 d . . . . .
Ag3 Ag -0.31951(7) 0.46877(8) 0.11071(5) 0.0902(4) Uani 1 1 d . . . . .
S1 S 0.11375(14) 0.19046(14) 0.29627(11) 0.0436(5) Uani 1 1 d . . . . .
S2 S 0.24445(14) 0.10334(14) 0.33635(11) 0.0436(5) Uani 1 1 d . . . . .
S3 S -0.08986(13) 0.32023(13) 0.21245(11) 0.0405(5) Uani 1 1 d . . . . .
S4 S -0.21498(14) 0.39897(15) 0.15529(11) 0.0465(5) Uani 1 1 d . . . . .
P1 P 0.0050(2) 0.8321(2) 0.09327(17) 0.0741(9) Uani 1 1 d . . . . .
P2 P 0.2823(3) 0.6942(2) 0.1687(2) 0.0879(12) Uani 1 1 d . . . . .
P3 P 0.0292(2) 0.6479(2) 0.38629(15) 0.0707(9) Uani 1 1 d . . . . .
P4 P 0.3900(2) 0.0812(3) -0.0615(2) 0.0961(14) Uani 1 1 d . . . . .
P5 P 0.4126(3) 0.3860(3) 0.2442(3) 0.1005(14) Uani 1 1 d . . . . .
P6 P 0.65049(18) 0.15304(19) 0.44351(16) 0.0630(8) Uani 1 1 d . . . . .
P7 P 0.2938(3) 0.1837(3) 0.7000(2) 0.1010(14) Uani 1 1 d . . . . .
F1 F -0.0207(9) 0.7852(7) 0.1423(5) 0.150(5) Uani 1 1 d . . . . .
F2 F 0.0278(8) 0.8786(11) 0.0447(7) 0.213(8) Uani 1 1 d . . . . .
F3 F 0.0684(10) 0.7708(11) 0.0790(8) 0.217(8) Uani 1 1 d . . . . .
F4 F -0.0604(10) 0.8844(8) 0.1090(10) 0.232(9) Uani 1 1 d . . . . .
F5 F -0.0490(13) 0.7776(8) 0.0455(7) 0.237(10) Uani 1 1 d . . . . .
F6 F 0.0637(12) 0.8810(9) 0.1367(8) 0.247(10) Uani 1 1 d . . . . .
F7 F 0.2959(7) 0.6415(6) 0.2176(5) 0.126(4) Uani 1 1 d . . . . .
F8 F 0.2668(8) 0.7478(6) 0.1215(5) 0.147(4) Uani 1 1 d . . . . .
F9 F 0.3438(13) 0.6521(10) 0.1262(8) 0.250(10) Uani 1 1 d . . . . .
F10 F 0.2211(9) 0.7373(10) 0.2113(7) 0.191(7) Uani 1 1 d . . . . .
F11 F 0.2116(11) 0.6390(9) 0.1372(7) 0.214(9) Uani 1 1 d . . . . .
F12 F 0.3452(9) 0.7517(7) 0.2045(8) 0.189(7) Uani 1 1 d . . . . .
F13 F 0.0050(5) 0.6055(5) 0.4402(4) 0.092(3) Uani 1 1 d . . . . .
F14 F 0.0537(8) 0.6909(5) 0.3331(4) 0.126(4) Uani 1 1 d . . . . .
F15 F 0.0667(7) 0.5733(5) 0.3520(5) 0.124(4) Uani 1 1 d . . . . .
F16 F -0.0094(11) 0.7207(6) 0.4214(5) 0.178(7) Uani 1 1 d . . . . .
F17 F -0.0522(7) 0.6162(7) 0.3522(5) 0.137(4) Uani 1 1 d . . . . .
F18 F 0.1085(8) 0.6796(10) 0.4230(5) 0.198(8) Uani 1 1 d . . . . .
F19 F 0.3847(9) -0.0045(7) -0.1037(6) 0.175(6) Uani 1 1 d . . . . .
F20 F 0.3947(6) 0.1651(6) -0.0180(5) 0.136(4) Uani 1 1 d . . . . .
F21 F 0.4496(14) 0.0681(11) -0.0088(11) 0.290(12) Uani 1 1 d . . . . .
F22 F 0.3271(13) 0.1022(9) -0.1043(11) 0.302(14) Uani 1 1 d . . . . .
F23 F 0.3286(10) 0.0484(9) -0.0195(8) 0.233(10) Uani 1 1 d . . . . .
F24 F 0.4633(10) 0.1072(9) -0.0942(7) 0.210(7) Uani 1 1 d . . . . .
F25 F 0.4622(6) 0.3129(7) 0.2509(5) 0.130(4) Uani 1 1 d . . . . .
F26 F 0.3637(8) 0.4566(7) 0.2367(7) 0.172(6) Uani 1 1 d . . . . .
F27 F 0.4164(13) 0.4125(11) 0.3144(6) 0.252(10) Uani 1 1 d . . . . .
F28 F 0.4124(9) 0.3572(10) 0.1694(6) 0.196(7) Uani 1 1 d . . . . .
F29 F 0.3332(7) 0.3333(8) 0.2398(9) 0.201(7) Uani 1 1 d . . . . .
F30 F 0.4929(8) 0.4319(8) 0.2420(9) 0.196(7) Uani 1 1 d . . . . .
F31 F 0.6792(5) 0.0689(5) 0.4336(6) 0.141(5) Uani 1 1 d . . . . .
F32 F 0.6257(5) 0.2399(4) 0.4544(4) 0.091(2) Uani 1 1 d . . . . .
F33 F 0.7321(5) 0.1848(6) 0.4833(4) 0.111(3) Uani 1 1 d . . . . .
F34 F 0.5685(5) 0.1246(6) 0.4073(5) 0.131(4) Uani 1 1 d . . . . .
F35 F 0.6094(6) 0.1454(6) 0.5056(4) 0.118(3) Uani 1 1 d . . . . .
F36 F 0.6936(6) 0.1650(5) 0.3840(4) 0.108(3) Uani 1 1 d . . . . .
F37 F 0.2478(9) 0.1380(8) 0.7413(6) 0.164(5) Uani 1 1 d . . . . .
F38 F 0.3439(9) 0.2270(6) 0.6584(5) 0.145(5) Uani 1 1 d . . . . .
F39 F 0.3062(8) 0.2576(6) 0.7547(5) 0.139(4) Uani 1 1 d . . . . .
F40 F 0.2857(9) 0.1132(7) 0.6468(6) 0.178(6) Uani 1 1 d . . . . .
F41 F 0.3754(9) 0.1545(8) 0.7227(8) 0.182(6) Uani 1 1 d . . . . .
F42 F 0.2183(9) 0.2151(10) 0.6776(7) 0.200(7) Uani 1 1 d . . . . .
N1 N 0.1775(7) 0.3657(7) 0.4738(5) 0.084(4) Uani 1 1 d . . . . .
N2 N 0.1821(5) 0.4018(5) 0.3881(5) 0.060(2) Uani 1 1 d . . . . .
N3 N 0.3071(5) 0.2662(6) 0.4988(4) 0.063(3) Uani 1 1 d . . . . .
N4 N 0.3902(5) 0.2476(5) 0.4272(4) 0.057(2) Uani 1 1 d . . . . .
N5 N 0.2240(7) 0.1485(6) 0.1086(4) 0.067(3) Uani 1 1 d . . . . .
N6 N 0.1056(6) 0.1037(5) 0.1167(5) 0.068(3) Uani 1 1 d . . . . .
N7 N 0.3492(6) 0.0699(7) 0.1609(5) 0.071(3) Uani 1 1 d . . . . .
N8 N 0.2964(6) -0.0272(6) 0.1918(4) 0.063(3) Uani 1 1 d . . . . .
N9 N -0.0573(7) 0.0019(9) 0.3281(7) 0.096(4) Uani 1 1 d . . . . .
N10 N -0.0614(7) 0.1130(8) 0.3841(6) 0.088(4) Uani 1 1 d . . . . .
N11 N 0.0826(8) -0.0800(6) 0.3581(7) 0.090(4) Uani 1 1 d . . . . .
N12 N 0.1529(7) -0.0170(7) 0.4359(5) 0.080(3) Uani 1 1 d . . . . .
N13 N -0.1818(7) 0.0944(7) 0.0944(7) 0.086(4) Uani 1 1 d . . . . .
N14 N -0.1839(7) 0.1198(6) 0.1939(6) 0.078(3) Uani 1 1 d . . . . .
N15 N -0.2964(8) 0.1853(9) 0.0325(6) 0.116(5) Uani 1 1 d . . . . .
N16 N -0.3749(6) 0.2393(8) 0.0984(5) 0.088(4) Uani 1 1 d . . . . .
N17 N -0.2345(5) 0.3499(5) 0.3749(4) 0.052(2) Uani 1 1 d . . . . .
N18 N -0.1105(5) 0.3895(4) 0.3884(4) 0.048(2) Uani 1 1 d . . . . .
N19 N -0.3331(5) 0.4659(5) 0.3297(4) 0.055(2) Uani 1 1 d . . . . .
N20 N -0.2672(5) 0.5476(5) 0.2883(4) 0.051(2) Uani 1 1 d . . . . .
N21 N 0.0824(6) 0.4964(5) 0.1798(4) 0.055(2) Uani 1 1 d . . . . .
N22 N 0.1020(5) 0.3787(5) 0.1419(5) 0.057(2) Uani 1 1 d . . . . .
N23 N -0.0403(6) 0.5574(6) 0.0989(5) 0.063(3) Uani 1 1 d . . . . .
N24 N -0.1133(6) 0.4698(7) 0.0346(4) 0.070(3) Uani 1 1 d . . . . .
N25 N 0.3986(7) 0.0601(6) 0.4655(5) 0.076(3) Uani 1 1 d . . . . .
N26 N 0.4549(8) 0.0130(9) 0.3033(6) 0.103(5) Uani 1 1 d . . . . .
N27 N 0.3147(9) -0.1049(8) 0.3630(6) 0.102(4) Uani 1 1 d . . . . .
N28 N -0.4027(13) 0.4012(16) 0.0315(9) 0.198(11) Uani 1 1 d . . . . .
N29 N -0.4098(12) 0.5347(13) 0.1649(9) 0.149(8) Uani 1 1 d . . . . .
N30 N -0.2694(15) 0.5873(13) 0.0976(12) 0.177(10) Uani 1 1 d . . . . .
C1 C 0.1897(6) 0.3406(6) 0.4109(6) 0.056(3) Uani 1 1 d . . . . .
C2 C 0.1647(10) 0.4418(10) 0.4856(9) 0.107(6) Uani 1 1 d . . . . .
H2 H 0.155853 0.472589 0.524993 0.128 Uiso 1 1 calc R U . . .
C3 C 0.1666(8) 0.4657(7) 0.4326(9) 0.086(5) Uani 1 1 d . . . . .
H3 H 0.158992 0.516131 0.426411 0.103 Uiso 1 1 calc R U . . .
C4 C 0.1910(9) 0.4026(9) 0.3234(8) 0.094(5) Uani 1 1 d . . . . .
H4A H 0.182842 0.454242 0.316297 0.113 Uiso 1 1 calc R U . . .
H4B H 0.244690 0.388031 0.312279 0.113 Uiso 1 1 calc R U . . .
H4C H 0.151392 0.365936 0.297824 0.113 Uiso 1 1 calc R U . . .
C5 C 0.1794(14) 0.3181(18) 0.5204(11) 0.224(18) Uani 1 1 d . . . . .
H5A H 0.174352 0.353945 0.560462 0.268 Uiso 1 1 calc R U . . .
H5B H 0.129133 0.285520 0.512297 0.268 Uiso 1 1 calc R U . . .
C6 C 0.2313(10) 0.2749(11) 0.5304(8) 0.106(6) Uani 1 1 d . . . . .
H6A H 0.204684 0.222864 0.523327 0.127 Uiso 1 1 calc R U . . .
H6B H 0.246332 0.289654 0.575364 0.127 Uiso 1 1 calc R U . . .
C7 C 0.3110(6) 0.2502(6) 0.4363(5) 0.049(2) Uani 1 1 d . . . . .
C8 C 0.3820(7) 0.2728(8) 0.5280(6) 0.075(4) Uani 1 1 d . . . . .
H8 H 0.394281 0.283651 0.571446 0.090 Uiso 1 1 calc R U . . .
C9 C 0.4337(7) 0.2610(8) 0.4841(6) 0.076(4) Uani 1 1 d . . . . .
H9 H 0.490099 0.261704 0.490180 0.091 Uiso 1 1 calc R U . . .
C10 C 0.4234(8) 0.2336(8) 0.3661(6) 0.077(4) Uani 1 1 d . . . . .
H10A H 0.481691 0.234239 0.371085 0.092 Uiso 1 1 calc R U . . .
H10B H 0.402753 0.183330 0.342223 0.092 Uiso 1 1 calc R U . . .
H10C H 0.408060 0.273710 0.344229 0.092 Uiso 1 1 calc R U . . .
C11 C 0.1748(6) 0.1264(6) 0.1489(5) 0.047(2) Uani 1 1 d . . . . .
C12 C 0.1810(15) 0.1397(10) 0.0506(6) 0.111(7) Uani 1 1 d . . . . .
H12 H 0.200168 0.151632 0.013773 0.133 Uiso 1 1 calc R U . . .
C13 C 0.1079(13) 0.1111(9) 0.0580(8) 0.109(7) Uani 1 1 d . . . . .
H13 H 0.065437 0.098369 0.027087 0.130 Uiso 1 1 calc R U . . .
C14 C 0.0342(9) 0.0756(9) 0.1412(9) 0.109(6) Uani 1 1 d . . . . .
H14A H 0.044885 0.074488 0.185038 0.131 Uiso 1 1 calc R U . . .
H14B H -0.008964 0.109753 0.137270 0.131 Uiso 1 1 calc R U . . .
H14C H 0.018340 0.023673 0.117976 0.131 Uiso 1 1 calc R U . . .
C15 C 0.3059(10) 0.1792(10) 0.1197(10) 0.117(7) Uani 1 1 d . . . . .
H15A H 0.326634 0.179435 0.078514 0.140 Uiso 1 1 calc R U . . .
H15B H 0.304031 0.233611 0.140997 0.140 Uiso 1 1 calc R U . . .
C16 C 0.3610(11) 0.1490(12) 0.1510(8) 0.117(7) Uani 1 1 d . . . . .
H16A H 0.369699 0.183276 0.192444 0.141 Uiso 1 1 calc R U . . .
H16B H 0.411262 0.151634 0.129829 0.141 Uiso 1 1 calc R U . . .
C17 C 0.2902(7) 0.0491(6) 0.1944(5) 0.053(3) Uani 1 1 d . . . . .
C18 C 0.3928(10) 0.0084(13) 0.1372(7) 0.106(6) Uani 1 1 d . . . . .
H18 H 0.437329 0.008668 0.112375 0.128 Uiso 1 1 calc R U . . .
C19 C 0.3593(10) -0.0532(11) 0.1566(6) 0.096(6) Uani 1 1 d . . . . .
H19 H 0.376047 -0.104300 0.147522 0.115 Uiso 1 1 calc R U . . .
C20 C 0.2416(10) -0.0769(7) 0.2163(7) 0.086(4) Uani 1 1 d . . . . .
H20A H 0.259938 -0.129227 0.208242 0.103 Uiso 1 1 calc R U . . .
H20B H 0.239221 -0.058064 0.261027 0.103 Uiso 1 1 calc R U . . .
H20C H 0.188353 -0.077057 0.196055 0.103 Uiso 1 1 calc R U . . .
C21 C -0.0108(8) 0.0664(7) 0.3506(6) 0.064(3) Uani 1 1 d . . . . .
C22 C -0.1342(14) 0.0082(19) 0.3459(14) 0.158(14) Uani 1 1 d . . . . .
H22 H -0.177424 -0.029321 0.335264 0.190 Uiso 1 1 calc R U . . .
C23 C -0.1351(13) 0.077(2) 0.3805(12) 0.157(14) Uani 1 1 d . . . . .
H23 H -0.180230 0.097944 0.400333 0.188 Uiso 1 1 calc R U . . .
C24 C -0.0355(13) 0.1894(12) 0.4196(8) 0.138(9) Uani 1 1 d . . . . .
H24A H -0.080802 0.213624 0.440381 0.165 Uiso 1 1 calc R U . . .
H24B H 0.006669 0.184961 0.450678 0.165 Uiso 1 1 calc R U . . .
H24C H -0.014936 0.220822 0.391596 0.165 Uiso 1 1 calc R U . . .
C25 C -0.0346(16) -0.0690(13) 0.2898(11) 0.150(9) Uani 1 1 d . . . . .
H25A H -0.076581 -0.108933 0.292263 0.180 Uiso 1 1 calc R U . . .
H25B H -0.037303 -0.061877 0.246453 0.180 Uiso 1 1 calc R U . . .
C26 C 0.0353(13) -0.0983(12) 0.2994(11) 0.147(9) Uani 1 1 d . . . . .
H26A H 0.070255 -0.085323 0.267724 0.177 Uiso 1 1 calc R U . . .
H26B H 0.025596 -0.154848 0.289268 0.177 Uiso 1 1 calc R U . . .
C27 C 0.1153(8) -0.0091(7) 0.3832(6) 0.064(3) Uani 1 1 d . . . . .
C28 C 0.1017(16) -0.1320(12) 0.3929(14) 0.154(10) Uani 1 1 d . . . . .
H28 H 0.088230 -0.185604 0.383389 0.185 Uiso 1 1 calc R U . . .
C29 C 0.1432(14) -0.0924(13) 0.4426(11) 0.130(8) Uani 1 1 d . . . . .
H29 H 0.162771 -0.112168 0.476907 0.156 Uiso 1 1 calc R U . . .
C30 C 0.1924(10) 0.0481(11) 0.4826(6) 0.110(6) Uani 1 1 d . . . . .
H30A H 0.215943 0.028482 0.517302 0.132 Uiso 1 1 calc R U . . .
H30B H 0.234350 0.073436 0.463349 0.132 Uiso 1 1 calc R U . . .
H30C H 0.152839 0.085045 0.497798 0.132 Uiso 1 1 calc R U . . .
C31 C -0.1872(6) 0.1514(6) 0.1433(6) 0.063(3) Uani 1 1 d . . . . .
C32 C -0.1761(10) 0.0272(9) 0.1145(12) 0.118(8) Uani 1 1 d . . . . .
H32 H -0.171668 -0.021978 0.088764 0.141 Uiso 1 1 calc R U . . .
C33 C -0.1777(12) 0.0421(10) 0.1775(12) 0.124(8) Uani 1 1 d . . . . .
H33 H -0.175116 0.006449 0.204083 0.149 Uiso 1 1 calc R U . . .
C34 C -0.1925(10) 0.1585(9) 0.2576(7) 0.098(5) Uani 1 1 d . . . . .
H34A H -0.187440 0.121601 0.284766 0.117 Uiso 1 1 calc R U . . .
H34B H -0.150767 0.199858 0.269875 0.117 Uiso 1 1 calc R U . . .
H34C H -0.244976 0.180126 0.261254 0.117 Uiso 1 1 calc R U . . .
C35 C -0.1865(12) 0.0937(11) 0.0279(10) 0.121(7) Uani 1 1 d . . . . .
H35A H -0.221744 0.048710 0.007365 0.145 Uiso 1 1 calc R U . . .
H35B H -0.132622 0.084526 0.012732 0.145 Uiso 1 1 calc R U . . .
C36 C -0.2148(10) 0.1610(14) 0.0054(8) 0.125(8) Uani 1 1 d . . . . .
H36A H -0.221018 0.148515 -0.040425 0.150 Uiso 1 1 calc R U . . .
H36B H -0.174532 0.204539 0.017817 0.150 Uiso 1 1 calc R U . . .
C37 C -0.2964(7) 0.2308(8) 0.0898(5) 0.068(3) Uani 1 1 d . . . . .
C38 C -0.3725(12) 0.1623(14) 0.0071(9) 0.153(10) Uani 1 1 d . . . . .
H38 H -0.387116 0.128794 -0.031530 0.183 Uiso 1 1 calc R U . . .
C39 C -0.4200(10) 0.1968(13) 0.0478(9) 0.135(8) Uani 1 1 d . . . . .
H39 H -0.476655 0.193218 0.043366 0.162 Uiso 1 1 calc R U . . .
C40 C -0.4071(8) 0.2874(10) 0.1555(7) 0.097(5) Uani 1 1 d . . . . .
H40A H -0.465511 0.284804 0.151113 0.116 Uiso 1 1 calc R U . . .
H40B H -0.389918 0.267861 0.192033 0.116 Uiso 1 1 calc R U . . .
H40C H -0.386789 0.340904 0.160271 0.116 Uiso 1 1 calc R U . . .
C41 C -0.1730(5) 0.3797(5) 0.3471(5) 0.044(2) Uani 1 1 d . . . . .
C42 C -0.2100(7) 0.3418(6) 0.4340(5) 0.058(3) Uani 1 1 d . . . . .
H42 H -0.241433 0.322937 0.462821 0.069 Uiso 1 1 calc R U . . .
C43 C -0.1317(8) 0.3664(6) 0.4420(5) 0.063(3) Uani 1 1 d . . . . .
H43 H -0.097664 0.367486 0.477878 0.076 Uiso 1 1 calc R U . . .
C44 C -0.0300(6) 0.4195(7) 0.3780(6) 0.062(3) Uani 1 1 d . . . . .
H44A H 0.005309 0.421295 0.414934 0.075 Uiso 1 1 calc R U . . .
H44B H -0.008893 0.385700 0.342340 0.075 Uiso 1 1 calc R U . . .
H44C H -0.033137 0.471276 0.369795 0.075 Uiso 1 1 calc R U . . .
C45 C -0.3144(6) 0.3319(7) 0.3447(5) 0.056(3) Uani 1 1 d . . . . .
H45A H -0.341293 0.291539 0.362533 0.067 Uiso 1 1 calc R U . . .
H45B H -0.309226 0.310624 0.300105 0.067 Uiso 1 1 calc R U . . .
C46 C -0.3652(8) 0.3982(8) 0.3510(7) 0.073(3) Uani 1 1 d . . . . .
H46A H -0.416716 0.380722 0.327659 0.087 Uiso 1 1 calc R U . . .
H46B H -0.376383 0.414412 0.395212 0.087 Uiso 1 1 calc R U . . .
C47 C -0.2692(6) 0.4732(6) 0.2946(4) 0.045(2) Uani 1 1 d . . . . .
C48 C -0.3689(8) 0.5358(8) 0.3452(6) 0.074(4) Uani 1 1 d . . . . .
H48 H -0.412915 0.546091 0.370495 0.089 Uiso 1 1 calc R U . . .
C49 C -0.3305(8) 0.5847(7) 0.3186(6) 0.072(3) Uani 1 1 d . . . . .
H49 H -0.343255 0.636252 0.319610 0.087 Uiso 1 1 calc R U . . .
C50 C -0.2065(7) 0.5836(6) 0.2563(6) 0.061(3) Uani 1 1 d . . . . .
H50A H -0.217894 0.637412 0.258054 0.074 Uiso 1 1 calc R U . . .
H50B H -0.153795 0.581130 0.276564 0.074 Uiso 1 1 calc R U . . .
H50C H -0.207166 0.556361 0.212962 0.074 Uiso 1 1 calc R U . . .
C51 C 0.0448(6) 0.4288(6) 0.1561(4) 0.047(2) Uani 1 1 d . . . . .
C52 C 0.1638(7) 0.4916(8) 0.1835(7) 0.075(4) Uani 1 1 d . . . . .
H52 H 0.203025 0.531574 0.199921 0.091 Uiso 1 1 calc R U . . .
C53 C 0.1755(7) 0.4183(9) 0.1588(7) 0.083(4) Uani 1 1 d . . . . .
H53 H 0.225960 0.396754 0.153701 0.099 Uiso 1 1 calc R U . . .
C54 C 0.0893(8) 0.2982(7) 0.1118(6) 0.075(4) Uani 1 1 d . . . . .
H54A H 0.140813 0.274814 0.106918 0.091 Uiso 1 1 calc R U . . .
H54B H 0.056549 0.271495 0.137324 0.091 Uiso 1 1 calc R U . . .
H54C H 0.061813 0.293912 0.071010 0.091 Uiso 1 1 calc R U . . .
C55 C 0.0383(8) 0.5654(6) 0.2007(6) 0.070(3) Uani 1 1 d . . . . .
H55A H 0.073513 0.603123 0.230460 0.084 Uiso 1 1 calc R U . . .
H55B H -0.007741 0.551182 0.223217 0.084 Uiso 1 1 calc R U . . .
C56 C 0.0078(9) 0.6037(7) 0.1498(7) 0.079(4) Uani 1 1 d . . . . .
H56A H -0.023647 0.646972 0.168928 0.094 Uiso 1 1 calc R U . . .
H56B H 0.054552 0.625863 0.132540 0.094 Uiso 1 1 calc R U . . .
C57 C -0.0754(6) 0.4866(6) 0.0921(5) 0.051(2) Uani 1 1 d . . . . .
C58 C -0.0561(9) 0.5881(10) 0.0476(7) 0.084(4) Uani 1 1 d . . . . .
H58 H -0.038984 0.637680 0.042177 0.101 Uiso 1 1 calc R U . . .
C59 C -0.1001(10) 0.5346(11) 0.0069(7) 0.095(5) Uani 1 1 d . . . . .
H59 H -0.119292 0.538938 -0.033369 0.113 Uiso 1 1 calc R U . . .
C60 C -0.1556(8) 0.3991(9) 0.0034(6) 0.086(4) Uani 1 1 d . . . . .
H60A H -0.176461 0.404644 -0.037589 0.104 Uiso 1 1 calc R U . . .
H60B H -0.119062 0.357261 -0.001422 0.104 Uiso 1 1 calc R U . . .
H60C H -0.199851 0.387446 0.027841 0.104 Uiso 1 1 calc R U . . .
C61 C 0.4267(7) 0.0705(7) 0.5143(6) 0.058(3) Uani 1 1 d . . . . .
C62 C 0.4603(8) 0.0843(8) 0.5777(6) 0.075(3) Uani 1 1 d . . . . .
H62A H 0.512443 0.062116 0.578465 0.089 Uiso 1 1 calc R U . . .
H62B H 0.424474 0.060393 0.602986 0.089 Uiso 1 1 calc R U . . .
H62C H 0.466466 0.139743 0.594543 0.089 Uiso 1 1 calc R U . . .
C63 C 0.5154(11) 0.0149(9) 0.2806(7) 0.087(4) Uani 1 1 d . . . . .
C64 C 0.5955(11) 0.0169(12) 0.2533(9) 0.126(7) Uani 1 1 d . . . . .
H64A H 0.636489 0.037886 0.286233 0.151 Uiso 1 1 calc R U . . .
H64B H 0.594482 0.049503 0.222493 0.151 Uiso 1 1 calc R U . . .
H64C H 0.607783 -0.035241 0.233268 0.151 Uiso 1 1 calc R U . . .
C65 C 0.3003(12) -0.1684(10) 0.3637(7) 0.102(5) Uani 1 1 d . . . . .
C66 C 0.2843(14) -0.2498(9) 0.3630(8) 0.126(7) Uani 1 1 d . . . . .
H66A H 0.332979 -0.271349 0.376702 0.151 Uiso 1 1 calc R U . . .
H66B H 0.267172 -0.276986 0.320907 0.151 Uiso 1 1 calc R U . . .
H66C H 0.242154 -0.255681 0.391129 0.151 Uiso 1 1 calc R U . . .
C67 C -0.4478(16) 0.3621(18) -0.0093(12) 0.169(10) Uani 1 1 d . . . . .
C68 C -0.5034(17) 0.3125(17) -0.0621(12) 0.215(15) Uani 1 1 d . . . . .
H68A H -0.485245 0.319261 -0.102237 0.258 Uiso 1 1 calc R U . . .
H68B H -0.558082 0.328724 -0.057713 0.258 Uiso 1 1 calc R U . . .
H68C H -0.501851 0.258346 -0.059569 0.258 Uiso 1 1 calc R U . . .
C69 C -0.4473(14) 0.5742(16) 0.1937(12) 0.141(9) Uani 1 1 d . . . . .
C70 C -0.5011(14) 0.633(2) 0.2399(14) 0.27(2) Uani 1 1 d . . . . .
H70A H -0.481947 0.686509 0.240950 0.327 Uiso 1 1 calc R U . . .
H70B H -0.496207 0.623115 0.281793 0.327 Uiso 1 1 calc R U . . .
H70C H -0.557114 0.626001 0.224479 0.327 Uiso 1 1 calc R U . . .
C71 C -0.2540(13) 0.6558(17) 0.1032(9) 0.123(7) Uani 1 1 d . . . . .
C72 C -0.2390(13) 0.7375(11) 0.1085(9) 0.130(7) Uani 1 1 d . . . . .
H72A H -0.188728 0.754279 0.132863 0.156 Uiso 1 1 calc R U . . .
H72B H -0.282719 0.764839 0.129248 0.156 Uiso 1 1 calc R U . . .
H72C H -0.235458 0.748731 0.067097 0.156 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 for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
Ag Ag -0.8971 1.1015
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
F F 0.0171 0.0103
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
N N 0.0061 0.0033
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
P P 0.1023 0.0942
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
Pt Pt -1.7033 8.3905
;
International Tables for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
S S 0.1246 0.1234
;
International Tables for Crystallography
(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
C7 Pt1 C1 87.6(4) . . ?
C7 Pt1 S2 93.8(3) . . ?
C1 Pt1 S2 175.3(3) . . ?
C7 Pt1 S1 170.5(3) . . ?
C1 Pt1 S1 101.8(3) . . ?
S2 Pt1 S1 76.75(8) . . ?
C7 Pt1 Pt3 123.8(3) . . ?
C1 Pt1 Pt3 127.6(3) . . ?
S2 Pt1 Pt3 48.22(7) . . ?
S1 Pt1 Pt3 48.81(6) . . ?
C17 Pt2 C11 85.3(4) . . ?
C17 Pt2 S2 95.5(3) . . ?
C11 Pt2 S2 179.2(3) . . ?
C17 Pt2 S1 172.2(3) . . ?
C11 Pt2 S1 102.5(3) . . ?
S2 Pt2 S1 76.71(8) . . ?
C17 Pt2 Pt3 125.2(3) . . ?
C11 Pt2 Pt3 131.3(3) . . ?
S2 Pt2 Pt3 47.93(7) . . ?
S1 Pt2 Pt3 48.50(6) . . ?
C21 Pt3 C27 86.3(5) . . ?
C21 Pt3 S2 178.2(3) . . ?
C27 Pt3 S2 95.5(4) . . ?
C21 Pt3 S1 101.8(3) . . ?
C27 Pt3 S1 171.8(4) . . ?
S2 Pt3 S1 76.40(8) . . ?
C21 Pt3 Pt1 131.0(4) . . ?
C27 Pt3 Pt1 126.1(4) . . ?
S2 Pt3 Pt1 47.83(6) . . ?
S1 Pt3 Pt1 48.71(6) . . ?
C21 Pt3 Pt2 131.2(3) . . ?
C27 Pt3 Pt2 124.6(4) . . ?
S2 Pt3 Pt2 47.45(6) . . ?
S1 Pt3 Pt2 48.55(6) . . ?
Pt1 Pt3 Pt2 63.73(2) . . ?
C37 Pt4 C31 86.5(5) . . ?
C37 Pt4 S4 97.1(4) . . ?
C31 Pt4 S4 175.6(4) . . ?
C37 Pt4 S3 173.9(4) . . ?
C31 Pt4 S3 99.6(3) . . ?
S4 Pt4 S3 76.76(8) . . ?
C37 Pt4 Pt5 126.6(4) . . ?
C31 Pt4 Pt5 126.9(4) . . ?
S4 Pt4 Pt5 48.81(6) . . ?
S3 Pt4 Pt5 49.12(6) . . ?
C41 Pt5 C47 87.7(4) . . ?
C41 Pt5 S4 170.2(3) . . ?
C47 Pt5 S4 97.1(3) . . ?
C41 Pt5 S3 99.1(3) . . ?
C47 Pt5 S3 172.2(3) . . ?
S4 Pt5 S3 76.78(8) . . ?
C41 Pt5 Pt4 121.8(3) . . ?
C47 Pt5 Pt4 129.7(3) . . ?
S4 Pt5 Pt4 48.88(7) . . ?
S3 Pt5 Pt4 49.08(6) . . ?
C57 Pt6 C51 87.4(4) . . ?
C57 Pt6 S4 96.9(3) . . ?
C51 Pt6 S4 172.5(3) . . ?
C57 Pt6 S3 173.1(3) . . ?
C51 Pt6 S3 99.2(3) . . ?
S4 Pt6 S3 76.74(8) . . ?
S1 Ag1 S3 177.40(9) . . ?
N25 Ag2 N26 108.8(4) . . ?
N25 Ag2 N27 100.5(4) . . ?
N26 Ag2 N27 101.9(6) . . ?
N25 Ag2 S2 113.7(3) . . ?
N26 Ag2 S2 113.6(4) . . ?
N27 Ag2 S2 116.9(4) . . ?
N29 Ag3 N28 98.2(8) . . ?
N29 Ag3 N30 85.1(9) . . ?
N28 Ag3 N30 115.7(10) . . ?
N29 Ag3 S4 124.4(5) . . ?
N28 Ag3 S4 118.0(6) . . ?
N30 Ag3 S4 111.1(6) . . ?
Ag1 S1 Pt1 132.03(11) . . ?
Ag1 S1 Pt3 129.73(11) . . ?
Pt1 S1 Pt3 82.49(8) . . ?
Ag1 S1 Pt2 124.94(11) . . ?
Pt1 S1 Pt2 88.50(8) . . ?
Pt3 S1 Pt2 82.95(8) . . ?
Pt2 S2 Pt1 90.61(8) . . ?
Pt2 S2 Pt3 84.62(8) . . ?
Pt1 S2 Pt3 83.95(7) . . ?
Pt2 S2 Ag2 125.79(10) . . ?
Pt1 S2 Ag2 131.27(11) . . ?
Pt3 S2 Ag2 125.76(11) . . ?
Ag1 S3 Pt4 127.93(10) . . ?
Ag1 S3 Pt5 129.52(11) . . ?
Pt4 S3 Pt5 81.80(7) . . ?
Ag1 S3 Pt6 128.30(10) . . ?
Pt4 S3 Pt6 87.62(8) . . ?
Pt5 S3 Pt6 86.11(8) . . ?
Pt5 S4 Pt6 86.72(8) . . ?
Pt5 S4 Pt4 82.31(8) . . ?
Pt6 S4 Pt4 88.17(8) . . ?
Pt5 S4 Ag3 126.44(11) . . ?
Pt6 S4 Ag3 128.10(12) . . ?
Pt4 S4 Ag3 129.93(11) . . ?
F6 P1 F4 94.0(12) . . ?
F6 P1 F5 174.4(13) . . ?
F4 P1 F5 91.4(12) . . ?
F6 P1 F2 87.9(9) . . ?
F4 P1 F2 87.8(9) . . ?
F5 P1 F2 90.8(9) . . ?
F6 P1 F3 88.9(11) . . ?
F4 P1 F3 174.2(10) . . ?
F5 P1 F3 85.9(10) . . ?
F2 P1 F3 97.4(10) . . ?
F6 P1 F1 93.1(9) . . ?
F4 P1 F1 90.9(8) . . ?
F5 P1 F1 88.4(8) . . ?
F2 P1 F1 178.4(8) . . ?
F3 P1 F1 83.9(8) . . ?
F12 P2 F9 92.6(12) . . ?
F12 P2 F11 173.9(12) . . ?
F9 P2 F11 93.5(11) . . ?
F12 P2 F10 87.0(10) . . ?
F9 P2 F10 179.4(11) . . ?
F11 P2 F10 87.0(11) . . ?
F12 P2 F8 90.7(7) . . ?
F9 P2 F8 90.0(9) . . ?
F11 P2 F8 90.1(7) . . ?
F10 P2 F8 89.6(8) . . ?
F12 P2 F7 89.3(7) . . ?
F9 P2 F7 91.8(8) . . ?
F11 P2 F7 89.7(6) . . ?
F10 P2 F7 88.7(7) . . ?
F8 P2 F7 178.2(8) . . ?
F18 P3 F17 177.4(7) . . ?
F18 P3 F16 87.6(9) . . ?
F17 P3 F16 91.1(8) . . ?
F18 P3 F15 93.0(9) . . ?
F17 P3 F15 88.3(7) . . ?
F16 P3 F15 178.4(6) . . ?
F18 P3 F14 89.1(6) . . ?
F17 P3 F14 93.1(7) . . ?
F16 P3 F14 91.1(5) . . ?
F15 P3 F14 90.4(5) . . ?
F18 P3 F13 90.4(5) . . ?
F17 P3 F13 87.4(6) . . ?
F16 P3 F13 88.5(6) . . ?
F15 P3 F13 90.0(5) . . ?
F14 P3 F13 179.4(6) . . ?
F22 P4 F24 96.9(13) . . ?
F22 P4 F21 171.2(15) . . ?
F24 P4 F21 87.6(12) . . ?
F22 P4 F23 94.8(12) . . ?
F24 P4 F23 168.2(12) . . ?
F21 P4 F23 80.9(12) . . ?
F22 P4 F20 92.2(9) . . ?
F24 P4 F20 88.0(7) . . ?
F21 P4 F20 80.4(9) . . ?
F23 P4 F20 92.7(6) . . ?
F22 P4 F19 88.7(9) . . ?
F24 P4 F19 93.2(8) . . ?
F21 P4 F19 98.6(10) . . ?
F23 P4 F19 85.9(7) . . ?
F20 P4 F19 178.4(8) . . ?
F27 P5 F30 89.8(12) . . ?
F27 P5 F26 90.5(9) . . ?
F30 P5 F26 91.7(8) . . ?
F27 P5 F29 95.7(11) . . ?
F30 P5 F29 173.8(10) . . ?
F26 P5 F29 91.0(8) . . ?
F27 P5 F25 90.3(7) . . ?
F30 P5 F25 88.7(7) . . ?
F26 P5 F25 179.1(9) . . ?
F29 P5 F25 88.5(7) . . ?
F27 P5 F28 177.7(10) . . ?
F30 P5 F28 88.5(9) . . ?
F26 P5 F28 91.0(8) . . ?
F29 P5 F28 86.0(9) . . ?
F25 P5 F28 88.2(7) . . ?
F34 P6 F31 91.9(6) . . ?
F34 P6 F36 94.3(6) . . ?
F31 P6 F36 89.8(6) . . ?
F34 P6 F35 88.0(6) . . ?
F31 P6 F35 92.2(6) . . ?
F36 P6 F35 176.8(6) . . ?
F34 P6 F32 90.8(5) . . ?
F31 P6 F32 177.2(5) . . ?
F36 P6 F32 89.2(4) . . ?
F35 P6 F32 88.7(5) . . ?
F34 P6 F33 177.1(6) . . ?
F31 P6 F33 90.1(6) . . ?
F36 P6 F33 87.8(6) . . ?
F35 P6 F33 89.8(5) . . ?
F32 P6 F33 87.3(5) . . ?
F42 P7 F40 92.1(10) . . ?
F42 P7 F37 92.5(10) . . ?
F40 P7 F37 89.8(7) . . ?
F42 P7 F38 90.3(9) . . ?
F40 P7 F38 89.1(7) . . ?
F37 P7 F38 177.0(8) . . ?
F42 P7 F41 177.1(10) . . ?
F40 P7 F41 89.1(9) . . ?
F37 P7 F41 90.1(8) . . ?
F38 P7 F41 87.1(8) . . ?
F42 P7 F39 89.6(8) . . ?
F40 P7 F39 177.5(8) . . ?
F37 P7 F39 92.0(7) . . ?
F38 P7 F39 89.1(6) . . ?
F41 P7 F39 89.1(8) . . ?
C2 N1 C1 109.6(13) . . ?
C2 N1 C5 124.8(16) . . ?
C1 N1 C5 125.6(14) . . ?
C1 N2 C3 112.7(12) . . ?
C1 N2 C4 123.0(11) . . ?
C3 N2 C4 124.3(12) . . ?
C7 N3 C8 111.1(10) . . ?
C7 N3 C6 123.6(11) . . ?
C8 N3 C6 125.3(12) . . ?
C7 N4 C9 110.1(10) . . ?
C7 N4 C10 124.0(10) . . ?
C9 N4 C10 125.9(10) . . ?
C11 N5 C12 108.0(13) . . ?
C11 N5 C15 128.7(12) . . ?
C12 N5 C15 123.2(15) . . ?
C13 N6 C11 112.2(14) . . ?
C13 N6 C14 122.2(14) . . ?
C11 N6 C14 125.5(12) . . ?
C17 N7 C18 111.1(13) . . ?
C17 N7 C16 122.2(12) . . ?
C18 N7 C16 126.6(15) . . ?
C17 N8 C19 109.8(13) . . ?
C17 N8 C20 126.1(10) . . ?
C19 N8 C20 123.8(13) . . ?
C21 N9 C22 112.5(19) . . ?
C21 N9 C25 127.9(15) . . ?
C22 N9 C25 120(2) . . ?
C21 N10 C23 110.0(18) . . ?
C21 N10 C24 122.2(13) . . ?
C23 N10 C24 127.7(18) . . ?
C27 N11 C28 111.9(16) . . ?
C27 N11 C26 123.4(14) . . ?
C28 N11 C26 124.6(18) . . ?
C27 N12 C29 109.9(14) . . ?
C27 N12 C30 124.0(12) . . ?
C29 N12 C30 125.8(15) . . ?
C31 N13 C32 108.7(15) . . ?
C31 N13 C35 131.0(14) . . ?
C32 N13 C35 120.1(15) . . ?
C31 N14 C33 111.0(15) . . ?
C31 N14 C34 126.9(11) . . ?
C33 N14 C34 121.9(16) . . ?
C37 N15 C38 112.5(13) . . ?
C37 N15 C36 118.9(11) . . ?
C38 N15 C36 128.4(13) . . ?
C37 N16 C39 109.8(12) . . ?
C37 N16 C40 124.3(10) . . ?
C39 N16 C40 125.9(12) . . ?
C41 N17 C42 110.6(9) . . ?
C41 N17 C45 122.5(8) . . ?
C42 N17 C45 126.9(10) . . ?
C41 N18 C43 110.4(9) . . ?
C41 N18 C44 124.8(9) . . ?
C43 N18 C44 124.8(9) . . ?
C47 N19 C48 110.2(10) . . ?
C47 N19 C46 129.6(9) . . ?
C48 N19 C46 120.2(10) . . ?
C47 N20 C49 109.6(10) . . ?
C47 N20 C50 124.8(8) . . ?
C49 N20 C50 125.5(10) . . ?
C51 N21 C52 112.0(10) . . ?
C51 N21 C55 121.4(10) . . ?
C52 N21 C55 126.5(10) . . ?
C51 N22 C53 107.9(10) . . ?
C51 N22 C54 126.0(9) . . ?
C53 N22 C54 126.0(10) . . ?
C57 N23 C58 111.3(12) . . ?
C57 N23 C56 130.9(10) . . ?
C58 N23 C56 117.8(12) . . ?
C57 N24 C59 107.5(12) . . ?
C57 N24 C60 128.6(11) . . ?
C59 N24 C60 123.8(12) . . ?
C61 N25 Ag2 171.7(11) . . ?
C63 N26 Ag2 168.0(13) . . ?
C65 N27 Ag2 176.2(14) . . ?
C67 N28 Ag3 177(3) . . ?
C69 N29 Ag3 171(3) . . ?
C71 N30 Ag3 164(2) . . ?
N2 C1 N1 103.9(10) . . ?
N2 C1 Pt1 133.4(9) . . ?
N1 C1 Pt1 122.6(9) . . ?
C3 C2 N1 108.0(14) . . ?
C3 C2 H2 126.0 . . ?
N1 C2 H2 126.0 . . ?
C2 C3 N2 105.8(12) . . ?
C2 C3 H3 127.1 . . ?
N2 C3 H3 127.1 . . ?
N2 C4 H4A 109.5 . . ?
N2 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
N2 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C6 C5 N1 127.8(16) . . ?
C6 C5 H5A 105.3 . . ?
N1 C5 H5A 105.3 . . ?
C6 C5 H5B 105.3 . . ?
N1 C5 H5B 105.3 . . ?
H5A C5 H5B 106.0 . . ?
C5 C6 N3 124.8(17) . . ?
C5 C6 H6A 106.1 . . ?
N3 C6 H6A 106.1 . . ?
C5 C6 H6B 106.1 . . ?
N3 C6 H6B 106.1 . . ?
H6A C6 H6B 106.3 . . ?
N4 C7 N3 104.4(9) . . ?
N4 C7 Pt1 129.6(8) . . ?
N3 C7 Pt1 126.0(7) . . ?
C9 C8 N3 107.1(11) . . ?
C9 C8 H8 126.4 . . ?
N3 C8 H8 126.4 . . ?
C8 C9 N4 107.3(10) . . ?
C8 C9 H9 126.3 . . ?
N4 C9 H9 126.3 . . ?
N4 C10 H10A 109.5 . . ?
N4 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
N4 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
N6 C11 N5 105.8(10) . . ?
N6 C11 Pt2 128.4(9) . . ?
N5 C11 Pt2 125.1(8) . . ?
C13 C12 N5 106.5(14) . . ?
C13 C12 H12 126.8 . . ?
N5 C12 H12 126.8 . . ?
N6 C13 C12 107.4(14) . . ?
N6 C13 H13 126.3 . . ?
C12 C13 H13 126.3 . . ?
N6 C14 H14A 109.5 . . ?
N6 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
N6 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 N5 123.2(14) . . ?
C16 C15 H15A 106.5 . . ?
N5 C15 H15A 106.5 . . ?
C16 C15 H15B 106.5 . . ?
N5 C15 H15B 106.5 . . ?
H15A C15 H15B 106.5 . . ?
C15 C16 N7 120.8(14) . . ?
C15 C16 H16A 107.1 . . ?
N7 C16 H16A 107.1 . . ?
C15 C16 H16B 107.1 . . ?
N7 C16 H16B 107.1 . . ?
H16A C16 H16B 106.8 . . ?
N7 C17 N8 105.6(10) . . ?
N7 C17 Pt2 126.8(8) . . ?
N8 C17 Pt2 127.5(9) . . ?
C19 C18 N7 106.3(14) . . ?
C19 C18 H18 126.8 . . ?
N7 C18 H18 126.8 . . ?
C18 C19 N8 107.1(13) . . ?
C18 C19 H19 126.5 . . ?
N8 C19 H19 126.5 . . ?
N8 C20 H20A 109.5 . . ?
N8 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
N8 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
N9 C21 N10 102.9(13) . . ?
N9 C21 Pt3 127.5(10) . . ?
N10 C21 Pt3 129.1(11) . . ?
C23 C22 N9 105(2) . . ?
C23 C22 H22 127.6 . . ?
N9 C22 H22 127.6 . . ?
C22 C23 N10 110(2) . . ?
C22 C23 H23 125.2 . . ?
N10 C23 H23 125.2 . . ?
N10 C24 H24A 109.5 . . ?
N10 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
N10 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C26 C25 N9 121.7(18) . . ?
C26 C25 H25A 106.9 . . ?
N9 C25 H25A 106.9 . . ?
C26 C25 H25B 106.9 . . ?
N9 C25 H25B 106.9 . . ?
H25A C25 H25B 106.7 . . ?
C25 C26 N11 124(2) . . ?
C25 C26 H26A 106.4 . . ?
N11 C26 H26A 106.4 . . ?
C25 C26 H26B 106.4 . . ?
N11 C26 H26B 106.4 . . ?
H26A C26 H26B 106.4 . . ?
N12 C27 N11 104.4(11) . . ?
N12 C27 Pt3 131.2(9) . . ?
N11 C27 Pt3 124.4(10) . . ?
C29 C28 N11 105.8(18) . . ?
C29 C28 H28 127.1 . . ?
N11 C28 H28 127.1 . . ?
C28 C29 N12 107.9(16) . . ?
C28 C29 H29 126.1 . . ?
N12 C29 H29 126.1 . . ?
N12 C30 H30A 109.5 . . ?
N12 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
N12 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
N13 C31 N14 106.7(12) . . ?
N13 C31 Pt4 128.6(11) . . ?
N14 C31 Pt4 124.6(9) . . ?
C33 C32 N13 109.1(15) . . ?
C33 C32 H32 125.5 . . ?
N13 C32 H32 125.5 . . ?
C32 C33 N14 104.5(17) . . ?
C32 C33 H33 127.7 . . ?
N14 C33 H33 127.7 . . ?
N14 C34 H34A 109.5 . . ?
N14 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
N14 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
N13 C35 C36 120.0(14) . . ?
N13 C35 H35A 107.3 . . ?
C36 C35 H35A 107.3 . . ?
N13 C35 H35B 107.3 . . ?
C36 C35 H35B 107.3 . . ?
H35A C35 H35B 106.9 . . ?
C35 C36 N15 111.2(17) . . ?
C35 C36 H36A 109.4 . . ?
N15 C36 H36A 109.4 . . ?
C35 C36 H36B 109.4 . . ?
N15 C36 H36B 109.4 . . ?
H36A C36 H36B 108.0 . . ?
N16 C37 N15 103.2(10) . . ?
N16 C37 Pt4 131.4(9) . . ?
N15 C37 Pt4 125.2(9) . . ?
C39 C38 N15 105.0(14) . . ?
C39 C38 H38 127.5 . . ?
N15 C38 H38 127.5 . . ?
C38 C39 N16 109.3(14) . . ?
C38 C39 H39 125.4 . . ?
N16 C39 H39 125.4 . . ?
N16 C40 H40A 109.5 . . ?
N16 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
N16 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
N18 C41 N17 105.6(9) . . ?
N18 C41 Pt5 133.9(7) . . ?
N17 C41 Pt5 120.5(7) . . ?
C43 C42 N17 105.9(10) . . ?
C43 C42 H42 127.1 . . ?
N17 C42 H42 127.1 . . ?
C42 C43 N18 107.5(10) . . ?
C42 C43 H43 126.2 . . ?
N18 C43 H43 126.2 . . ?
N18 C44 H44A 109.5 . . ?
N18 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
N18 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
N17 C45 C46 114.3(10) . . ?
N17 C45 H45A 108.7 . . ?
C46 C45 H45A 108.7 . . ?
N17 C45 H45B 108.7 . . ?
C46 C45 H45B 108.7 . . ?
H45A C45 H45B 107.6 . . ?
N19 C46 C45 116.7(10) . . ?
N19 C46 H46A 108.1 . . ?
C45 C46 H46A 108.1 . . ?
N19 C46 H46B 108.1 . . ?
C45 C46 H46B 108.1 . . ?
H46A C46 H46B 107.3 . . ?
N20 C47 N19 104.7(8) . . ?
N20 C47 Pt5 124.2(7) . . ?
N19 C47 Pt5 131.0(7) . . ?
C49 C48 N19 107.3(11) . . ?
C49 C48 H48 126.4 . . ?
N19 C48 H48 126.4 . . ?
C48 C49 N20 108.2(11) . . ?
C48 C49 H49 125.9 . . ?
N20 C49 H49 125.9 . . ?
N20 C50 H50A 109.5 . . ?
N20 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
N20 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
N21 C51 N22 106.2(9) . . ?
N21 C51 Pt6 122.8(7) . . ?
N22 C51 Pt6 130.9(8) . . ?
C53 C52 N21 104.7(11) . . ?
C53 C52 H52 127.6 . . ?
N21 C52 H52 127.6 . . ?
C52 C53 N22 109.1(11) . . ?
C52 C53 H53 125.5 . . ?
N22 C53 H53 125.5 . . ?
N22 C54 H54A 109.5 . . ?
N22 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
N22 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
N21 C55 C56 115.1(10) . . ?
N21 C55 H55A 108.5 . . ?
C56 C55 H55A 108.5 . . ?
N21 C55 H55B 108.5 . . ?
C56 C55 H55B 108.5 . . ?
H55A C55 H55B 107.5 . . ?
N23 C56 C55 117.9(10) . . ?
N23 C56 H56A 107.8 . . ?
C55 C56 H56A 107.8 . . ?
N23 C56 H56B 107.8 . . ?
C55 C56 H56B 107.8 . . ?
H56A C56 H56B 107.2 . . ?
N23 C57 N24 106.6(10) . . ?
N23 C57 Pt6 130.5(8) . . ?
N24 C57 Pt6 122.9(9) . . ?
C59 C58 N23 106.8(13) . . ?
C59 C58 H58 126.6 . . ?
N23 C58 H58 126.6 . . ?
C58 C59 N24 107.8(12) . . ?
C58 C59 H59 126.1 . . ?
N24 C59 H59 126.1 . . ?
N24 C60 H60A 109.5 . . ?
N24 C60 H60B 109.5 . . ?
H60A C60 H60B 109.5 . . ?
N24 C60 H60C 109.5 . . ?
H60A C60 H60C 109.5 . . ?
H60B C60 H60C 109.5 . . ?
N25 C61 C62 178.1(13) . . ?
C61 C62 H62A 109.5 . . ?
C61 C62 H62B 109.5 . . ?
H62A C62 H62B 109.5 . . ?
C61 C62 H62C 109.5 . . ?
H62A C62 H62C 109.5 . . ?
H62B C62 H62C 109.5 . . ?
N26 C63 C64 177.9(17) . . ?
C63 C64 H64A 109.5 . . ?
C63 C64 H64B 109.5 . . ?
H64A C64 H64B 109.5 . . ?
C63 C64 H64C 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
N27 C65 C66 178(2) . . ?
C65 C66 H66A 109.5 . . ?
C65 C66 H66B 109.5 . . ?
H66A C66 H66B 109.5 . . ?
C65 C66 H66C 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
N28 C67 C68 179(3) . . ?
C67 C68 H68A 109.5 . . ?
C67 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
C67 C68 H68C 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
N29 C69 C70 177(3) . . ?
C69 C70 H70A 109.5 . . ?
C69 C70 H70B 109.5 . . ?
H70A C70 H70B 109.5 . . ?
C69 C70 H70C 109.5 . . ?
H70A C70 H70C 109.5 . . ?
H70B C70 H70C 109.5 . . ?
N30 C71 C72 178(3) . . ?
C71 C72 H72A 109.5 . . ?
C71 C72 H72B 109.5 . . ?
H72A C72 H72B 109.5 . . ?
C71 C72 H72C 109.5 . . ?
H72A C72 H72C 109.5 . . ?
H72B C72 H72C 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 C7 1.980(10) . ?
Pt1 C1 2.015(10) . ?
Pt1 S2 2.358(2) . ?
Pt1 S1 2.398(3) . ?
Pt1 Pt3 3.1638(11) . ?
Pt2 C17 1.990(11) . ?
Pt2 C11 1.999(10) . ?
Pt2 S2 2.355(2) . ?
Pt2 S1 2.403(2) . ?
Pt2 Pt3 3.1821(11) . ?
Pt3 C21 1.977(13) . ?
Pt3 C27 1.984(12) . ?
Pt3 S2 2.373(3) . ?
Pt3 S1 2.401(3) . ?
Pt4 C37 1.951(11) . ?
Pt4 C31 2.041(12) . ?
Pt4 S4 2.375(3) . ?
Pt4 S3 2.385(2) . ?
Pt4 Pt5 3.1244(11) . ?
Pt5 C41 1.989(10) . ?
Pt5 C47 1.990(10) . ?
Pt5 S4 2.373(3) . ?
Pt5 S3 2.387(2) . ?
Pt6 C57 1.996(10) . ?
Pt6 C51 2.010(10) . ?
Pt6 S4 2.374(3) . ?
Pt6 S3 2.387(2) . ?
Ag1 S1 2.364(2) . ?
Ag1 S3 2.368(2) . ?
Ag2 N25 2.259(11) . ?
Ag2 N26 2.276(14) . ?
Ag2 N27 2.309(14) . ?
Ag2 S2 2.491(2) . ?
Ag3 N29 2.209(17) . ?
Ag3 N28 2.28(2) . ?
Ag3 N30 2.32(2) . ?
Ag3 S4 2.479(3) . ?
P1 F6 1.463(12) . ?
P1 F4 1.482(12) . ?
P1 F5 1.513(13) . ?
P1 F2 1.535(11) . ?
P1 F3 1.559(14) . ?
P1 F1 1.562(11) . ?
P2 F12 1.511(11) . ?
P2 F9 1.545(14) . ?
P2 F11 1.548(12) . ?
P2 F10 1.550(14) . ?
P2 F8 1.573(11) . ?
P2 F7 1.584(10) . ?
P3 F18 1.547(11) . ?
P3 F17 1.554(10) . ?
P3 F16 1.554(11) . ?
P3 F15 1.565(9) . ?
P3 F14 1.589(8) . ?
P3 F13 1.594(8) . ?
P4 F22 1.496(13) . ?
P4 F24 1.559(13) . ?
P4 F21 1.561(16) . ?
P4 F23 1.588(14) . ?
P4 F20 1.598(10) . ?
P4 F19 1.615(12) . ?
P5 F27 1.521(13) . ?
P5 F30 1.554(12) . ?
P5 F26 1.567(11) . ?
P5 F29 1.583(13) . ?
P5 F25 1.606(11) . ?
P5 F28 1.627(14) . ?
P6 F34 1.568(9) . ?
P6 F31 1.573(9) . ?
P6 F36 1.578(8) . ?
P6 F35 1.592(9) . ?
P6 F32 1.594(8) . ?
P6 F33 1.608(9) . ?
P7 F42 1.512(14) . ?
P7 F40 1.530(12) . ?
P7 F37 1.552(12) . ?
P7 F38 1.566(12) . ?
P7 F41 1.586(13) . ?
P7 F39 1.591(11) . ?
N1 C2 1.357(18) . ?
N1 C1 1.398(15) . ?
N1 C5 1.46(2) . ?
N2 C1 1.301(14) . ?
N2 C3 1.386(16) . ?
N2 C4 1.445(18) . ?
N3 C7 1.357(13) . ?
N3 C8 1.376(14) . ?
N3 C6 1.482(16) . ?
N4 C7 1.357(13) . ?
N4 C9 1.394(15) . ?
N4 C10 1.463(15) . ?
N5 C11 1.348(14) . ?
N5 C12 1.416(18) . ?
N5 C15 1.45(2) . ?
N6 C13 1.33(2) . ?
N6 C11 1.335(13) . ?
N6 C14 1.451(19) . ?
N7 C17 1.348(15) . ?
N7 C18 1.374(18) . ?
N7 C16 1.48(2) . ?
N8 C17 1.359(13) . ?
N8 C19 1.383(17) . ?
N8 C20 1.447(17) . ?
N9 C21 1.350(17) . ?
N9 C22 1.37(3) . ?
N9 C25 1.45(2) . ?
N10 C21 1.353(16) . ?
N10 C23 1.36(3) . ?
N10 C24 1.46(2) . ?
N11 C27 1.351(15) . ?
N11 C28 1.36(2) . ?
N11 C26 1.46(2) . ?
N12 C27 1.332(15) . ?
N12 C29 1.39(2) . ?
N12 C30 1.490(18) . ?
N13 C31 1.333(15) . ?
N13 C32 1.37(2) . ?
N13 C35 1.46(2) . ?
N14 C31 1.351(17) . ?
N14 C33 1.367(19) . ?
N14 C34 1.452(19) . ?
N15 C37 1.355(15) . ?
N15 C38 1.38(2) . ?
N15 C36 1.568(19) . ?
N16 C37 1.354(14) . ?
N16 C39 1.383(18) . ?
N16 C40 1.511(17) . ?
N17 C41 1.369(12) . ?
N17 C42 1.386(13) . ?
N17 C45 1.461(13) . ?
N18 C41 1.340(12) . ?
N18 C43 1.388(14) . ?
N18 C44 1.477(14) . ?
N19 C47 1.371(13) . ?
N19 C48 1.395(14) . ?
N19 C46 1.471(15) . ?
N20 C47 1.359(12) . ?
N20 C49 1.403(14) . ?
N20 C50 1.465(14) . ?
N21 C51 1.327(13) . ?
N21 C52 1.375(15) . ?
N21 C55 1.470(15) . ?
N22 C51 1.347(12) . ?
N22 C53 1.390(15) . ?
N22 C54 1.453(15) . ?
N23 C57 1.343(14) . ?
N23 C58 1.376(15) . ?
N23 C56 1.438(16) . ?
N24 C57 1.362(14) . ?
N24 C59 1.428(17) . ?
N24 C60 1.442(17) . ?
N25 C61 1.130(14) . ?
N26 C63 1.158(19) . ?
N27 C65 1.150(18) . ?
N28 C67 1.22(3) . ?
N29 C69 1.09(3) . ?
N30 C71 1.21(3) . ?
C2 C3 1.33(2) . ?
C2 H2 0.9500 . ?
C3 H3 0.9500 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 C6 1.23(2) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C8 C9 1.325(18) . ?
C8 H8 0.9500 . ?
C9 H9 0.9500 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C12 C13 1.34(3) . ?
C12 H12 0.9500 . ?
C13 H13 0.9500 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.33(2) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C18 C19 1.36(2) . ?
C18 H18 0.9500 . ?
C19 H19 0.9500 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C22 C23 1.30(4) . ?
C22 H22 0.9500 . ?
C23 H23 0.9500 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 C26 1.33(3) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C28 C29 1.32(3) . ?
C28 H28 0.9500 . ?
C29 H29 0.9500 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C32 C33 1.36(3) . ?
C32 H32 0.9500 . ?
C33 H33 0.9500 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 C36 1.48(3) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C38 C39 1.31(2) . ?
C38 H38 0.9500 . ?
C39 H39 0.9500 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C42 C43 1.360(17) . ?
C42 H42 0.9500 . ?
C43 H43 0.9500 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 C46 1.477(16) . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C48 C49 1.310(18) . ?
C48 H48 0.9500 . ?
C49 H49 0.9500 . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C52 C53 1.334(19) . ?
C52 H52 0.9500 . ?
C53 H53 0.9500 . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
C55 C56 1.511(18) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C58 C59 1.34(2) . ?
C58 H58 0.9500 . ?
C59 H59 0.9500 . ?
C60 H60A 0.9800 . ?
C60 H60B 0.9800 . ?
C60 H60C 0.9800 . ?
C61 C62 1.453(16) . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C63 C64 1.50(2) . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C65 C66 1.46(2) . ?
C66 H66A 0.9800 . ?
C66 H66B 0.9800 . ?
C66 H66C 0.9800 . ?
C67 C68 1.55(3) . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
C69 C70 1.64(3) . ?
C70 H70A 0.9800 . ?
C70 H70B 0.9800 . ?
C70 H70C 0.9800 . ?
C71 C72 1.45(3) . ?
C72 H72A 0.9800 . ?
C72 H72B 0.9800 . ?
C72 H72C 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
C3 N2 C1 N1 0.8(13) . . . . ?
C4 N2 C1 N1 179.3(11) . . . . ?
C3 N2 C1 Pt1 -175.2(9) . . . . ?
C4 N2 C1 Pt1 3.3(17) . . . . ?
C2 N1 C1 N2 -1.2(15) . . . . ?
C5 N1 C1 N2 179.7(17) . . . . ?
C2 N1 C1 Pt1 175.3(10) . . . . ?
C5 N1 C1 Pt1 -4(2) . . . . ?
C1 N1 C2 C3 1.2(19) . . . . ?
C5 N1 C2 C3 -179.7(18) . . . . ?
N1 C2 C3 N2 -0.7(18) . . . . ?
C1 N2 C3 C2 0.0(16) . . . . ?
C4 N2 C3 C2 -178.5(13) . . . . ?
C2 N1 C5 C6 -129(3) . . . . ?
C1 N1 C5 C6 50(5) . . . . ?
N1 C5 C6 N3 4(5) . . . . ?
C7 N3 C6 C5 -53(3) . . . . ?
C8 N3 C6 C5 127(3) . . . . ?
C9 N4 C7 N3 0.7(12) . . . . ?
C10 N4 C7 N3 -178.5(11) . . . . ?
C9 N4 C7 Pt1 -178.1(8) . . . . ?
C10 N4 C7 Pt1 2.7(16) . . . . ?
C8 N3 C7 N4 -0.5(13) . . . . ?
C6 N3 C7 N4 179.7(12) . . . . ?
C8 N3 C7 Pt1 178.3(9) . . . . ?
C6 N3 C7 Pt1 -1.5(17) . . . . ?
C7 N3 C8 C9 0.1(16) . . . . ?
C6 N3 C8 C9 179.9(13) . . . . ?
N3 C8 C9 N4 0.4(16) . . . . ?
C7 N4 C9 C8 -0.7(15) . . . . ?
C10 N4 C9 C8 178.5(12) . . . . ?
C13 N6 C11 N5 -0.7(13) . . . . ?
C14 N6 C11 N5 -179.3(11) . . . . ?
C13 N6 C11 Pt2 -171.8(9) . . . . ?
C14 N6 C11 Pt2 9.7(16) . . . . ?
C12 N5 C11 N6 1.1(12) . . . . ?
C15 N5 C11 N6 179.0(12) . . . . ?
C12 N5 C11 Pt2 172.6(8) . . . . ?
C15 N5 C11 Pt2 -9.5(17) . . . . ?
C11 N5 C12 C13 -1.2(16) . . . . ?
C15 N5 C12 C13 -179.2(14) . . . . ?
C11 N6 C13 C12 0.0(17) . . . . ?
C14 N6 C13 C12 178.6(13) . . . . ?
N5 C12 C13 N6 0.7(18) . . . . ?
C11 N5 C15 C16 46(3) . . . . ?
C12 N5 C15 C16 -137(2) . . . . ?
N5 C15 C16 N7 18(3) . . . . ?
C17 N7 C16 C15 -64(2) . . . . ?
C18 N7 C16 C15 114(2) . . . . ?
C18 N7 C17 N8 0.0(13) . . . . ?
C16 N7 C17 N8 178.2(11) . . . . ?
C18 N7 C17 Pt2 -176.8(9) . . . . ?
C16 N7 C17 Pt2 1.4(16) . . . . ?
C19 N8 C17 N7 -0.2(12) . . . . ?
C20 N8 C17 N7 -174.2(11) . . . . ?
C19 N8 C17 Pt2 176.6(8) . . . . ?
C20 N8 C17 Pt2 2.6(16) . . . . ?
C17 N7 C18 C19 0.2(17) . . . . ?
C16 N7 C18 C19 -177.9(13) . . . . ?
N7 C18 C19 N8 -0.3(17) . . . . ?
C17 N8 C19 C18 0.3(15) . . . . ?
C20 N8 C19 C18 174.5(12) . . . . ?
C22 N9 C21 N10 0.9(19) . . . . ?
C25 N9 C21 N10 -178.5(18) . . . . ?
C22 N9 C21 Pt3 173.4(14) . . . . ?
C25 N9 C21 Pt3 -6(2) . . . . ?
C23 N10 C21 N9 -0.5(17) . . . . ?
C24 N10 C21 N9 177.3(13) . . . . ?
C23 N10 C21 Pt3 -172.8(13) . . . . ?
C24 N10 C21 Pt3 5.0(19) . . . . ?
C21 N9 C22 C23 -1(3) . . . . ?
C25 N9 C22 C23 178(2) . . . . ?
N9 C22 C23 N10 1(3) . . . . ?
C21 N10 C23 C22 0(3) . . . . ?
C24 N10 C23 C22 -178(2) . . . . ?
C21 N9 C25 C26 40(4) . . . . ?
C22 N9 C25 C26 -140(3) . . . . ?
N9 C25 C26 N11 22(4) . . . . ?
C27 N11 C26 C25 -65(3) . . . . ?
C28 N11 C26 C25 118(3) . . . . ?
C29 N12 C27 N11 0.2(18) . . . . ?
C30 N12 C27 N11 -174.5(13) . . . . ?
C29 N12 C27 Pt3 -179.5(13) . . . . ?
C30 N12 C27 Pt3 6(2) . . . . ?
C28 N11 C27 N12 -2(2) . . . . ?
C26 N11 C27 N12 -179.9(16) . . . . ?
C28 N11 C27 Pt3 177.2(15) . . . . ?
C26 N11 C27 Pt3 0(2) . . . . ?
C27 N11 C28 C29 4(3) . . . . ?
C26 N11 C28 C29 -179(2) . . . . ?
N11 C28 C29 N12 -4(3) . . . . ?
C27 N12 C29 C28 2(3) . . . . ?
C30 N12 C29 C28 177(2) . . . . ?
C32 N13 C31 N14 0.8(15) . . . . ?
C35 N13 C31 N14 176.1(15) . . . . ?
C32 N13 C31 Pt4 -177.2(10) . . . . ?
C35 N13 C31 Pt4 -2(2) . . . . ?
C33 N14 C31 N13 -1.1(16) . . . . ?
C34 N14 C31 N13 -175.9(13) . . . . ?
C33 N14 C31 Pt4 177.0(11) . . . . ?
C34 N14 C31 Pt4 2.1(19) . . . . ?
C31 N13 C32 C33 0(2) . . . . ?
C35 N13 C32 C33 -176.1(16) . . . . ?
N13 C32 C33 N14 0(2) . . . . ?
C31 N14 C33 C32 1(2) . . . . ?
C34 N14 C33 C32 176.1(15) . . . . ?
C31 N13 C35 C36 -12(3) . . . . ?
C32 N13 C35 C36 163.0(17) . . . . ?
N13 C35 C36 N15 -52(2) . . . . ?
C37 N15 C36 C35 83(2) . . . . ?
C38 N15 C36 C35 -92(3) . . . . ?
C39 N16 C37 N15 2(2) . . . . ?
C40 N16 C37 N15 -178.4(15) . . . . ?
C39 N16 C37 Pt4 -172.6(14) . . . . ?
C40 N16 C37 Pt4 7(2) . . . . ?
C38 N15 C37 N16 -3(2) . . . . ?
C36 N15 C37 N16 -179.3(17) . . . . ?
C38 N15 C37 Pt4 172.2(16) . . . . ?
C36 N15 C37 Pt4 -4(2) . . . . ?
C37 N15 C38 C39 3(3) . . . . ?
C36 N15 C38 C39 178(2) . . . . ?
N15 C38 C39 N16 -1(3) . . . . ?
C37 N16 C39 C38 -1(3) . . . . ?
C40 N16 C39 C38 -180(2) . . . . ?
C43 N18 C41 N17 0.0(11) . . . . ?
C44 N18 C41 N17 179.0(9) . . . . ?
C43 N18 C41 Pt5 -179.9(8) . . . . ?
C44 N18 C41 Pt5 -0.8(15) . . . . ?
C42 N17 C41 N18 0.4(11) . . . . ?
C45 N17 C41 N18 179.2(9) . . . . ?
C42 N17 C41 Pt5 -179.7(7) . . . . ?
C45 N17 C41 Pt5 -0.9(13) . . . . ?
C41 N17 C42 C43 -0.6(12) . . . . ?
C45 N17 C42 C43 -179.3(10) . . . . ?
N17 C42 C43 N18 0.6(12) . . . . ?
C41 N18 C43 C42 -0.4(12) . . . . ?
C44 N18 C43 C42 -179.4(9) . . . . ?
C41 N17 C45 C46 -83.7(13) . . . . ?
C42 N17 C45 C46 94.9(13) . . . . ?
C47 N19 C46 C45 13.0(18) . . . . ?
C48 N19 C46 C45 -166.8(11) . . . . ?
N17 C45 C46 N19 55.6(15) . . . . ?
C49 N20 C47 N19 -1.0(11) . . . . ?
C50 N20 C47 N19 177.3(10) . . . . ?
C49 N20 C47 Pt5 -177.8(8) . . . . ?
C50 N20 C47 Pt5 0.5(14) . . . . ?
C48 N19 C47 N20 -0.8(12) . . . . ?
C46 N19 C47 N20 179.4(11) . . . . ?
C48 N19 C47 Pt5 175.6(8) . . . . ?
C46 N19 C47 Pt5 -4.2(17) . . . . ?
C47 N19 C48 C49 2.4(15) . . . . ?
C46 N19 C48 C49 -177.7(12) . . . . ?
N19 C48 C49 N20 -3.0(15) . . . . ?
C47 N20 C49 C48 2.6(14) . . . . ?
C50 N20 C49 C48 -175.7(11) . . . . ?
C52 N21 C51 N22 -2.0(13) . . . . ?
C55 N21 C51 N22 180.0(10) . . . . ?
C52 N21 C51 Pt6 175.8(8) . . . . ?
C55 N21 C51 Pt6 -2.1(14) . . . . ?
C53 N22 C51 N21 1.0(12) . . . . ?
C54 N22 C51 N21 -176.7(10) . . . . ?
C53 N22 C51 Pt6 -176.6(9) . . . . ?
C54 N22 C51 Pt6 5.6(17) . . . . ?
C51 N21 C52 C53 2.3(15) . . . . ?
C55 N21 C52 C53 -179.9(12) . . . . ?
N21 C52 C53 N22 -1.5(16) . . . . ?
C51 N22 C53 C52 0.4(15) . . . . ?
C54 N22 C53 C52 178.1(12) . . . . ?
C51 N21 C55 C56 -79.9(14) . . . . ?
C52 N21 C55 C56 102.5(15) . . . . ?
C57 N23 C56 C55 12(2) . . . . ?
C58 N23 C56 C55 -168.6(12) . . . . ?
N21 C55 C56 N23 54.0(17) . . . . ?
C58 N23 C57 N24 1.4(13) . . . . ?
C56 N23 C57 N24 -179.5(12) . . . . ?
C58 N23 C57 Pt6 179.7(9) . . . . ?
C56 N23 C57 Pt6 -1.1(18) . . . . ?
C59 N24 C57 N23 -0.5(12) . . . . ?
C60 N24 C57 N23 175.8(11) . . . . ?
C59 N24 C57 Pt6 -179.0(8) . . . . ?
C60 N24 C57 Pt6 -2.7(16) . . . . ?
C57 N23 C58 C59 -1.7(16) . . . . ?
C56 N23 C58 C59 179.0(12) . . . . ?
N23 C58 C59 N24 1.3(16) . . . . ?
C57 N24 C59 C58 -0.5(15) . . . . ?
C60 N24 C59 C58 -177.1(13) . . . . ?
