#------------------------------------------------------------------------------
#$Date: 2016-03-23 03:30:50 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179249 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/69/4316902.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_4316902
loop_
_publ_author_name
'Sayandev Chatterjee'
'Jeanette A. Krause'
'Allen G. Oliver'
'William B. Connick'
_publ_contact_author_address
;     Department of Chemistry
      University of Cincinnati
      Cincinnati, OH 45221
;
_publ_contact_author_email       bill.connick@uc.edu
_publ_contact_author_fax         '513 556 9239'
_publ_contact_author_name        'Dr. William B. Connick'
_publ_contact_author_phone       '513 556 0148 '
_publ_section_title
;
 Intramolecular NH...Pt Interactions of Platinum(II) Diimine Complexes
 with Phenyl Ligands
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              9798
_journal_page_last               9808
_journal_paper_doi               10.1021/ic1007582
_journal_volume                  49
_journal_year                    2010
_chemical_formula_moiety         'C34 H42 N4 Pt, 2(P F6)'
_chemical_formula_sum            'C34 H42 F12 N4 P2 Pt'
_chemical_formula_weight         991.75
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           9
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 93.313(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   26.0414(5)
_cell_length_b                   11.3056(2)
_cell_length_c                   25.2438(5)
_cell_measurement_reflns_used    8940
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      68.00
_cell_measurement_theta_min      2.51
_cell_volume                     7419.7(2)
_computing_cell_refinement       'Bruker SAINT v6.45A'
_computing_data_collection       'Bruker SMART v5.31'
_computing_data_reduction        'Bruker SAINT v6.45A'
_computing_molecular_graphics    'Bruker SHELXTL v6.14'
_computing_publication_material  'Bruker SHELXTL v6.14'
_computing_structure_refinement  'Bruker SHELXTL v6.14'
_computing_structure_solution    'Bruker SHELXTL v6.14'
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 0.83
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker SMART6000 CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0364
_diffrn_reflns_av_sigmaI/netI    0.0450
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            30383
_diffrn_reflns_theta_full        67.90
_diffrn_reflns_theta_max         67.90
_diffrn_reflns_theta_min         3.40
_diffrn_standards_decay_%        0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    8.724
_exptl_absorpt_correction_T_max  0.2936
_exptl_absorpt_correction_T_min  0.1235
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS v2.10 (Sheldrick)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.776
_exptl_crystal_density_meas      ?
_exptl_crystal_description       'irregular block'
_exptl_crystal_F_000             3920
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.725
_refine_diff_density_min         -0.606
_refine_diff_density_rms         0.089
_refine_ls_abs_structure_details
'Flack H D (1983), Acta Cryst. A39, 876-881, 5632 Friedel pairs'
_refine_ls_abs_structure_Flack   -0.011(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.032
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1037
_refine_ls_number_reflns         12271
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.032
_refine_ls_R_factor_all          0.0241
_refine_ls_R_factor_gt           0.0238
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0283P)²+4.3491P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0589
_refine_ls_wR_factor_ref         0.0590
_reflns_number_gt                12142
_reflns_number_total             12271
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            ic1007582_si_001_5.cif
_cod_data_source_block           4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to the built-in table from CIF Core dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_database_code               4316902
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'x, -y, z+1/2'
'x+1/2, y+1/2, z'
'x+1/2, -y+1/2, z+1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.886221(4) 1.022878(12) 0.880171(4) 0.01757(5) Uani 1 1 d . . .
N1A N 0.96389(13) 0.9688(3) 0.88207(15) 0.0223(7) Uani 1 1 d . . .
N2A N 0.89145(13) 0.9153(3) 0.94846(12) 0.0212(7) Uani 1 1 d . . .
N3A N 0.85642(12) 0.8692(3) 0.77712(12) 0.0223(6) Uani 1 1 d . . .
H1A H 0.8669 0.8851 0.8140 0.050 Uiso 1 1 d . . .
N4A N 0.84921(13) 1.2812(3) 0.93013(14) 0.0302(8) Uani 1 1 d . . .
H2A H 0.8697 1.2126 0.9249 0.050 Uiso 1 1 d . . .
C1A C 0.9990(2) 1.0019(5) 0.8485(2) 0.0325(12) Uani 1 1 d . . .
H3A H 0.9907 1.0641 0.8242 0.039 Uiso 1 1 calc R . .
C2A C 1.04727(18) 0.9494(5) 0.8475(2) 0.0399(11) Uani 1 1 d . . .
H4A H 1.0715 0.9747 0.8232 0.048 Uiso 1 1 calc R . .
C3A C 1.05873(17) 0.8588(4) 0.8832(2) 0.0376(10) Uani 1 1 d . . .
H5A H 1.0911 0.8201 0.8833 0.045 Uiso 1 1 calc R . .
C4A C 1.02314(17) 0.8250(4) 0.91861(18) 0.0350(9) Uani 1 1 d . . .
H6A H 1.0309 0.7633 0.9433 0.042 Uiso 1 1 calc R . .
C5A C 0.97584(15) 0.8818(4) 0.91788(15) 0.0244(8) Uani 1 1 d . . .
C8A C 0.94339(18) 0.7738(4) 0.99710(18) 0.0349(9) Uani 1 1 d . . .
H7A H 0.9744 0.7295 1.0012 0.042 Uiso 1 1 calc R . .
C9A C 0.93600(15) 0.8547(3) 0.95539(15) 0.0255(8) Uani 1 1 d . . .
C10A C 0.90510(19) 0.7590(4) 1.03237(18) 0.0391(10) Uani 1 1 d . . .
H8A H 0.9095 0.7042 1.0608 0.047 Uiso 1 1 calc R . .
C11A C 0.86059(19) 0.8244(4) 1.02583(17) 0.0339(10) Uani 1 1 d . . .
H9A H 0.8343 0.8172 1.0502 0.041 Uiso 1 1 calc R . .
C12A C 0.85476(17) 0.9006(4) 0.98319(16) 0.0254(8) Uani 1 1 d . . .
H10A H 0.8237 0.9443 0.9782 0.030 Uiso 1 1 calc R . .
C13A C 0.88880(14) 1.1195(3) 0.81239(15) 0.0206(8) Uani 1 1 d . . .
C14A C 0.91995(16) 1.2195(4) 0.81258(17) 0.0245(9) Uani 1 1 d . . .
H11A H 0.9384 1.2413 0.8447 0.029 Uiso 1 1 calc R . .
C15A C 0.92520(17) 1.2890(4) 0.76763(19) 0.0285(9) Uani 1 1 d . . .
H12A H 0.9465 1.3573 0.7697 0.034 Uiso 1 1 calc R . .
C16A C 0.89955(17) 1.2589(4) 0.71994(17) 0.0315(9) Uani 1 1 d . . .
H13A H 0.9030 1.3056 0.6891 0.038 Uiso 1 1 calc R . .
C17A C 0.86856(16) 1.1580(4) 0.71837(16) 0.0290(8) Uani 1 1 d . . .
H14A H 0.8506 1.1366 0.6860 0.035 Uiso 1 1 calc R . .
C18A C 0.86332(14) 1.0882(3) 0.76308(15) 0.0233(7) Uani 1 1 d . . .
C19A C 0.82926(18) 0.9800(3) 0.75695(19) 0.0272(9) Uani 1 1 d . . .
H15A H 0.7980 0.9924 0.7768 0.033 Uiso 1 1 calc R . .
H16A H 0.8184 0.9696 0.7190 0.033 Uiso 1 1 calc R . .
C20A C 0.90521(17) 0.8424(4) 0.75019(16) 0.0306(9) Uani 1 1 d . . .
H17A H 0.9279 0.9128 0.7517 0.037 Uiso 1 1 calc R . .
H18A H 0.8969 0.8230 0.7124 0.037 Uiso 1 1 calc R . .
C21A C 0.93258(18) 0.7396(4) 0.7773(2) 0.0367(11) Uani 1 1 d . . .
H19A H 0.9434 0.7622 0.8142 0.044 Uiso 1 1 calc R . .
H20A H 0.9639 0.7209 0.7586 0.044 Uiso 1 1 calc R . .
C22A C 0.89873(19) 0.6299(4) 0.7783(2) 0.0386(10) Uani 1 1 d . . .
H21A H 0.8920 0.5998 0.7417 0.046 Uiso 1 1 calc R . .
H22A H 0.9167 0.5672 0.7996 0.046 Uiso 1 1 calc R . .
C23A C 0.84800(19) 0.6596(4) 0.80221(19) 0.0342(10) Uani 1 1 d . . .
H23A H 0.8251 0.5897 0.7994 0.041 Uiso 1 1 calc R . .
H24A H 0.8545 0.6783 0.8403 0.041 Uiso 1 1 calc R . .
C24A C 0.82142(16) 0.7634(4) 0.77474(16) 0.0289(9) Uani 1 1 d . . .
H25A H 0.8122 0.7429 0.7373 0.035 Uiso 1 1 calc R . .
H26A H 0.7893 0.7821 0.7922 0.035 Uiso 1 1 calc R . .
C25A C 0.80921(14) 1.0489(4) 0.88033(15) 0.0201(7) Uani 1 1 d . . .
C26A C 0.77812(16) 0.9468(4) 0.87954(16) 0.0237(8) Uani 1 1 d . . .
H27A H 0.7944 0.8717 0.8816 0.028 Uiso 1 1 calc R . .
C27A C 0.72453(18) 0.9511(4) 0.87595(17) 0.0299(9) Uani 1 1 d . . .
H28A H 0.7050 0.8800 0.8750 0.036 Uiso 1 1 calc R . .
C28A C 0.69996(16) 1.0597(5) 0.87370(17) 0.0304(9) Uani 1 1 d . . .
H29A H 0.6635 1.0641 0.8703 0.036 Uiso 1 1 calc R . .
C29A C 0.72948(15) 1.1625(4) 0.87650(15) 0.0284(9) Uani 1 1 d . . .
H30A H 0.7127 1.2371 0.8762 0.034 Uiso 1 1 calc R . .
C30A C 0.78328(14) 1.1581(4) 0.87972(14) 0.0230(8) Uani 1 1 d . . .
C31A C 0.81137(15) 1.2755(3) 0.88236(15) 0.0261(8) Uani 1 1 d . . .
H31A H 0.8300 1.2864 0.8496 0.031 Uiso 1 1 calc R . .
H32A H 0.7861 1.3405 0.8844 0.031 Uiso 1 1 calc R . .
C32A C 0.8240(2) 1.2740(5) 0.98266(17) 0.0375(10) Uani 1 1 d . . .
H33A H 0.7994 1.2071 0.9817 0.045 Uiso 1 1 calc R . .
H34A H 0.8506 1.2589 1.0115 0.045 Uiso 1 1 calc R . .
C33A C 0.79621(19) 1.3859(5) 0.99391(19) 0.0412(11) Uani 1 1 d . . .
H35A H 0.7811 1.3792 1.0289 0.049 Uiso 1 1 calc R . .
H36A H 0.7677 1.3969 0.9667 0.049 Uiso 1 1 calc R . .
C34A C 0.8312(2) 1.4942(4) 0.9942(2) 0.0422(12) Uani 1 1 d . . .
H37A H 0.8580 1.4882 1.0236 0.051 Uiso 1 1 calc R . .
H38A H 0.8109 1.5668 0.9994 0.051 Uiso 1 1 calc R . .
C35A C 0.8565(2) 1.4999(4) 0.9407(2) 0.0408(12) Uani 1 1 d . . .
H39A H 0.8298 1.5145 0.9120 0.049 Uiso 1 1 calc R . .
H40A H 0.8812 1.5665 0.9412 0.049 Uiso 1 1 calc R . .
C36A C 0.88422(17) 1.3869(4) 0.9297(2) 0.0414(11) Uani 1 1 d . . .
H41A H 0.9128 1.3760 0.9569 0.050 Uiso 1 1 calc R . .
H42A H 0.8992 1.3927 0.8947 0.050 Uiso 1 1 calc R . .
Pt2 Pt 0.613805(5) 0.485836(13) 0.619668(5) 0.01727(5) Uani 1 1 d . . .
N1B N 0.61800(13) 0.3435(3) 0.67420(13) 0.0234(7) Uani 1 1 d . . .
N2B N 0.69117(14) 0.4933(3) 0.64864(15) 0.0212(7) Uani 1 1 d . . .
N3B N 0.59806(12) 0.3318(3) 0.51377(12) 0.0239(7) Uani 1 1 d . . .
H1B H 0.6197 0.3732 0.5412 0.050 Uiso 1 1 d . . .
N4B N 0.58103(12) 0.7514(3) 0.66346(12) 0.0223(6) Uani 1 1 d . . .
H2B H 0.6011 0.6806 0.6632 0.050 Uiso 1 1 d . . .
C1B C 0.57851(17) 0.2729(4) 0.68659(18) 0.0267(9) Uani 1 1 d . . .
H3B H 0.5457 0.2847 0.6690 0.032 Uiso 1 1 calc R . .
C2B C 0.58442(19) 0.1847(4) 0.72384(18) 0.0343(10) Uani 1 1 d . . .
H4B H 0.5561 0.1360 0.7317 0.041 Uiso 1 1 calc R . .
C3B C 0.6320(2) 0.1677(4) 0.7497(2) 0.0436(12) Uani 1 1 d . . .
H5B H 0.6366 0.1086 0.7764 0.052 Uiso 1 1 calc R . .
C4B C 0.67271(19) 0.2372(4) 0.73656(19) 0.0386(10) Uani 1 1 d . . .
H6B H 0.7058 0.2259 0.7537 0.046 Uiso 1 1 calc R . .
C5B C 0.66510(16) 0.3237(3) 0.69808(16) 0.0267(8) Uani 1 1 d . . .
C8B C 0.75780(17) 0.3885(4) 0.69850(18) 0.0355(10) Uani 1 1 d . . .
H7B H 0.7681 0.3242 0.7209 0.043 Uiso 1 1 calc R . .
C9B C 0.70642(15) 0.4032(3) 0.68182(15) 0.0238(8) Uani 1 1 d . . .
C10B C 0.79391(19) 0.4684(4) 0.6822(2) 0.0357(11) Uani 1 1 d . . .
H8B H 0.8293 0.4581 0.6924 0.043 Uiso 1 1 calc R . .
C11B C 0.77801(17) 0.5631(4) 0.6509(2) 0.0334(10) Uani 1 1 d . . .
H9B H 0.8020 0.6206 0.6404 0.040 Uiso 1 1 calc R . .
C12B C 0.72677(17) 0.5727(4) 0.63531(17) 0.0259(9) Uani 1 1 d . . .
H10B H 0.7159 0.6385 0.6141 0.031 Uiso 1 1 calc R . .
C13B C 0.53809(15) 0.4641(4) 0.59629(17) 0.0208(8) Uani 1 1 d . . .
C14B C 0.5013(2) 0.4811(4) 0.6346(2) 0.0283(12) Uani 1 1 d . . .
H11B H 0.5129 0.5022 0.6697 0.034 Uiso 1 1 calc R . .
C15B C 0.44913(19) 0.4681(4) 0.6230(2) 0.0358(12) Uani 1 1 d . . .
H12B H 0.4256 0.4844 0.6495 0.043 Uiso 1 1 calc R . .
C16B C 0.43108(16) 0.4315(4) 0.5732(2) 0.0362(10) Uani 1 1 d . . .
H13B H 0.3953 0.4211 0.5652 0.043 Uiso 1 1 calc R . .
C17B C 0.46567(16) 0.4104(4) 0.53555(18) 0.0331(9) Uani 1 1 d . . .
H14B H 0.4535 0.3836 0.5014 0.040 Uiso 1 1 calc R . .
C18B C 0.51865(15) 0.4274(3) 0.54613(16) 0.0248(8) Uani 1 1 d . . .
C19B C 0.55186(15) 0.4073(4) 0.50020(15) 0.0282(8) Uani 1 1 d . . .
H15B H 0.5309 0.3692 0.4710 0.034 Uiso 1 1 calc R . .
H16B H 0.5635 0.4849 0.4872 0.034 Uiso 1 1 calc R . .
C20B C 0.63289(17) 0.3261(4) 0.46806(16) 0.0318(9) Uani 1 1 d . . .
H17B H 0.6413 0.4072 0.4566 0.038 Uiso 1 1 calc R . .
H18B H 0.6151 0.2848 0.4377 0.038 Uiso 1 1 calc R . .
C21B C 0.68204(19) 0.2604(5) 0.4850(2) 0.0415(11) Uani 1 1 d . . .
H19B H 0.7040 0.2537 0.4544 0.050 Uiso 1 1 calc R . .
H20B H 0.7013 0.3058 0.5132 0.050 Uiso 1 1 calc R . .
C22B C 0.6703(2) 0.1383(5) 0.5054(2) 0.0493(13) Uani 1 1 d . . .
H21B H 0.7026 0.0994 0.5184 0.059 Uiso 1 1 calc R . .
H22B H 0.6546 0.0899 0.4761 0.059 Uiso 1 1 calc R . .
C23B C 0.6336(2) 0.1452(4) 0.5501(2) 0.0415(11) Uani 1 1 d . . .
H23B H 0.6509 0.1863 0.5809 0.050 Uiso 1 1 calc R . .
H24B H 0.6249 0.0642 0.5615 0.050 Uiso 1 1 calc R . .
C24B C 0.58444(18) 0.2110(4) 0.53300(18) 0.0332(9) Uani 1 1 d . . .
H25B H 0.5654 0.1668 0.5043 0.040 Uiso 1 1 calc R . .
H26B H 0.5621 0.2178 0.5633 0.040 Uiso 1 1 calc R . .
C25B C 0.61803(14) 0.6196(4) 0.56657(15) 0.0206(8) Uani 1 1 d . . .
C26B C 0.65288(16) 0.6084(4) 0.52704(17) 0.0248(9) Uani 1 1 d . . .
H27B H 0.6737 0.5395 0.5264 0.030 Uiso 1 1 calc R . .
C27B C 0.65834(17) 0.6948(4) 0.48830(17) 0.0289(9) Uani 1 1 d . . .
H28B H 0.6817 0.6826 0.4613 0.035 Uiso 1 1 calc R . .
C28B C 0.62985(15) 0.7986(4) 0.48896(16) 0.0291(9) Uani 1 1 d . . .
H29B H 0.6336 0.8579 0.4628 0.035 Uiso 1 1 calc R . .
C29B C 0.59633(15) 0.8136(4) 0.52816(17) 0.0261(8) Uani 1 1 d . . .
H30B H 0.5771 0.8849 0.5293 0.031 Uiso 1 1 calc R . .
C30B C 0.58952(14) 0.7267(3) 0.56688(15) 0.0208(7) Uani 1 1 d . . .
C31B C 0.55317(14) 0.7550(3) 0.60953(14) 0.0238(8) Uani 1 1 d . . .
H31B H 0.5382 0.8346 0.6032 0.029 Uiso 1 1 calc R . .
H32B H 0.5247 0.6969 0.6082 0.029 Uiso 1 1 calc R . .
C32B C 0.62189(16) 0.8450(4) 0.66994(16) 0.0307(9) Uani 1 1 d . . .
H33B H 0.6057 0.9242 0.6677 0.037 Uiso 1 1 calc R . .
H34B H 0.6457 0.8382 0.6409 0.037 Uiso 1 1 calc R . .
C33B C 0.65171(17) 0.8318(5) 0.72284(18) 0.0371(11) Uani 1 1 d . . .
H35B H 0.6769 0.8971 0.7274 0.044 Uiso 1 1 calc R . .
H36B H 0.6710 0.7563 0.7234 0.044 Uiso 1 1 calc R . .
C34B C 0.61598(18) 0.8336(5) 0.76880(17) 0.0379(10) Uani 1 1 d . . .
H37B H 0.6361 0.8180 0.8025 0.045 Uiso 1 1 calc R . .
H38B H 0.6001 0.9129 0.7713 0.045 Uiso 1 1 calc R . .
C35B C 0.57420(18) 0.7409(4) 0.76058(17) 0.0328(10) Uani 1 1 d . . .
H39B H 0.5899 0.6612 0.7618 0.039 Uiso 1 1 calc R . .
H40B H 0.5502 0.7464 0.7895 0.039 Uiso 1 1 calc R . .
C36B C 0.54483(16) 0.7583(4) 0.70789(16) 0.0271(8) Uani 1 1 d . . .
H41B H 0.5276 0.8363 0.7073 0.032 Uiso 1 1 calc R . .
H42B H 0.5180 0.6965 0.7030 0.032 Uiso 1 1 calc R . .
P1 P 0.53046(5) 0.02657(11) 0.38829(6) 0.0319(3) Uani 1 1 d . . .
F1 F 0.55870(13) -0.0874(3) 0.36742(14) 0.0530(8) Uani 1 1 d . . .
F2 F 0.47806(13) -0.0457(3) 0.39057(15) 0.0594(8) Uani 1 1 d . . .
F3 F 0.54536(16) -0.0098(3) 0.44758(14) 0.0535(9) Uani 1 1 d . . .
F4 F 0.58306(12) 0.0994(3) 0.38628(13) 0.0523(7) Uani 1 1 d . . .
F5 F 0.51449(15) 0.0641(4) 0.32841(14) 0.0681(10) Uani 1 1 d . . .
F6 F 0.50351(12) 0.1439(3) 0.40961(15) 0.0572(8) Uani 1 1 d . . .
P2 P 0.45905(5) 0.06191(11) 0.62562(6) 0.0333(3) Uani 1 1 d . . .
F7A F 0.4541(2) -0.0742(6) 0.6130(3) 0.0624(18) Uani 0.70 1 d P . .
F7B F 0.4617(7) -0.0517(15) 0.5818(7) 0.070(5) Uani 0.30 1 d P . .
F8 F 0.52049(12) 0.0573(3) 0.61898(14) 0.0554(8) Uani 1 1 d . . .
F9 F 0.46458(14) 0.1906(3) 0.64968(16) 0.0679(10) Uani 1 1 d . . .
F10 F 0.39999(13) 0.0619(4) 0.6362(2) 0.0776(12) Uani 1 1 d . . .
F11 F 0.47110(16) 0.0139(4) 0.68524(19) 0.0703(12) Uani 1 1 d . . .
F12 F 0.44758(18) 0.1124(5) 0.56895(15) 0.0901(14) Uani 1 1 d . . .
P3 P 0.76590(5) 0.92220(13) 0.60607(5) 0.0314(3) Uani 1 1 d . . .
F13 F 0.75473(12) 0.8626(3) 0.66194(11) 0.0509(8) Uani 1 1 d . A .
F14 F 0.77780(14) 0.9753(3) 0.54941(14) 0.0558(9) Uani 1 1 d . A .
F15A F 0.7067(2) 0.9288(10) 0.5881(3) 0.068(2) Uani 0.55 1 d P A 1
F16A F 0.8176(5) 0.9854(12) 0.6278(4) 0.086(4) Uani 0.55 1 d P A 1
F17A F 0.7594(5) 1.0515(8) 0.6322(5) 0.082(3) Uani 0.55 1 d P A 1
F18A F 0.8036(4) 0.8117(8) 0.5910(3) 0.078(2) Uani 0.55 1 d P A 1
F15B F 0.7210(4) 0.8414(12) 0.5811(3) 0.073(3) Uani 0.45 1 d P A 2
F16B F 0.8231(4) 0.9141(12) 0.6270(6) 0.065(3) Uani 0.45 1 d P A 2
F17B F 0.7291(7) 1.0191(11) 0.6166(5) 0.090(5) Uani 0.45 1 d P A 2
F18B F 0.7684(5) 0.7949(7) 0.5828(3) 0.062(2) Uani 0.45 1 d P A 2
P4 P 0.70042(5) 0.54219(11) 0.83568(5) 0.0320(2) Uani 1 1 d . . .
F19 F 0.74519(13) 0.4581(3) 0.81678(14) 0.0537(9) Uani 1 1 d . B .
F20 F 0.65586(14) 0.6258(3) 0.85488(12) 0.0636(10) Uani 1 1 d . B .
F21A F 0.7172(6) 0.5105(16) 0.8946(4) 0.095(6) Uani 0.50 1 d P B 3
F22A F 0.7159(3) 0.6312(7) 0.7882(3) 0.0597(17) Uani 0.60 1 d P B 3
F23A F 0.6675(3) 0.4135(7) 0.8397(7) 0.070(3) Uani 0.40 1 d P B 3
F24A F 0.7457(3) 0.6154(12) 0.8713(4) 0.090(3) Uani 0.60 1 d P B 3
F21B F 0.6872(6) 0.4632(10) 0.8820(5) 0.075(4) Uani 0.50 1 d P B 4
F22B F 0.6765(6) 0.5485(16) 0.7765(4) 0.092(6) Uani 0.40 1 d P B 4
F23B F 0.6596(3) 0.4897(8) 0.7977(4) 0.074(3) Uani 0.60 1 d P B 4
F24B F 0.7267(5) 0.6512(8) 0.8315(9) 0.091(5) Uani 0.40 1 d P B 4
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 '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
C25A Pt1 C13A 90.26(15) . . ?
C25A Pt1 N2A 95.69(14) . . ?
C13A Pt1 N2A 173.74(13) . . ?
C25A Pt1 N1A 171.38(15) . . ?
C13A Pt1 N1A 95.53(14) . . ?
N2A Pt1 N1A 78.33(13) . . ?
C1A N1A C5A 119.1(4) . . ?
C1A N1A Pt1 126.5(3) . . ?
C5A N1A Pt1 114.0(3) . . ?
C12A N2A C9A 119.4(3) . . ?
C12A N2A Pt1 126.2(3) . . ?
C9A N2A Pt1 114.4(3) . . ?
C24A N3A C20A 110.3(3) . . ?
C24A N3A C19A 112.0(3) . . ?
C20A N3A C19A 113.9(3) . . ?
C36A N4A C31A 113.3(4) . . ?
C36A N4A C32A 110.0(4) . . ?
C31A N4A C32A 113.6(3) . . ?
N1A C1A C2A 122.9(5) . . ?
C3A C2A C1A 117.7(5) . . ?
C4A C3A C2A 120.0(4) . . ?
C3A C4A C5A 119.5(4) . . ?
N1A C5A C4A 120.8(4) . . ?
N1A C5A C9A 115.7(3) . . ?
C4A C5A C9A 123.4(4) . . ?
C10A C8A C9A 119.3(4) . . ?
N2A C9A C8A 120.6(4) . . ?
N2A C9A C5A 116.2(3) . . ?
C8A C9A C5A 123.2(4) . . ?
C11A C10A C8A 119.4(4) . . ?
C10A C11A C12A 118.9(4) . . ?
N2A C12A C11A 122.4(4) . . ?
C14A C13A C18A 116.6(4) . . ?
C14A C13A Pt1 118.7(3) . . ?
C18A C13A Pt1 124.5(3) . . ?
C13A C14A C15A 122.7(4) . . ?
C16A C15A C14A 120.3(4) . . ?
C15A C16A C17A 118.3(4) . . ?
C18A C17A C16A 121.6(4) . . ?
C17A C18A C13A 120.5(4) . . ?
C17A C18A C19A 117.4(4) . . ?
C13A C18A C19A 122.1(4) . . ?
N3A C19A C18A 112.0(4) . . ?
N3A C20A C21A 109.8(3) . . ?
C20A C21A C22A 112.1(4) . . ?
C23A C22A C21A 110.1(4) . . ?
C24A C23A C22A 112.0(4) . . ?
N3A C24A C23A 109.8(3) . . ?
C30A C25A C26A 116.3(4) . . ?
C30A C25A Pt1 127.0(3) . . ?
C26A C25A Pt1 116.7(3) . . ?
C27A C26A C25A 123.0(4) . . ?
C28A C27A C26A 119.5(4) . . ?
C27A C28A C29A 119.0(4) . . ?
C28A C29A C30A 121.4(4) . . ?
C29A C30A C25A 120.7(4) . . ?
C29A C30A C31A 116.8(4) . . ?
C25A C30A C31A 122.6(3) . . ?
N4A C31A C30A 111.3(3) . . ?
C33A C32A N4A 111.1(4) . . ?
C32A C33A C34A 112.6(4) . . ?
C33A C34A C35A 108.4(4) . . ?
C36A C35A C34A 111.2(5) . . ?
C35A C36A N4A 112.2(4) . . ?
C25B Pt2 C13B 89.25(15) . . ?
C25B Pt2 N2B 96.46(14) . . ?
C13B Pt2 N2B 174.26(13) . . ?
C25B Pt2 N1B 173.81(14) . . ?
C13B Pt2 N1B 96.27(14) . . ?
N2B Pt2 N1B 77.99(13) . . ?
C1B N1B C5B 118.8(4) . . ?
C1B N1B Pt2 126.0(3) . . ?
C5B N1B Pt2 115.2(3) . . ?
C12B N2B C9B 118.1(4) . . ?
C12B N2B Pt2 126.8(3) . . ?
C9B N2B Pt2 115.0(3) . . ?
C19B N3B C24B 113.0(3) . . ?
C19B N3B C20B 111.1(3) . . ?
C24B N3B C20B 111.8(3) . . ?
C32B N4B C31B 112.4(3) . . ?
C32B N4B C36B 110.6(3) . . ?
C31B N4B C36B 112.4(3) . . ?
N1B C1B C2B 122.0(4) . . ?
C1B C2B C3B 119.1(4) . . ?
C4B C3B C2B 119.3(4) . . ?
C3B C4B C5B 119.5(4) . . ?
N1B C5B C4B 121.2(4) . . ?
N1B C5B C9B 115.6(3) . . ?
C4B C5B C9B 123.2(4) . . ?
C10B C8B C9B 119.4(4) . . ?
N2B C9B C8B 121.1(4) . . ?
N2B C9B C5B 115.7(3) . . ?
C8B C9B C5B 123.2(4) . . ?
C11B C10B C8B 119.4(4) . . ?
C12B C11B C10B 118.7(4) . . ?
N2B C12B C11B 123.2(4) . . ?
C18B C13B C14B 115.8(4) . . ?
C18B C13B Pt2 126.2(3) . . ?
C14B C13B Pt2 117.9(4) . . ?
C15B C14B C13B 122.6(5) . . ?
C14B C15B C16B 120.2(5) . . ?
C17B C16B C15B 118.8(4) . . ?
C16B C17B C18B 121.6(4) . . ?
C13B C18B C17B 120.9(4) . . ?
C13B C18B C19B 123.3(3) . . ?
C17B C18B C19B 115.8(4) . . ?
N3B C19B C18B 113.6(3) . . ?
N3B C20B C21B 109.8(3) . . ?
C22B C21B C20B 111.0(4) . . ?
C21B C22B C23B 110.7(4) . . ?
C22B C23B C24B 111.6(4) . . ?
N3B C24B C23B 109.0(4) . . ?
C26B C25B C30B 116.3(4) . . ?
C26B C25B Pt2 118.0(3) . . ?
C30B C25B Pt2 125.7(3) . . ?
C25B C26B C27B 122.4(4) . . ?
C28B C27B C26B 120.5(4) . . ?
C29B C28B C27B 118.5(4) . . ?
C28B C29B C30B 121.9(4) . . ?
C29B C30B C25B 120.4(4) . . ?
C29B C30B C31B 117.2(3) . . ?
C25B C30B C31B 122.3(3) . . ?
N4B C31B C30B 110.5(3) . . ?
N4B C32B C33B 110.5(3) . . ?
C32B C33B C34B 111.4(4) . . ?
C35B C34B C33B 110.5(4) . . ?
C36B C35B C34B 110.7(4) . . ?
C35B C36B N4B 110.0(3) . . ?
F3 P1 F1 90.58(19) . . ?
F3 P1 F2 89.8(2) . . ?
F1 P1 F2 90.6(2) . . ?
F3 P1 F4 90.0(2) . . ?
F1 P1 F4 89.61(19) . . ?
F2 P1 F4 179.7(2) . . ?
F3 P1 F5 179.1(2) . . ?
F1 P1 F5 90.1(2) . . ?
F2 P1 F5 89.6(2) . . ?
F4 P1 F5 90.55(19) . . ?
F3 P1 F6 89.18(19) . . ?
F1 P1 F6 178.3(2) . . ?
F2 P1 F6 91.10(19) . . ?
F4 P1 F6 88.70(18) . . ?
F5 P1 F6 90.2(2) . . ?
F12 P2 F7A 99.4(4) . . ?
F12 P2 F10 91.1(3) . . ?
F7A P2 F10 88.0(3) . . ?
F12 P2 F9 91.4(3) . . ?
F7A P2 F9 169.1(4) . . ?
F10 P2 F9 90.2(2) . . ?
F12 P2 F11 178.1(3) . . ?
F7A P2 F11 82.5(4) . . ?
F10 P2 F11 88.9(2) . . ?
F9 P2 F11 86.7(2) . . ?
F12 P2 F8 93.2(2) . . ?
F7A P2 F8 91.0(3) . . ?
F10 P2 F8 175.8(2) . . ?
F9 P2 F8 90.05(19) . . ?
F11 P2 F8 86.9(2) . . ?
F10 P2 F7B 100.8(7) . . ?
F9 P2 F7B 160.1(8) . . ?
F11 P2 F7B 109.9(7) . . ?
F8 P2 F7B 80.2(7) . . ?
F17B P3 F16B 126.6(10) . . ?
F17B P3 F18B 142.1(9) . . ?
F16B P3 F18B 90.8(7) . . ?
F16B P3 F15A 176.7(5) . . ?
F18B P3 F15A 89.8(6) . . ?
F17B P3 F15B 91.6(9) . . ?
F16B P3 F15B 140.5(8) . . ?
F17B P3 F16A 98.5(10) . . ?
F18B P3 F16A 119.4(7) . . ?
F15A P3 F16A 150.1(7) . . ?
F15B P3 F16A 169.9(8) . . ?
F17B P3 F14 92.5(5) . . ?
F16B P3 F14 95.4(5) . . ?
F18B P3 F14 89.7(3) . . ?
F15A P3 F14 87.8(3) . . ?
F15B P3 F14 92.1(3) . . ?
F16A P3 F14 86.4(4) . . ?
F17B P3 F13 90.0(5) . . ?
F16B P3 F13 84.0(5) . . ?
F18B P3 F13 87.6(3) . . ?
F15A P3 F13 92.8(3) . . ?
F15B P3 F13 86.6(3) . . ?
F16A P3 F13 94.5(4) . . ?
F14 P3 F13 177.2(2) . . ?
F16B P3 F17A 92.1(7) . . ?
F18B P3 F17A 175.7(6) . . ?
F15A P3 F17A 87.1(6) . . ?
F14 P3 F17A 93.2(5) . . ?
F13 P3 F17A 89.5(5) . . ?
F17B P3 F18A 175.9(8) . . ?
F15A P3 F18A 123.6(6) . . ?
F15B P3 F18A 84.7(7) . . ?
F16A P3 F18A 85.2(7) . . ?
F14 P3 F18A 85.9(3) . . ?
F13 P3 F18A 91.4(3) . . ?
F17A P3 F18A 149.1(6) . . ?
F24B P4 F23B 128.3(10) . . ?
F24B P4 F21B 134.2(10) . . ?
F23B P4 F21B 94.3(8) . . ?
F24B P4 F21A 99.2(11) . . ?
F23B P4 F21A 131.3(9) . . ?
F24B P4 F22B 93.2(11) . . ?
F21B P4 F22B 130.8(11) . . ?
F21A P4 F22B 167.6(11) . . ?
F24B P4 F20 82.5(4) . . ?
F23B P4 F20 85.9(3) . . ?
F21B P4 F20 85.0(4) . . ?
F21A P4 F20 90.9(4) . . ?
F22B P4 F20 90.3(4) . . ?
F24B P4 F19 97.6(4) . . ?
F23B P4 F19 94.3(3) . . ?
F21B P4 F19 94.7(3) . . ?
F21A P4 F19 88.8(4) . . ?
F22B P4 F19 90.0(4) . . ?
F20 P4 F19 179.65(19) . . ?
F23B P4 F22A 88.3(5) . . ?
F21B P4 F22A 177.2(8) . . ?
F21A P4 F22A 140.3(8) . . ?
F20 P4 F22A 94.2(3) . . ?
F19 P4 F22A 86.1(3) . . ?
F23B P4 F24A 171.9(7) . . ?
F21B P4 F24A 93.5(7) . . ?
F22B P4 F24A 135.7(9) . . ?
F20 P4 F24A 92.7(3) . . ?
F19 P4 F24A 87.2(3) . . ?
F22A P4 F24A 83.8(5) . . ?
F24B P4 F23A 178.3(9) . . ?
F21A P4 F23A 82.0(8) . . ?
F22B P4 F23A 85.5(9) . . ?
F20 P4 F23A 96.4(4) . . ?
F19 P4 F23A 83.5(3) . . ?
F22A P4 F23A 136.1(7) . . ?
F24A P4 F23A 137.8(7) . . ?
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 C25A 2.027(4) . ?
Pt1 C13A 2.035(4) . ?
Pt1 N2A 2.108(3) . ?
Pt1 N1A 2.111(3) . ?
N1A C1A 1.336(7) . ?
N1A C5A 1.360(5) . ?
N2A C12A 1.344(5) . ?
N2A C9A 1.350(5) . ?
N3A C24A 1.504(5) . ?
N3A C20A 1.506(5) . ?
N3A C19A 1.513(5) . ?
N4A C36A 1.504(6) . ?
N4A C31A 1.514(5) . ?
N4A C32A 1.516(6) . ?
C1A C2A 1.392(7) . ?
C2A C3A 1.386(8) . ?
C3A C4A 1.378(7) . ?
C4A C5A 1.388(6) . ?
C5A C9A 1.477(6) . ?
C8A C10A 1.385(7) . ?
C8A C9A 1.400(6) . ?
C10A C11A 1.377(7) . ?
C11A C12A 1.380(6) . ?
C13A C14A 1.391(6) . ?
C13A C18A 1.421(6) . ?
C14A C15A 1.393(6) . ?
C15A C16A 1.385(7) . ?
C16A C17A 1.396(6) . ?
C17A C18A 1.391(6) . ?
C18A C19A 1.513(5) . ?
C20A C21A 1.508(7) . ?
C21A C22A 1.522(7) . ?
C22A C23A 1.522(6) . ?
C23A C24A 1.510(6) . ?
C25A C30A 1.407(6) . ?
C25A C26A 1.409(6) . ?
C26A C27A 1.394(6) . ?
C27A C28A 1.384(7) . ?
C28A C29A 1.393(7) . ?
C29A C30A 1.400(5) . ?
C30A C31A 1.515(5) . ?
C32A C33A 1.493(7) . ?
C33A C34A 1.526(7) . ?
C34A C35A 1.536(8) . ?
C35A C36A 1.500(7) . ?
Pt2 C25B 2.028(4) . ?
Pt2 C13B 2.040(4) . ?
Pt2 N2B 2.105(4) . ?
Pt2 N1B 2.117(3) . ?
N1B C1B 1.352(5) . ?
N1B C5B 1.354(5) . ?
N2B C12B 1.347(6) . ?
N2B C9B 1.363(5) . ?
N3B C19B 1.499(5) . ?
N3B C24B 1.499(5) . ?
N3B C20B 1.510(5) . ?
N4B C32B 1.503(5) . ?
N4B C31B 1.506(5) . ?
N4B C36B 1.508(5) . ?
C1B C2B 1.373(6) . ?
C2B C3B 1.382(7) . ?
C3B C4B 1.375(7) . ?
C4B C5B 1.385(6) . ?
C5B C9B 1.478(6) . ?
C8B C10B 1.384(7) . ?
C8B C9B 1.389(6) . ?
C10B C11B 1.379(7) . ?
C11B C12B 1.374(7) . ?
C13B C18B 1.399(6) . ?
C13B C14B 1.414(7) . ?
C14B C15B 1.380(8) . ?
C15B C16B 1.381(8) . ?
C16B C17B 1.367(7) . ?
C17B C18B 1.404(6) . ?
C18B C19B 1.503(6) . ?
C20B C21B 1.519(7) . ?
C21B C22B 1.511(8) . ?
C22B C23B 1.522(7) . ?
C23B C24B 1.522(7) . ?
C25B C26B 1.393(6) . ?
C25B C30B 1.420(5) . ?
C26B C27B 1.395(6) . ?
C27B C28B 1.389(6) . ?
C28B C29B 1.367(6) . ?
C29B C30B 1.405(5) . ?
C30B C31B 1.509(5) . ?
C32B C33B 1.513(6) . ?
C33B C34B 1.529(6) . ?
C34B C35B 1.516(7) . ?
C35B C36B 1.508(6) . ?
P1 F3 1.579(3) . ?
P1 F1 1.588(3) . ?
P1 F2 1.594(3) . ?
P1 F4 1.601(3) . ?
P1 F5 1.602(3) . ?
P1 F6 1.608(3) . ?
P2 F12 1.553(4) . ?
P2 F7A 1.576(6) . ?
P2 F10 1.576(4) . ?
P2 F9 1.580(3) . ?
P2 F11 1.614(4) . ?
P2 F8 1.619(3) . ?
P2 F7B 1.699(14) . ?
P3 F17B 1.489(12) . ?
P3 F16B 1.555(11) . ?
P3 F18B 1.557(8) . ?
P3 F15A 1.584(6) . ?
P3 F15B 1.585(7) . ?
P3 F16A 1.593(10) . ?
P3 F14 1.598(3) . ?
P3 F13 1.604(3) . ?
P3 F17A 1.616(9) . ?
P3 F18A 1.648(8) . ?
P4 F24B 1.416(8) . ?
P4 F23B 1.512(7) . ?
P4 F21B 1.526(7) . ?
P4 F21A 1.568(10) . ?
P4 F22B 1.586(9) . ?
P4 F20 1.593(3) . ?
P4 F19 1.598(3) . ?
P4 F22A 1.632(5) . ?
P4 F24A 1.662(8) . ?
P4 F23A 1.694(8) . ?
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
C25A Pt1 N1A C1A 135.8(9) . . . . ?
C13A Pt1 N1A C1A 3.7(4) . . . . ?
N2A Pt1 N1A C1A -177.5(4) . . . . ?
C25A Pt1 N1A C5A -36.4(11) . . . . ?
C13A Pt1 N1A C5A -168.5(3) . . . . ?
N2A Pt1 N1A C5A 10.2(3) . . . . ?
C25A Pt1 N2A C12A -13.0(4) . . . . ?
C13A Pt1 N2A C12A -175.0(12) . . . . ?
N1A Pt1 N2A C12A 173.3(4) . . . . ?
C25A Pt1 N2A C9A 165.0(3) . . . . ?
C13A Pt1 N2A C9A 3.0(14) . . . . ?
N1A Pt1 N2A C9A -8.7(3) . . . . ?
C5A N1A C1A C2A 1.6(7) . . . . ?
Pt1 N1A C1A C2A -170.3(4) . . . . ?
N1A C1A C2A C3A 0.0(8) . . . . ?
C1A C2A C3A C4A -0.9(8) . . . . ?
C2A C3A C4A C5A 0.4(7) . . . . ?
C1A N1A C5A C4A -2.2(6) . . . . ?
Pt1 N1A C5A C4A 170.6(3) . . . . ?
C1A N1A C5A C9A 176.9(4) . . . . ?
Pt1 N1A C5A C9A -10.2(4) . . . . ?
C3A C4A C5A N1A 1.2(6) . . . . ?
C3A C4A C5A C9A -177.8(4) . . . . ?
C12A N2A C9A C8A 2.4(6) . . . . ?
Pt1 N2A C9A C8A -175.7(3) . . . . ?
C12A N2A C9A C5A -175.8(3) . . . . ?
Pt1 N2A C9A C5A 6.1(4) . . . . ?
C10A C8A C9A N2A -2.0(6) . . . . ?
C10A C8A C9A C5A 176.1(4) . . . . ?
N1A C5A C9A N2A 2.8(5) . . . . ?
C4A C5A C9A N2A -178.1(4) . . . . ?
N1A C5A C9A C8A -175.3(4) . . . . ?
C4A C5A C9A C8A 3.8(6) . . . . ?
C9A C8A C10A C11A -0.2(7) . . . . ?
C8A C10A C11A C12A 1.9(7) . . . . ?
C9A N2A C12A C11A -0.7(6) . . . . ?
Pt1 N2A C12A C11A 177.2(3) . . . . ?
C10A C11A C12A N2A -1.5(7) . . . . ?
C25A Pt1 C13A C14A 121.4(3) . . . . ?
N2A Pt1 C13A C14A -76.5(14) . . . . ?
N1A Pt1 C13A C14A -65.0(3) . . . . ?
C25A Pt1 C13A C18A -62.8(3) . . . . ?
N2A Pt1 C13A C18A 99.3(13) . . . . ?
N1A Pt1 C13A C18A 110.8(3) . . . . ?
C18A C13A C14A C15A 2.0(6) . . . . ?
Pt1 C13A C14A C15A 178.1(3) . . . . ?
C13A C14A C15A C16A -1.0(6) . . . . ?
C14A C15A C16A C17A 0.1(6) . . . . ?
C15A C16A C17A C18A -0.3(6) . . . . ?
C16A C17A C18A C13A 1.4(6) . . . . ?
C16A C17A C18A C19A -179.3(4) . . . . ?
C14A C13A C18A C17A -2.2(6) . . . . ?
Pt1 C13A C18A C17A -178.1(3) . . . . ?
C14A C13A C18A C19A 178.6(4) . . . . ?
Pt1 C13A C18A C19A 2.7(5) . . . . ?
C24A N3A C19A C18A 175.8(3) . . . . ?
C20A N3A C19A C18A -58.1(5) . . . . ?
C17A C18A C19A N3A 127.8(4) . . . . ?
C13A C18A C19A N3A -52.9(5) . . . . ?
C24A N3A C20A C21A -59.8(4) . . . . ?
C19A N3A C20A C21A 173.2(3) . . . . ?
N3A C20A C21A C22A 56.9(5) . . . . ?
C20A C21A C22A C23A -53.5(5) . . . . ?
C21A C22A C23A C24A 53.5(5) . . . . ?
C20A N3A C24A C23A 59.9(4) . . . . ?
C19A N3A C24A C23A -172.1(3) . . . . ?
C22A C23A C24A N3A -57.1(5) . . . . ?
C13A Pt1 C25A C30A -56.2(4) . . . . ?
N2A Pt1 C25A C30A 125.7(3) . . . . ?
N1A Pt1 C25A C30A 171.4(8) . . . . ?
C13A Pt1 C25A C26A 121.9(3) . . . . ?
N2A Pt1 C25A C26A -56.1(3) . . . . ?
N1A Pt1 C25A C26A -10.4(11) . . . . ?
C30A C25A C26A C27A 2.8(6) . . . . ?
Pt1 C25A C26A C27A -175.5(3) . . . . ?
C25A C26A C27A C28A -0.9(6) . . . . ?
C26A C27A C28A C29A -1.7(6) . . . . ?
C27A C28A C29A C30A 2.2(6) . . . . ?
C28A C29A C30A C25A -0.1(6) . . . . ?
C28A C29A C30A C31A 179.8(4) . . . . ?
C26A C25A C30A C29A -2.3(5) . . . . ?
Pt1 C25A C30A C29A 175.9(3) . . . . ?
C26A C25A C30A C31A 177.8(3) . . . . ?
Pt1 C25A C30A C31A -4.0(5) . . . . ?
C36A N4A C31A C30A 170.4(3) . . . . ?
C32A N4A C31A C30A -63.1(4) . . . . ?
C29A C30A C31A N4A 125.6(4) . . . . ?
C25A C30A C31A N4A -54.5(5) . . . . ?
C36A N4A C32A C33A 55.6(5) . . . . ?
C31A N4A C32A C33A -72.6(5) . . . . ?
N4A C32A C33A C34A -57.2(5) . . . . ?
C32A C33A C34A C35A 55.9(6) . . . . ?
C33A C34A C35A C36A -55.2(6) . . . . ?
C34A C35A C36A N4A 57.3(6) . . . . ?
C31A N4A C36A C35A 72.0(5) . . . . ?
C32A N4A C36A C35A -56.3(6) . . . . ?
C25B Pt2 N1B C1B -155.7(12) . . . . ?
C13B Pt2 N1B C1B -2.6(4) . . . . ?
N2B Pt2 N1B C1B 177.6(4) . . . . ?
C25B Pt2 N1B C5B 24.3(14) . . . . ?
C13B Pt2 N1B C5B 177.4(3) . . . . ?
N2B Pt2 N1B C5B -2.4(3) . . . . ?
C25B Pt2 N2B C12B 4.3(4) . . . . ?
C13B Pt2 N2B C12B 180(100) . . . . ?
N1B Pt2 N2B C12B -178.5(4) . . . . ?
C25B Pt2 N2B C9B -171.5(3) . . . . ?
C13B Pt2 N2B C9B 3.7(18) . . . . ?
N1B Pt2 N2B C9B 5.7(3) . . . . ?
C5B N1B C1B C2B 2.2(6) . . . . ?
Pt2 N1B C1B C2B -177.9(3) . . . . ?
N1B C1B C2B C3B 0.4(7) . . . . ?
C1B C2B C3B C4B -1.8(8) . . . . ?
C2B C3B C4B C5B 0.7(8) . . . . ?
C1B N1B C5B C4B -3.3(6) . . . . ?
Pt2 N1B C5B C4B 176.7(3) . . . . ?
C1B N1B C5B C9B 179.0(3) . . . . ?
Pt2 N1B C5B C9B -0.9(4) . . . . ?
C3B C4B C5B N1B 1.9(7) . . . . ?
C3B C4B C5B C9B 179.3(4) . . . . ?
C12B N2B C9B C8B -4.5(6) . . . . ?
Pt2 N2B C9B C8B 171.8(3) . . . . ?
C12B N2B C9B C5B 175.8(4) . . . . ?
Pt2 N2B C9B C5B -7.9(4) . . . . ?
C10B C8B C9B N2B 1.6(7) . . . . ?
C10B C8B C9B C5B -178.8(4) . . . . ?
N1B C5B C9B N2B 5.9(5) . . . . ?
C4B C5B C9B N2B -171.7(4) . . . . ?
N1B C5B C9B C8B -173.8(4) . . . . ?
C4B C5B C9B C8B 8.6(6) . . . . ?
C9B C8B C10B C11B 1.9(7) . . . . ?
C8B C10B C11B C12B -2.4(8) . . . . ?
C9B N2B C12B C11B 4.0(6) . . . . ?
Pt2 N2B C12B C11B -171.7(3) . . . . ?
C10B C11B C12B N2B -0.6(7) . . . . ?
C25B Pt2 C13B C18B 65.2(3) . . . . ?
N2B Pt2 C13B C18B -110.1(16) . . . . ?
N1B Pt2 C13B C18B -112.0(3) . . . . ?
C25B Pt2 C13B C14B -118.5(3) . . . . ?
N2B Pt2 C13B C14B 66.2(17) . . . . ?
N1B Pt2 C13B C14B 64.3(3) . . . . ?
C18B C13B C14B C15B -3.0(6) . . . . ?
Pt2 C13B C14B C15B -179.7(3) . . . . ?
C13B C14B C15B C16B 3.3(7) . . . . ?
C14B C15B C16B C17B -1.1(7) . . . . ?
C15B C16B C17B C18B -1.3(7) . . . . ?
C14B C13B C18B C17B 0.6(6) . . . . ?
Pt2 C13B C18B C17B 177.0(3) . . . . ?
C14B C13B C18B C19B 178.7(4) . . . . ?
Pt2 C13B C18B C19B -4.9(6) . . . . ?
C16B C17B C18B C13B 1.5(6) . . . . ?
C16B C17B C18B C19B -176.7(4) . . . . ?
C24B N3B C19B C18B 59.7(4) . . . . ?
C20B N3B C19B C18B -173.7(3) . . . . ?
C13B C18B C19B N3B 49.2(5) . . . . ?
C17B C18B C19B N3B -132.6(4) . . . . ?
C19B N3B C20B C21B 173.8(4) . . . . ?
C24B N3B C20B C21B -58.9(5) . . . . ?
N3B C20B C21B C22B 56.5(5) . . . . ?
C20B C21B C22B C23B -55.3(6) . . . . ?
C21B C22B C23B C24B 55.8(6) . . . . ?
C19B N3B C24B C23B -175.2(3) . . . . ?
C20B N3B C24B C23B 58.5(4) . . . . ?
C22B C23B C24B N3B -56.7(5) . . . . ?
C13B Pt2 C25B C26B -120.4(3) . . . . ?
N2B Pt2 C25B C26B 59.1(3) . . . . ?
N1B Pt2 C25B C26B 32.9(14) . . . . ?
C13B Pt2 C25B C30B 61.7(3) . . . . ?
N2B Pt2 C25B C30B -118.8(3) . . . . ?
N1B Pt2 C25B C30B -145.0(11) . . . . ?
C30B C25B C26B C27B -2.6(6) . . . . ?
Pt2 C25B C26B C27B 179.3(3) . . . . ?
C25B C26B C27B C28B 2.2(6) . . . . ?
C26B C27B C28B C29B -0.3(6) . . . . ?
C27B C28B C29B C30B -1.0(6) . . . . ?
C28B C29B C30B C25B 0.5(6) . . . . ?
C28B C29B C30B C31B 177.5(4) . . . . ?
C26B C25B C30B C29B 1.3(5) . . . . ?
Pt2 C25B C30B C29B 179.2(3) . . . . ?
C26B C25B C30B C31B -175.6(3) . . . . ?
Pt2 C25B C30B C31B 2.3(5) . . . . ?
C32B N4B C31B C30B 64.3(4) . . . . ?
C36B N4B C31B C30B -170.2(3) . . . . ?
C29B C30B C31B N4B -119.8(3) . . . . ?
C25B C30B C31B N4B 57.1(5) . . . . ?
C31B N4B C32B C33B -175.4(3) . . . . ?
C36B N4B C32B C33B 58.1(4) . . . . ?
N4B C32B C33B C34B -55.5(5) . . . . ?
C32B C33B C34B C35B 54.4(5) . . . . ?
C33B C34B C35B C36B -55.9(5) . . . . ?
C34B C35B C36B N4B 58.6(4) . . . . ?
C32B N4B C36B C35B -59.6(4) . . . . ?
C31B N4B C36B C35B 173.9(3) . . . . ?
