# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_mo_liusimin170414_0m_a_sq
_database_code_depnum_ccdc_archive 'CCDC 1576902'
_audit_update_record             
;
2017-09-28 deposited with the CCDC.
2018-02-02 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2017/1
_shelx_SHELXL_version_number     2017/1
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C210 H208 F18 N96 O60 Pt4 S6'
_chemical_formula_weight         6351.43

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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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'
F F 0.0171 0.0103 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   18.9989(6)
_cell_length_b                   19.6522(6)
_cell_length_c                   20.0079(7)
_cell_angle_alpha                89.7820(10)
_cell_angle_beta                 80.6320(10)
_cell_angle_gamma                88.2600(10)
_cell_volume                     7367.3(4)
_cell_formula_units_Z            1
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9443
_cell_measurement_theta_min      2.32
_cell_measurement_theta_max      30.01

_exptl_crystal_description       block
_exptl_crystal_colour            'faint yellow'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.432
_exptl_crystal_F_000             3190
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.200
_exptl_absorpt_coefficient_mu    2.032
_shelx_estimated_absorpt_T_min   0.687
_shelx_estimated_absorpt_T_max   0.687
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker D8 VENTURE PHOTON II'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            281681
_diffrn_reflns_av_unetI/netI     0.0236
_diffrn_reflns_av_R_equivalents  0.0395
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         1.524
_diffrn_reflns_theta_max         30.118
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             43295
_reflns_number_gt                34218
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0600P)²+50.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         43295
_refine_ls_number_parameters     2137
_refine_ls_number_restraints     3008
_refine_ls_R_factor_all          0.1170
_refine_ls_R_factor_gt           0.0949
_refine_ls_wR_factor_ref         0.2368
_refine_ls_wR_factor_gt          0.2207
_refine_ls_goodness_of_fit_ref   1.167
_refine_ls_restrained_S_all      1.177
_refine_ls_shift/su_max          0.087
_refine_ls_shift/su_mean         0.002

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_1 Pt 1.04794(2) 0.92336(2) 0.52734(2) 0.05665(4) Uani 1 1 d D U . . .
N1_1 N 1.14524(12) 0.94831(12) 0.48087(13) 0.0517(6) Uani 1 1 d D U . . .
C1_1 C 1.19795(15) 0.97306(16) 0.51237(19) 0.0613(8) Uani 1 1 d D U . . .
H1_1 H 1.190618 0.975415 0.559416 0.074 Uiso 1 1 calc R U . . .
C2_1 C 1.26170(17) 0.99465(19) 0.47648(19) 0.0710(9) Uani 1 1 d D U . . .
H2_1 H 1.296725 1.011254 0.499023 0.085 Uiso 1 1 calc R U . . .
C3_1 C 1.27248(18) 0.9913(2) 0.40759(19) 0.0765(10) Uani 1 1 d D U . . .
H3_1 H 1.314047 1.007994 0.382804 0.092 Uiso 1 1 calc R U . . .
C4_1 C 1.22252(16) 0.96338(17) 0.3745(2) 0.0672(9) Uani 1 1 d D U . . .
H4_1 H 1.231379 0.958321 0.327683 0.081 Uiso 1 1 calc R U . . .
C5_1 C 1.15744(15) 0.94241(15) 0.41232(17) 0.0616(8) Uani 1 1 d D U . . .
N2_1 N 1.04036(9) 0.90766(8) 0.42933(11) 0.0369(5) Uani 1 1 d D U . . .
C6_1 C 1.10048(16) 0.91619(15) 0.38343(16) 0.0604(8) Uani 1 1 d D U . . .
C7_1 C 1.09798(19) 0.90228(19) 0.31510(18) 0.0735(9) Uani 1 1 d D U . . .
H7_1 H 1.137150 0.909891 0.281786 0.088 Uiso 1 1 calc R U . . .
C8_1 C 1.03618(18) 0.87713(19) 0.2986(2) 0.0777(10) Uani 1 1 d D U . . .
H8_1 H 1.034477 0.867452 0.253412 0.093 Uiso 1 1 calc R U . . .
C9_1 C 0.97657(18) 0.86567(16) 0.34642(17) 0.0679(8) Uani 1 1 d D U . . .
H9_1 H 0.935493 0.848215 0.334235 0.081 Uiso 1 1 calc R U . . .
C10_1 C 0.98040(16) 0.88139(14) 0.41414(17) 0.0636(8) Uani 1 1 d D U . . .
C11_1 C 0.92993(15) 0.87443(13) 0.47228(17) 0.0633(7) Uani 1 1 d D U . . .
C12_1 C 0.86037(18) 0.85368(18) 0.4691(2) 0.0825(10) Uani 1 1 d D U . . .
H12_1 H 0.847072 0.842651 0.427853 0.099 Uiso 1 1 calc R U . . .
C13_1 C 0.8116(2) 0.8500(2) 0.5293(2) 0.0953(11) Uani 1 1 d D U . . .
H13_1 H 0.765290 0.836773 0.527933 0.114 Uiso 1 1 calc R U . . .
C14_1 C 0.8311(2) 0.86547(18) 0.5901(2) 0.0925(11) Uani 1 1 d D U . . .
H14_1 H 0.798444 0.862669 0.629969 0.111 Uiso 1 1 calc R U . . .
C15_1 C 0.90198(19) 0.88595(18) 0.5916(2) 0.0909(11) Uani 1 1 d D U . . .
H15_1 H 0.915797 0.896059 0.632907 0.109 Uiso 1 1 calc R U . . .
N3_1 N 0.94839(15) 0.89076(13) 0.53514(16) 0.0759(8) Uani 1 1 d D U . . .
C16_1 C 1.0558(3) 0.9443(2) 0.62093(18) 0.0891(11) Uani 1 1 d D U . . .
C17_1 C 1.0661(4) 0.9606(4) 0.67897(16) 0.1370(15) Uani 1 1 d D U . . .
C18_1 C 1.0674(2) 0.9484(3) 0.75713(16) 0.1769(15) Uani 1 1 d D U . . .
H18A_1 H 1.030403 0.975933 0.784529 0.212 Uiso 1 1 calc R U . . .
H18B_1 H 1.059993 0.900897 0.768660 0.212 Uiso 1 1 calc R U . . .
N4_1 N 1.1386(2) 0.9686(2) 0.76845(16) 0.1764(16) Uani 1 1 d D U . . .
C19_1 C 1.1356(4) 0.9809(3) 0.84165(15) 0.235(4) Uani 1 1 d D U . . .
H19A_1 H 1.098548 1.014245 0.856883 0.352 Uiso 1 1 calc R U . . .
H19B_1 H 1.125680 0.939182 0.866015 0.352 Uiso 1 1 calc R U . . .
H19C_1 H 1.180600 0.997272 0.849617 0.352 Uiso 1 1 calc R U . . .
C20_1 C 1.1503(4) 1.0355(2) 0.7324(3) 0.251(4) Uani 1 1 d D U . . .
H20A_1 H 1.112787 1.067404 0.750390 0.377 Uiso 1 1 calc R U . . .
H20B_1 H 1.195431 1.052657 0.738927 0.377 Uiso 1 1 calc R U . . .
H20C_1 H 1.150045 1.029096 0.684907 0.377 Uiso 1 1 calc R U . . .
C21_1 C 1.1933(3) 0.9190(3) 0.7434(3) 0.216(3) Uani 1 1 d D U . . .
H21A_1 H 1.238554 0.934244 0.751880 0.324 Uiso 1 1 calc R U . . .
H21B_1 H 1.183041 0.876406 0.766025 0.324 Uiso 1 1 calc R U . . .
H21C_1 H 1.194894 0.913148 0.695577 0.324 Uiso 1 1 calc R U . . .
Pt2A_2 Pt 0.07449(2) 0.44751(2) 1.06417(2) 0.07964(10) Uani 0.52079(5) 1 d D U
P A 1
N1A_2 N 0.13488(15) 0.52213(19) 1.01791(13) 0.0920(8) Uani 0.52079(5) 1 d DG U
P A 1
C1A_2 C 0.20268(16) 0.5156(2) 0.97962(16) 0.0958(8) Uani 0.52079(5) 1 d DG U P
A 1
H1A_2 H 0.225899 0.473102 0.974490 0.115 Uiso 0.52079(5) 1 calc R U P A 1
C2A_2 C 0.2358(2) 0.5724(3) 0.9490(2) 0.0955(9) Uani 0.52079(5) 1 d DG U P A 1
H2A_2 H 0.281136 0.568042 0.923406 0.115 Uiso 0.52079(5) 1 calc R U P A 1
C3A_2 C 0.2011(3) 0.6359(3) 0.9567(3) 0.0959(10) Uani 0.52079(5) 1 d DG U P A 1
H3A_2 H 0.223212 0.673956 0.936217 0.115 Uiso 0.52079(5) 1 calc R U P A 1
C4A_2 C 0.1333(3) 0.64247(19) 0.9950(3) 0.0939(10) Uani 0.52079(5) 1 d DG U P A
1
H4A_2 H 0.110048 0.684931 1.000110 0.113 Uiso 0.52079(5) 1 calc R U P A 1
C5A_2 C 0.1002(2) 0.5856(2) 1.02558(18) 0.0804(9) Uani 0.52079(5) 1 d DG U P A
1
N2A_2 N 0.01352(16) 0.52619(15) 1.09140(14) 0.0805(8) Uani 0.52079(5) 1 d DG U
P A 1
C6A_2 C 0.0343(2) 0.59044(16) 1.06823(19) 0.0802(9) Uani 0.52079(5) 1 d DG U P
A 1
C7A_2 C -0.0123(3) 0.64626(15) 1.0825(3) 0.0852(9) Uani 0.52079(5) 1 d DG U P A
1
H7A_2 H 0.001597 0.689245 1.066950 0.102 Uiso 0.52079(5) 1 calc R U P A 1
C8A_2 C -0.0799(3) 0.6378(2) 1.1198(3) 0.0862(10) Uani 0.52079(5) 1 d DG U P A
1
H8A_2 H -0.111088 0.675166 1.129363 0.103 Uiso 0.52079(5) 1 calc R U P A 1
C9A_2 C -0.10068(19) 0.5736(2) 1.1430(3) 0.0824(10) Uani 0.52079(5) 1 d DG U P
A 1
H9A_2 H -0.145852 0.567926 1.168039 0.099 Uiso 0.52079(5) 1 calc R U P A 1
C10A_2 C -0.05399(18) 0.51775(19) 1.12880(19) 0.0745(8) Uani 0.52079(5) 1 d DG
U P A 1
C11A_2 C -0.05126(16) 0.44802(15) 1.13892(12) 0.0741(8) Uani 0.52079(5) 1 d DG
U P A 1
C12A_2 C -0.11392(18) 0.4243(2) 1.17614(18) 0.0840(8) Uani 0.52079(5) 1 d DG U
P A 1
H12A_2 H -0.151161 0.454701 1.192396 0.101 Uiso 0.52079(5) 1 calc R U P A 1
C13A_2 C -0.1209(3) 0.3551(2) 1.1891(2) 0.0854(9) Uani 0.52079(5) 1 d DG U P A
1
H13A_2 H -0.162840 0.339169 1.213966 0.103 Uiso 0.52079(5) 1 calc R U P A 1
C14A_2 C -0.0653(3) 0.30958(16) 1.1648(2) 0.0891(10) Uani 0.52079(5) 1 d DG U P
A 1
H14A_2 H -0.069932 0.263264 1.173412 0.107 Uiso 0.52079(5) 1 calc R U P A 1
C15A_2 C -0.0026(3) 0.33332(17) 1.1275(2) 0.0824(8) Uani 0.52079(5) 1 d DG U P
A 1
H15A_2 H 0.034656 0.302890 1.111286 0.099 Uiso 0.52079(5) 1 calc R U P A 1
N3A_2 N 0.00441(18) 0.40254(18) 1.11462(18) 0.0681(6) Uani 0.52079(5) 1 d DG U
P A 1
C16A_2 C 0.1405(3) 0.3673(3) 1.0329(5) 0.0992(9) Uani 0.52079(5) 1 d D U P A 1
C17A_2 C 0.1882(4) 0.3215(3) 1.0200(5) 0.1103(10) Uani 0.52079(5) 1 d D U P A 1
C18A_2 C 0.2407(4) 0.2581(3) 1.0437(3) 0.1304(13) Uani 0.52079(5) 1 d D U P A 1
H18A_2 H 0.283989 0.274562 1.057028 0.157 Uiso 0.52079(5) 1 calc R U P A 1
H18B_2 H 0.215674 0.230044 1.079381 0.157 Uiso 0.52079(5) 1 calc R U P A 1
N4A_2 N 0.2541(3) 0.2232(2) 0.9779(3) 0.1604(19) Uani 0.52079(5) 1 d D U P A 1
C19A_2 C 0.2894(6) 0.1569(3) 0.9870(8) 0.286(5) Uani 0.52079(5) 1 d D U P A 1
H19A_2 H 0.298647 0.133180 0.944467 0.429 Uiso 0.52079(5) 1 calc R U P A 1
H19B_2 H 0.333572 0.163855 1.002995 0.429 Uiso 0.52079(5) 1 calc R U P A 1
H19C_2 H 0.258868 0.130412 1.019449 0.429 Uiso 0.52079(5) 1 calc R U P A 1
C20A_2 C 0.2986(5) 0.2731(4) 0.9372(5) 0.247(4) Uani 0.52079(5) 1 d D U P A 1
H20A_2 H 0.311659 0.256494 0.891642 0.370 Uiso 0.52079(5) 1 calc R U P A 1
H20B_2 H 0.272268 0.315545 0.936779 0.370 Uiso 0.52079(5) 1 calc R U P A 1
H20C_2 H 0.340922 0.279877 0.956472 0.370 Uiso 0.52079(5) 1 calc R U P A 1
C21A_2 C 0.1845(3) 0.2089(7) 0.9582(5) 0.244(4) Uani 0.52079(5) 1 d D U P A 1
H21A_2 H 0.191993 0.186075 0.915207 0.366 Uiso 0.52079(5) 1 calc R U P A 1
H21B_2 H 0.158057 0.180441 0.991796 0.366 Uiso 0.52079(5) 1 calc R U P A 1
H21C_2 H 0.158215 0.250933 0.954840 0.366 Uiso 0.52079(5) 1 calc R U P A 1
Pt2B_2 Pt 0.02230(2) 0.54417(2) 1.07135(2) 0.05329(10) Uani 0.31201(5) 1 d D U
P B 2
N1B_2 N 0.1223(2) 0.5593(2) 1.02012(16) 0.0832(8) Uani 0.31201(5) 1 d DG U P B
2
C1B_2 C 0.1463(3) 0.6182(2) 0.9862(2) 0.0911(9) Uani 0.31201(5) 1 d DG U P B 2
H1B_2 H 0.116029 0.656372 0.987255 0.109 Uiso 0.31201(5) 1 calc R U P B 2
C2B_2 C 0.2155(3) 0.6199(3) 0.9507(3) 0.0940(10) Uani 0.31201(5) 1 d DG U P B 2
H2B_2 H 0.231487 0.659297 0.927966 0.113 Uiso 0.31201(5) 1 calc R U P B 2
C3B_2 C 0.2607(2) 0.5628(4) 0.9491(3) 0.0944(10) Uani 0.31201(5) 1 d DG U P B 2
H3B_2 H 0.306964 0.563958 0.925309 0.113 Uiso 0.31201(5) 1 calc R U P B 2
C4B_2 C 0.2367(3) 0.5039(4) 0.9830(3) 0.0921(8) Uani 0.31201(5) 1 d DG U P B 2
H4B_2 H 0.266983 0.465694 0.981944 0.111 Uiso 0.31201(5) 1 calc R U P B 2
C5B_2 C 0.1676(3) 0.5022(2) 1.0185(2) 0.0892(8) Uani 0.31201(5) 1 d DG U P B 2
N2B_2 N 0.0697(2) 0.45569(18) 1.07556(19) 0.0746(8) Uani 0.31201(5) 1 d DG U P
B 2
C6B_2 C 0.1434(2) 0.4483(2) 1.0579(3) 0.0845(8) Uani 0.31201(5) 1 d DG U P B 2
C7B_2 C 0.1783(2) 0.3888(3) 1.0740(4) 0.0947(9) Uani 0.31201(5) 1 d DG U P B 2
H7B_2 H 0.227545 0.383852 1.062190 0.114 Uiso 0.31201(5) 1 calc R U P B 2
C8B_2 C 0.1394(4) 0.3365(3) 1.1078(4) 0.0944(8) Uani 0.31201(5) 1 d DG U P B 2
H8B_2 H 0.162734 0.296690 1.118526 0.113 Uiso 0.31201(5) 1 calc R U P B 2
C9B_2 C 0.0657(4) 0.3439(2) 1.1254(3) 0.0801(9) Uani 0.31201(5) 1 d DG U P B 2
H9B_2 H 0.039765 0.308957 1.147993 0.096 Uiso 0.31201(5) 1 calc R U P B 2
C10B_2 C 0.0309(2) 0.4035(2) 1.1093(3) 0.0591(7) Uani 0.31201(5) 1 d DG U P B 2
C11B_2 C -0.0356(2) 0.4315(2) 1.13827(19) 0.0754(8) Uani 0.31201(5) 1 d DG U P
B 2
C12B_2 C -0.0845(3) 0.3881(3) 1.1740(3) 0.0797(7) Uani 0.31201(5) 1 d DG U P B
2
H12B_2 H -0.070682 0.343545 1.182675 0.096 Uiso 0.31201(5) 1 calc R U P B 2
C13B_2 C -0.1541(2) 0.4112(4) 1.1969(3) 0.0770(10) Uani 0.31201(5) 1 d DG U P B
2
H13B_2 H -0.186837 0.382135 1.220833 0.092 Uiso 0.31201(5) 1 calc R U P B 2
C14B_2 C -0.1748(2) 0.4778(4) 1.1840(4) 0.0771(11) Uani 0.31201(5) 1 d DG U P B
2
H14B_2 H -0.221354 0.493253 1.199289 0.093 Uiso 0.31201(5) 1 calc R U P B 2
C15B_2 C -0.1259(3) 0.5212(3) 1.1482(4) 0.0738(10) Uani 0.31201(5) 1 d DG U P B
2
H15B_2 H -0.139716 0.565781 1.139585 0.089 Uiso 0.31201(5) 1 calc R U P B 2
N3B_2 N -0.0563(3) 0.4981(2) 1.1254(3) 0.0715(8) Uani 0.31201(5) 1 d DG U P B 2
C16B_2 C -0.0262(5) 0.6329(2) 1.0570(6) 0.0802(9) Uani 0.31201(5) 1 d D U P B 2
C17B_2 C -0.0342(5) 0.6970(3) 1.0624(7) 0.0904(9) Uani 0.31201(5) 1 d D U P B 2
C18B_2 C -0.0985(4) 0.7563(3) 1.0638(5) 0.0978(13) Uani 0.31201(5) 1 d D U P B
2
H18C_2 H -0.136365 0.741064 1.040834 0.117 Uiso 0.31201(5) 1 calc R U P B 2
H18D_2 H -0.118467 0.769506 1.109839 0.117 Uiso 0.31201(5) 1 calc R U P B 2
N4B_2 N -0.0593(3) 0.8122(3) 1.0268(3) 0.1088(19) Uani 0.31201(5) 1 d D U P B 2
C19B_2 C -0.1097(4) 0.8701(4) 1.0310(8) 0.154(4) Uani 0.31201(5) 1 d D U P B 2
H19D_2 H -0.122501 0.884251 1.077389 0.231 Uiso 0.31201(5) 1 calc R U P B 2
H19E_2 H -0.088112 0.907017 1.004478 0.231 Uiso 0.31201(5) 1 calc R U P B 2
H19F_2 H -0.151765 0.857078 1.013962 0.231 Uiso 0.31201(5) 1 calc R U P B 2
C20B_2 C 0.0000(3) 0.8233(7) 1.0630(4) 0.134(4) Uani 0.31201(5) 1 d D U P B 2
H20D_2 H 0.031316 0.783705 1.058473 0.201 Uiso 0.31201(5) 1 calc R U P B 2
H20E_2 H 0.025770 0.862015 1.044210 0.201 Uiso 0.31201(5) 1 calc R U P B 2
H20F_2 H -0.018049 0.831321 1.110005 0.201 Uiso 0.31201(5) 1 calc R U P B 2
C21B_2 C -0.0416(8) 0.7927(7) 0.9557(3) 0.133(4) Uani 0.31201(5) 1 d D U P B 2
H21D_2 H -0.008365 0.754580 0.951186 0.199 Uiso 0.31201(5) 1 calc R U P B 2
H21E_2 H -0.084242 0.780365 0.939312 0.199 Uiso 0.31201(5) 1 calc R U P B 2
H21F_2 H -0.020590 0.830304 0.929828 0.199 Uiso 0.31201(5) 1 calc R U P B 2
Pt2C_2 Pt 0.04043(6) 0.46250(5) 1.06969(4) 0.0747(2) Uani 0.16711(5) 1 d D U P
C 3
N1C_2 N 0.1353(2) 0.4914(3) 1.02481(18) 0.0855(8) Uani 0.16711(5) 1 d DG U P C
3
C1C_2 C 0.1540(4) 0.5565(3) 1.0025(2) 0.0897(7) Uani 0.16711(5) 1 d DG U P C 3
H1C_2 H 0.120323 0.592213 1.009397 0.108 Uiso 0.16711(5) 1 calc R U P C 3
C2C_2 C 0.2229(4) 0.5682(4) 0.9698(3) 0.0936(8) Uani 0.16711(5) 1 d DG U P C 3
H2C_2 H 0.235327 0.611758 0.954911 0.112 Uiso 0.16711(5) 1 calc R U P C 3
C3C_2 C 0.2732(3) 0.5148(5) 0.9595(4) 0.0960(11) Uani 0.16711(5) 1 d DG U P C 3
H3C_2 H 0.319258 0.522677 0.937677 0.115 Uiso 0.16711(5) 1 calc R U P C 3
C4C_2 C 0.2545(3) 0.4498(4) 0.9818(4) 0.0961(12) Uani 0.16711(5) 1 d DG U P C 3
H4C_2 H 0.288184 0.414051 0.974929 0.115 Uiso 0.16711(5) 1 calc R U P C 3
C5C_2 C 0.1856(3) 0.4380(3) 1.0145(3) 0.0932(8) Uani 0.16711(5) 1 d DG U P C 3
N2C_2 N 0.0919(2) 0.3795(2) 1.0753(3) 0.0806(8) Uani 0.16711(5) 1 d DG U P C 3
C6C_2 C 0.1647(2) 0.3779(3) 1.0509(4) 0.0954(9) Uani 0.16711(5) 1 d DG U P C 3
C7C_2 C 0.2029(3) 0.3162(4) 1.0450(6) 0.1048(10) Uani 0.16711(5) 1 d DG U P C 3
H7C_2 H 0.251605 0.315102 1.028636 0.126 Uiso 0.16711(5) 1 calc R U P C 3
C8C_2 C 0.1682(4) 0.2560(3) 1.0635(6) 0.1072(12) Uani 0.16711(5) 1 d DG U P C 3
H8C_2 H 0.193749 0.214737 1.059562 0.129 Uiso 0.16711(5) 1 calc R U P C 3
C9C_2 C 0.0954(4) 0.2577(2) 1.0879(6) 0.0929(13) Uani 0.16711(5) 1 d DG U P C 3
H9C_2 H 0.072177 0.217427 1.100317 0.111 Uiso 0.16711(5) 1 calc R U P C 3
C10C_2 C 0.0572(3) 0.3194(2) 1.0938(4) 0.0800(9) Uani 0.16711(5) 1 d DG U P C 3
C11C_2 C -0.0143(2) 0.3397(3) 1.1170(3) 0.0776(8) Uani 0.16711(5) 1 d DG U P C
3
C12C_2 C -0.0631(3) 0.2926(4) 1.1464(4) 0.0844(11) Uani 0.16711(5) 1 d DG U P C
3
H12C_2 H -0.049206 0.246926 1.148463 0.101 Uiso 0.16711(5) 1 calc R U P C 3
C13C_2 C -0.1325(3) 0.3137(5) 1.1726(5) 0.0858(12) Uani 0.16711(5) 1 d DG U P C
3
H13C_2 H -0.165143 0.282129 1.192277 0.103 Uiso 0.16711(5) 1 calc R U P C 3
C14C_2 C -0.1532(3) 0.3819(6) 1.1695(5) 0.0821(10) Uani 0.16711(5) 1 d DG U P C
3
H14C_2 H -0.199722 0.396009 1.187057 0.098 Uiso 0.16711(5) 1 calc R U P C 3
C15C_2 C -0.1045(4) 0.4290(4) 1.1401(6) 0.0786(8) Uani 0.16711(5) 1 d DG U P C
3
H15C_2 H -0.118365 0.474685 1.138017 0.094 Uiso 0.16711(5) 1 calc R U P C 3
N3C_2 N -0.0350(3) 0.4079(3) 1.1139(4) 0.0755(8) Uani 0.16711(5) 1 d DG U P C 3
C16C_2 C -0.0146(5) 0.5539(3) 1.0900(9) 0.0749(9) Uani 0.16711(5) 1 d D U P C 3
C17C_2 C -0.0390(7) 0.6146(3) 1.1020(6) 0.0804(8) Uani 0.16711(5) 1 d D U P C 3
C18C_2 C -0.0675(7) 0.6778(3) 1.0566(4) 0.0884(10) Uani 0.16711(5) 1 d D U P C
3
H18E_2 H -0.032716 0.686273 1.016538 0.106 Uiso 0.16711(5) 1 calc R U P C 3
H18F_2 H -0.112321 0.666671 1.042552 0.106 Uiso 0.16711(5) 1 calc R U P C 3
N4C_2 N -0.0771(3) 0.7376(3) 1.1008(3) 0.0956(12) Uani 0.16711(5) 1 d D U P C 3
C19C_2 C -0.0869(8) 0.7992(3) 1.0602(5) 0.109(4) Uani 0.16711(5) 1 d D U P C 3
H19G_2 H -0.093155 0.838433 1.089286 0.163 Uiso 0.16711(5) 1 calc R U P C 3
H19H_2 H -0.045499 0.804434 1.026187 0.163 Uiso 0.16711(5) 1 calc R U P C 3
H19I_2 H -0.128211 0.794794 1.038847 0.163 Uiso 0.16711(5) 1 calc R U P C 3
C20C_2 C -0.0114(3) 0.7393(9) 1.1305(5) 0.0966(16) Uani 0.16711(5) 1 d D U P C
3
H20G_2 H -0.013912 0.777636 1.160458 0.145 Uiso 0.16711(5) 1 calc R U P C 3
H20H_2 H -0.006239 0.698092 1.155416 0.145 Uiso 0.16711(5) 1 calc R U P C 3
H20I_2 H 0.028859 0.743254 1.095030 0.145 Uiso 0.16711(5) 1 calc R U P C 3
C21C_2 C -0.1431(4) 0.7335(10) 1.1499(5) 0.130(5) Uani 0.16711(5) 1 d D U P C 3
H21G_2 H -0.148541 0.773092 1.178435 0.196 Uiso 0.16711(5) 1 calc R U P C 3
H21H_2 H -0.183070 0.731359 1.126201 0.196 Uiso 0.16711(5) 1 calc R U P C 3
H21I_2 H -0.140955 0.693432 1.177132 0.196 Uiso 0.16711(5) 1 calc R U P C 3
C1_4 C 0.19627(12) 0.55240(13) 1.23308(12) 0.0338(6) Uani 1 1 d . . . . .
H1A_4 H 0.214992 0.567587 1.272608 0.051 Uiso 1 1 calc R U . . .
H1B_4 H 0.203854 0.503427 1.229566 0.051 Uiso 1 1 calc R U . . .
N1_4 N 0.19429(9) 0.69841(10) 1.14752(9) 0.0283(4) Uani 1 1 d . . . . .
O1_4 O -0.08332(10) 0.54278(8) 0.74543(9) 0.0362(4) Uani 1 1 d . . . . .
C2_4 C 0.24786(11) 0.65696(12) 1.17303(11) 0.0285(5) Uani 1 1 d . . . . .
H2_4 H 0.256004 0.672733 1.217468 0.034 Uiso 1 1 calc R U . . .
N2_4 N 0.28891(10) 0.70223(10) 1.06522(9) 0.0299(5) Uani 1 1 d . . . . .
O2_4 O 0.01184(8) 0.24284(8) 0.79634(9) 0.0320(4) Uani 1 1 d . . . . .
C3_4 C 0.31526(12) 0.66393(13) 1.11831(10) 0.0305(5) Uani 1 1 d . . . . .
H3_4 H 0.353171 0.687547 1.135807 0.037 Uiso 1 1 calc R U . . .
N3_4 N 0.23485(10) 0.58420(11) 1.17314(10) 0.0316(5) Uani 1 1 d . . . . .
O3_4 O 0.13229(8) 0.59946(8) 0.66239(9) 0.0312(4) Uani 1 1 d . . . . .
C4_4 C 0.29136(12) 0.54842(13) 1.13527(12) 0.0347(6) Uani 1 1 d . . . . .
N4_4 N 0.33578(10) 0.59409(11) 1.10050(9) 0.0336(5) Uani 1 1 d . . . . .
O4_4 O 0.21837(9) 0.31876(8) 0.75947(9) 0.0340(4) Uani 1 1 d . . . . .
C5_4 C 0.22138(12) 0.72860(12) 1.08646(11) 0.0308(5) Uani 1 1 d . . . . .
N5_4 N 0.37053(11) 0.69248(11) 0.95940(9) 0.0323(5) Uani 1 1 d . . . . .
O5_4 O 0.29418(9) 0.67805(9) 0.71430(8) 0.0336(4) Uani 1 1 d . . . . .
C6_4 C 0.33806(14) 0.73642(13) 1.01423(11) 0.0344(6) Uani 1 1 d . . . . .
H6A_4 H 0.312789 0.773806 0.995775 0.041 Uiso 1 1 calc R U . . .
H6B_4 H 0.375390 0.755563 1.035486 0.041 Uiso 1 1 calc R U . . .
N6_4 N 0.41763(10) 0.58491(11) 0.99558(9) 0.0319(5) Uani 1 1 d . . . . .
O6_4 O 0.38691(10) 0.40430(9) 0.81785(9) 0.0404(5) Uani 1 1 d . . . . .
C7_4 C 0.43294(12) 0.64940(13) 0.96301(10) 0.0296(5) Uani 1 1 d . . . . .
H7_4 H 0.469163 0.673508 0.982586 0.036 Uiso 1 1 calc R U . . .
N7_4 N 0.40860(11) 0.66387(11) 0.85237(9) 0.0314(5) Uani 1 1 d . . . . .
O7_4 O 0.31433(10) 0.74082(10) 0.87603(9) 0.0428(5) Uani 1 1 d . . . . .
C8_4 C 0.40703(12) 0.57536(15) 1.06816(11) 0.0377(6) Uani 1 1 d . . . . .
H8A_4 H 0.416860 0.527940 1.077873 0.045 Uiso 1 1 calc R U . . .
H8B_4 H 0.440771 0.602487 1.087128 0.045 Uiso 1 1 calc R U . . .
N8_4 N 0.45604(10) 0.55662(11) 0.88871(9) 0.0299(5) Uani 1 1 d . . . . .
O8_4 O 0.42975(9) 0.47130(10) 0.96796(9) 0.0385(5) Uani 1 1 d . . . . .
C9_4 C 0.43353(11) 0.53053(13) 0.95266(11) 0.0309(5) Uani 1 1 d . . . . .
N9_4 N 0.42983(9) 0.50963(10) 0.78443(9) 0.0272(4) Uani 1 1 d . . . . .
O9_4 O 0.29929(11) 0.48688(10) 1.13301(10) 0.0469(5) Uani 1 1 d . . . . .
C11_4 C 0.45968(11) 0.62977(12) 0.88741(10) 0.0283(5) Uani 1 1 d . . . . .
H11_4 H 0.508299 0.644759 0.871661 0.034 Uiso 1 1 calc R U . . .
N11_4 N 0.32372(9) 0.56696(9) 0.68116(9) 0.0249(4) Uani 1 1 d . . . . .
C10_4 C 0.48018(11) 0.51347(13) 0.83121(11) 0.0311(5) Uani 1 1 d . . . . .
H10A_4 H 0.489668 0.467970 0.847170 0.037 Uiso 1 1 calc R U . . .
H10B_4 H 0.524761 0.530298 0.807193 0.037 Uiso 1 1 calc R U . . .
N10_4 N 0.39179(10) 0.61908(9) 0.74413(9) 0.0266(4) Uani 1 1 d . . . . .
O10_4 O 0.18964(10) 0.77024(10) 1.05617(9) 0.0413(5) Uani 1 1 d . . . . .
C12_4 C 0.35990(13) 0.70320(12) 0.89347(11) 0.0318(5) Uani 1 1 d . . . . .
N12_4 N 0.36201(9) 0.45809(9) 0.72141(9) 0.0281(4) Uani 1 1 d . . . . .
C13_4 C 0.42018(13) 0.67293(11) 0.77969(10) 0.0297(5) Uani 1 1 d . . . . .
H13A_4 H 0.398117 0.715953 0.769161 0.036 Uiso 1 1 calc R U . . .
H13B_4 H 0.471038 0.675232 0.763555 0.036 Uiso 1 1 calc R U . . .
N13_4 N 0.22316(9) 0.51840(8) 0.64036(9) 0.0253(4) Uani 1 1 d . . . . .
C14_4 C 0.42939(10) 0.55548(11) 0.72809(10) 0.0237(4) Uani 1 1 d . . . . .
H14_4 H 0.477694 0.562119 0.703549 0.028 Uiso 1 1 calc R U . . .
N14_4 N 0.25446(8) 0.41165(8) 0.69237(9) 0.0237(4) Uani 1 1 d . . . . .
C15_4 C 0.39234(11) 0.45222(12) 0.77856(11) 0.0285(5) Uani 1 1 d . . . . .
N15_4 N 0.11116(8) 0.48387(8) 0.66307(9) 0.0235(4) Uani 1 1 d . . . . .
C16_4 C 0.38212(10) 0.51912(10) 0.68316(10) 0.0231(4) Uani 1 1 d . . . . .
H16_4 H 0.408273 0.508710 0.637809 0.028 Uiso 1 1 calc R U . . .
N16_4 N 0.14803(8) 0.36871(8) 0.68860(9) 0.0241(4) Uani 1 1 d . . . . .
C17_4 C 0.33265(11) 0.62712(11) 0.71294(10) 0.0257(5) Uani 1 1 d . . . . .
N17_4 N -0.00986(9) 0.45188(8) 0.70422(9) 0.0230(4) Uani 1 1 d . . . . .
C18_4 C 0.33022(10) 0.40122(11) 0.69371(12) 0.0290(5) Uani 1 1 d . . . . .
H18A_4 H 0.337153 0.361017 0.720430 0.035 Uiso 1 1 calc R U . . .
H18B_4 H 0.354671 0.392790 0.647909 0.035 Uiso 1 1 calc R U . . .
N18_4 N -0.11991(9) 0.43136(9) 0.75802(9) 0.0264(4) Uani 1 1 d . . . . .
C19_4 C 0.23107(10) 0.44588(10) 0.63494(10) 0.0224(4) Uani 1 1 d . . . . .
H19_4 H 0.260586 0.431961 0.592078 0.027 Uiso 1 1 calc R U . . .
N19_4 N -0.08203(9) 0.31419(9) 0.77865(9) 0.0261(4) Uani 1 1 d . . . . .
C20_4 C 0.28109(10) 0.56469(10) 0.62728(10) 0.0259(4) Uani 1 1 d . . . . .
H20A_4 H 0.261755 0.610040 0.620768 0.031 Uiso 1 1 calc R U . . .
H20B_4 H 0.311774 0.551307 0.585526 0.031 Uiso 1 1 calc R U . . .
N20_4 N 0.02696(9) 0.33454(9) 0.72344(9) 0.0240(4) Uani 1 1 d . . . . .
C21_4 C 0.20820(10) 0.36146(10) 0.71738(11) 0.0243(4) Uani 1 1 d . . . . .
C22_4 C 0.09774(10) 0.31455(10) 0.68998(12) 0.0254(5) Uani 1 1 d . . . . .
H22A_4 H 0.095410 0.300862 0.643879 0.030 Uiso 1 1 calc R U . . .
H22B_4 H 0.114782 0.275498 0.713211 0.030 Uiso 1 1 calc R U . . .
C23_4 C 0.03692(10) 0.49083(10) 0.65545(11) 0.0259(5) Uani 1 1 d . . . . .
H23A_4 H 0.022171 0.538505 0.659962 0.031 Uiso 1 1 calc R U . . .
H23B_4 H 0.031943 0.476303 0.610215 0.031 Uiso 1 1 calc R U . . .
C24_4 C -0.01874(10) 0.38037(10) 0.69179(10) 0.0204(4) Uani 1 1 d . . . . .
H24_4 H -0.014568 0.370982 0.643215 0.025 Uiso 1 1 calc R U . . .
C26_4 C -0.07243(11) 0.48163(11) 0.73710(11) 0.0265(5) Uani 1 1 d . . . . .
C27_4 C -0.13764(11) 0.26809(11) 0.80618(12) 0.0293(5) Uani 1 1 d . . . . .
H27A_4 H -0.157528 0.248396 0.769231 0.044 Uiso 1 1 calc R U . . .
H27B_4 H -0.116848 0.231280 0.829675 0.044 Uiso 1 1 calc R U . . .
C28_4 C 0.15307(10) 0.54023(10) 0.65612(10) 0.0240(4) Uani 1 1 d . . . . .
C29_4 C -0.01204(11) 0.29160(10) 0.76945(11) 0.0249(5) Uani 1 1 d . . . . .
C30_4 C 0.15279(10) 0.42280(10) 0.63915(11) 0.0224(4) Uani 1 1 d . . . . .
H30_4 H 0.142671 0.407303 0.595283 0.027 Uiso 1 1 calc R U . . .
C25_4 C -0.09414(10) 0.36576(10) 0.72937(10) 0.0233(4) Uani 1 1 d . . . . .
H25_4 H -0.124684 0.349219 0.698260 0.028 Uiso 1 1 calc R U . . .
C1_5 C 1.44113(11) 0.89641(11) 0.46500(13) 0.0329(5) Uani 1 1 d . . . . .
H1A_5 H 1.443782 0.914779 0.509421 0.049 Uiso 1 1 calc R U . . .
H1B_5 H 1.482459 0.866269 0.452126 0.049 Uiso 1 1 calc R U . . .
N1_5 N 1.37694(9) 0.85712(8) 0.46932(10) 0.0270(4) Uani 1 1 d . . . . .
O1_5 O 0.63858(12) 1.04394(11) 0.77927(10) 0.0490(6) Uani 1 1 d . . . . .
C2_5 C 1.37147(11) 0.80299(10) 0.42075(12) 0.0279(5) Uani 1 1 d . . . . .
H2_5 H 1.414371 0.773240 0.413705 0.033 Uiso 1 1 calc R U . . .
N2_5 N 1.28715(9) 0.79632(8) 0.52090(9) 0.0249(4) Uani 1 1 d . . . . .
O2_5 O 0.57782(9) 0.96259(8) 0.50346(9) 0.0335(4) Uani 1 1 d . . . . .
C3_5 C 1.30534(10) 0.76460(9) 0.45515(11) 0.0244(4) Uani 1 1 d . . . . .
H3_5 H 1.315928 0.715742 0.458857 0.029 Uiso 1 1 calc R U . . .
N3_5 N 1.35253(10) 0.82578(9) 0.35773(10) 0.0282(4) Uani 1 1 d . . . . .
O3_5 O 0.64866(9) 0.78922(9) 0.53125(8) 0.0328(4) Uani 1 1 d . . . . .
C4_5 C 1.28512(11) 0.80777(10) 0.35046(11) 0.0262(5) Uani 1 1 d . . . . .
N4_5 N 1.25361(9) 0.77804(9) 0.41027(9) 0.0245(4) Uani 1 1 d . . . . .
O4_5 O 0.70579(12) 0.87903(14) 0.80469(11) 0.0630(7) Uani 1 1 d . . . . .
C5_5 C 1.33331(11) 0.84694(10) 0.52953(11) 0.0279(5) Uani 1 1 d . . . . .
N5_5 N 1.13988(9) 0.73652(8) 0.46464(8) 0.0219(4) Uani 1 1 d . . . . .
O5_5 O 0.89967(10) 0.79622(13) 0.75948(11) 0.0668(6) Uani 1 1 d . . . . .
C6_5 C 1.24962(11) 0.75999(11) 0.57805(11) 0.0275(5) Uani 1 1 d . . . . .
H6A_5 H 1.254736 0.783604 0.619398 0.033 Uiso 1 1 calc R U . . .
H6B_5 H 1.271423 0.714872 0.579707 0.033 Uiso 1 1 calc R U . . .
N6_5 N 1.17436(9) 0.75358(9) 0.57535(9) 0.0253(4) Uani 1 1 d . . . . .
O6_5 O 0.82596(8) 0.69624(9) 0.48765(8) 0.0298(4) Uani 1 1 d . . . . .
C7_5 C 1.19702(11) 0.73100(11) 0.40722(11) 0.0263(5) Uani 1 1 d . . . . .
H7A_5 H 1.217011 0.684901 0.405002 0.032 Uiso 1 1 calc R U . . .
H7B_5 H 1.177417 0.739338 0.366003 0.032 Uiso 1 1 calc R U . . .
N7_5 N 1.02975(8) 0.70739(8) 0.51317(8) 0.0197(3) Uani 1 1 d . . . . .
O7_5 O 1.04950(8) 0.73643(7) 0.39963(7) 0.0266(3) Uani 1 1 d . . . . .
C8_5 C 1.15004(10) 0.70712(9) 0.52909(10) 0.0210(4) Uani 1 1 d . . . . .
H8_5 H 1.180612 0.665818 0.522692 0.025 Uiso 1 1 calc R U . . .
N8_5 N 1.06183(9) 0.73451(9) 0.62295(8) 0.0232(4) Uani 1 1 d . . . . .
O8_5 O 1.13436(9) 0.79104(9) 0.68495(9) 0.0380(4) Uani 1 1 d . . . . .
C9_5 C 1.07343(10) 0.69085(9) 0.56382(9) 0.0197(4) Uani 1 1 d . . . . .
H9_5 H 1.069954 0.642761 0.576688 0.024 Uiso 1 1 calc R U . . .
N9_5 N 0.90710(8) 0.68967(9) 0.56166(8) 0.0216(4) Uani 1 1 d . . . . .
O9_5 O 1.25655(9) 0.81650(9) 0.30052(8) 0.0329(4) Uani 1 1 d . . . . .
C10_5 C 1.12450(11) 0.76291(10) 0.63293(11) 0.0273(5) Uani 1 1 d . . . . .
N10_5 N 0.93679(9) 0.72333(9) 0.67028(9) 0.0261(4) Uani 1 1 d . . . . .
O10_5 O 1.33470(9) 0.87752(8) 0.58187(8) 0.0362(4) Uani 1 1 d . . . . .
C11_5 C 1.07083(10) 0.72768(9) 0.45306(10) 0.0202(4) Uani 1 1 d . . . . .
N11_5 N 0.79148(9) 0.69066(9) 0.60351(9) 0.0248(4) Uani 1 1 d . . . . .
C12_5 C 0.96654(9) 0.66873(10) 0.51096(10) 0.0222(4) Uani 1 1 d . . . . .
H12A_5 H 0.952857 0.673810 0.466530 0.027 Uiso 1 1 calc R U . . .
H12B_5 H 0.977720 0.620897 0.517334 0.027 Uiso 1 1 calc R U . . .
N12_5 N 0.82053(11) 0.73459(14) 0.70893(11) 0.0462(6) Uani 1 1 d . . . . .
C13_5 C 1.01008(11) 0.71594(11) 0.68179(10) 0.0258(5) Uani 1 1 d . . . . .
H13A_5 H 1.019471 0.669042 0.693772 0.031 Uiso 1 1 calc R U . . .
H13B_5 H 1.016275 0.744366 0.719805 0.031 Uiso 1 1 calc R U . . .
N13_5 N 0.67255(9) 0.74347(10) 0.63161(9) 0.0274(4) Uani 1 1 d . . . . .
C14_5 C 0.90541(10) 0.67294(10) 0.63276(10) 0.0233(4) Uani 1 1 d . . . . .
H14_5 H 0.925666 0.627238 0.638477 0.028 Uiso 1 1 calc R U . . .
N14_5 N 0.70245(11) 0.78638(14) 0.73588(11) 0.0458(6) Uani 1 1 d . . . . .
C15_5 C 0.82505(11) 0.67790(12) 0.66209(12) 0.0303(5) Uani 1 1 d . . . . .
H15_5 H 0.808618 0.635837 0.685204 0.036 Uiso 1 1 calc R U . . .
N15_5 N 0.59514(9) 0.83069(9) 0.63570(9) 0.0260(4) Uani 1 1 d . . . . .
C16_5 C 0.83948(10) 0.69284(10) 0.54535(11) 0.0229(4) Uani 1 1 d . . . . .
N16_5 N 0.61147(11) 0.85976(10) 0.74977(10) 0.0341(5) Uani 1 1 d . . . . .
C17_5 C 0.88703(13) 0.75530(15) 0.71767(13) 0.0417(6) Uani 1 1 d . . . . .
N17_5 N 0.54113(10) 0.94136(9) 0.61695(11) 0.0301(5) Uani 1 1 d . . . . .
C18_5 C 0.71517(11) 0.68507(11) 0.60384(12) 0.0287(5) Uani 1 1 d . . . . .
H18A_5 H 0.707260 0.678064 0.557707 0.034 Uiso 1 1 calc R U . . .
H18B_5 H 0.698846 0.645166 0.629838 0.034 Uiso 1 1 calc R U . . .
N18_5 N 0.56960(12) 0.97345(10) 0.72648(11) 0.0372(5) Uani 1 1 d . . . . .
C19_5 C 0.75865(14) 0.7466(2) 0.76077(14) 0.0563(9) Uani 1 1 d . . . . .
H19A_5 H 0.773073 0.770522 0.798429 0.068 Uiso 1 1 calc R U . . .
H19B_5 H 0.740054 0.703250 0.777419 0.068 Uiso 1 1 calc R U . . .
N19_5 N 0.55601(10) 1.04815(9) 0.58306(10) 0.0296(4) Uani 1 1 d . . . . .
C20_5 C 0.67600(14) 0.84566(16) 0.76769(13) 0.0433(7) Uani 1 1 d . . . . .
N20_5 N 0.57876(11) 1.08057(10) 0.69417(11) 0.0344(5) Uani 1 1 d . . . . .
C21_5 C 0.64944(11) 0.75348(12) 0.70289(11) 0.0294(5) Uani 1 1 d . . . . .
H21_5 H 0.632276 0.711653 0.726012 0.035 Uiso 1 1 calc R U . . .
C22_5 C 0.59022(11) 0.80956(11) 0.70612(12) 0.0285(5) Uani 1 1 d . . . . .
H22_5 H 0.543092 0.792169 0.724036 0.034 Uiso 1 1 calc R U . . .
C23_5 C 0.63967(10) 0.78777(11) 0.59281(12) 0.0265(5) Uani 1 1 d . . . . .
C24_5 C 0.53713(11) 0.86812(10) 0.61204(13) 0.0303(5) Uani 1 1 d . . . . .
H24A_5 H 0.536820 0.856072 0.565120 0.036 Uiso 1 1 calc R U . . .
H24B_5 H 0.492365 0.854126 0.638195 0.036 Uiso 1 1 calc R U . . .
C25_5 C 0.52052(12) 0.97968(11) 0.67881(14) 0.0339(6) Uani 1 1 d . . . . .
H25_5 H 0.471503 0.970639 0.700077 0.041 Uiso 1 1 calc R U . . .
C26_5 C 0.52843(11) 1.05516(11) 0.65415(13) 0.0316(5) Uani 1 1 d . . . . .
H26_5 H 0.482821 1.080855 0.662206 0.038 Uiso 1 1 calc R U . . .
C27_5 C 0.56034(10) 0.98174(10) 0.56192(12) 0.0279(5) Uani 1 1 d . . . . .
C28_5 C 0.59529(12) 1.15170(11) 0.69817(13) 0.0334(6) Uani 1 1 d . . . . .
H28A_5 H 0.551711 1.179032 0.699416 0.050 Uiso 1 1 calc R U . . .
H28B_5 H 0.613101 1.159426 0.740182 0.050 Uiso 1 1 calc R U . . .
C29_5 C 0.59982(13) 1.03386(12) 0.73822(12) 0.0346(6) Uani 1 1 d . . . . .
C30_5 C 0.56802(16) 0.91837(13) 0.77523(13) 0.0407(7) Uani 1 1 d . . . . .
H30A_5 H 0.584401 0.934940 0.815473 0.049 Uiso 1 1 calc R U . . .
H30B_5 H 0.519096 0.904631 0.788362 0.049 Uiso 1 1 calc R U . . .
S1_6 S 0.12953(3) 0.52475(2) 0.44768(3) 0.02403(11) Uani 1 1 d . . . . .
C1_6 C 0.43070(14) 0.60588(16) 0.35112(13) 0.0421(7) Uani 1 1 d . . . . .
F1_6 F 0.48513(11) 0.56680(14) 0.33823(11) 0.0976(7) Uani 1 1 d . U . . .
O1_6 O 0.36783(17) 0.56381(16) 0.25750(16) 0.1018(10) Uani 1 1 d . . . . .
S2_6 S 0.38681(3) 0.62708(4) 0.28034(3) 0.03931(16) Uani 1 1 d . . . . .
C2_6 C 0.53246(13) 0.61649(12) 0.53162(12) 0.0330(5) Uani 1 1 d . . . . .
O2_6 O 0.4406(2) 0.6516(2) 0.23271(17) 0.1558(14) Uani 1 1 d . . . . .
F2_6 F 0.45578(18) 0.66039(16) 0.37390(15) 0.1676(10) Uani 1 1 d . U . . .
S3_6 S 0.47158(3) 0.68663(3) 0.56368(3) 0.03103(13) Uani 1 1 d . . . . .
C3_6 C 0.22533(12) 0.50856(12) 0.43933(12) 0.0315(5) Uani 1 1 d . . . . .
O3_6 O 0.32701(14) 0.66515(16) 0.30789(13) 0.1116(8) Uani 1 1 d . . . . .
F4_6 F 0.25694(8) 0.55977(9) 0.46519(11) 0.0605(5) Uani 1 1 d . U . . .
O4_6 O 0.12390(10) 0.58661(9) 0.41047(11) 0.0441(5) Uani 1 1 d . . . . .
F5_6 F 0.25507(10) 0.49883(12) 0.37640(9) 0.0648(6) Uani 1 1 d . U . . .
O5_6 O 0.10501(12) 0.46616(10) 0.41872(14) 0.0667(7) Uani 1 1 d . . . . .
F6_6 F 0.23965(9) 0.45239(8) 0.47355(9) 0.0515(4) Uani 1 1 d . U . . .
O6_6 O 0.10910(12) 0.53299(12) 0.51944(10) 0.0536(6) Uani 1 1 d . . . . .
F7_6 F 0.51844(10) 0.59027(11) 0.47518(9) 0.0663(6) Uani 1 1 d . U . . .
O7_6 O 0.48253(10) 0.73692(9) 0.51099(9) 0.0408(5) Uani 1 1 d . . . . .
F8_6 F 0.59958(9) 0.63516(10) 0.51696(13) 0.0709(7) Uani 1 1 d . U . . .
O8_6 O 0.40331(10) 0.65612(12) 0.57253(13) 0.0579(6) Uani 1 1 d . . . . .
F9_6 F 0.53067(15) 0.56680(10) 0.57588(11) 0.0821(8) Uani 1 1 d . U . . .
O10_6 O 0.58702(13) 0.76380(16) 0.39746(13) 0.0720(9) Uani 1 1 d . . . . .
O9_6 O 0.49700(13) 0.70469(11) 0.62464(10) 0.0513(6) Uani 1 1 d . . . . .
F3_6 F 0.39222(14) 0.5899(3) 0.40256(13) 0.1722(16) Uani 1 1 d . U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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_1 C16_1 1.949(4) . ?
Pt1_1 N3_1 1.997(3) . ?
Pt1_1 N1_1 2.004(2) . ?
Pt1_1 N2_1 2.015(2) . ?
N1_1 C5_1 1.358(4) . ?
N1_1 C1_1 1.369(4) . ?
C1_1 C2_1 1.381(4) . ?
C1_1 H1_1 0.9300 . ?
C2_1 C3_1 1.362(5) . ?
C2_1 H2_1 0.9300 . ?
C3_1 C4_1 1.370(5) . ?
C3_1 H3_1 0.9300 . ?
C4_1 C5_1 1.412(4) . ?
C4_1 H4_1 0.9300 . ?
C5_1 C6_1 1.418(4) . ?
N2_1 C10_1 1.344(4) . ?
N2_1 C6_1 1.358(3) . ?
C6_1 C7_1 1.404(5) . ?
C7_1 C8_1 1.377(5) . ?
C7_1 H7_1 0.9300 . ?
C8_1 C9_1 1.382(5) . ?
C8_1 H8_1 0.9300 . ?
C9_1 C10_1 1.405(5) . ?
C9_1 H9_1 0.9300 . ?
C10_1 C11_1 1.391(4) . ?
C11_1 N3_1 1.400(5) . ?
C11_1 C12_1 1.406(4) . ?
C12_1 C13_1 1.398(5) . ?
C12_1 H12_1 0.9300 . ?
C13_1 C14_1 1.366(6) . ?
C13_1 H13_1 0.9300 . ?
C14_1 C15_1 1.422(5) . ?
C14_1 H14_1 0.9300 . ?
C15_1 N3_1 1.321(5) . ?
C15_1 H15_1 0.9300 . ?
C16_1 C17_1 1.253(5) . ?
C17_1 C18_1 1.585(4) . ?
C18_1 N4_1 1.473(6) . ?
C18_1 H18A_1 0.9700 . ?
C18_1 H18B_1 0.9700 . ?
N4_1 C21_1 1.432(6) . ?
N4_1 C19_1 1.477(4) . ?
N4_1 C20_1 1.502(6) . ?
C19_1 H19A_1 0.9600 . ?
C19_1 H19B_1 0.9600 . ?
C19_1 H19C_1 0.9600 . ?
C20_1 H20A_1 0.9600 . ?
C20_1 H20B_1 0.9600 . ?
C20_1 H20C_1 0.9600 . ?
C21_1 H21A_1 0.9600 . ?
C21_1 H21B_1 0.9600 . ?
C21_1 H21C_1 0.9600 . ?
Pt2A_2 N3A_2 1.789(4) . ?
Pt2A_2 N2A_2 1.929(3) . ?
Pt2A_2 N1A_2 2.017(3) . ?
Pt2A_2 C16A_2 2.021(5) . ?
N1A_2 C1A_2 1.3900 . ?
N1A_2 C5A_2 1.3900 . ?
C1A_2 C2A_2 1.3900 . ?
C1A_2 H1A_2 0.9300 . ?
C2A_2 C3A_2 1.3900 . ?
C2A_2 H2A_2 0.9300 . ?
C3A_2 C4A_2 1.3900 . ?
C3A_2 H3A_2 0.9300 . ?
C4A_2 C5A_2 1.3900 . ?
C4A_2 H4A_2 0.9300 . ?
C5A_2 C6A_2 1.395(5) . ?
N2A_2 C6A_2 1.3900 . ?
N2A_2 C10A_2 1.3900 . ?
C6A_2 C7A_2 1.3900 . ?
C7A_2 C8A_2 1.3900 . ?
C7A_2 H7A_2 0.9300 . ?
C8A_2 C9A_2 1.3900 . ?
C8A_2 H8A_2 0.9300 . ?
C9A_2 C10A_2 1.3900 . ?
C9A_2 H9A_2 0.9300 . ?
C10A_2 C11A_2 1.385(5) . ?
C11A_2 C12A_2 1.3900 . ?
C11A_2 N3A_2 1.3900 . ?
C12A_2 C13A_2 1.3900 . ?
C12A_2 H12A_2 0.9300 . ?
C13A_2 C14A_2 1.3900 . ?
C13A_2 H13A_2 0.9300 . ?
C14A_2 C15A_2 1.3900 . ?
C14A_2 H14A_2 0.9300 . ?
C15A_2 N3A_2 1.3900 . ?
C15A_2 H15A_2 0.9300 . ?
C16A_2 C17A_2 1.255(7) . ?
C17A_2 C18A_2 1.686(9) . ?
C18A_2 N4A_2 1.468(7) . ?
C18A_2 H18A_2 0.9700 . ?
C18A_2 H18B_2 0.9700 . ?
N4A_2 C20A_2 1.470(8) . ?
N4A_2 C19A_2 1.471(8) . ?
N4A_2 C21A_2 1.474(8) . ?
C19A_2 H19A_2 0.9600 . ?
C19A_2 H19B_2 0.9600 . ?
C19A_2 H19C_2 0.9600 . ?
C20A_2 H20A_2 0.9600 . ?
C20A_2 H20B_2 0.9600 . ?
C20A_2 H20C_2 0.9600 . ?
C21A_2 H21A_2 0.9600 . ?
C21A_2 H21B_2 0.9600 . ?
C21A_2 H21C_2 0.9600 . ?
Pt2B_2 N2B_2 1.942(4) . ?
Pt2B_2 N3B_2 1.940(5) . ?
Pt2B_2 C16B_2 1.989(6) . ?
Pt2B_2 N1B_2 2.037(4) . ?
N1B_2 C1B_2 1.3900 . ?
N1B_2 C5B_2 1.3900 . ?
C1B_2 C2B_2 1.3900 . ?
C1B_2 H1B_2 0.9300 . ?
C2B_2 C3B_2 1.3900 . ?
C2B_2 H2B_2 0.9300 . ?
C3B_2 C4B_2 1.3900 . ?
C3B_2 H3B_2 0.9300 . ?
C4B_2 C5B_2 1.3900 . ?
C4B_2 H4B_2 0.9300 . ?
C5B_2 C6B_2 1.362(6) . ?
N2B_2 C6B_2 1.3900 . ?
N2B_2 C10B_2 1.3900 . ?
C6B_2 C7B_2 1.3900 . ?
C7B_2 C8B_2 1.3900 . ?
C7B_2 H7B_2 0.9300 . ?
C8B_2 C9B_2 1.3900 . ?
C8B_2 H8B_2 0.9300 . ?
C9B_2 C10B_2 1.3900 . ?
C9B_2 H9B_2 0.9300 . ?
C10B_2 C11B_2 1.399(6) . ?
C11B_2 C12B_2 1.3900 . ?
C11B_2 N3B_2 1.3900 . ?
C12B_2 C13B_2 1.3900 . ?
C12B_2 H12B_2 0.9300 . ?
C13B_2 C14B_2 1.3900 . ?
C13B_2 H13B_2 0.9300 . ?
C14B_2 C15B_2 1.3900 . ?
C14B_2 H14B_2 0.9300 . ?
C15B_2 N3B_2 1.3900 . ?
C15B_2 H15B_2 0.9300 . ?
C16B_2 C17B_2 1.267(7) . ?
C17B_2 C18B_2 1.660(9) . ?
C18B_2 N4B_2 1.475(8) . ?
C18B_2 H18C_2 0.9700 . ?
C18B_2 H18D_2 0.9700 . ?
N4B_2 C19B_2 1.458(8) . ?
N4B_2 C21B_2 1.458(7) . ?
N4B_2 C20B_2 1.455(8) . ?
C19B_2 H19D_2 0.9600 . ?
C19B_2 H19E_2 0.9600 . ?
C19B_2 H19F_2 0.9600 . ?
C20B_2 H20D_2 0.9600 . ?
C20B_2 H20E_2 0.9600 . ?
C20B_2 H20F_2 0.9600 . ?
C21B_2 H21D_2 0.9600 . ?
C21B_2 H21E_2 0.9600 . ?
C21B_2 H21F_2 0.9600 . ?
Pt2C_2 N2C_2 1.888(4) . ?
Pt2C_2 N3C_2 1.913(6) . ?
Pt2C_2 N1C_2 1.978(4) . ?
Pt2C_2 C16C_2 2.060(6) . ?
N1C_2 C1C_2 1.3900 . ?
N1C_2 C5C_2 1.3900 . ?
C1C_2 C2C_2 1.3900 . ?
C1C_2 H1C_2 0.9300 . ?
C2C_2 C3C_2 1.3900 . ?
C2C_2 H2C_2 0.9300 . ?
C3C_2 C4C_2 1.3900 . ?
C3C_2 H3C_2 0.9300 . ?
C4C_2 C5C_2 1.3900 . ?
C4C_2 H4C_2 0.9300 . ?
C5C_2 C6C_2 1.418(8) . ?
N2C_2 C6C_2 1.3900 . ?
N2C_2 C10C_2 1.3900 . ?
C6C_2 C7C_2 1.3900 . ?
C7C_2 C8C_2 1.3900 . ?
C7C_2 H7C_2 0.9300 . ?
C8C_2 C9C_2 1.3900 . ?
C8C_2 H8C_2 0.9300 . ?
C9C_2 C10C_2 1.3900 . ?
C9C_2 H9C_2 0.9300 . ?
C10C_2 C11C_2 1.409(7) . ?
C11C_2 C12C_2 1.3900 . ?
C11C_2 N3C_2 1.3900 . ?
C12C_2 C13C_2 1.3900 . ?
C12C_2 H12C_2 0.9300 . ?
C13C_2 C14C_2 1.3900 . ?
C13C_2 H13C_2 0.9300 . ?
C14C_2 C15C_2 1.3900 . ?
C14C_2 H14C_2 0.9300 . ?
C15C_2 N3C_2 1.3900 . ?
C15C_2 H15C_2 0.9300 . ?
C16C_2 C17C_2 1.274(8) . ?
C17C_2 C18C_2 1.666(10) . ?
C18C_2 N4C_2 1.461(7) . ?
C18C_2 H18E_2 0.9700 . ?
C18C_2 H18F_2 0.9700 . ?
N4C_2 C21C_2 1.465(8) . ?
N4C_2 C20C_2 1.469(8) . ?
N4C_2 C19C_2 1.480(8) . ?
C19C_2 H19G_2 0.9600 . ?
C19C_2 H19H_2 0.9600 . ?
C19C_2 H19I_2 0.9600 . ?
C20C_2 O2_4 1.505(10) 2_567 ?
C20C_2 H20G_2 0.9600 . ?
C20C_2 H20H_2 0.9600 . ?
C20C_2 H20I_2 0.9600 . ?
C21C_2 H21G_2 0.9600 . ?
C21C_2 H21H_2 0.9600 . ?
C21C_2 H21I_2 0.9600 . ?
C1_4 N3_4 1.450(3) . ?
C1_4 N18_4 1.458(3) 2_567 ?
C1_4 H1A_4 0.9700 . ?
C1_4 H1B_4 0.9700 . ?
N1_4 C5_4 1.385(3) . ?
N1_4 C2_4 1.441(3) . ?
N1_4 C27_4 1.445(3) 2_567 ?
O1_4 C26_4 1.221(3) . ?
C2_4 N3_4 1.458(3) . ?
C2_4 C3_4 1.552(3) . ?
C2_4 H2_4 0.9800 . ?
N2_4 C5_4 1.371(3) . ?
N2_4 C6_4 1.445(3) . ?
N2_4 C3_4 1.446(3) . ?
O2_4 C29_4 1.210(3) . ?
C3_4 N4_4 1.445(3) . ?
C3_4 H3_4 0.9800 . ?
N3_4 C4_4 1.384(3) . ?
O3_4 C28_4 1.218(2) . ?
C4_4 O9_4 1.214(3) . ?
C4_4 N4_4 1.361(3) . ?
N4_4 C8_4 1.440(3) . ?
O4_4 C21_4 1.220(3) . ?
C5_4 O10_4 1.219(3) . ?
N5_4 C12_4 1.381(3) . ?
N5_4 C6_4 1.444(3) . ?
N5_4 C7_4 1.447(3) . ?
O5_4 C17_4 1.219(3) . ?
C6_4 H6A_4 0.9700 . ?
C6_4 H6B_4 0.9700 . ?
N6_4 C9_4 1.369(3) . ?
N6_4 C7_4 1.439(3) . ?
N6_4 C8_4 1.446(3) . ?
O6_4 C15_4 1.220(3) . ?
C7_4 C11_4 1.561(3) . ?
C7_4 H7_4 0.9800 . ?
N7_4 C12_4 1.358(3) . ?
N7_4 C11_4 1.436(3) . ?
N7_4 C13_4 1.446(3) . ?
O7_4 C12_4 1.215(3) . ?
C8_4 H8A_4 0.9700 . ?
C8_4 H8B_4 0.9700 . ?
N8_4 C9_4 1.383(3) . ?
N8_4 C10_4 1.437(3) . ?
N8_4 C11_4 1.441(3) . ?
O8_4 C9_4 1.204(3) . ?
N9_4 C15_4 1.368(3) . ?
N9_4 C14_4 1.441(3) . ?
N9_4 C10_4 1.447(3) . ?
C11_4 H11_4 0.9800 . ?
N11_4 C17_4 1.373(3) . ?
N11_4 C16_4 1.438(3) . ?
N11_4 C20_4 1.452(3) . ?
C10_4 H10A_4 0.9700 . ?
C10_4 H10B_4 0.9700 . ?
N10_4 C17_4 1.376(3) . ?
N10_4 C14_4 1.432(3) . ?
N10_4 C13_4 1.443(3) . ?
N12_4 C15_4 1.365(3) . ?
N12_4 C18_4 1.441(3) . ?
N12_4 C16_4 1.448(3) . ?
C13_4 H13A_4 0.9700 . ?
C13_4 H13B_4 0.9700 . ?
N13_4 C28_4 1.373(2) . ?
N13_4 C19_4 1.431(3) . ?
N13_4 C20_4 1.440(3) . ?
C14_4 C16_4 1.559(3) . ?
C14_4 H14_4 0.9800 . ?
N14_4 C21_4 1.379(3) . ?
N14_4 C18_4 1.452(3) . ?
N14_4 C19_4 1.453(3) . ?
N15_4 C28_4 1.377(3) . ?
N15_4 C23_4 1.446(3) . ?
N15_4 C30_4 1.455(2) . ?
C16_4 H16_4 0.9800 . ?
N16_4 C21_4 1.365(3) . ?
N16_4 C30_4 1.444(3) . ?
N16_4 C22_4 1.449(3) . ?
N17_4 C26_4 1.376(3) . ?
N17_4 C23_4 1.443(3) . ?
N17_4 C24_4 1.448(3) . ?
C18_4 H18A_4 0.9700 . ?
C18_4 H18B_4 0.9700 . ?
N18_4 C26_4 1.376(3) . ?
N18_4 C25_4 1.451(3) . ?
C19_4 C30_4 1.557(3) . ?
C19_4 H19_4 0.9800 . ?
N19_4 C29_4 1.373(3) . ?
N19_4 C25_4 1.451(3) . ?
N19_4 C27_4 1.451(3) . ?
C20_4 H20A_4 0.9700 . ?
C20_4 H20B_4 0.9700 . ?
N20_4 C29_4 1.385(3) . ?
N20_4 C22_4 1.445(2) . ?
N20_4 C24_4 1.447(3) . ?
C22_4 H22A_4 0.9700 . ?
C22_4 H22B_4 0.9700 . ?
C23_4 H23A_4 0.9700 . ?
C23_4 H23B_4 0.9700 . ?
C24_4 C25_4 1.540(3) . ?
C24_4 H24_4 0.9800 . ?
C27_4 H27A_4 0.9700 . ?
C27_4 H27B_4 0.9700 . ?
C30_4 H30_4 0.9800 . ?
C25_4 H25_4 0.9800 . ?
C1_5 N19_5 1.447(3) 2_776 ?
C1_5 N1_5 1.454(3) . ?
C1_5 H1A_5 0.9700 . ?
C1_5 H1B_5 0.9700 . ?
N1_5 C5_5 1.364(3) . ?
N1_5 C2_5 1.461(3) . ?
O1_5 C29_5 1.210(3) . ?
C2_5 N3_5 1.433(3) . ?
C2_5 C3_5 1.547(3) . ?
C2_5 H2_5 0.9800 . ?
N2_5 C5_5 1.376(3) . ?
N2_5 C3_5 1.444(3) . ?
N2_5 C6_5 1.444(3) . ?
O2_5 C27_5 1.220(3) . ?
C3_5 N4_5 1.453(3) . ?
C3_5 H3_5 0.9800 . ?
N3_5 C4_5 1.369(3) . ?
N3_5 C28_5 1.446(3) 2_776 ?
O3_5 C23_5 1.216(3) . ?
C4_5 O9_5 1.221(3) . ?
C4_5 N4_5 1.384(3) . ?
N4_5 C7_5 1.448(3) . ?
O4_5 C20_5 1.209(4) . ?
C5_5 O10_5 1.214(3) . ?
N5_5 C11_5 1.385(3) . ?
N5_5 C7_5 1.448(2) . ?
N5_5 C8_5 1.450(3) . ?
O5_5 C17_5 1.219(4) . ?
C6_5 N6_5 1.449(3) . ?
C6_5 H6A_5 0.9700 . ?
C6_5 H6B_5 0.9700 . ?
N6_5 C10_5 1.376(3) . ?
N6_5 C8_5 1.441(3) . ?
O6_5 C16_5 1.224(3) . ?
C7_5 H7A_5 0.9700 . ?
C7_5 H7B_5 0.9700 . ?
N7_5 C11_5 1.387(2) . ?
N7_5 C9_5 1.441(3) . ?
N7_5 C12_5 1.447(2) . ?
O7_5 C11_5 1.213(3) . ?
C8_5 C9_5 1.549(3) . ?
C8_5 H8_5 0.9800 . ?
N8_5 C10_5 1.374(3) . ?
N8_5 C9_5 1.448(2) . ?
N8_5 C13_5 1.459(3) . ?
O8_5 C10_5 1.224(3) . ?
C9_5 H9_5 0.9800 . ?
N9_5 C16_5 1.376(3) . ?
N9_5 C12_5 1.441(2) . ?
N9_5 C14_5 1.454(3) . ?
N10_5 C17_5 1.365(3) . ?
N10_5 C14_5 1.445(3) . ?
N10_5 C13_5 1.451(3) . ?
N11_5 C16_5 1.358(3) . ?
N11_5 C15_5 1.441(3) . ?
N11_5 C18_5 1.456(3) . ?
C12_5 H12A_5 0.9700 . ?
C12_5 H12B_5 0.9700 . ?
N12_5 C17_5 1.377(3) . ?
N12_5 C19_5 1.450(3) . ?
N12_5 C15_5 1.450(3) . ?
C13_5 H13A_5 0.9700 . ?
C13_5 H13B_5 0.9700 . ?
N13_5 C23_5 1.368(3) . ?
N13_5 C21_5 1.435(3) . ?
N13_5 C18_5 1.443(3) . ?
C14_5 C15_5 1.544(3) . ?
C14_5 H14_5 0.9800 . ?
N14_5 C20_5 1.371(4) . ?
N14_5 C19_5 1.455(4) . ?
N14_5 C21_5 1.458(3) . ?
C15_5 H15_5 0.9800 . ?
N15_5 C23_5 1.375(3) . ?
N15_5 C24_5 1.448(3) . ?
N15_5 C22_5 1.456(3) . ?
N16_5 C20_5 1.353(4) . ?
N16_5 C22_5 1.430(3) . ?
N16_5 C30_5 1.441(3) . ?
N17_5 C27_5 1.362(3) . ?
N17_5 C25_5 1.443(3) . ?
N17_5 C24_5 1.448(3) . ?
C18_5 H18A_5 0.9700 . ?
C18_5 H18B_5 0.9700 . ?
N18_5 C29_5 1.372(3) . ?
N18_5 C25_5 1.441(4) . ?
N18_5 C30_5 1.452(3) . ?
C19_5 H19A_5 0.9700 . ?
C19_5 H19B_5 0.9700 . ?
N19_5 C27_5 1.369(3) . ?
N19_5 C26_5 1.439(3) . ?
N20_5 C29_5 1.366(3) . ?
N20_5 C26_5 1.444(3) . ?
N20_5 C28_5 1.447(3) . ?
C21_5 C22_5 1.545(3) . ?
C21_5 H21_5 0.9800 . ?
C22_5 H22_5 0.9800 . ?
C24_5 H24A_5 0.9700 . ?
C24_5 H24B_5 0.9700 . ?
C25_5 C26_5 1.565(3) . ?
C25_5 H25_5 0.9800 . ?
C26_5 H26_5 0.9800 . ?
C28_5 H28A_5 0.9700 . ?
C28_5 H28B_5 0.9700 . ?
C30_5 H30A_5 0.9700 . ?
C30_5 H30B_5 0.9700 . ?
S1_6 O5_6 1.416(2) . ?
S1_6 O4_6 1.4333(19) . ?
S1_6 O6_6 1.433(2) . ?
S1_6 C3_6 1.819(2) . ?
C1_6 F3_6 1.208(4) . ?
C1_6 F1_6 1.262(3) . ?
C1_6 F2_6 1.299(4) . ?
C1_6 S2_6 1.798(3) . ?
O1_6 S2_6 1.404(3) . ?
S2_6 O2_6 1.377(4) . ?
S2_6 O3_6 1.379(3) . ?
C2_6 F7_6 1.312(3) . ?
C2_6 F9_6 1.313(3) . ?
C2_6 F8_6 1.324(3) . ?
C2_6 S3_6 1.821(2) . ?
S3_6 O8_6 1.430(2) . ?
S3_6 O9_6 1.433(2) . ?
S3_6 O7_6 1.4369(19) . ?
C3_6 F5_6 1.306(3) . ?
C3_6 F4_6 1.335(3) . ?
C3_6 F6_6 1.341(3) . ?

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
C16_1 Pt1_1 N3_1 102.74(17) . . ?
C16_1 Pt1_1 N1_1 100.24(16) . . ?
N3_1 Pt1_1 N1_1 157.02(12) . . ?
C16_1 Pt1_1 N2_1 176.59(13) . . ?
N3_1 Pt1_1 N2_1 78.69(11) . . ?
N1_1 Pt1_1 N2_1 78.34(9) . . ?
C5_1 N1_1 C1_1 118.6(3) . . ?
C5_1 N1_1 Pt1_1 116.03(19) . . ?
C1_1 N1_1 Pt1_1 125.3(2) . . ?
N1_1 C1_1 C2_1 122.1(3) . . ?
N1_1 C1_1 H1_1 119.0 . . ?
C2_1 C1_1 H1_1 119.0 . . ?
C3_1 C2_1 C1_1 119.0(3) . . ?
C3_1 C2_1 H2_1 120.5 . . ?
C1_1 C2_1 H2_1 120.5 . . ?
C2_1 C3_1 C4_1 120.5(3) . . ?
C2_1 C3_1 H3_1 119.8 . . ?
C4_1 C3_1 H3_1 119.8 . . ?
C3_1 C4_1 C5_1 119.3(3) . . ?
C3_1 C4_1 H4_1 120.3 . . ?
C5_1 C4_1 H4_1 120.3 . . ?
N1_1 C5_1 C4_1 120.3(3) . . ?
N1_1 C5_1 C6_1 115.4(3) . . ?
C4_1 C5_1 C6_1 124.3(3) . . ?
C10_1 N2_1 C6_1 123.8(3) . . ?
C10_1 N2_1 Pt1_1 118.86(18) . . ?
C6_1 N2_1 Pt1_1 116.71(18) . . ?
N2_1 C6_1 C7_1 118.1(3) . . ?
N2_1 C6_1 C5_1 113.2(3) . . ?
C7_1 C6_1 C5_1 128.6(3) . . ?
C8_1 C7_1 C6_1 118.4(3) . . ?
C8_1 C7_1 H7_1 120.8 . . ?
C6_1 C7_1 H7_1 120.8 . . ?
C7_1 C8_1 C9_1 122.6(4) . . ?
C7_1 C8_1 H8_1 118.7 . . ?
C9_1 C8_1 H8_1 118.7 . . ?
C8_1 C9_1 C10_1 117.5(3) . . ?
C8_1 C9_1 H9_1 121.3 . . ?
C10_1 C9_1 H9_1 121.3 . . ?
N2_1 C10_1 C11_1 110.6(3) . . ?
N2_1 C10_1 C9_1 119.3(3) . . ?
C11_1 C10_1 C9_1 130.1(3) . . ?
N3_1 C11_1 C10_1 119.0(3) . . ?
N3_1 C11_1 C12_1 119.4(3) . . ?
C10_1 C11_1 C12_1 121.6(3) . . ?
C13_1 C12_1 C11_1 118.6(4) . . ?
C13_1 C12_1 H12_1 120.7 . . ?
C11_1 C12_1 H12_1 120.7 . . ?
C14_1 C13_1 C12_1 120.9(4) . . ?
C14_1 C13_1 H13_1 119.5 . . ?
C12_1 C13_1 H13_1 119.5 . . ?
C13_1 C14_1 C15_1 119.1(4) . . ?
C13_1 C14_1 H14_1 120.4 . . ?
C15_1 C14_1 H14_1 120.4 . . ?
N3_1 C15_1 C14_1 120.7(4) . . ?
N3_1 C15_1 H15_1 119.6 . . ?
C14_1 C15_1 H15_1 119.6 . . ?
C15_1 N3_1 C11_1 121.2(3) . . ?
C15_1 N3_1 Pt1_1 126.1(3) . . ?
C11_1 N3_1 Pt1_1 112.7(2) . . ?
C17_1 C16_1 Pt1_1 174.6(5) . . ?
C16_1 C17_1 C18_1 154.8(6) . . ?
N4_1 C18_1 C17_1 105.7(4) . . ?
N4_1 C18_1 H18A_1 110.6 . . ?
C17_1 C18_1 H18A_1 110.6 . . ?
N4_1 C18_1 H18B_1 110.6 . . ?
C17_1 C18_1 H18B_1 110.6 . . ?
H18A_1 C18_1 H18B_1 108.7 . . ?
C21_1 N4_1 C18_1 112.4(4) . . ?
C21_1 N4_1 C19_1 111.4(5) . . ?
C18_1 N4_1 C19_1 108.3(4) . . ?
C21_1 N4_1 C20_1 111.7(4) . . ?
C18_1 N4_1 C20_1 104.7(4) . . ?
C19_1 N4_1 C20_1 108.0(4) . . ?
N4_1 C19_1 H19A_1 109.5 . . ?
N4_1 C19_1 H19B_1 109.5 . . ?
H19A_1 C19_1 H19B_1 109.5 . . ?
N4_1 C19_1 H19C_1 109.5 . . ?
H19A_1 C19_1 H19C_1 109.5 . . ?
H19B_1 C19_1 H19C_1 109.5 . . ?
N4_1 C20_1 H20A_1 109.5 . . ?
N4_1 C20_1 H20B_1 109.5 . . ?
H20A_1 C20_1 H20B_1 109.5 . . ?
N4_1 C20_1 H20C_1 109.5 . . ?
H20A_1 C20_1 H20C_1 109.5 . . ?
H20B_1 C20_1 H20C_1 109.5 . . ?
N4_1 C21_1 H21A_1 109.5 . . ?
N4_1 C21_1 H21B_1 109.5 . . ?
H21A_1 C21_1 H21B_1 109.5 . . ?
N4_1 C21_1 H21C_1 109.5 . . ?
H21A_1 C21_1 H21C_1 109.5 . . ?
H21B_1 C21_1 H21C_1 109.5 . . ?
N3A_2 Pt2A_2 N2A_2 83.51(13) . . ?
N3A_2 Pt2A_2 N1A_2 162.96(14) . . ?
N2A_2 Pt2A_2 N1A_2 79.49(13) . . ?
N3A_2 Pt2A_2 C16A_2 98.6(2) . . ?
N2A_2 Pt2A_2 C16A_2 177.8(2) . . ?
N1A_2 Pt2A_2 C16A_2 98.4(2) . . ?
C1A_2 N1A_2 C5A_2 120.0 . . ?
C1A_2 N1A_2 Pt2A_2 127.56(16) . . ?
C5A_2 N1A_2 Pt2A_2 112.40(16) . . ?
N1A_2 C1A_2 C2A_2 120.0 . . ?
N1A_2 C1A_2 H1A_2 120.0 . . ?
C2A_2 C1A_2 H1A_2 120.0 . . ?
C3A_2 C2A_2 C1A_2 120.0 . . ?
C3A_2 C2A_2 H2A_2 120.0 . . ?
C1A_2 C2A_2 H2A_2 120.0 . . ?
C4A_2 C3A_2 C2A_2 120.0 . . ?
C4A_2 C3A_2 H3A_2 120.0 . . ?
C2A_2 C3A_2 H3A_2 120.0 . . ?
C3A_2 C4A_2 C5A_2 120.0 . . ?
C3A_2 C4A_2 H4A_2 120.0 . . ?
C5A_2 C4A_2 H4A_2 120.0 . . ?
C4A_2 C5A_2 N1A_2 120.0 . . ?
C4A_2 C5A_2 C6A_2 122.0(3) . . ?
N1A_2 C5A_2 C6A_2 117.9(3) . . ?
C6A_2 N2A_2 C10A_2 120.0 . . ?
C6A_2 N2A_2 Pt2A_2 119.93(15) . . ?
C10A_2 N2A_2 Pt2A_2 119.79(15) . . ?
N2A_2 C6A_2 C7A_2 120.0 . . ?
N2A_2 C6A_2 C5A_2 110.0(3) . . ?
C7A_2 C6A_2 C5A_2 129.5(3) . . ?
C8A_2 C7A_2 C6A_2 120.0 . . ?
C8A_2 C7A_2 H7A_2 120.0 . . ?
C6A_2 C7A_2 H7A_2 120.0 . . ?
C9A_2 C8A_2 C7A_2 120.0 . . ?
C9A_2 C8A_2 H8A_2 120.0 . . ?
C7A_2 C8A_2 H8A_2 120.0 . . ?
C8A_2 C9A_2 C10A_2 120.0 . . ?
C8A_2 C9A_2 H9A_2 120.0 . . ?
C10A_2 C9A_2 H9A_2 120.0 . . ?
C11A_2 C10A_2 C9A_2 140.3(2) . . ?
C11A_2 C10A_2 N2A_2 99.7(2) . . ?
C9A_2 C10A_2 N2A_2 120.0 . . ?
C10A_2 C11A_2 C12A_2 112.6(2) . . ?
C10A_2 C11A_2 N3A_2 127.4(2) . . ?
C12A_2 C11A_2 N3A_2 120.0 . . ?
C13A_2 C12A_2 C11A_2 120.0 . . ?
C13A_2 C12A_2 H12A_2 120.0 . . ?
C11A_2 C12A_2 H12A_2 120.0 . . ?
C12A_2 C13A_2 C14A_2 120.0 . . ?
C12A_2 C13A_2 H13A_2 120.0 . . ?
C14A_2 C13A_2 H13A_2 120.0 . . ?
C15A_2 C14A_2 C13A_2 120.0 . . ?
C15A_2 C14A_2 H14A_2 120.0 . . ?
C13A_2 C14A_2 H14A_2 120.0 . . ?
C14A_2 C15A_2 N3A_2 120.0 . . ?
C14A_2 C15A_2 H15A_2 120.0 . . ?
N3A_2 C15A_2 H15A_2 120.0 . . ?
C15A_2 N3A_2 C11A_2 120.0 . . ?
C15A_2 N3A_2 Pt2A_2 130.51(17) . . ?
C11A_2 N3A_2 Pt2A_2 109.35(17) . . ?
C17A_2 C16A_2 Pt2A_2 170.2(7) . . ?
C16A_2 C17A_2 C18A_2 152.0(9) . . ?
N4A_2 C18A_2 C17A_2 96.1(5) . . ?
N4A_2 C18A_2 H18A_2 112.5 . . ?
C17A_2 C18A_2 H18A_2 112.5 . . ?
N4A_2 C18A_2 H18B_2 112.5 . . ?
C17A_2 C18A_2 H18B_2 112.5 . . ?
H18A_2 C18A_2 H18B_2 110.1 . . ?
C18A_2 N4A_2 C20A_2 100.4(6) . . ?
C18A_2 N4A_2 C19A_2 108.1(7) . . ?
C20A_2 N4A_2 C19A_2 115.5(6) . . ?
C18A_2 N4A_2 C21A_2 108.0(6) . . ?
C20A_2 N4A_2 C21A_2 117.4(7) . . ?
C19A_2 N4A_2 C21A_2 106.7(7) . . ?
N4A_2 C19A_2 H19A_2 109.5 . . ?
N4A_2 C19A_2 H19B_2 109.5 . . ?
H19A_2 C19A_2 H19B_2 109.5 . . ?
N4A_2 C19A_2 H19C_2 109.5 . . ?
H19A_2 C19A_2 H19C_2 109.5 . . ?
H19B_2 C19A_2 H19C_2 109.5 . . ?
N4A_2 C20A_2 H20A_2 109.5 . . ?
N4A_2 C20A_2 H20B_2 109.5 . . ?
H20A_2 C20A_2 H20B_2 109.5 . . ?
N4A_2 C20A_2 H20C_2 109.5 . . ?
H20A_2 C20A_2 H20C_2 109.5 . . ?
H20B_2 C20A_2 H20C_2 109.5 . . ?
N4A_2 C21A_2 H21A_2 109.5 . . ?
N4A_2 C21A_2 H21B_2 109.5 . . ?
H21A_2 C21A_2 H21B_2 109.5 . . ?
N4A_2 C21A_2 H21C_2 109.5 . . ?
H21A_2 C21A_2 H21C_2 109.5 . . ?
H21B_2 C21A_2 H21C_2 109.5 . . ?
N2B_2 Pt2B_2 N3B_2 82.31(17) . . ?
N2B_2 Pt2B_2 C16B_2 174.1(4) . . ?
N3B_2 Pt2B_2 C16B_2 99.7(3) . . ?
N2B_2 Pt2B_2 N1B_2 76.84(16) . . ?
N3B_2 Pt2B_2 N1B_2 159.07(18) . . ?
C16B_2 Pt2B_2 N1B_2 101.2(3) . . ?
C1B_2 N1B_2 C5B_2 120.0 . . ?
C1B_2 N1B_2 Pt2B_2 126.5(2) . . ?
C5B_2 N1B_2 Pt2B_2 113.4(2) . . ?
N1B_2 C1B_2 C2B_2 120.0 . . ?
N1B_2 C1B_2 H1B_2 120.0 . . ?
C2B_2 C1B_2 H1B_2 120.0 . . ?
C3B_2 C2B_2 C1B_2 120.0 . . ?
C3B_2 C2B_2 H2B_2 120.0 . . ?
C1B_2 C2B_2 H2B_2 120.0 . . ?
C4B_2 C3B_2 C2B_2 120.0 . . ?
C4B_2 C3B_2 H3B_2 120.0 . . ?
C2B_2 C3B_2 H3B_2 120.0 . . ?
C3B_2 C4B_2 C5B_2 120.0 . . ?
C3B_2 C4B_2 H4B_2 120.0 . . ?
C5B_2 C4B_2 H4B_2 120.0 . . ?
C6B_2 C5B_2 C4B_2 122.5(3) . . ?
C6B_2 C5B_2 N1B_2 117.2(3) . . ?
C4B_2 C5B_2 N1B_2 120.0 . . ?
C6B_2 N2B_2 C10B_2 120.0 . . ?
C6B_2 N2B_2 Pt2B_2 120.61(19) . . ?
C10B_2 N2B_2 Pt2B_2 118.11(19) . . ?
C5B_2 C6B_2 C7B_2 130.9(3) . . ?
C5B_2 C6B_2 N2B_2 108.6(3) . . ?
C7B_2 C6B_2 N2B_2 120.0 . . ?
C8B_2 C7B_2 C6B_2 120.0 . . ?
C8B_2 C7B_2 H7B_2 120.0 . . ?
C6B_2 C7B_2 H7B_2 120.0 . . ?
C9B_2 C8B_2 C7B_2 120.0 . . ?
C9B_2 C8B_2 H8B_2 120.0 . . ?
C7B_2 C8B_2 H8B_2 120.0 . . ?
C10B_2 C9B_2 C8B_2 120.0 . . ?
C10B_2 C9B_2 H9B_2 120.0 . . ?
C8B_2 C9B_2 H9B_2 120.0 . . ?
C9B_2 C10B_2 N2B_2 120.0 . . ?
C9B_2 C10B_2 C11B_2 129.8(3) . . ?
N2B_2 C10B_2 C11B_2 107.2(3) . . ?
C12B_2 C11B_2 N3B_2 120.0 . . ?
C12B_2 C11B_2 C10B_2 117.6(3) . . ?
N3B_2 C11B_2 C10B_2 122.0(3) . . ?
C11B_2 C12B_2 C13B_2 120.0 . . ?
C11B_2 C12B_2 H12B_2 120.0 . . ?
C13B_2 C12B_2 H12B_2 120.0 . . ?
C14B_2 C13B_2 C12B_2 120.0 . . ?
C14B_2 C13B_2 H13B_2 120.0 . . ?
C12B_2 C13B_2 H13B_2 120.0 . . ?
C15B_2 C14B_2 C13B_2 120.0 . . ?
C15B_2 C14B_2 H14B_2 120.0 . . ?
C13B_2 C14B_2 H14B_2 120.0 . . ?
C14B_2 C15B_2 N3B_2 120.0 . . ?
C14B_2 C15B_2 H15B_2 120.0 . . ?
N3B_2 C15B_2 H15B_2 120.0 . . ?
C15B_2 N3B_2 C11B_2 120.0 . . ?
C15B_2 N3B_2 Pt2B_2 129.9(2) . . ?
C11B_2 N3B_2 Pt2B_2 110.1(2) . . ?
C17B_2 C16B_2 Pt2B_2 153.3(9) . . ?
C16B_2 C17B_2 C18B_2 138.8(8) . . ?
N4B_2 C18B_2 C17B_2 101.4(5) . . ?
N4B_2 C18B_2 H18C_2 111.5 . . ?
C17B_2 C18B_2 H18C_2 111.5 . . ?
N4B_2 C18B_2 H18D_2 111.5 . . ?
C17B_2 C18B_2 H18D_2 111.5 . . ?
H18C_2 C18B_2 H18D_2 109.3 . . ?
C19B_2 N4B_2 C21B_2 107.4(9) . . ?
C19B_2 N4B_2 C20B_2 113.1(8) . . ?
C21B_2 N4B_2 C20B_2 117.1(8) . . ?
C19B_2 N4B_2 C18B_2 105.9(6) . . ?
C21B_2 N4B_2 C18B_2 108.1(7) . . ?
C20B_2 N4B_2 C18B_2 104.5(7) . . ?
N4B_2 C19B_2 H19D_2 109.5 . . ?
N4B_2 C19B_2 H19E_2 109.4 . . ?
H19D_2 C19B_2 H19E_2 109.5 . . ?
N4B_2 C19B_2 H19F_2 109.5 . . ?
H19D_2 C19B_2 H19F_2 109.5 . . ?
H19E_2 C19B_2 H19F_2 109.5 . . ?
N4B_2 C20B_2 H20D_2 109.5 . . ?
N4B_2 C20B_2 H20E_2 109.5 . . ?
H20D_2 C20B_2 H20E_2 109.5 . . ?
N4B_2 C20B_2 H20F_2 109.4 . . ?
H20D_2 C20B_2 H20F_2 109.5 . . ?
H20E_2 C20B_2 H20F_2 109.5 . . ?
N4B_2 C21B_2 H21D_2 109.4 . . ?
N4B_2 C21B_2 H21E_2 109.5 . . ?
H21D_2 C21B_2 H21E_2 109.5 . . ?
N4B_2 C21B_2 H21F_2 109.5 . . ?
H21D_2 C21B_2 H21F_2 109.5 . . ?
H21E_2 C21B_2 H21F_2 109.5 . . ?
N2C_2 Pt2C_2 N3C_2 80.5(2) . . ?
N2C_2 Pt2C_2 N1C_2 81.4(2) . . ?
N3C_2 Pt2C_2 N1C_2 161.9(2) . . ?
N2C_2 Pt2C_2 C16C_2 165.1(5) . . ?
N3C_2 Pt2C_2 C16C_2 95.1(3) . . ?
N1C_2 Pt2C_2 C16C_2 102.5(3) . . ?
C1C_2 N1C_2 C5C_2 120.0 . . ?
C1C_2 N1C_2 Pt2C_2 127.0(2) . . ?
C5C_2 N1C_2 Pt2C_2 113.0(2) . . ?
N1C_2 C1C_2 C2C_2 120.0 . . ?
N1C_2 C1C_2 H1C_2 120.0 . . ?
C2C_2 C1C_2 H1C_2 120.0 . . ?
C3C_2 C2C_2 C1C_2 120.0 . . ?
C3C_2 C2C_2 H2C_2 120.0 . . ?
C1C_2 C2C_2 H2C_2 120.0 . . ?
C2C_2 C3C_2 C4C_2 120.0 . . ?
C2C_2 C3C_2 H3C_2 120.0 . . ?
C4C_2 C3C_2 H3C_2 120.0 . . ?
C5C_2 C4C_2 C3C_2 120.0 . . ?
C5C_2 C4C_2 H4C_2 120.0 . . ?
C3C_2 C4C_2 H4C_2 120.0 . . ?
C4C_2 C5C_2 N1C_2 120.0 . . ?
C4C_2 C5C_2 C6C_2 124.5(4) . . ?
N1C_2 C5C_2 C6C_2 114.3(4) . . ?
C6C_2 N2C_2 C10C_2 120.0 . . ?
C6C_2 N2C_2 Pt2C_2 118.0(2) . . ?
C10C_2 N2C_2 Pt2C_2 121.4(2) . . ?
N2C_2 C6C_2 C7C_2 120.0 . . ?
N2C_2 C6C_2 C5C_2 111.4(4) . . ?
C7C_2 C6C_2 C5C_2 125.3(4) . . ?
C8C_2 C7C_2 C6C_2 120.0 . . ?
C8C_2 C7C_2 H7C_2 120.0 . . ?
C6C_2 C7C_2 H7C_2 120.0 . . ?
C7C_2 C8C_2 C9C_2 120.0 . . ?
C7C_2 C8C_2 H8C_2 120.0 . . ?
C9C_2 C8C_2 H8C_2 120.0 . . ?
C10C_2 C9C_2 C8C_2 120.0 . . ?
C10C_2 C9C_2 H9C_2 120.0 . . ?
C8C_2 C9C_2 H9C_2 120.0 . . ?
C9C_2 C10C_2 N2C_2 120.0 . . ?
C9C_2 C10C_2 C11C_2 135.1(4) . . ?
N2C_2 C10C_2 C11C_2 104.9(4) . . ?
C12C_2 C11C_2 N3C_2 120.0 . . ?
C12C_2 C11C_2 C10C_2 120.3(4) . . ?
N3C_2 C11C_2 C10C_2 119.6(4) . . ?
C13C_2 C12C_2 C11C_2 120.0 . . ?
C13C_2 C12C_2 H12C_2 120.0 . . ?
C11C_2 C12C_2 H12C_2 120.0 . . ?
C12C_2 C13C_2 C14C_2 120.0 . . ?
C12C_2 C13C_2 H13C_2 120.0 . . ?
C14C_2 C13C_2 H13C_2 120.0 . . ?
C13C_2 C14C_2 C15C_2 120.0 . . ?
C13C_2 C14C_2 H14C_2 120.0 . . ?
C15C_2 C14C_2 H14C_2 120.0 . . ?
N3C_2 C15C_2 C14C_2 120.0 . . ?
N3C_2 C15C_2 H15C_2 120.0 . . ?
C14C_2 C15C_2 H15C_2 120.0 . . ?
C15C_2 N3C_2 C11C_2 120.0 . . ?
C15C_2 N3C_2 Pt2C_2 127.6(3) . . ?
C11C_2 N3C_2 Pt2C_2 112.4(3) . . ?
C17C_2 C16C_2 Pt2C_2 170.9(9) . . ?
C16C_2 C17C_2 C18C_2 135.8(12) . . ?
N4C_2 C18C_2 C17C_2 106.2(6) . . ?
N4C_2 C18C_2 H18E_2 110.5 . . ?
C17C_2 C18C_2 H18E_2 110.5 . . ?
N4C_2 C18C_2 H18F_2 110.5 . . ?
C17C_2 C18C_2 H18F_2 110.5 . . ?
H18E_2 C18C_2 H18F_2 108.7 . . ?
C18C_2 N4C_2 C21C_2 110.6(9) . . ?
C18C_2 N4C_2 C20C_2 104.8(8) . . ?
C21C_2 N4C_2 C20C_2 115.0(6) . . ?
C18C_2 N4C_2 C19C_2 109.5(6) . . ?
C21C_2 N4C_2 C19C_2 105.2(9) . . ?
C20C_2 N4C_2 C19C_2 111.8(9) . . ?
N4C_2 C19C_2 H19G_2 109.5 . . ?
N4C_2 C19C_2 H19H_2 109.5 . . ?
H19G_2 C19C_2 H19H_2 109.5 . . ?
N4C_2 C19C_2 H19I_2 109.5 . . ?
H19G_2 C19C_2 H19I_2 109.5 . . ?
H19H_2 C19C_2 H19I_2 109.5 . . ?
N4C_2 C20C_2 H20G_2 109.5 . . ?
O2_4 C20C_2 H20G_2 38.3 2_567 . ?
N4C_2 C20C_2 H20H_2 109.5 . . ?
O2_4 C20C_2 H20H_2 71.2 2_567 . ?
H20G_2 C20C_2 H20H_2 109.5 . . ?
N4C_2 C20C_2 H20I_2 109.5 . . ?
O2_4 C20C_2 H20I_2 124.9 2_567 . ?
H20G_2 C20C_2 H20I_2 109.5 . . ?
H20H_2 C20C_2 H20I_2 109.5 . . ?
N4C_2 C21C_2 H21G_2 109.4 . . ?
N4C_2 C21C_2 H21H_2 109.5 . . ?
H21G_2 C21C_2 H21H_2 109.5 . . ?
N4C_2 C21C_2 H21I_2 109.5 . . ?
H21G_2 C21C_2 H21I_2 109.5 . . ?
H21H_2 C21C_2 H21I_2 109.5 . . ?
N3_4 C1_4 N18_4 112.08(19) . 2_567 ?
N3_4 C1_4 H1A_4 109.2 . . ?
N18_4 C1_4 H1A_4 109.2 2_567 . ?
N3_4 C1_4 H1B_4 109.2 . . ?
N18_4 C1_4 H1B_4 109.2 2_567 . ?
H1A_4 C1_4 H1B_4 107.9 . . ?
C5_4 N1_4 C2_4 111.52(17) . . ?
C5_4 N1_4 C27_4 120.44(19) . 2_567 ?
C2_4 N1_4 C27_4 120.28(18) . 2_567 ?
N1_4 C2_4 N3_4 113.96(19) . . ?
N1_4 C2_4 C3_4 103.82(17) . . ?
N3_4 C2_4 C3_4 103.30(17) . . ?
N1_4 C2_4 H2_4 111.7 . . ?
N3_4 C2_4 H2_4 111.7 . . ?
C3_4 C2_4 H2_4 111.7 . . ?
C5_4 N2_4 C6_4 120.9(2) . . ?
C5_4 N2_4 C3_4 111.62(17) . . ?
C6_4 N2_4 C3_4 120.15(19) . . ?
C29_4 O2_4 C20C_2 107.8(6) . 2_567 ?
N4_4 C3_4 N2_4 114.12(19) . . ?
N4_4 C3_4 C2_4 103.18(18) . . ?
N2_4 C3_4 C2_4 103.29(17) . . ?
N4_4 C3_4 H3_4 111.9 . . ?
N2_4 C3_4 H3_4 111.9 . . ?
C2_4 C3_4 H3_4 111.9 . . ?
C4_4 N3_4 C1_4 118.7(2) . . ?
C4_4 N3_4 C2_4 111.27(18) . . ?
C1_4 N3_4 C2_4 120.05(18) . . ?
O9_4 C4_4 N4_4 126.1(2) . . ?
O9_4 C4_4 N3_4 125.7(2) . . ?
N4_4 C4_4 N3_4 108.2(2) . . ?
C4_4 N4_4 C8_4 122.3(2) . . ?
C4_4 N4_4 C3_4 113.05(18) . . ?
C8_4 N4_4 C3_4 121.5(2) . . ?
O10_4 C5_4 N2_4 126.1(2) . . ?
O10_4 C5_4 N1_4 125.5(2) . . ?
N2_4 C5_4 N1_4 108.36(19) . . ?
C12_4 N5_4 C6_4 122.0(2) . . ?
C12_4 N5_4 C7_4 112.13(17) . . ?
C6_4 N5_4 C7_4 122.91(19) . . ?
N5_4 C6_4 N2_4 113.6(2) . . ?
N5_4 C6_4 H6A_4 108.8 . . ?
N2_4 C6_4 H6A_4 108.8 . . ?
N5_4 C6_4 H6B_4 108.8 . . ?
N2_4 C6_4 H6B_4 108.8 . . ?
H6A_4 C6_4 H6B_4 107.7 . . ?
C9_4 N6_4 C7_4 113.30(17) . . ?
C9_4 N6_4 C8_4 120.6(2) . . ?
C7_4 N6_4 C8_4 123.7(2) . . ?
N6_4 C7_4 N5_4 114.31(18) . . ?
N6_4 C7_4 C11_4 103.61(19) . . ?
N5_4 C7_4 C11_4 103.09(17) . . ?
N6_4 C7_4 H7_4 111.7 . . ?
N5_4 C7_4 H7_4 111.7 . . ?
C11_4 C7_4 H7_4 111.7 . . ?
C12_4 N7_4 C11_4 113.38(18) . . ?
C12_4 N7_4 C13_4 121.2(2) . . ?
C11_4 N7_4 C13_4 122.82(18) . . ?
N4_4 C8_4 N6_4 112.88(19) . . ?
N4_4 C8_4 H8A_4 109.0 . . ?
N6_4 C8_4 H8A_4 109.0 . . ?
N4_4 C8_4 H8B_4 109.0 . . ?
N6_4 C8_4 H8B_4 109.0 . . ?
H8A_4 C8_4 H8B_4 107.8 . . ?
C9_4 N8_4 C10_4 122.1(2) . . ?
C9_4 N8_4 C11_4 113.55(18) . . ?
C10_4 N8_4 C11_4 124.06(18) . . ?
O8_4 C9_4 N6_4 126.4(2) . . ?
O8_4 C9_4 N8_4 126.6(2) . . ?
N6_4 C9_4 N8_4 106.9(2) . . ?
C15_4 N9_4 C14_4 112.74(18) . . ?
C15_4 N9_4 C10_4 121.76(19) . . ?
C14_4 N9_4 C10_4 123.23(18) . . ?
N7_4 C11_4 N8_4 114.75(19) . . ?
N7_4 C11_4 C7_4 103.12(17) . . ?
N8_4 C11_4 C7_4 102.48(17) . . ?
N7_4 C11_4 H11_4 111.9 . . ?
N8_4 C11_4 H11_4 111.9 . . ?
C7_4 C11_4 H11_4 111.9 . . ?
C17_4 N11_4 C16_4 112.31(17) . . ?
C17_4 N11_4 C20_4 120.91(17) . . ?
C16_4 N11_4 C20_4 120.98(17) . . ?
N8_4 C10_4 N9_4 113.78(18) . . ?
N8_4 C10_4 H10A_4 108.8 . . ?
N9_4 C10_4 H10A_4 108.8 . . ?
N8_4 C10_4 H10B_4 108.8 . . ?
N9_4 C10_4 H10B_4 108.8 . . ?
H10A_4 C10_4 H10B_4 107.7 . . ?
C17_4 N10_4 C14_4 112.84(17) . . ?
C17_4 N10_4 C13_4 123.75(18) . . ?
C14_4 N10_4 C13_4 122.61(18) . . ?
O7_4 C12_4 N7_4 126.6(2) . . ?
O7_4 C12_4 N5_4 125.5(2) . . ?
N7_4 C12_4 N5_4 107.9(2) . . ?
C15_4 N12_4 C18_4 121.91(19) . . ?
C15_4 N12_4 C16_4 112.89(18) . . ?
C18_4 N12_4 C16_4 123.16(18) . . ?
N10_4 C13_4 N7_4 113.29(18) . . ?
N10_4 C13_4 H13A_4 108.9 . . ?
N7_4 C13_4 H13A_4 108.9 . . ?
N10_4 C13_4 H13B_4 108.9 . . ?
N7_4 C13_4 H13B_4 108.9 . . ?
H13A_4 C13_4 H13B_4 107.7 . . ?
C28_4 N13_4 C19_4 112.64(16) . . ?
C28_4 N13_4 C20_4 122.64(17) . . ?
C19_4 N13_4 C20_4 124.63(16) . . ?
N10_4 C14_4 N9_4 115.14(16) . . ?
N10_4 C14_4 C16_4 103.10(16) . . ?
N9_4 C14_4 C16_4 103.35(16) . . ?
N10_4 C14_4 H14_4 111.5 . . ?
N9_4 C14_4 H14_4 111.5 . . ?
C16_4 C14_4 H14_4 111.5 . . ?
C21_4 N14_4 C18_4 119.11(17) . . ?
C21_4 N14_4 C19_4 111.02(17) . . ?
C18_4 N14_4 C19_4 119.72(16) . . ?
O6_4 C15_4 N12_4 126.1(2) . . ?
O6_4 C15_4 N9_4 125.8(2) . . ?
N12_4 C15_4 N9_4 108.11(18) . . ?
C28_4 N15_4 C23_4 119.59(16) . . ?
C28_4 N15_4 C30_4 110.96(15) . . ?
C23_4 N15_4 C30_4 120.29(17) . . ?
N11_4 C16_4 N12_4 113.72(16) . . ?
N11_4 C16_4 C14_4 103.52(16) . . ?
N12_4 C16_4 C14_4 102.78(16) . . ?
N11_4 C16_4 H16_4 112.0 . . ?
N12_4 C16_4 H16_4 112.0 . . ?
C14_4 C16_4 H16_4 112.0 . . ?
C21_4 N16_4 C30_4 112.50(16) . . ?
C21_4 N16_4 C22_4 121.87(17) . . ?
C30_4 N16_4 C22_4 122.37(18) . . ?
O5_4 C17_4 N11_4 126.0(2) . . ?
O5_4 C17_4 N10_4 126.2(2) . . ?
N11_4 C17_4 N10_4 107.76(18) . . ?
C26_4 N17_4 C23_4 119.54(17) . . ?
C26_4 N17_4 C24_4 110.91(16) . . ?
C23_4 N17_4 C24_4 119.53(16) . . ?
N12_4 C18_4 N14_4 113.45(17) . . ?
N12_4 C18_4 H18A_4 108.9 . . ?
N14_4 C18_4 H18A_4 108.9 . . ?
N12_4 C18_4 H18B_4 108.9 . . ?
N14_4 C18_4 H18B_4 108.9 . . ?
H18A_4 C18_4 H18B_4 107.7 . . ?
C26_4 N18_4 C25_4 111.46(16) . . ?
C26_4 N18_4 C1_4 119.16(18) . 2_567 ?
C25_4 N18_4 C1_4 118.63(18) . 2_567 ?
N13_4 C19_4 N14_4 115.41(17) . . ?
N13_4 C19_4 C30_4 103.07(15) . . ?
N14_4 C19_4 C30_4 103.00(15) . . ?
N13_4 C19_4 H19_4 111.6 . . ?
N14_4 C19_4 H19_4 111.6 . . ?
C30_4 C19_4 H19_4 111.6 . . ?
C29_4 N19_4 C25_4 111.69(16) . . ?
C29_4 N19_4 C27_4 119.34(18) . . ?
C25_4 N19_4 C27_4 121.18(18) . . ?
N13_4 C20_4 N11_4 113.59(17) . . ?
N13_4 C20_4 H20A_4 108.8 . . ?
N11_4 C20_4 H20A_4 108.8 . . ?
N13_4 C20_4 H20B_4 108.8 . . ?
N11_4 C20_4 H20B_4 108.8 . . ?
H20A_4 C20_4 H20B_4 107.7 . . ?
C29_4 N20_4 C22_4 120.77(16) . . ?
C29_4 N20_4 C24_4 111.86(15) . . ?
C22_4 N20_4 C24_4 121.61(17) . . ?
O4_4 C21_4 N16_4 125.54(19) . . ?
O4_4 C21_4 N14_4 125.9(2) . . ?
N16_4 C21_4 N14_4 108.53(17) . . ?
N20_4 C22_4 N16_4 112.59(16) . . ?
N20_4 C22_4 H22A_4 109.1 . . ?
N16_4 C22_4 H22A_4 109.1 . . ?
N20_4 C22_4 H22B_4 109.1 . . ?
N16_4 C22_4 H22B_4 109.1 . . ?
H22A_4 C22_4 H22B_4 107.8 . . ?
N17_4 C23_4 N15_4 113.39(17) . . ?
N17_4 C23_4 H23A_4 108.9 . . ?
N15_4 C23_4 H23A_4 108.9 . . ?
N17_4 C23_4 H23B_4 108.9 . . ?
N15_4 C23_4 H23B_4 108.9 . . ?
H23A_4 C23_4 H23B_4 107.7 . . ?
N20_4 C24_4 N17_4 114.68(17) . . ?
N20_4 C24_4 C25_4 103.55(15) . . ?
N17_4 C24_4 C25_4 104.40(14) . . ?
N20_4 C24_4 H24_4 111.2 . . ?
N17_4 C24_4 H24_4 111.2 . . ?
C25_4 C24_4 H24_4 111.2 . . ?
O1_4 C26_4 N18_4 126.32(19) . . ?
O1_4 C26_4 N17_4 124.9(2) . . ?
N18_4 C26_4 N17_4 108.80(17) . . ?
N1_4 C27_4 N19_4 112.48(18) 2_567 . ?
N1_4 C27_4 H27A_4 109.1 2_567 . ?
N19_4 C27_4 H27A_4 109.1 . . ?
N1_4 C27_4 H27B_4 109.1 2_567 . ?
N19_4 C27_4 H27B_4 109.1 . . ?
H27A_4 C27_4 H27B_4 107.8 . . ?
O3_4 C28_4 N13_4 125.28(18) . . ?
O3_4 C28_4 N15_4 126.50(18) . . ?
N13_4 C28_4 N15_4 108.22(16) . . ?
O2_4 C29_4 N19_4 126.50(19) . . ?
O2_4 C29_4 N20_4 125.61(18) . . ?
N19_4 C29_4 N20_4 107.88(17) . . ?
N16_4 C30_4 N15_4 113.56(16) . . ?
N16_4 C30_4 C19_4 103.01(16) . . ?
N15_4 C30_4 C19_4 102.79(15) . . ?
N16_4 C30_4 H30_4 112.2 . . ?
N15_4 C30_4 H30_4 112.2 . . ?
C19_4 C30_4 H30_4 112.2 . . ?
N19_4 C25_4 N18_4 114.84(17) . . ?
N19_4 C25_4 C24_4 103.96(15) . . ?
N18_4 C25_4 C24_4 103.44(16) . . ?
N19_4 C25_4 H25_4 111.4 . . ?
N18_4 C25_4 H25_4 111.4 . . ?
C24_4 C25_4 H25_4 111.4 . . ?
N19_5 C1_5 N1_5 113.46(19) 2_776 . ?
N19_5 C1_5 H1A_5 108.9 2_776 . ?
N1_5 C1_5 H1A_5 108.9 . . ?
N19_5 C1_5 H1B_5 108.9 2_776 . ?
N1_5 C1_5 H1B_5 108.9 . . ?
H1A_5 C1_5 H1B_5 107.7 . . ?
C5_5 N1_5 C1_5 121.68(19) . . ?
C5_5 N1_5 C2_5 111.72(16) . . ?
C1_5 N1_5 C2_5 121.19(17) . . ?
N3_5 C2_5 N1_5 114.81(17) . . ?
N3_5 C2_5 C3_5 104.10(17) . . ?
N1_5 C2_5 C3_5 102.64(17) . . ?
N3_5 C2_5 H2_5 111.6 . . ?
N1_5 C2_5 H2_5 111.6 . . ?
C3_5 C2_5 H2_5 111.6 . . ?
C5_5 N2_5 C3_5 111.68(16) . . ?
C5_5 N2_5 C6_5 121.30(18) . . ?
C3_5 N2_5 C6_5 121.27(16) . . ?
N2_5 C3_5 N4_5 114.17(16) . . ?
N2_5 C3_5 C2_5 104.08(16) . . ?
N4_5 C3_5 C2_5 103.03(17) . . ?
N2_5 C3_5 H3_5 111.7 . . ?
N4_5 C3_5 H3_5 111.7 . . ?
C2_5 C3_5 H3_5 111.7 . . ?
C4_5 N3_5 C2_5 112.31(17) . . ?
C4_5 N3_5 C28_5 123.1(2) . 2_776 ?
C2_5 N3_5 C28_5 122.66(19) . 2_776 ?
O9_5 C4_5 N3_5 126.8(2) . . ?
O9_5 C4_5 N4_5 125.0(2) . . ?
N3_5 C4_5 N4_5 108.21(19) . . ?
C4_5 N4_5 C7_5 117.96(18) . . ?
C4_5 N4_5 C3_5 111.25(17) . . ?
C7_5 N4_5 C3_5 120.13(16) . . ?
O10_5 C5_5 N1_5 125.9(2) . . ?
O10_5 C5_5 N2_5 125.65(19) . . ?
N1_5 C5_5 N2_5 108.49(18) . . ?
C11_5 N5_5 C7_5 117.79(17) . . ?
C11_5 N5_5 C8_5 110.79(15) . . ?
C7_5 N5_5 C8_5 119.53(16) . . ?
N2_5 C6_5 N6_5 113.11(18) . . ?
N2_5 C6_5 H6A_5 109.0 . . ?
N6_5 C6_5 H6A_5 109.0 . . ?
N2_5 C6_5 H6B_5 109.0 . . ?
N6_5 C6_5 H6B_5 109.0 . . ?
H6A_5 C6_5 H6B_5 107.8 . . ?
C10_5 N6_5 C8_5 111.33(16) . . ?
C10_5 N6_5 C6_5 120.24(18) . . ?
C8_5 N6_5 C6_5 121.39(16) . . ?
N4_5 C7_5 N5_5 113.30(17) . . ?
N4_5 C7_5 H7A_5 108.9 . . ?
N5_5 C7_5 H7A_5 108.9 . . ?
N4_5 C7_5 H7B_5 108.9 . . ?
N5_5 C7_5 H7B_5 108.9 . . ?
H7A_5 C7_5 H7B_5 107.7 . . ?
C11_5 N7_5 C9_5 111.39(15) . . ?
C11_5 N7_5 C12_5 119.45(16) . . ?
C9_5 N7_5 C12_5 118.93(15) . . ?
N6_5 C8_5 N5_5 114.94(16) . . ?
N6_5 C8_5 C9_5 103.78(15) . . ?
N5_5 C8_5 C9_5 103.82(15) . . ?
N6_5 C8_5 H8_5 111.3 . . ?
N5_5 C8_5 H8_5 111.3 . . ?
C9_5 C8_5 H8_5 111.3 . . ?
C10_5 N8_5 C9_5 110.76(16) . . ?
C10_5 N8_5 C13_5 118.96(17) . . ?
C9_5 N8_5 C13_5 119.63(16) . . ?
N7_5 C9_5 N8_5 115.14(15) . . ?
N7_5 C9_5 C8_5 104.05(15) . . ?
N8_5 C9_5 C8_5 103.63(15) . . ?
N7_5 C9_5 H9_5 111.2 . . ?
N8_5 C9_5 H9_5 111.2 . . ?
C8_5 C9_5 H9_5 111.2 . . ?
C16_5 N9_5 C12_5 119.46(17) . . ?
C16_5 N9_5 C14_5 111.27(15) . . ?
C12_5 N9_5 C14_5 121.32(16) . . ?
O8_5 C10_5 N8_5 125.36(19) . . ?
O8_5 C10_5 N6_5 125.8(2) . . ?
N8_5 C10_5 N6_5 108.81(18) . . ?
C17_5 N10_5 C14_5 111.89(18) . . ?
C17_5 N10_5 C13_5 119.61(19) . . ?
C14_5 N10_5 C13_5 121.38(16) . . ?
O7_5 C11_5 N5_5 126.06(17) . . ?
O7_5 C11_5 N7_5 125.53(18) . . ?
N5_5 C11_5 N7_5 108.41(17) . . ?
C16_5 N11_5 C15_5 112.37(16) . . ?
C16_5 N11_5 C18_5 122.53(18) . . ?
C15_5 N11_5 C18_5 123.47(17) . . ?
N9_5 C12_5 N7_5 113.06(16) . . ?
N9_5 C12_5 H12A_5 109.0 . . ?
N7_5 C12_5 H12A_5 109.0 . . ?
N9_5 C12_5 H12B_5 109.0 . . ?
N7_5 C12_5 H12B_5 109.0 . . ?
H12A_5 C12_5 H12B_5 107.8 . . ?
C17_5 N12_5 C19_5 121.1(2) . . ?
C17_5 N12_5 C15_5 111.84(19) . . ?
C19_5 N12_5 C15_5 121.8(2) . . ?
N10_5 C13_5 N8_5 113.00(17) . . ?
N10_5 C13_5 H13A_5 109.0 . . ?
N8_5 C13_5 H13A_5 109.0 . . ?
N10_5 C13_5 H13B_5 109.0 . . ?
N8_5 C13_5 H13B_5 109.0 . . ?
H13A_5 C13_5 H13B_5 107.8 . . ?
C23_5 N13_5 C21_5 112.86(17) . . ?
C23_5 N13_5 C18_5 122.98(19) . . ?
C21_5 N13_5 C18_5 123.16(19) . . ?
N10_5 C14_5 N9_5 114.01(16) . . ?
N10_5 C14_5 C15_5 104.12(16) . . ?
N9_5 C14_5 C15_5 103.14(16) . . ?
N10_5 C14_5 H14_5 111.7 . . ?
N9_5 C14_5 H14_5 111.7 . . ?
C15_5 C14_5 H14_5 111.7 . . ?
C20_5 N14_5 C19_5 120.4(2) . . ?
C20_5 N14_5 C21_5 112.0(2) . . ?
C19_5 N14_5 C21_5 121.0(3) . . ?
N11_5 C15_5 N12_5 114.7(2) . . ?
N11_5 C15_5 C14_5 103.71(16) . . ?
N12_5 C15_5 C14_5 102.89(18) . . ?
N11_5 C15_5 H15_5 111.7 . . ?
N12_5 C15_5 H15_5 111.7 . . ?
C14_5 C15_5 H15_5 111.7 . . ?
C23_5 N15_5 C24_5 120.54(19) . . ?
C23_5 N15_5 C22_5 111.76(17) . . ?
C24_5 N15_5 C22_5 121.38(17) . . ?
O6_5 C16_5 N11_5 126.57(18) . . ?
O6_5 C16_5 N9_5 124.87(17) . . ?
N11_5 C16_5 N9_5 108.56(18) . . ?
C20_5 N16_5 C22_5 113.3(2) . . ?
C20_5 N16_5 C30_5 122.4(2) . . ?
C22_5 N16_5 C30_5 124.2(2) . . ?
O5_5 C17_5 N10_5 125.5(2) . . ?
O5_5 C17_5 N12_5 126.2(2) . . ?
N10_5 C17_5 N12_5 108.3(2) . . ?
C27_5 N17_5 C25_5 112.90(18) . . ?
C27_5 N17_5 C24_5 122.7(2) . . ?
C25_5 N17_5 C24_5 124.25(19) . . ?
N13_5 C18_5 N11_5 114.49(18) . . ?
N13_5 C18_5 H18A_5 108.6 . . ?
N11_5 C18_5 H18A_5 108.6 . . ?
N13_5 C18_5 H18B_5 108.6 . . ?
N11_5 C18_5 H18B_5 108.6 . . ?
H18A_5 C18_5 H18B_5 107.6 . . ?
C29_5 N18_5 C25_5 113.1(2) . . ?
C29_5 N18_5 C30_5 120.1(2) . . ?
C25_5 N18_5 C30_5 123.1(2) . . ?
N12_5 C19_5 N14_5 112.5(2) . . ?
N12_5 C19_5 H19A_5 109.1 . . ?
N14_5 C19_5 H19A_5 109.1 . . ?
N12_5 C19_5 H19B_5 109.1 . . ?
N14_5 C19_5 H19B_5 109.1 . . ?
H19A_5 C19_5 H19B_5 107.8 . . ?
C27_5 N19_5 C26_5 112.55(18) . . ?
C27_5 N19_5 C1_5 121.1(2) . 2_776 ?
C26_5 N19_5 C1_5 123.97(17) . 2_776 ?
O4_5 C20_5 N16_5 126.7(3) . . ?
O4_5 C20_5 N14_5 125.6(3) . . ?
N16_5 C20_5 N14_5 107.7(2) . . ?
C29_5 N20_5 C26_5 113.84(19) . . ?
C29_5 N20_5 C28_5 121.2(2) . . ?
C26_5 N20_5 C28_5 123.9(2) . . ?
N13_5 C21_5 N14_5 112.91(18) . . ?
N13_5 C21_5 C22_5 103.62(18) . . ?
N14_5 C21_5 C22_5 102.14(19) . . ?
N13_5 C21_5 H21_5 112.5 . . ?
N14_5 C21_5 H21_5 112.5 . . ?
C22_5 C21_5 H21_5 112.5 . . ?
N16_5 C22_5 N15_5 114.35(18) . . ?
N16_5 C22_5 C21_5 103.55(19) . . ?
N15_5 C22_5 C21_5 102.94(16) . . ?
N16_5 C22_5 H22_5 111.8 . . ?
N15_5 C22_5 H22_5 111.8 . . ?
C21_5 C22_5 H22_5 111.8 . . ?
O3_5 C23_5 N13_5 126.01(19) . . ?
O3_5 C23_5 N15_5 126.1(2) . . ?
N13_5 C23_5 N15_5 107.91(19) . . ?
N17_5 C24_5 N15_5 114.09(19) . . ?
N17_5 C24_5 H24A_5 108.7 . . ?
N15_5 C24_5 H24A_5 108.7 . . ?
N17_5 C24_5 H24B_5 108.7 . . ?
N15_5 C24_5 H24B_5 108.7 . . ?
H24A_5 C24_5 H24B_5 107.6 . . ?
N18_5 C25_5 N17_5 114.89(19) . . ?
N18_5 C25_5 C26_5 103.24(19) . . ?
N17_5 C25_5 C26_5 102.80(19) . . ?
N18_5 C25_5 H25_5 111.7 . . ?
N17_5 C25_5 H25_5 111.7 . . ?
C26_5 C25_5 H25_5 111.7 . . ?
N19_5 C26_5 N20_5 114.41(18) . . ?
N19_5 C26_5 C25_5 103.20(18) . . ?
N20_5 C26_5 C25_5 102.3(2) . . ?
N19_5 C26_5 H26_5 112.1 . . ?
N20_5 C26_5 H26_5 112.1 . . ?
C25_5 C26_5 H26_5 112.1 . . ?
O2_5 C27_5 N17_5 126.26(19) . . ?
O2_5 C27_5 N19_5 125.4(2) . . ?
N17_5 C27_5 N19_5 108.4(2) . . ?
N3_5 C28_5 N20_5 113.57(19) 2_776 . ?
N3_5 C28_5 H28A_5 108.9 2_776 . ?
N20_5 C28_5 H28A_5 108.9 . . ?
N3_5 C28_5 H28B_5 108.9 2_776 . ?
N20_5 C28_5 H28B_5 108.9 . . ?
H28A_5 C28_5 H28B_5 107.7 . . ?
O1_5 C29_5 N20_5 126.2(2) . . ?
O1_5 C29_5 N18_5 126.6(2) . . ?
N20_5 C29_5 N18_5 107.2(2) . . ?
N16_5 C30_5 N18_5 113.4(2) . . ?
N16_5 C30_5 H30A_5 108.9 . . ?
N18_5 C30_5 H30A_5 108.9 . . ?
N16_5 C30_5 H30B_5 108.9 . . ?
N18_5 C30_5 H30B_5 108.9 . . ?
H30A_5 C30_5 H30B_5 107.7 . . ?
O5_6 S1_6 O4_6 115.23(14) . . ?
O5_6 S1_6 O6_6 116.48(15) . . ?
O4_6 S1_6 O6_6 113.44(13) . . ?
O5_6 S1_6 C3_6 103.51(12) . . ?
O4_6 S1_6 C3_6 103.45(11) . . ?
O6_6 S1_6 C3_6 102.20(12) . . ?
F3_6 C1_6 F1_6 112.0(3) . . ?
F3_6 C1_6 F2_6 97.8(3) . . ?
F1_6 C1_6 F2_6 103.1(3) . . ?
F3_6 C1_6 S2_6 115.9(2) . . ?
F1_6 C1_6 S2_6 115.7(2) . . ?
F2_6 C1_6 S2_6 109.9(2) . . ?
O2_6 S2_6 O3_6 123.7(2) . . ?
O2_6 S2_6 O1_6 107.9(2) . . ?
O3_6 S2_6 O1_6 110.86(19) . . ?
O2_6 S2_6 C1_6 103.74(18) . . ?
O3_6 S2_6 C1_6 104.70(14) . . ?
O1_6 S2_6 C1_6 103.94(17) . . ?
F7_6 C2_6 F9_6 107.2(2) . . ?
F7_6 C2_6 F8_6 104.8(2) . . ?
F9_6 C2_6 F8_6 107.1(2) . . ?
F7_6 C2_6 S3_6 113.21(18) . . ?
F9_6 C2_6 S3_6 111.42(17) . . ?
F8_6 C2_6 S3_6 112.67(18) . . ?
O8_6 S3_6 O9_6 115.82(14) . . ?
O8_6 S3_6 O7_6 114.74(13) . . ?
O9_6 S3_6 O7_6 114.58(12) . . ?
O8_6 S3_6 C2_6 102.98(12) . . ?
O9_6 S3_6 C2_6 102.15(12) . . ?
O7_6 S3_6 C2_6 104.08(11) . . ?
F5_6 C3_6 F4_6 109.1(2) . . ?
F5_6 C3_6 F6_6 106.8(2) . . ?
F4_6 C3_6 F6_6 106.7(2) . . ?
F5_6 C3_6 S1_6 112.19(18) . . ?
F4_6 C3_6 S1_6 111.03(16) . . ?
F6_6 C3_6 S1_6 110.75(16) . . ?

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
C5_1 N1_1 C1_1 C2_1 2.7(4) . . . . ?
Pt1_1 N1_1 C1_1 C2_1 -174.4(2) . . . . ?
N1_1 C1_1 C2_1 C3_1 0.0(5) . . . . ?
C1_1 C2_1 C3_1 C4_1 -3.6(6) . . . . ?
C2_1 C3_1 C4_1 C5_1 4.3(5) . . . . ?
C1_1 N1_1 C5_1 C4_1 -1.8(4) . . . . ?
Pt1_1 N1_1 C5_1 C4_1 175.5(2) . . . . ?
C1_1 N1_1 C5_1 C6_1 179.8(3) . . . . ?
Pt1_1 N1_1 C5_1 C6_1 -2.9(3) . . . . ?
C3_1 C4_1 C5_1 N1_1 -1.6(5) . . . . ?
C3_1 C4_1 C5_1 C6_1 176.6(3) . . . . ?
C10_1 N2_1 C6_1 C7_1 5.7(4) . . . . ?
Pt1_1 N2_1 C6_1 C7_1 176.8(2) . . . . ?
C10_1 N2_1 C6_1 C5_1 -177.7(2) . . . . ?
Pt1_1 N2_1 C6_1 C5_1 -6.6(3) . . . . ?
N1_1 C5_1 C6_1 N2_1 6.1(4) . . . . ?
C4_1 C5_1 C6_1 N2_1 -172.2(3) . . . . ?
N1_1 C5_1 C6_1 C7_1 -177.7(3) . . . . ?
C4_1 C5_1 C6_1 C7_1 4.0(5) . . . . ?
N2_1 C6_1 C7_1 C8_1 -3.6(5) . . . . ?
C5_1 C6_1 C7_1 C8_1 -179.6(3) . . . . ?
C6_1 C7_1 C8_1 C9_1 0.6(6) . . . . ?
C7_1 C8_1 C9_1 C10_1 0.6(5) . . . . ?
C6_1 N2_1 C10_1 C11_1 175.7(2) . . . . ?
Pt1_1 N2_1 C10_1 C11_1 4.7(3) . . . . ?
C6_1 N2_1 C10_1 C9_1 -4.5(4) . . . . ?
Pt1_1 N2_1 C10_1 C9_1 -175.4(2) . . . . ?
C8_1 C9_1 C10_1 N2_1 1.2(4) . . . . ?
C8_1 C9_1 C10_1 C11_1 -179.0(3) . . . . ?
N2_1 C10_1 C11_1 N3_1 -3.5(4) . . . . ?
C9_1 C10_1 C11_1 N3_1 176.7(3) . . . . ?
N2_1 C10_1 C11_1 C12_1 174.3(3) . . . . ?
C9_1 C10_1 C11_1 C12_1 -5.5(5) . . . . ?
N3_1 C11_1 C12_1 C13_1 0.0(5) . . . . ?
C10_1 C11_1 C12_1 C13_1 -177.9(3) . . . . ?
C11_1 C12_1 C13_1 C14_1 -0.7(6) . . . . ?
C12_1 C13_1 C14_1 C15_1 0.3(6) . . . . ?
C13_1 C14_1 C15_1 N3_1 0.8(5) . . . . ?
C14_1 C15_1 N3_1 C11_1 -1.5(5) . . . . ?
C14_1 C15_1 N3_1 Pt1_1 176.5(2) . . . . ?
C10_1 C11_1 N3_1 C15_1 179.0(3) . . . . ?
C12_1 C11_1 N3_1 C15_1 1.1(4) . . . . ?
C10_1 C11_1 N3_1 Pt1_1 0.8(3) . . . . ?
C12_1 C11_1 N3_1 Pt1_1 -177.1(2) . . . . ?
C16_1 C17_1 C18_1 N4_1 129.8(14) . . . . ?
C17_1 C18_1 N4_1 C21_1 -75.4(5) . . . . ?
C17_1 C18_1 N4_1 C19_1 161.0(5) . . . . ?
C17_1 C18_1 N4_1 C20_1 46.0(5) . . . . ?
C5A_2 N1A_2 C1A_2 C2A_2 0.0 . . . . ?
Pt2A_2 N1A_2 C1A_2 C2A_2 177.56(17) . . . . ?
N1A_2 C1A_2 C2A_2 C3A_2 0.0 . . . . ?
C1A_2 C2A_2 C3A_2 C4A_2 0.0 . . . . ?
C2A_2 C3A_2 C4A_2 C5A_2 0.0 . . . . ?
C3A_2 C4A_2 C5A_2 N1A_2 0.0 . . . . ?
C3A_2 C4A_2 C5A_2 C6A_2 175.5(3) . . . . ?
C1A_2 N1A_2 C5A_2 C4A_2 0.0 . . . . ?
Pt2A_2 N1A_2 C5A_2 C4A_2 -177.91(15) . . . . ?
C1A_2 N1A_2 C5A_2 C6A_2 -175.7(3) . . . . ?
Pt2A_2 N1A_2 C5A_2 C6A_2 6.4(3) . . . . ?
C10A_2 N2A_2 C6A_2 C7A_2 0.0 . . . . ?
Pt2A_2 N2A_2 C6A_2 C7A_2 173.86(18) . . . . ?
C10A_2 N2A_2 C6A_2 C5A_2 -173.0(3) . . . . ?
Pt2A_2 N2A_2 C6A_2 C5A_2 0.8(3) . . . . ?
C4A_2 C5A_2 C6A_2 N2A_2 179.63(15) . . . . ?
N1A_2 C5A_2 C6A_2 N2A_2 -4.8(4) . . . . ?
C4A_2 C5A_2 C6A_2 C7A_2 7.4(3) . . . . ?
N1A_2 C5A_2 C6A_2 C7A_2 -176.97(18) . . . . ?
N2A_2 C6A_2 C7A_2 C8A_2 0.0 . . . . ?
C5A_2 C6A_2 C7A_2 C8A_2 171.5(4) . . . . ?
C6A_2 C7A_2 C8A_2 C9A_2 0.0 . . . . ?
C7A_2 C8A_2 C9A_2 C10A_2 0.0 . . . . ?
C8A_2 C9A_2 C10A_2 C11A_2 -178.1(4) . . . . ?
C8A_2 C9A_2 C10A_2 N2A_2 0.0 . . . . ?
C6A_2 N2A_2 C10A_2 C11A_2 178.8(3) . . . . ?
Pt2A_2 N2A_2 C10A_2 C11A_2 4.9(3) . . . . ?
C6A_2 N2A_2 C10A_2 C9A_2 0.0 . . . . ?
Pt2A_2 N2A_2 C10A_2 C9A_2 -173.87(18) . . . . ?
C9A_2 C10A_2 C11A_2 C12A_2 -1.6(4) . . . . ?
N2A_2 C10A_2 C11A_2 C12A_2 -179.90(18) . . . . ?
C9A_2 C10A_2 C11A_2 N3A_2 176.3(2) . . . . ?
N2A_2 C10A_2 C11A_2 N3A_2 -2.1(3) . . . . ?
C10A_2 C11A_2 C12A_2 C13A_2 178.0(3) . . . . ?
N3A_2 C11A_2 C12A_2 C13A_2 0.0 . . . . ?
C11A_2 C12A_2 C13A_2 C14A_2 0.0 . . . . ?
C12A_2 C13A_2 C14A_2 C15A_2 0.0 . . . . ?
C13A_2 C14A_2 C15A_2 N3A_2 0.0 . . . . ?
C14A_2 C15A_2 N3A_2 C11A_2 0.0 . . . . ?
C14A_2 C15A_2 N3A_2 Pt2A_2 -175.0(3) . . . . ?
C10A_2 C11A_2 N3A_2 C15A_2 -177.7(3) . . . . ?
C12A_2 C11A_2 N3A_2 C15A_2 0.0 . . . . ?
C10A_2 C11A_2 N3A_2 Pt2A_2 -1.7(3) . . . . ?
C12A_2 C11A_2 N3A_2 Pt2A_2 176.0(2) . . . . ?
N2A_2 Pt2A_2 N3A_2 C15A_2 178.78(19) . . . . ?
N1A_2 Pt2A_2 N3A_2 C15A_2 -177.3(4) . . . . ?
C16A_2 Pt2A_2 N3A_2 C15A_2 -0.7(3) . . . . ?
N2A_2 Pt2A_2 N3A_2 C11A_2 3.33(18) . . . . ?
N1A_2 Pt2A_2 N3A_2 C11A_2 7.3(6) . . . . ?
C16A_2 Pt2A_2 N3A_2 C11A_2 -176.1(3) . . . . ?
C16A_2 C17A_2 C18A_2 N4A_2 156.6(13) . . . . ?
C17A_2 C18A_2 N4A_2 C20A_2 68.8(6) . . . . ?
C17A_2 C18A_2 N4A_2 C19A_2 -169.8(6) . . . . ?
C17A_2 C18A_2 N4A_2 C21A_2 -54.7(7) . . . . ?
C5B_2 N1B_2 C1B_2 C2B_2 0.0 . . . . ?
Pt2B_2 N1B_2 C1B_2 C2B_2 -177.0(2) . . . . ?
N1B_2 C1B_2 C2B_2 C3B_2 0.0 . . . . ?
C1B_2 C2B_2 C3B_2 C4B_2 0.0 . . . . ?
C2B_2 C3B_2 C4B_2 C5B_2 0.0 . . . . ?
C3B_2 C4B_2 C5B_2 C6B_2 -173.6(4) . . . . ?
C3B_2 C4B_2 C5B_2 N1B_2 0.0 . . . . ?
C1B_2 N1B_2 C5B_2 C6B_2 173.9(4) . . . . ?
Pt2B_2 N1B_2 C5B_2 C6B_2 -8.7(4) . . . . ?
C1B_2 N1B_2 C5B_2 C4B_2 0.0 . . . . ?
Pt2B_2 N1B_2 C5B_2 C4B_2 177.38(18) . . . . ?
C4B_2 C5B_2 C6B_2 C7B_2 3.1(4) . . . . ?
N1B_2 C5B_2 C6B_2 C7B_2 -170.7(2) . . . . ?
C4B_2 C5B_2 C6B_2 N2B_2 -168.5(2) . . . . ?
N1B_2 C5B_2 C6B_2 N2B_2 17.8(5) . . . . ?
C10B_2 N2B_2 C6B_2 C5B_2 172.6(4) . . . . ?
Pt2B_2 N2B_2 C6B_2 C5B_2 -20.5(4) . . . . ?
C10B_2 N2B_2 C6B_2 C7B_2 0.0 . . . . ?
Pt2B_2 N2B_2 C6B_2 C7B_2 166.8(2) . . . . ?
C5B_2 C6B_2 C7B_2 C8B_2 -170.8(5) . . . . ?
N2B_2 C6B_2 C7B_2 C8B_2 0.0 . . . . ?
C6B_2 C7B_2 C8B_2 C9B_2 0.0 . . . . ?
C7B_2 C8B_2 C9B_2 C10B_2 0.0 . . . . ?
C8B_2 C9B_2 C10B_2 N2B_2 0.0 . . . . ?
C8B_2 C9B_2 C10B_2 C11B_2 -157.8(5) . . . . ?
C6B_2 N2B_2 C10B_2 C9B_2 0.0 . . . . ?
Pt2B_2 N2B_2 C10B_2 C9B_2 -167.2(2) . . . . ?
C6B_2 N2B_2 C10B_2 C11B_2 162.3(4) . . . . ?
Pt2B_2 N2B_2 C10B_2 C11B_2 -4.9(4) . . . . ?
C9B_2 C10B_2 C11B_2 C12B_2 -21.1(4) . . . . ?
N2B_2 C10B_2 C11B_2 C12B_2 178.9(2) . . . . ?
C9B_2 C10B_2 C11B_2 N3B_2 166.7(3) . . . . ?
N2B_2 C10B_2 C11B_2 N3B_2 6.8(5) . . . . ?
N3B_2 C11B_2 C12B_2 C13B_2 0.0 . . . . ?
C10B_2 C11B_2 C12B_2 C13B_2 -172.3(4) . . . . ?
C11B_2 C12B_2 C13B_2 C14B_2 0.0 . . . . ?
C12B_2 C13B_2 C14B_2 C15B_2 0.0 . . . . ?
C13B_2 C14B_2 C15B_2 N3B_2 0.0 . . . . ?
C14B_2 C15B_2 N3B_2 C11B_2 0.0 . . . . ?
C14B_2 C15B_2 N3B_2 Pt2B_2 176.9(4) . . . . ?
C12B_2 C11B_2 N3B_2 C15B_2 0.0 . . . . ?
C10B_2 C11B_2 N3B_2 C15B_2 172.0(4) . . . . ?
C12B_2 C11B_2 N3B_2 Pt2B_2 -177.5(3) . . . . ?
C10B_2 C11B_2 N3B_2 Pt2B_2 -5.5(4) . . . . ?
Pt2B_2 C16B_2 C17B_2 C18B_2 -154.9(13) . . . . ?
C16B_2 C17B_2 C18B_2 N4B_2 -143.2(17) . . . . ?
C17B_2 C18B_2 N4B_2 C19B_2 -174.4(9) . . . . ?
C17B_2 C18B_2 N4B_2 C21B_2 70.8(10) . . . . ?
C17B_2 C18B_2 N4B_2 C20B_2 -54.7(9) . . . . ?
C5C_2 N1C_2 C1C_2 C2C_2 0.0 . . . . ?
Pt2C_2 N1C_2 C1C_2 C2C_2 -178.0(2) . . . . ?
N1C_2 C1C_2 C2C_2 C3C_2 0.0 . . . . ?
C1C_2 C2C_2 C3C_2 C4C_2 0.0 . . . . ?
C2C_2 C3C_2 C4C_2 C5C_2 0.0 . . . . ?
C3C_2 C4C_2 C5C_2 N1C_2 0.0 . . . . ?
C3C_2 C4C_2 C5C_2 C6C_2 -166.9(5) . . . . ?
C1C_2 N1C_2 C5C_2 C4C_2 0.0 . . . . ?
Pt2C_2 N1C_2 C5C_2 C4C_2 178.3(2) . . . . ?
C1C_2 N1C_2 C5C_2 C6C_2 168.2(5) . . . . ?
Pt2C_2 N1C_2 C5C_2 C6C_2 -13.5(5) . . . . ?
N3C_2 Pt2C_2 N2C_2 C6C_2 -178.2(4) . . . . ?
N1C_2 Pt2C_2 N2C_2 C6C_2 2.4(4) . . . . ?
C16C_2 Pt2C_2 N2C_2 C6C_2 -104.1(12) . . . . ?
N3C_2 Pt2C_2 N2C_2 C10C_2 11.1(4) . . . . ?
N1C_2 Pt2C_2 N2C_2 C10C_2 -168.3(4) . . . . ?
C16C_2 Pt2C_2 N2C_2 C10C_2 85.2(12) . . . . ?
C10C_2 N2C_2 C6C_2 C7C_2 0.0 . . . . ?
Pt2C_2 N2C_2 C6C_2 C7C_2 -170.9(4) . . . . ?
C10C_2 N2C_2 C6C_2 C5C_2 160.6(6) . . . . ?
Pt2C_2 N2C_2 C6C_2 C5C_2 -10.3(6) . . . . ?
C4C_2 C5C_2 C6C_2 N2C_2 -177.2(3) . . . . ?
N1C_2 C5C_2 C6C_2 N2C_2 15.2(7) . . . . ?
C4C_2 C5C_2 C6C_2 C7C_2 -17.9(5) . . . . ?
N1C_2 C5C_2 C6C_2 C7C_2 174.6(3) . . . . ?
N2C_2 C6C_2 C7C_2 C8C_2 0.0 . . . . ?
C5C_2 C6C_2 C7C_2 C8C_2 -157.7(7) . . . . ?
C6C_2 C7C_2 C8C_2 C9C_2 0.0 . . . . ?
C7C_2 C8C_2 C9C_2 C10C_2 0.0 . . . . ?
C8C_2 C9C_2 C10C_2 N2C_2 0.0 . . . . ?
C8C_2 C9C_2 C10C_2 C11C_2 -178.5(8) . . . . ?
C6C_2 N2C_2 C10C_2 C9C_2 0.0 . . . . ?
Pt2C_2 N2C_2 C10C_2 C9C_2 170.5(4) . . . . ?
C6C_2 N2C_2 C10C_2 C11C_2 178.9(6) . . . . ?
Pt2C_2 N2C_2 C10C_2 C11C_2 -10.5(6) . . . . ?
C9C_2 C10C_2 C11C_2 C12C_2 5.4(8) . . . . ?
N2C_2 C10C_2 C11C_2 C12C_2 -173.3(4) . . . . ?
C9C_2 C10C_2 C11C_2 N3C_2 -178.2(5) . . . . ?
N2C_2 C10C_2 C11C_2 N3C_2 3.1(6) . . . . ?
N3C_2 C11C_2 C12C_2 C13C_2 0.0 . . . . ?
C10C_2 C11C_2 C12C_2 C13C_2 176.3(6) . . . . ?
C11C_2 C12C_2 C13C_2 C14C_2 0.0 . . . . ?
C12C_2 C13C_2 C14C_2 C15C_2 0.0 . . . . ?
C13C_2 C14C_2 C15C_2 N3C_2 0.0 . . . . ?
C14C_2 C15C_2 N3C_2 C11C_2 0.0 . . . . ?
C14C_2 C15C_2 N3C_2 Pt2C_2 178.6(5) . . . . ?
C12C_2 C11C_2 N3C_2 C15C_2 0.0 . . . . ?
C10C_2 C11C_2 N3C_2 C15C_2 -176.4(6) . . . . ?
C12C_2 C11C_2 N3C_2 Pt2C_2 -178.8(5) . . . . ?
C10C_2 C11C_2 N3C_2 Pt2C_2 4.8(6) . . . . ?
C16C_2 C17C_2 C18C_2 N4C_2 -171.0(13) . . . . ?
C17C_2 C18C_2 N4C_2 C21C_2 -77.0(10) . . . . ?
C17C_2 C18C_2 N4C_2 C20C_2 47.5(10) . . . . ?
C17C_2 C18C_2 N4C_2 C19C_2 167.5(9) . . . . ?
C18C_2 N4C_2 C20C_2 O2_4 -139.6(12) . . . 2_567 ?
C21C_2 N4C_2 C20C_2 O2_4 -18.0(18) . . . 2_567 ?
C19C_2 N4C_2 C20C_2 O2_4 101.9(12) . . . 2_567 ?
C5_4 N1_4 C2_4 N3_4 -112.2(2) . . . . ?
C27_4 N1_4 C2_4 N3_4 98.4(2) 2_567 . . . ?
C5_4 N1_4 C2_4 C3_4 -0.6(3) . . . . ?
C27_4 N1_4 C2_4 C3_4 -150.0(2) 2_567 . . . ?
C5_4 N2_4 C3_4 N4_4 122.6(2) . . . . ?
C6_4 N2_4 C3_4 N4_4 -86.9(3) . . . . ?
C5_4 N2_4 C3_4 C2_4 11.4(3) . . . . ?
C6_4 N2_4 C3_4 C2_4 161.8(2) . . . . ?
N1_4 C2_4 C3_4 N4_4 -125.36(19) . . . . ?
N3_4 C2_4 C3_4 N4_4 -6.2(2) . . . . ?
N1_4 C2_4 C3_4 N2_4 -6.2(2) . . . . ?
N3_4 C2_4 C3_4 N2_4 113.0(2) . . . . ?
N18_4 C1_4 N3_4 C4_4 -142.6(2) 2_567 . . . ?
N18_4 C1_4 N3_4 C2_4 74.9(3) 2_567 . . . ?
N1_4 C2_4 N3_4 C4_4 122.1(2) . . . . ?
C3_4 C2_4 N3_4 C4_4 10.1(2) . . . . ?
N1_4 C2_4 N3_4 C1_4 -92.8(2) . . . . ?
C3_4 C2_4 N3_4 C1_4 155.22(19) . . . . ?
C1_4 N3_4 C4_4 O9_4 24.9(4) . . . . ?
C2_4 N3_4 C4_4 O9_4 170.5(2) . . . . ?
C1_4 N3_4 C4_4 N4_4 -155.9(2) . . . . ?
C2_4 N3_4 C4_4 N4_4 -10.3(3) . . . . ?
O9_4 C4_4 N4_4 C8_4 -14.8(4) . . . . ?
N3_4 C4_4 N4_4 C8_4 166.0(2) . . . . ?
O9_4 C4_4 N4_4 C3_4 -174.9(2) . . . . ?
N3_4 C4_4 N4_4 C3_4 5.9(3) . . . . ?
N2_4 C3_4 N4_4 C4_4 -110.8(2) . . . . ?
C2_4 C3_4 N4_4 C4_4 0.5(3) . . . . ?
N2_4 C3_4 N4_4 C8_4 88.9(2) . . . . ?
C2_4 C3_4 N4_4 C8_4 -159.80(19) . . . . ?
C6_4 N2_4 C5_4 O10_4 19.3(4) . . . . ?
C3_4 N2_4 C5_4 O10_4 169.5(2) . . . . ?
C6_4 N2_4 C5_4 N1_4 -162.4(2) . . . . ?
C3_4 N2_4 C5_4 N1_4 -12.2(3) . . . . ?
C2_4 N1_4 C5_4 O10_4 -174.0(2) . . . . ?
C27_4 N1_4 C5_4 O10_4 -24.6(4) 2_567 . . . ?
C2_4 N1_4 C5_4 N2_4 7.7(3) . . . . ?
C27_4 N1_4 C5_4 N2_4 157.0(2) 2_567 . . . ?
C12_4 N5_4 C6_4 N2_4 117.1(2) . . . . ?
C7_4 N5_4 C6_4 N2_4 -83.9(3) . . . . ?
C5_4 N2_4 C6_4 N5_4 -129.4(2) . . . . ?
C3_4 N2_4 C6_4 N5_4 83.0(3) . . . . ?
C9_4 N6_4 C7_4 N5_4 113.9(2) . . . . ?
C8_4 N6_4 C7_4 N5_4 -83.4(3) . . . . ?
C9_4 N6_4 C7_4 C11_4 2.5(2) . . . . ?
C8_4 N6_4 C7_4 C11_4 165.17(19) . . . . ?
C12_4 N5_4 C7_4 N6_4 -114.9(2) . . . . ?
C6_4 N5_4 C7_4 N6_4 84.2(3) . . . . ?
C12_4 N5_4 C7_4 C11_4 -3.2(3) . . . . ?
C6_4 N5_4 C7_4 C11_4 -164.1(2) . . . . ?
C4_4 N4_4 C8_4 N6_4 118.1(3) . . . . ?
C3_4 N4_4 C8_4 N6_4 -83.4(3) . . . . ?
C9_4 N6_4 C8_4 N4_4 -116.7(2) . . . . ?
C7_4 N6_4 C8_4 N4_4 81.8(3) . . . . ?
C7_4 N6_4 C9_4 O8_4 175.3(2) . . . . ?
C8_4 N6_4 C9_4 O8_4 12.0(3) . . . . ?
C7_4 N6_4 C9_4 N8_4 -3.6(2) . . . . ?
C8_4 N6_4 C9_4 N8_4 -166.82(19) . . . . ?
C10_4 N8_4 C9_4 O8_4 -1.6(4) . . . . ?
C11_4 N8_4 C9_4 O8_4 -175.6(2) . . . . ?
C10_4 N8_4 C9_4 N6_4 177.21(19) . . . . ?
C11_4 N8_4 C9_4 N6_4 3.2(2) . . . . ?
C12_4 N7_4 C11_4 N8_4 114.6(2) . . . . ?
C13_4 N7_4 C11_4 N8_4 -83.5(3) . . . . ?
C12_4 N7_4 C11_4 C7_4 4.0(3) . . . . ?
C13_4 N7_4 C11_4 C7_4 165.9(2) . . . . ?
C9_4 N8_4 C11_4 N7_4 -112.6(2) . . . . ?
C10_4 N8_4 C11_4 N7_4 73.5(3) . . . . ?
C9_4 N8_4 C11_4 C7_4 -1.6(2) . . . . ?
C10_4 N8_4 C11_4 C7_4 -175.50(19) . . . . ?
N6_4 C7_4 C11_4 N7_4 118.98(19) . . . . ?
N5_4 C7_4 C11_4 N7_4 -0.4(2) . . . . ?
N6_4 C7_4 C11_4 N8_4 -0.5(2) . . . . ?
N5_4 C7_4 C11_4 N8_4 -119.90(19) . . . . ?
C9_4 N8_4 C10_4 N9_4 106.4(2) . . . . ?
C11_4 N8_4 C10_4 N9_4 -80.3(3) . . . . ?
C15_4 N9_4 C10_4 N8_4 -108.3(2) . . . . ?
C14_4 N9_4 C10_4 N8_4 90.1(2) . . . . ?
C11_4 N7_4 C12_4 O7_4 174.5(2) . . . . ?
C13_4 N7_4 C12_4 O7_4 12.3(4) . . . . ?
C11_4 N7_4 C12_4 N5_4 -6.1(3) . . . . ?
C13_4 N7_4 C12_4 N5_4 -168.3(2) . . . . ?
C6_4 N5_4 C12_4 O7_4 -13.8(4) . . . . ?
C7_4 N5_4 C12_4 O7_4 -174.9(2) . . . . ?
C6_4 N5_4 C12_4 N7_4 166.8(2) . . . . ?
C7_4 N5_4 C12_4 N7_4 5.7(3) . . . . ?
C17_4 N10_4 C13_4 N7_4 108.8(2) . . . . ?
C14_4 N10_4 C13_4 N7_4 -82.2(2) . . . . ?
C12_4 N7_4 C13_4 N10_4 -107.2(2) . . . . ?
C11_4 N7_4 C13_4 N10_4 92.3(3) . . . . ?
C17_4 N10_4 C14_4 N9_4 -115.1(2) . . . . ?
C13_4 N10_4 C14_4 N9_4 74.8(2) . . . . ?
C17_4 N10_4 C14_4 C16_4 -3.3(2) . . . . ?
C13_4 N10_4 C14_4 C16_4 -173.45(17) . . . . ?
C15_4 N9_4 C14_4 N10_4 113.3(2) . . . . ?
C10_4 N9_4 C14_4 N10_4 -83.6(2) . . . . ?
C15_4 N9_4 C14_4 C16_4 1.6(2) . . . . ?
C10_4 N9_4 C14_4 C16_4 164.73(17) . . . . ?
C18_4 N12_4 C15_4 O6_4 -12.1(3) . . . . ?
C16_4 N12_4 C15_4 O6_4 -176.3(2) . . . . ?
C18_4 N12_4 C15_4 N9_4 168.12(17) . . . . ?
C16_4 N12_4 C15_4 N9_4 3.9(2) . . . . ?
C14_4 N9_4 C15_4 O6_4 176.8(2) . . . . ?
C10_4 N9_4 C15_4 O6_4 13.4(3) . . . . ?
C14_4 N9_4 C15_4 N12_4 -3.4(2) . . . . ?
C10_4 N9_4 C15_4 N12_4 -166.80(17) . . . . ?
C17_4 N11_4 C16_4 N12_4 115.73(19) . . . . ?
C20_4 N11_4 C16_4 N12_4 -90.9(2) . . . . ?
C17_4 N11_4 C16_4 C14_4 5.0(2) . . . . ?
C20_4 N11_4 C16_4 C14_4 158.37(16) . . . . ?
C15_4 N12_4 C16_4 N11_4 -113.97(19) . . . . ?
C18_4 N12_4 C16_4 N11_4 82.0(2) . . . . ?
C15_4 N12_4 C16_4 C14_4 -2.8(2) . . . . ?
C18_4 N12_4 C16_4 C14_4 -166.77(17) . . . . ?
N10_4 C14_4 C16_4 N11_4 -0.97(18) . . . . ?
N9_4 C14_4 C16_4 N11_4 119.26(16) . . . . ?
N10_4 C14_4 C16_4 N12_4 -119.58(16) . . . . ?
N9_4 C14_4 C16_4 N12_4 0.65(18) . . . . ?
C16_4 N11_4 C17_4 O5_4 174.10(19) . . . . ?
C20_4 N11_4 C17_4 O5_4 20.7(3) . . . . ?
C16_4 N11_4 C17_4 N10_4 -7.2(2) . . . . ?
C20_4 N11_4 C17_4 N10_4 -160.60(16) . . . . ?
C14_4 N10_4 C17_4 O5_4 -174.78(19) . . . . ?
C13_4 N10_4 C17_4 O5_4 -4.8(3) . . . . ?
C14_4 N10_4 C17_4 N11_4 6.5(2) . . . . ?
C13_4 N10_4 C17_4 N11_4 176.54(17) . . . . ?
C15_4 N12_4 C18_4 N14_4 118.1(2) . . . . ?
C16_4 N12_4 C18_4 N14_4 -79.3(2) . . . . ?
C21_4 N14_4 C18_4 N12_4 -131.2(2) . . . . ?
C19_4 N14_4 C18_4 N12_4 86.6(2) . . . . ?
C28_4 N13_4 C19_4 N14_4 -103.2(2) . . . . ?
C20_4 N13_4 C19_4 N14_4 80.1(2) . . . . ?
C28_4 N13_4 C19_4 C30_4 8.3(2) . . . . ?
C20_4 N13_4 C19_4 C30_4 -168.46(19) . . . . ?
C21_4 N14_4 C19_4 N13_4 125.85(17) . . . . ?
C18_4 N14_4 C19_4 N13_4 -89.1(2) . . . . ?
C21_4 N14_4 C19_4 C30_4 14.3(2) . . . . ?
C18_4 N14_4 C19_4 C30_4 159.37(17) . . . . ?
C28_4 N13_4 C20_4 N11_4 107.8(2) . . . . ?
C19_4 N13_4 C20_4 N11_4 -75.8(2) . . . . ?
C17_4 N11_4 C20_4 N13_4 -122.80(19) . . . . ?
C16_4 N11_4 C20_4 N13_4 86.1(2) . . . . ?
C30_4 N16_4 C21_4 O4_4 -178.4(2) . . . . ?
C22_4 N16_4 C21_4 O4_4 -18.4(3) . . . . ?
C30_4 N16_4 C21_4 N14_4 3.3(2) . . . . ?
C22_4 N16_4 C21_4 N14_4 163.32(17) . . . . ?
C18_4 N14_4 C21_4 O4_4 24.9(3) . . . . ?
C19_4 N14_4 C21_4 O4_4 170.1(2) . . . . ?
C18_4 N14_4 C21_4 N16_4 -156.87(18) . . . . ?
C19_4 N14_4 C21_4 N16_4 -11.6(2) . . . . ?
C29_4 N20_4 C22_4 N16_4 -135.5(2) . . . . ?
C24_4 N20_4 C22_4 N16_4 73.4(3) . . . . ?
C21_4 N16_4 C22_4 N20_4 120.7(2) . . . . ?
C30_4 N16_4 C22_4 N20_4 -81.2(2) . . . . ?
C26_4 N17_4 C23_4 N15_4 134.6(2) . . . . ?
C24_4 N17_4 C23_4 N15_4 -83.0(2) . . . . ?
C28_4 N15_4 C23_4 N17_4 -139.12(19) . . . . ?
C30_4 N15_4 C23_4 N17_4 77.0(2) . . . . ?
C29_4 N20_4 C24_4 N17_4 118.49(18) . . . . ?
C22_4 N20_4 C24_4 N17_4 -88.1(2) . . . . ?
C29_4 N20_4 C24_4 C25_4 5.4(2) . . . . ?
C22_4 N20_4 C24_4 C25_4 158.80(17) . . . . ?
C26_4 N17_4 C24_4 N20_4 -119.33(18) . . . . ?
C23_4 N17_4 C24_4 N20_4 95.3(2) . . . . ?
C26_4 N17_4 C24_4 C25_4 -6.7(2) . . . . ?
C23_4 N17_4 C24_4 C25_4 -152.14(17) . . . . ?
C25_4 N18_4 C26_4 O1_4 169.8(2) . . . . ?
C1_4 N18_4 C26_4 O1_4 25.8(3) 2_567 . . . ?
C25_4 N18_4 C26_4 N17_4 -9.7(3) . . . . ?
C1_4 N18_4 C26_4 N17_4 -153.70(19) 2_567 . . . ?
C23_4 N17_4 C26_4 O1_4 -23.8(3) . . . . ?
C24_4 N17_4 C26_4 O1_4 -169.2(2) . . . . ?
C23_4 N17_4 C26_4 N18_4 155.69(19) . . . . ?
C24_4 N17_4 C26_4 N18_4 10.3(2) . . . . ?
C29_4 N19_4 C27_4 N1_4 141.5(2) . . . 2_567 ?
C25_4 N19_4 C27_4 N1_4 -71.8(3) . . . 2_567 ?
C19_4 N13_4 C28_4 O3_4 -178.7(2) . . . . ?
C20_4 N13_4 C28_4 O3_4 -1.9(3) . . . . ?
C19_4 N13_4 C28_4 N15_4 1.0(2) . . . . ?
C20_4 N13_4 C28_4 N15_4 177.78(18) . . . . ?
C23_4 N15_4 C28_4 O3_4 21.8(3) . . . . ?
C30_4 N15_4 C28_4 O3_4 168.8(2) . . . . ?
C23_4 N15_4 C28_4 N13_4 -157.87(18) . . . . ?
C30_4 N15_4 C28_4 N13_4 -10.9(2) . . . . ?
C20C_2 O2_4 C29_4 N19_4 -72.2(4) 2_567 . . . ?
C20C_2 O2_4 C29_4 N20_4 108.0(4) 2_567 . . . ?
C25_4 N19_4 C29_4 O2_4 -169.1(2) . . . . ?
C27_4 N19_4 C29_4 O2_4 -19.5(3) . . . . ?
C25_4 N19_4 C29_4 N20_4 10.7(2) . . . . ?
C27_4 N19_4 C29_4 N20_4 160.30(19) . . . . ?
C22_4 N20_4 C29_4 O2_4 16.1(3) . . . . ?
C24_4 N20_4 C29_4 O2_4 169.8(2) . . . . ?
C22_4 N20_4 C29_4 N19_4 -163.68(19) . . . . ?
C24_4 N20_4 C29_4 N19_4 -10.0(2) . . . . ?
C21_4 N16_4 C30_4 N15_4 -104.93(19) . . . . ?
C22_4 N16_4 C30_4 N15_4 95.2(2) . . . . ?
C21_4 N16_4 C30_4 C19_4 5.5(2) . . . . ?
C22_4 N16_4 C30_4 C19_4 -154.44(16) . . . . ?
C28_4 N15_4 C30_4 N16_4 125.81(18) . . . . ?
C23_4 N15_4 C30_4 N16_4 -87.5(2) . . . . ?
C28_4 N15_4 C30_4 C19_4 15.3(2) . . . . ?
C23_4 N15_4 C30_4 C19_4 162.01(17) . . . . ?
N13_4 C19_4 C30_4 N16_4 -131.84(16) . . . . ?
N14_4 C19_4 C30_4 N16_4 -11.46(19) . . . . ?
N13_4 C19_4 C30_4 N15_4 -13.6(2) . . . . ?
N14_4 C19_4 C30_4 N15_4 106.78(17) . . . . ?
C29_4 N19_4 C25_4 N18_4 -119.38(19) . . . . ?
C27_4 N19_4 C25_4 N18_4 91.6(2) . . . . ?
C29_4 N19_4 C25_4 C24_4 -7.1(2) . . . . ?
C27_4 N19_4 C25_4 C24_4 -156.09(18) . . . . ?
C26_4 N18_4 C25_4 N19_4 117.8(2) . . . . ?
C1_4 N18_4 C25_4 N19_4 -98.0(2) 2_567 . . . ?
C26_4 N18_4 C25_4 C24_4 5.2(2) . . . . ?
C1_4 N18_4 C25_4 C24_4 149.41(18) 2_567 . . . ?
N20_4 C24_4 C25_4 N19_4 1.0(2) . . . . ?
N17_4 C24_4 C25_4 N19_4 -119.39(17) . . . . ?
N20_4 C24_4 C25_4 N18_4 121.25(17) . . . . ?
N17_4 C24_4 C25_4 N18_4 0.9(2) . . . . ?
N19_5 C1_5 N1_5 C5_5 -125.3(2) 2_776 . . . ?
N19_5 C1_5 N1_5 C2_5 82.8(2) 2_776 . . . ?
C5_5 N1_5 C2_5 N3_5 123.64(19) . . . . ?
C1_5 N1_5 C2_5 N3_5 -81.9(2) . . . . ?
C5_5 N1_5 C2_5 C3_5 11.4(2) . . . . ?
C1_5 N1_5 C2_5 C3_5 165.84(18) . . . . ?
C5_5 N2_5 C3_5 N4_5 -111.94(19) . . . . ?
C6_5 N2_5 C3_5 N4_5 94.5(2) . . . . ?
C5_5 N2_5 C3_5 C2_5 -0.4(2) . . . . ?
C6_5 N2_5 C3_5 C2_5 -153.96(18) . . . . ?
N3_5 C2_5 C3_5 N2_5 -126.27(17) . . . . ?
N1_5 C2_5 C3_5 N2_5 -6.3(2) . . . . ?
N3_5 C2_5 C3_5 N4_5 -6.84(19) . . . . ?
N1_5 C2_5 C3_5 N4_5 113.14(17) . . . . ?
N1_5 C2_5 N3_5 C4_5 -110.25(19) . . . . ?
C3_5 C2_5 N3_5 C4_5 1.1(2) . . . . ?
N1_5 C2_5 N3_5 C28_5 85.2(2) . . . 2_776 ?
C3_5 C2_5 N3_5 C28_5 -163.37(18) . . . 2_776 ?
C2_5 N3_5 C4_5 O9_5 -175.1(2) . . . . ?
C28_5 N3_5 C4_5 O9_5 -10.6(3) 2_776 . . . ?
C2_5 N3_5 C4_5 N4_5 5.5(2) . . . . ?
C28_5 N3_5 C4_5 N4_5 169.92(18) 2_776 . . . ?
O9_5 C4_5 N4_5 C7_5 25.5(3) . . . . ?
N3_5 C4_5 N4_5 C7_5 -155.07(17) . . . . ?
O9_5 C4_5 N4_5 C3_5 170.16(19) . . . . ?
N3_5 C4_5 N4_5 C3_5 -10.4(2) . . . . ?
N2_5 C3_5 N4_5 C4_5 122.79(18) . . . . ?
C2_5 C3_5 N4_5 C4_5 10.6(2) . . . . ?
N2_5 C3_5 N4_5 C7_5 -93.4(2) . . . . ?
C2_5 C3_5 N4_5 C7_5 154.43(16) . . . . ?
C1_5 N1_5 C5_5 O10_5 13.8(3) . . . . ?
C2_5 N1_5 C5_5 O10_5 168.1(2) . . . . ?
C1_5 N1_5 C5_5 N2_5 -166.49(18) . . . . ?
C2_5 N1_5 C5_5 N2_5 -12.2(2) . . . . ?
C3_5 N2_5 C5_5 O10_5 -172.7(2) . . . . ?
C6_5 N2_5 C5_5 O10_5 -19.1(3) . . . . ?
C3_5 N2_5 C5_5 N1_5 7.6(2) . . . . ?
C6_5 N2_5 C5_5 N1_5 161.15(18) . . . . ?
C5_5 N2_5 C6_5 N6_5 133.44(19) . . . . ?
C3_5 N2_5 C6_5 N6_5 -75.5(2) . . . . ?
N2_5 C6_5 N6_5 C10_5 -138.00(19) . . . . ?
N2_5 C6_5 N6_5 C8_5 73.9(2) . . . . ?
C4_5 N4_5 C7_5 N5_5 -142.02(18) . . . . ?
C3_5 N4_5 C7_5 N5_5 76.5(2) . . . . ?
C11_5 N5_5 C7_5 N4_5 143.65(18) . . . . ?
C8_5 N5_5 C7_5 N4_5 -76.9(2) . . . . ?
C10_5 N6_5 C8_5 N5_5 116.21(18) . . . . ?
C6_5 N6_5 C8_5 N5_5 -93.2(2) . . . . ?
C10_5 N6_5 C8_5 C9_5 3.5(2) . . . . ?
C6_5 N6_5 C8_5 C9_5 154.18(17) . . . . ?
C11_5 N5_5 C8_5 N6_5 -123.60(17) . . . . ?
C7_5 N5_5 C8_5 N6_5 94.4(2) . . . . ?
C11_5 N5_5 C8_5 C9_5 -10.96(19) . . . . ?
C7_5 N5_5 C8_5 C9_5 -152.98(16) . . . . ?
C11_5 N7_5 C9_5 N8_5 115.65(17) . . . . ?
C12_5 N7_5 C9_5 N8_5 -99.29(19) . . . . ?
C11_5 N7_5 C9_5 C8_5 2.95(19) . . . . ?
C12_5 N7_5 C9_5 C8_5 148.01(15) . . . . ?
C10_5 N8_5 C9_5 N7_5 -124.07(18) . . . . ?
C13_5 N8_5 C9_5 N7_5 91.7(2) . . . . ?
C10_5 N8_5 C9_5 C8_5 -11.1(2) . . . . ?
C13_5 N8_5 C9_5 C8_5 -155.37(17) . . . . ?
N6_5 C8_5 C9_5 N7_5 125.18(16) . . . . ?
N5_5 C8_5 C9_5 N7_5 4.69(18) . . . . ?
N6_5 C8_5 C9_5 N8_5 4.42(19) . . . . ?
N5_5 C8_5 C9_5 N8_5 -116.07(16) . . . . ?
C9_5 N8_5 C10_5 O8_5 -165.2(2) . . . . ?
C13_5 N8_5 C10_5 O8_5 -20.7(3) . . . . ?
C9_5 N8_5 C10_5 N6_5 13.9(2) . . . . ?
C13_5 N8_5 C10_5 N6_5 158.39(17) . . . . ?
C8_5 N6_5 C10_5 O8_5 168.4(2) . . . . ?
C6_5 N6_5 C10_5 O8_5 17.3(3) . . . . ?
C8_5 N6_5 C10_5 N8_5 -10.7(2) . . . . ?
C6_5 N6_5 C10_5 N8_5 -161.77(17) . . . . ?
C7_5 N5_5 C11_5 O7_5 -24.3(3) . . . . ?
C8_5 N5_5 C11_5 O7_5 -167.07(18) . . . . ?
C7_5 N5_5 C11_5 N7_5 156.00(16) . . . . ?
C8_5 N5_5 C11_5 N7_5 13.2(2) . . . . ?
C9_5 N7_5 C11_5 O7_5 170.37(18) . . . . ?
C12_5 N7_5 C11_5 O7_5 25.5(3) . . . . ?
C9_5 N7_5 C11_5 N5_5 -9.9(2) . . . . ?
C12_5 N7_5 C11_5 N5_5 -154.81(16) . . . . ?
C16_5 N9_5 C12_5 N7_5 140.34(18) . . . . ?
C14_5 N9_5 C12_5 N7_5 -73.4(2) . . . . ?
C11_5 N7_5 C12_5 N9_5 -138.90(17) . . . . ?
C9_5 N7_5 C12_5 N9_5 78.9(2) . . . . ?
C17_5 N10_5 C13_5 N8_5 -133.3(2) . . . . ?
C14_5 N10_5 C13_5 N8_5 78.6(2) . . . . ?
C10_5 N8_5 C13_5 N10_5 147.53(18) . . . . ?
C9_5 N8_5 C13_5 N10_5 -71.1(2) . . . . ?
C17_5 N10_5 C14_5 N9_5 113.0(2) . . . . ?
C13_5 N10_5 C14_5 N9_5 -96.6(2) . . . . ?
C17_5 N10_5 C14_5 C15_5 1.4(2) . . . . ?
C13_5 N10_5 C14_5 C15_5 151.75(18) . . . . ?
C16_5 N9_5 C14_5 N10_5 -121.47(18) . . . . ?
C12_5 N9_5 C14_5 N10_5 89.8(2) . . . . ?
C16_5 N9_5 C14_5 C15_5 -9.3(2) . . . . ?
C12_5 N9_5 C14_5 C15_5 -157.97(18) . . . . ?
C16_5 N11_5 C15_5 N12_5 112.3(2) . . . . ?
C18_5 N11_5 C15_5 N12_5 -82.0(3) . . . . ?
C16_5 N11_5 C15_5 C14_5 0.9(2) . . . . ?
C18_5 N11_5 C15_5 C14_5 166.65(18) . . . . ?
C17_5 N12_5 C15_5 N11_5 -120.9(2) . . . . ?
C19_5 N12_5 C15_5 N11_5 84.5(3) . . . . ?
C17_5 N12_5 C15_5 C14_5 -9.1(3) . . . . ?
C19_5 N12_5 C15_5 C14_5 -163.7(2) . . . . ?
N10_5 C14_5 C15_5 N11_5 124.18(18) . . . . ?
N9_5 C14_5 C15_5 N11_5 4.9(2) . . . . ?
N10_5 C14_5 C15_5 N12_5 4.4(2) . . . . ?
N9_5 C14_5 C15_5 N12_5 -114.88(19) . . . . ?
C15_5 N11_5 C16_5 O6_5 172.5(2) . . . . ?
C18_5 N11_5 C16_5 O6_5 6.5(3) . . . . ?
C15_5 N11_5 C16_5 N9_5 -6.8(2) . . . . ?
C18_5 N11_5 C16_5 N9_5 -172.68(18) . . . . ?
C12_5 N9_5 C16_5 O6_5 -19.6(3) . . . . ?
C14_5 N9_5 C16_5 O6_5 -169.00(19) . . . . ?
C12_5 N9_5 C16_5 N11_5 159.60(17) . . . . ?
C14_5 N9_5 C16_5 N11_5 10.2(2) . . . . ?
C14_5 N10_5 C17_5 O5_5 174.3(3) . . . . ?
C13_5 N10_5 C17_5 O5_5 23.4(4) . . . . ?
C14_5 N10_5 C17_5 N12_5 -7.1(3) . . . . ?
C13_5 N10_5 C17_5 N12_5 -158.0(2) . . . . ?
C19_5 N12_5 C17_5 O5_5 -16.3(5) . . . . ?
C15_5 N12_5 C17_5 O5_5 -171.1(3) . . . . ?
C19_5 N12_5 C17_5 N10_5 165.2(3) . . . . ?
C15_5 N12_5 C17_5 N10_5 10.4(3) . . . . ?
C23_5 N13_5 C18_5 N11_5 109.3(2) . . . . ?
C21_5 N13_5 C18_5 N11_5 -83.0(2) . . . . ?
C16_5 N11_5 C18_5 N13_5 -115.1(2) . . . . ?
C15_5 N11_5 C18_5 N13_5 80.6(3) . . . . ?
C17_5 N12_5 C19_5 N14_5 122.0(3) . . . . ?
C15_5 N12_5 C19_5 N14_5 -85.7(4) . . . . ?
C20_5 N14_5 C19_5 N12_5 -124.4(3) . . . . ?
C21_5 N14_5 C19_5 N12_5 86.6(3) . . . . ?
C22_5 N16_5 C20_5 O4_5 -178.9(3) . . . . ?
C30_5 N16_5 C20_5 O4_5 -1.5(4) . . . . ?
C22_5 N16_5 C20_5 N14_5 1.5(3) . . . . ?
C30_5 N16_5 C20_5 N14_5 178.9(2) . . . . ?
C19_5 N14_5 C20_5 O4_5 20.1(4) . . . . ?
C21_5 N14_5 C20_5 O4_5 171.7(3) . . . . ?
C19_5 N14_5 C20_5 N16_5 -160.3(2) . . . . ?
C21_5 N14_5 C20_5 N16_5 -8.7(3) . . . . ?
C23_5 N13_5 C21_5 N14_5 -105.7(2) . . . . ?
C18_5 N13_5 C21_5 N14_5 85.5(3) . . . . ?
C23_5 N13_5 C21_5 C22_5 4.0(2) . . . . ?
C18_5 N13_5 C21_5 C22_5 -164.79(18) . . . . ?
C20_5 N14_5 C21_5 N13_5 122.3(2) . . . . ?
C19_5 N14_5 C21_5 N13_5 -86.3(3) . . . . ?
C20_5 N14_5 C21_5 C22_5 11.6(3) . . . . ?
C19_5 N14_5 C21_5 C22_5 163.0(2) . . . . ?
C20_5 N16_5 C22_5 N15_5 -105.6(2) . . . . ?
C30_5 N16_5 C22_5 N15_5 77.0(3) . . . . ?
C20_5 N16_5 C22_5 C21_5 5.6(3) . . . . ?
C30_5 N16_5 C22_5 C21_5 -171.7(2) . . . . ?
C23_5 N15_5 C22_5 N16_5 121.4(2) . . . . ?
C24_5 N15_5 C22_5 N16_5 -86.4(2) . . . . ?
C23_5 N15_5 C22_5 C21_5 9.8(2) . . . . ?
C24_5 N15_5 C22_5 C21_5 162.00(18) . . . . ?
N13_5 C21_5 C22_5 N16_5 -127.35(18) . . . . ?
N14_5 C21_5 C22_5 N16_5 -9.8(2) . . . . ?
N13_5 C21_5 C22_5 N15_5 -8.0(2) . . . . ?
N14_5 C21_5 C22_5 N15_5 109.52(19) . . . . ?
C21_5 N13_5 C23_5 O3_5 -178.5(2) . . . . ?
C18_5 N13_5 C23_5 O3_5 -9.7(3) . . . . ?
C21_5 N13_5 C23_5 N15_5 2.0(2) . . . . ?
C18_5 N13_5 C23_5 N15_5 170.82(18) . . . . ?
C24_5 N15_5 C23_5 O3_5 20.3(3) . . . . ?
C22_5 N15_5 C23_5 O3_5 172.7(2) . . . . ?
C24_5 N15_5 C23_5 N13_5 -160.19(18) . . . . ?
C22_5 N15_5 C23_5 N13_5 -7.8(2) . . . . ?
C27_5 N17_5 C24_5 N15_5 105.8(2) . . . . ?
C25_5 N17_5 C24_5 N15_5 -78.9(3) . . . . ?
C23_5 N15_5 C24_5 N17_5 -120.2(2) . . . . ?
C22_5 N15_5 C24_5 N17_5 90.0(2) . . . . ?
C29_5 N18_5 C25_5 N17_5 116.6(2) . . . . ?
C30_5 N18_5 C25_5 N17_5 -85.1(3) . . . . ?
C29_5 N18_5 C25_5 C26_5 5.5(2) . . . . ?
C30_5 N18_5 C25_5 C26_5 163.8(2) . . . . ?
C27_5 N17_5 C25_5 N18_5 -110.4(2) . . . . ?
C24_5 N17_5 C25_5 N18_5 73.9(3) . . . . ?
C27_5 N17_5 C25_5 C26_5 1.0(2) . . . . ?
C24_5 N17_5 C25_5 C26_5 -174.72(19) . . . . ?
C27_5 N19_5 C26_5 N20_5 114.7(2) . . . . ?
C1_5 N19_5 C26_5 N20_5 -82.7(3) 2_776 . . . ?
C27_5 N19_5 C26_5 C25_5 4.4(2) . . . . ?
C1_5 N19_5 C26_5 C25_5 167.01(19) 2_776 . . . ?
C29_5 N20_5 C26_5 N19_5 -112.2(2) . . . . ?
C28_5 N20_5 C26_5 N19_5 79.6(3) . . . . ?
C29_5 N20_5 C26_5 C25_5 -1.4(2) . . . . ?
C28_5 N20_5 C26_5 C25_5 -169.6(2) . . . . ?
N18_5 C25_5 C26_5 N19_5 116.70(19) . . . . ?
N17_5 C25_5 C26_5 N19_5 -3.1(2) . . . . ?
N18_5 C25_5 C26_5 N20_5 -2.3(2) . . . . ?
N17_5 C25_5 C26_5 N20_5 -122.14(19) . . . . ?
C25_5 N17_5 C27_5 O2_5 -177.6(2) . . . . ?
C24_5 N17_5 C27_5 O2_5 -1.8(3) . . . . ?
C25_5 N17_5 C27_5 N19_5 1.7(2) . . . . ?
C24_5 N17_5 C27_5 N19_5 177.48(19) . . . . ?
C26_5 N19_5 C27_5 O2_5 175.3(2) . . . . ?
C1_5 N19_5 C27_5 O2_5 12.2(3) 2_776 . . . ?
C26_5 N19_5 C27_5 N17_5 -4.0(2) . . . . ?
C1_5 N19_5 C27_5 N17_5 -167.16(18) 2_776 . . . ?
C29_5 N20_5 C28_5 N3_5 110.2(3) . . . 2_776 ?
C26_5 N20_5 C28_5 N3_5 -82.4(3) . . . 2_776 ?
C26_5 N20_5 C29_5 O1_5 -176.1(2) . . . . ?
C28_5 N20_5 C29_5 O1_5 -7.4(4) . . . . ?
C26_5 N20_5 C29_5 N18_5 4.7(3) . . . . ?
C28_5 N20_5 C29_5 N18_5 173.36(19) . . . . ?
C25_5 N18_5 C29_5 O1_5 174.3(2) . . . . ?
C30_5 N18_5 C29_5 O1_5 15.3(4) . . . . ?
C25_5 N18_5 C29_5 N20_5 -6.5(3) . . . . ?
C30_5 N18_5 C29_5 N20_5 -165.5(2) . . . . ?
C20_5 N16_5 C30_5 N18_5 103.1(3) . . . . ?
C22_5 N16_5 C30_5 N18_5 -79.7(3) . . . . ?
C29_5 N18_5 C30_5 N16_5 -113.6(3) . . . . ?
C25_5 N18_5 C30_5 N16_5 89.5(3) . . . . ?
F3_6 C1_6 S2_6 O2_6 172.3(4) . . . . ?
F1_6 C1_6 S2_6 O2_6 -53.6(3) . . . . ?
F2_6 C1_6 S2_6 O2_6 62.6(3) . . . . ?
F3_6 C1_6 S2_6 O3_6 41.4(4) . . . . ?
F1_6 C1_6 S2_6 O3_6 175.5(3) . . . . ?
F2_6 C1_6 S2_6 O3_6 -68.3(3) . . . . ?
F3_6 C1_6 S2_6 O1_6 -75.0(4) . . . . ?
F1_6 C1_6 S2_6 O1_6 59.1(3) . . . . ?
F2_6 C1_6 S2_6 O1_6 175.3(2) . . . . ?
F7_6 C2_6 S3_6 O8_6 58.5(2) . . . . ?
F9_6 C2_6 S3_6 O8_6 -62.4(2) . . . . ?
F8_6 C2_6 S3_6 O8_6 177.1(2) . . . . ?
F7_6 C2_6 S3_6 O9_6 178.93(18) . . . . ?
F9_6 C2_6 S3_6 O9_6 58.0(2) . . . . ?
F8_6 C2_6 S3_6 O9_6 -62.4(2) . . . . ?
F7_6 C2_6 S3_6 O7_6 -61.6(2) . . . . ?
F9_6 C2_6 S3_6 O7_6 177.5(2) . . . . ?
F8_6 C2_6 S3_6 O7_6 57.1(2) . . . . ?
O5_6 S1_6 C3_6 F5_6 58.1(2) . . . . ?
O4_6 S1_6 C3_6 F5_6 -62.5(2) . . . . ?
O6_6 S1_6 C3_6 F5_6 179.47(19) . . . . ?
O5_6 S1_6 C3_6 F4_6 -179.52(19) . . . . ?
O4_6 S1_6 C3_6 F4_6 59.9(2) . . . . ?
O6_6 S1_6 C3_6 F4_6 -58.1(2) . . . . ?
O5_6 S1_6 C3_6 F6_6 -61.2(2) . . . . ?
O4_6 S1_6 C3_6 F6_6 178.30(17) . . . . ?
O6_6 S1_6 C3_6 F6_6 60.2(2) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
_geom_hbond_publ_flag
C2_1 H2_1 O2_5 0.93 2.45 3.274(4) 148.3 2_776 yes
C2B_2^b H2B_2^b O7_4 0.93 2.39 3.277(5) 158.4 . yes
C20B_2^b H20F_2^b O2_4 0.96 2.39 3.074(10) 128.2 2_567 yes
C20C_2^c H20H_2^c N19_4 0.96 2.30 2.913(10) 120.7 2_567 yes
C20C_2^c H20H_2^c N20_4 0.96 2.48 3.232(12) 135.5 2_567 yes
C21C_2^c H21I_2^c O4_4 0.96 1.80 2.371(11) 115.0 2_567 yes
C2_4 H2_4 O3_6 0.98 2.43 3.303(4) 148.4 1_556 yes
C14_4 H14_4 F9_6 0.98 2.59 3.338(3) 133.0 . yes
C19_4 H19_4 F6_6 0.98 2.50 3.209(3) 129.3 . yes
C23_4 H23B_4 O6_6 0.97 2.43 2.968(3) 114.6 . yes
C24_4 H24_4 O7_5 0.98 2.43 3.069(2) 122.2 2_666 yes
C24_4 H24_4 O4_6 0.98 2.60 3.137(3) 114.3 2_566 yes
C30_4 H30_4 O6_5 0.98 2.62 3.424(3) 139.1 2_666 yes
C25_4 H25_4 O4_6 0.98 2.51 3.080(3) 117.0 2_566 yes
C2_5 H2_5 F2_6 0.98 2.42 3.249(4) 141.6 1_655 yes
C2_5 H2_5 O7_6 0.98 2.59 3.233(3) 122.9 1_655 yes
C7_5 H7A_5 O3_6 0.97 2.63 3.155(3) 114.1 1_655 yes
C7_5 H7A_5 O4_6 0.97 2.65 3.193(3) 115.8 1_655 yes
C9_5 H9_5 O3_4 0.98 2.38 2.989(3) 119.8 1_655 yes
C9_5 H9_5 O6_6 0.98 2.48 3.251(3) 135.1 1_655 yes
C12_5 H12B_5 O5_6 0.97 2.55 3.228(3) 126.6 2_666 yes
C13_5 H13A_5 O3_4 0.97 2.50 3.189(3) 127.9 1_655 yes
C14_5 H14_5 O5_6 0.98 2.31 2.948(3) 122.3 2_666 yes
C18_5 H18A_5 F8_6 0.97 2.49 3.193(3) 128.9 . yes

_refine_diff_density_max         5.493
_refine_diff_density_min         -4.631
_refine_diff_density_rms         0.171



_exptl_crystal_recrystallization_method 'Re-crystallisation from solvent: water'
