# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2022

####################################################################### 
# 
# 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_shelx
_database_code_depnum_ccdc_archive 'CCDC 2083988'
loop_
_audit_author_name
_audit_author_address
'Akhil R. Chakravarty'
;Indian Institute of Science
India
;
_audit_update_record             
;
2021-05-16 deposited with the CCDC.	2022-02-01 downloaded from the CCDC.
;
_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C34 H32 B Cl2 F2 N6 O4 Pt'
_chemical_formula_weight         903.45

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_H-M_alt        'P 2/c'
_space_group_name_Hall           '-P 2yc'

_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+1/2'
'-x, -y, -z'
'x, -y, z-1/2'

_cell_length_a                   19.1358(7)
_cell_length_b                   15.9715(6)
_cell_length_c                   24.4234(8)
_cell_angle_alpha                90
_cell_angle_beta                 109.955(2)
_cell_angle_gamma                90
_cell_volume                     7016.3(4)
_cell_formula_units_Z            8
_cell_measurement_temperature    100
_cell_measurement_reflns_used    200
_cell_measurement_theta_min      3.1
_cell_measurement_theta_max      30.6

_exptl_crystal_description       Bloc
_exptl_crystal_colour            Orange
_exptl_crystal_density_meas      1.71
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.711
_exptl_crystal_F_000             3560
_exptl_transmission_factor_min   0.2762
_exptl_transmission_factor_max   0.5644
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.12
_exptl_absorpt_coefficient_mu    4.210
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   SADABS
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'Rotating Anode'
_diffrn_measurement_device_type  'Rotating Anode'
_diffrn_measurement_method       'φ and ω Scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            160362
_diffrn_reflns_av_unetI/netI     0.0463
_diffrn_reflns_av_R_equivalents  0.0744
_diffrn_reflns_limit_h_min       -27
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -34
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_theta_min         3.108
_diffrn_reflns_theta_max         30.636
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.997
_reflns_number_total             21539
_reflns_number_gt                16194
_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       'Bruker Apex 2'
_computing_cell_refinement       'Bruker Apex 2'
_computing_data_reduction        'Bruker Apex 2'
_computing_structure_solution    'Bruker Apex 2'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'ORTEP 3 for windows'
_computing_publication_material  WinGX
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           fullcycle
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0531P)²+33.8387P] 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         21539
_refine_ls_number_parameters     897
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0692
_refine_ls_R_factor_gt           0.0436
_refine_ls_wR_factor_ref         0.1217
_refine_ls_wR_factor_gt          0.1049
_refine_ls_goodness_of_fit_ref   0.963
_refine_ls_restrained_S_all      0.963
_refine_ls_shift/su_max          0.007
_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
Pt1A Pt 0.80531(2) 0.49167(2) 0.02456(2) 0.02813(5) Uani 1 1 d . . . . .
Pt1B Pt 0.70440(2) 0.26886(2) 0.48819(2) 0.03187(5) Uani 1 1 d . . . . .
Cl1A Cl 0.91109(7) 0.54107(8) 0.01197(6) 0.0365(3) Uani 1 1 d . . . . .
Cl2B Cl 0.59543(7) 0.32035(8) 0.49462(6) 0.0388(3) Uani 1 1 d . . . . .
Cl10 Cl 0.93048(7) 0.74390(8) 0.34146(5) 0.0366(2) Uani 1 1 d . . . . .
Cl11 Cl 0.56013(10) 0.49675(19) 0.16323(10) 0.0865(8) Uani 1 1 d . . . . .
F1A F 0.96003(15) 0.14787(17) 0.43495(12) 0.0311(6) Uani 1 1 d . . . . .
F2A F 1.06786(15) 0.16577(17) 0.41720(12) 0.0317(6) Uani 1 1 d . . . . .
F1B F 0.4589(2) -0.0543(2) 0.08266(15) 0.0555(10) Uani 1 1 d . . . . .
F2B F 0.5799(2) -0.0579(2) 0.08725(15) 0.0570(10) Uani 1 1 d . . . . .
O1 O 0.9694(2) 0.7784(2) 0.39807(17) 0.0450(9) Uani 1 1 d . . . . .
O2 O 0.9337(3) 0.6544(3) 0.3437(2) 0.0647(14) Uani 1 1 d . . . . .
O3 O 0.9632(3) 0.7734(4) 0.3007(2) 0.0695(14) Uani 1 1 d . . . . .
O4 O 0.8544(2) 0.7698(2) 0.32221(17) 0.0433(9) Uani 1 1 d . . . . .
O5 O 0.6357(8) 0.4889(10) 0.1922(7) 0.088(4) Uiso 0.5 1 d . . P . .
O6 O 0.5409(9) 0.5606(11) 0.1171(7) 0.101(5) Uiso 0.5 1 d . . P . .
O7 O 0.5725(8) 0.5841(9) 0.1807(6) 0.082(3) Uiso 0.5 1 d . . P . .
O8 O 0.5171(7) 0.4588(8) 0.1923(6) 0.085(3) Uiso 0.5 1 d . . P . .
O9 O 0.5544(9) 0.4112(10) 0.1156(7) 0.110(5) Uiso 0.5 1 d . . P . .
O10 O 0.6148(10) 0.4423(12) 0.1688(8) 0.117(5) Uiso 0.5 1 d . . P . .
O11 O 0.6109(17) 0.545(2) 0.2051(12) 0.191(10) Uiso 0.5 1 d . . P . .
O12 O 0.5092(14) 0.5222(16) 0.1131(11) 0.157(8) Uiso 0.5 1 d . . P . .
N1A N 0.7621(3) 0.4421(3) -0.05569(17) 0.0371(10) Uani 1 1 d . . . . .
N2A N 0.7093(2) 0.4502(2) 0.03333(17) 0.0282(8) Uani 1 1 d . . . . .
N3A N 0.8245(2) 0.5441(2) 0.10282(16) 0.0274(8) Uani 1 1 d . . . . .
N4A N 0.9705(2) 0.2672(2) 0.37744(16) 0.0240(7) Uani 1 1 d . . . . .
N5A N 0.9598(2) 0.1238(2) 0.33753(17) 0.0280(8) Uani 1 1 d . . . . .
N1B N 0.7415(3) 0.2178(3) 0.56754(19) 0.0403(10) Uani 1 1 d . . . . .
N2B N 0.8022(2) 0.2250(2) 0.4837(2) 0.0360(10) Uani 1 1 d . . . . .
N3B N 0.6926(2) 0.3216(3) 0.41130(19) 0.0343(9) Uani 1 1 d . . . . .
N4B N 0.5534(3) -0.0880(3) 0.1741(2) 0.0499(13) Uani 1 1 d . . . . .
N5B N 0.5405(2) 0.0547(3) 0.13496(17) 0.0318(8) Uani 1 1 d . . . . .
C1A C 0.7972(4) 0.4198(3) -0.0921(2) 0.0457(14) Uani 1 1 d . . . . .
H1A H 0.848599 0.425556 -0.080245 0.055 Uiso 1 1 calc R U . . .
C2A C 0.7597(5) 0.3886(4) -0.1466(2) 0.0564(19) Uani 1 1 d . . . . .
H2A H 0.784885 0.374255 -0.171778 0.068 Uiso 1 1 calc R U . . .
C3A C 0.6843(5) 0.3790(4) -0.1631(3) 0.0597(19) Uani 1 1 d . . . . .
H3A H 0.657668 0.358788 -0.200019 0.072 Uiso 1 1 calc R U . . .
C4A C 0.6477(4) 0.3994(3) -0.1249(2) 0.0496(16) Uani 1 1 d . . . . .
H4A H 0.596545 0.391978 -0.135599 0.060 Uiso 1 1 calc R U . . .
C5A C 0.6880(3) 0.4310(3) -0.0710(2) 0.0385(12) Uani 1 1 d . . . . .
C6A C 0.6543(3) 0.4610(3) -0.0273(2) 0.0377(11) Uani 1 1 d . . . . .
H6A1 H 0.609602 0.429265 -0.031463 0.045 Uiso 1 1 calc R U . . .
H6A2 H 0.640828 0.519552 -0.034302 0.045 Uiso 1 1 calc R U . . .
C7A C 0.6935(3) 0.5067(3) 0.0768(2) 0.0337(10) Uani 1 1 d . . . . .
H7A1 H 0.659627 0.550568 0.056243 0.040 Uiso 1 1 calc R U . . .
H7A2 H 0.669165 0.474673 0.098927 0.040 Uiso 1 1 calc R U . . .
C8A C 0.7628(3) 0.5457(3) 0.1179(2) 0.0317(10) Uani 1 1 d . . . . .
C9A C 0.7630(3) 0.5867(3) 0.1678(2) 0.0398(12) Uani 1 1 d . . . . .
H9A H 0.720368 0.587480 0.178016 0.048 Uiso 1 1 calc R U . . .
C10A C 0.8265(4) 0.6262(3) 0.2022(2) 0.0441(13) Uani 1 1 d . . . . .
H10A H 0.826909 0.655127 0.235409 0.053 Uiso 1 1 calc R U . . .
C11A C 0.8903(3) 0.6228(3) 0.1871(2) 0.0396(12) Uani 1 1 d . . . . .
H11A H 0.933976 0.648766 0.210092 0.047 Uiso 1 1 calc R U . . .
C12A C 0.8873(3) 0.5803(3) 0.1377(2) 0.0327(10) Uani 1 1 d . . . . .
H12A H 0.930081 0.576393 0.127879 0.039 Uiso 1 1 calc R U . . .
C13A C 0.7088(3) 0.3595(3) 0.0499(2) 0.0345(11) Uani 1 1 d . . . . .
H13A H 0.721061 0.325993 0.021327 0.041 Uiso 1 1 calc R U . . .
H13B H 0.658541 0.344818 0.047297 0.041 Uiso 1 1 calc R U . . .
C14A C 0.7606(3) 0.3349(3) 0.10960(19) 0.0284(9) Uani 1 1 d . . . . .
C15A C 0.8358(3) 0.3231(3) 0.1207(2) 0.0317(10) Uani 1 1 d . . . . .
H15A H 0.855843 0.335046 0.091898 0.038 Uiso 1 1 calc R U . . .
C16A C 0.8817(3) 0.2937(3) 0.1744(2) 0.0315(10) Uani 1 1 d . . . . .
H16A H 0.932232 0.286869 0.181394 0.038 Uiso 1 1 calc R U . . .
C17A C 0.8528(2) 0.2745(3) 0.21756(19) 0.0249(8) Uani 1 1 d . . . . .
C18A C 0.7774(3) 0.2862(3) 0.2068(2) 0.0306(9) Uani 1 1 d . . . . .
H18A H 0.757402 0.273918 0.235598 0.037 Uiso 1 1 calc R U . . .
C19A C 0.7316(3) 0.3163(3) 0.1532(2) 0.0318(10) Uani 1 1 d . . . . .
H19A H 0.681165 0.324052 0.146384 0.038 Uiso 1 1 calc R U . . .
C20A C 0.9010(2) 0.2412(3) 0.27561(19) 0.0252(8) Uani 1 1 d . . . . .
C21A C 0.9311(2) 0.2966(3) 0.32169(18) 0.0241(8) Uani 1 1 d . . . . .
C22A C 0.9297(3) 0.3862(3) 0.3245(2) 0.0282(9) Uani 1 1 d . . . . .
C23A C 0.8961(3) 0.4481(3) 0.2772(2) 0.0381(12) Uani 1 1 d . . . . .
H23A H 0.872968 0.419012 0.241076 0.057 Uiso 1 1 calc R U . . .
H23B H 0.859488 0.480659 0.286423 0.057 Uiso 1 1 calc R U . . .
H23C H 0.934217 0.484412 0.273463 0.057 Uiso 1 1 calc R U . . .
C24A C 0.9674(3) 0.4073(3) 0.3819(2) 0.0284(9) Uani 1 1 d . . . . .
H24A H 0.974861 0.461371 0.396874 0.034 Uiso 1 1 calc R U . . .
C25A C 0.9926(3) 0.3331(3) 0.41404(19) 0.0260(8) Uani 1 1 d . . . . .
C26A C 1.0356(3) 0.3237(3) 0.4771(2) 0.0302(9) Uani 1 1 d . . . . .
H26A H 1.045458 0.377962 0.495019 0.045 Uiso 1 1 calc R U . . .
H26B H 1.007276 0.291189 0.495266 0.045 Uiso 1 1 calc R U . . .
H26C H 1.081705 0.295792 0.481907 0.045 Uiso 1 1 calc R U . . .
C27A C 0.9659(3) 0.0405(3) 0.3330(2) 0.0324(10) Uani 1 1 d . . . . .
C28A C 1.0101(3) -0.0128(3) 0.3829(3) 0.0408(12) Uani 1 1 d . . . . .
H28A H 1.007327 -0.070133 0.370562 0.061 Uiso 1 1 calc R U . . .
H28B H 1.061058 0.005222 0.396147 0.061 Uiso 1 1 calc R U . . .
H28C H 0.990522 -0.007705 0.414029 0.061 Uiso 1 1 calc R U . . .
C29A C 0.9250(3) 0.0165(3) 0.2761(2) 0.0366(11) Uani 1 1 d . . . . .
H29A H 0.920303 -0.038045 0.261952 0.044 Uiso 1 1 calc R U . . .
C30A C 0.8926(3) 0.0863(3) 0.2440(2) 0.0325(10) Uani 1 1 d . . . . .
C31A C 0.8444(3) 0.0863(3) 0.1812(2) 0.0390(12) Uani 1 1 d . . . . .
H31A H 0.828877 0.142491 0.169144 0.059 Uiso 1 1 calc R U . . .
H31B H 0.871973 0.064456 0.158117 0.059 Uiso 1 1 calc R U . . .
H31C H 0.801527 0.051911 0.176172 0.059 Uiso 1 1 calc R U . . .
C32A C 0.7016(4) 0.1976(4) 0.6015(3) 0.0510(15) Uani 1 1 d . . . . .
H32A H 0.650144 0.203354 0.587112 0.061 Uiso 1 1 calc R U . . .
C1B C 0.7359(5) 0.1685(4) 0.6574(3) 0.062(2) Uani 1 1 d . . . . .
H1B H 0.708338 0.154567 0.681021 0.075 Uiso 1 1 calc R U . . .
C2B C 0.8130(5) 0.1606(4) 0.6776(3) 0.067(2) Uani 1 1 d . . . . .
H2B H 0.837584 0.143154 0.715643 0.080 Uiso 1 1 calc R U . . .
C3B C 0.8533(4) 0.1781(4) 0.6419(3) 0.0566(18) Uani 1 1 d . . . . .
H3B H 0.904584 0.171062 0.654978 0.068 Uiso 1 1 calc R U . . .
C4B C 0.8159(3) 0.2063(3) 0.5867(3) 0.0466(15) Uani 1 1 d . . . . .
C5B C 0.8546(3) 0.2334(4) 0.5451(3) 0.0455(14) Uani 1 1 d . . . . .
H5B1 H 0.870670 0.291138 0.552739 0.055 Uiso 1 1 calc R U . . .
H5B2 H 0.898131 0.198847 0.550566 0.055 Uiso 1 1 calc R U . . .
C6B C 0.8229(3) 0.2813(3) 0.4422(3) 0.0410(12) Uani 1 1 d . . . . .
H6B1 H 0.855838 0.325020 0.464164 0.049 Uiso 1 1 calc R U . . .
H6B2 H 0.849773 0.248944 0.422210 0.049 Uiso 1 1 calc R U . . .
C7B C 0.7570(3) 0.3204(3) 0.3984(2) 0.0386(11) Uani 1 1 d . . . . .
C8B C 0.7608(4) 0.3598(4) 0.3490(3) 0.0540(17) Uani 1 1 d . . . . .
H8B H 0.804774 0.358044 0.340729 0.065 Uiso 1 1 calc R U . . .
C9B C 0.7007(5) 0.4009(4) 0.3125(3) 0.0554(17) Uani 1 1 d . . . . .
H9B H 0.703317 0.428440 0.279713 0.066 Uiso 1 1 calc R U . . .
C10B C 0.9148(3) 0.1552(3) 0.28331(19) 0.0270(9) Uani 1 1 d . . . . .
C11B C 0.6370(4) 0.4010(3) 0.3250(3) 0.0527(17) Uani 1 1 d . . . . .
H11B H 0.595354 0.428539 0.300249 0.063 Uiso 1 1 calc R U . . .
C12B C 0.6329(3) 0.3605(3) 0.3741(2) 0.0394(12) Uani 1 1 d . . . . .
H12B H 0.588272 0.360197 0.381367 0.047 Uiso 1 1 calc R U . . .
C13B C 0.8008(3) 0.1350(3) 0.4656(2) 0.0367(11) Uani 1 1 d . . . . .
H13C H 0.787020 0.100940 0.493210 0.044 Uiso 1 1 calc R U . . .
H13D H 0.850784 0.119009 0.468387 0.044 Uiso 1 1 calc R U . . .
C14B C 0.7489(3) 0.1143(3) 0.4050(2) 0.0329(10) Uani 1 1 d . . . . .
C15B C 0.7770(3) 0.1007(3) 0.3605(2) 0.0359(11) Uani 1 1 d . . . . .
H15B H 0.827386 0.109228 0.367404 0.043 Uiso 1 1 calc R U . . .
C16B C 0.7310(3) 0.0745(3) 0.3056(2) 0.0379(11) Uani 1 1 d . . . . .
H16B H 0.750453 0.066150 0.275928 0.045 Uiso 1 1 calc R U . . .
C17B C 0.6560(3) 0.0608(3) 0.2955(2) 0.0314(10) Uani 1 1 d . . . . .
C18B C 0.6273(3) 0.0756(3) 0.3396(2) 0.0374(11) Uani 1 1 d . . . . .
H18B H 0.576826 0.068060 0.332668 0.045 Uiso 1 1 calc R U . . .
C19B C 0.6737(3) 0.1018(3) 0.3941(2) 0.0374(11) Uani 1 1 d . . . . .
H19B H 0.654069 0.110954 0.423627 0.045 Uiso 1 1 calc R U . . .
C20B C 0.6074(3) 0.0287(3) 0.2374(2) 0.0343(10) Uani 1 1 d . . . . .
C21B C 0.5954(3) -0.0570(3) 0.2296(2) 0.0452(14) Uani 1 1 d . . . . .
C22B C 0.6161(4) -0.1253(4) 0.2685(3) 0.064(2) Uani 1 1 d . . . . .
C23B C 0.6622(5) -0.1251(4) 0.3328(3) 0.081(3) Uani 1 1 d . . . . .
H23D H 0.678055 -0.069025 0.344995 0.121 Uiso 1 1 calc R U . . .
H23E H 0.632845 -0.146006 0.354751 0.121 Uiso 1 1 calc R U . . .
H23F H 0.705039 -0.160253 0.339323 0.121 Uiso 1 1 calc R U . . .
C24B C 0.5841(5) -0.1958(4) 0.2362(3) 0.083(3) Uani 1 1 d . . . . .
H24B H 0.586978 -0.250028 0.250728 0.099 Uiso 1 1 calc R U . . .
C25B C 0.5472(5) -0.1722(4) 0.1788(3) 0.071(2) Uani 1 1 d . . . . .
C26B C 0.5060(5) -0.2269(4) 0.1279(3) 0.083(3) Uani 1 1 d . . . . .
H26D H 0.508333 -0.284035 0.140489 0.124 Uiso 1 1 calc R U . . .
H26E H 0.455051 -0.209338 0.112307 0.124 Uiso 1 1 calc R U . . .
H26F H 0.528457 -0.222071 0.098347 0.124 Uiso 1 1 calc R U . . .
C27B C 0.5171(3) 0.1211(3) 0.0992(2) 0.0327(10) Uani 1 1 d . . . . .
C28B C 0.4784(3) 0.1113(4) 0.0352(2) 0.0423(12) Uani 1 1 d . . . . .
H28D H 0.466298 0.165552 0.017538 0.064 Uiso 1 1 calc R U . . .
H28E H 0.510352 0.082472 0.018564 0.064 Uiso 1 1 calc R U . . .
H28F H 0.433544 0.079633 0.028305 0.064 Uiso 1 1 calc R U . . .
C29B C 0.5364(3) 0.1950(3) 0.1317(2) 0.0328(10) Uani 1 1 d . . . . .
H29B H 0.525690 0.249092 0.117181 0.039 Uiso 1 1 calc R U . . .
C30B C 0.5744(3) 0.1736(3) 0.1897(2) 0.0309(9) Uani 1 1 d . . . . .
C31B C 0.6004(3) 0.2348(3) 0.2385(2) 0.0358(10) Uani 1 1 d . . . . .
H31D H 0.625005 0.205447 0.274191 0.054 Uiso 1 1 calc R U . . .
H31E H 0.634364 0.273513 0.230964 0.054 Uiso 1 1 calc R U . . .
H31F H 0.558478 0.264748 0.241717 0.054 Uiso 1 1 calc R U . . .
C32B C 0.5775(3) 0.0846(3) 0.1916(2) 0.0311(10) Uani 1 1 d . . . . .
C100 C 0.8538(4) 0.8883(4) 0.4492(3) 0.0473(14) Uani 1 1 d . . . . .
C101 C 0.8061(3) 0.8235(3) 0.4585(2) 0.0431(13) Uani 1 1 d . . . . .
N102 N 0.7685(3) 0.7723(3) 0.4657(2) 0.0536(14) Uani 1 1 d . . . . .
C200 C 0.6696(4) -0.1248(5) 0.5422(3) 0.0612(18) Uani 1 1 d . . . . .
C201 C 0.7148(5) -0.0509(4) 0.5449(3) 0.066(2) Uani 1 1 d . . . . .
N202 N 0.7514(7) 0.0045(5) 0.5469(3) 0.137(5) Uani 1 1 d . . . . .
B1A B 0.9915(3) 0.1751(3) 0.3942(2) 0.0263(9) Uani 1 1 d . . . . .
B1B B 0.5320(4) -0.0381(4) 0.1174(3) 0.0453(16) Uani 1 1 d . . . . .


_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
Pt1A N3A 2.003(4) . ?
Pt1A N1A 2.011(4) . ?
Pt1A N2A 2.032(4) . ?
Pt1A Cl1A 2.2888(13) . ?
Pt1B N1B 1.997(5) . ?
Pt1B N3B 1.999(5) . ?
Pt1B N2B 2.035(4) . ?
Pt1B Cl2B 2.2964(13) . ?
Cl10 O3 1.424(5) . ?
Cl10 O4 1.430(4) . ?
Cl10 O2 1.431(4) . ?
Cl10 O1 1.438(4) . ?
Cl11 O10 1.332(18) . ?
Cl11 O12 1.34(2) . ?
Cl11 O5 1.381(15) . ?
Cl11 O11 1.39(3) . ?
Cl11 O8 1.396(13) . ?
Cl11 O7 1.454(14) . ?
Cl11 O6 1.470(17) . ?
Cl11 O9 1.774(16) . ?
F1A B1A 1.397(6) . ?
F2A B1A 1.383(6) . ?
F1B B1B 1.390(7) . ?
F2B B1B 1.395(9) . ?
O5 O10 0.941(19) . ?
O5 O11 1.11(3) . ?
O6 O12 0.84(3) . ?
O6 O7 1.51(2) . ?
O7 O11 0.99(3) . ?
O9 O10 1.50(2) . ?
N1A C1A 1.333(7) . ?
N1A C5A 1.349(7) . ?
N2A C7A 1.500(6) . ?
N2A C6A 1.506(6) . ?
N2A C13A 1.506(6) . ?
N3A C12A 1.344(6) . ?
N3A C8A 1.351(6) . ?
N4A C25A 1.352(5) . ?
N4A C21A 1.393(5) . ?
N4A B1A 1.543(6) . ?
N5A C27A 1.344(6) . ?
N5A C10B 1.403(6) . ?
N5A B1A 1.543(6) . ?
N1B C32A 1.344(8) . ?
N1B C4B 1.352(7) . ?
N2B C5B 1.497(6) . ?
N2B C13B 1.502(6) . ?
N2B C6B 1.507(8) . ?
N3B C12B 1.344(7) . ?
N3B C7B 1.372(7) . ?
N4B C25B 1.359(8) . ?
N4B C21B 1.408(7) . ?
N4B B1B 1.527(8) . ?
N5B C27B 1.350(6) . ?
N5B C32B 1.406(6) . ?
N5B B1B 1.536(7) . ?
C1A C2A 1.373(8) . ?
C1A H1A 0.9300 . ?
C2A C3A 1.366(11) . ?
C2A H2A 0.9300 . ?
C3A C4A 1.383(10) . ?
C3A H3A 0.9300 . ?
C4A C5A 1.375(7) . ?
C4A H4A 0.9300 . ?
C5A C6A 1.500(8) . ?
C6A H6A1 0.9700 . ?
C6A H6A2 0.9700 . ?
C7A C8A 1.499(7) . ?
C7A H7A1 0.9700 . ?
C7A H7A2 0.9700 . ?
C8A C9A 1.383(7) . ?
C9A C10A 1.374(8) . ?
C9A H9A 0.9300 . ?
C10A C11A 1.392(9) . ?
C10A H10A 0.9300 . ?
C11A C12A 1.370(7) . ?
C11A H11A 0.9300 . ?
C12A H12A 0.9300 . ?
C13A C14A 1.509(6) . ?
C13A H13A 0.9700 . ?
C13A H13B 0.9700 . ?
C14A C15A 1.382(7) . ?
C14A C19A 1.390(7) . ?
C15A C16A 1.387(6) . ?
C15A H15A 0.9300 . ?
C16A C17A 1.381(6) . ?
C16A H16A 0.9300 . ?
C17A C18A 1.388(6) . ?
C17A C20A 1.500(6) . ?
C18A C19A 1.389(6) . ?
C18A H18A 0.9300 . ?
C19A H19A 0.9300 . ?
C20A C21A 1.392(6) . ?
C20A C10B 1.398(6) . ?
C21A C22A 1.434(6) . ?
C22A C24A 1.382(6) . ?
C22A C23A 1.489(6) . ?
C23A H23A 0.9600 . ?
C23A H23B 0.9600 . ?
C23A H23C 0.9600 . ?
C24A C25A 1.412(6) . ?
C24A H24A 0.9300 . ?
C25A C26A 1.486(6) . ?
C26A H26A 0.9600 . ?
C26A H26B 0.9600 . ?
C26A H26C 0.9600 . ?
C27A C29A 1.396(7) . ?
C27A C28A 1.490(7) . ?
C28A H28A 0.9600 . ?
C28A H28B 0.9600 . ?
C28A H28C 0.9600 . ?
C29A C30A 1.382(7) . ?
C29A H29A 0.9300 . ?
C30A C10B 1.426(6) . ?
C30A C31A 1.495(7) . ?
C31A H31A 0.9600 . ?
C31A H31B 0.9600 . ?
C31A H31C 0.9600 . ?
C32A C1B 1.378(8) . ?
C32A H32A 0.9300 . ?
C1B C2B 1.394(11) . ?
C1B H1B 0.9300 . ?
C2B C3B 1.374(11) . ?
C2B H2B 0.9300 . ?
C3B C4B 1.369(8) . ?
C3B H3B 0.9300 . ?
C4B C5B 1.511(10) . ?
C5B H5B1 0.9700 . ?
C5B H5B2 0.9700 . ?
C6B C7B 1.484(8) . ?
C6B H6B1 0.9700 . ?
C6B H6B2 0.9700 . ?
C7B C8B 1.384(9) . ?
C8B C9B 1.361(10) . ?
C8B H8B 0.9300 . ?
C9B C11B 1.353(10) . ?
C9B H9B 0.9300 . ?
C11B C12B 1.389(8) . ?
C11B H11B 0.9300 . ?
C12B H12B 0.9300 . ?
C13B C14B 1.511(6) . ?
C13B H13C 0.9700 . ?
C13B H13D 0.9700 . ?
C14B C15B 1.385(8) . ?
C14B C19B 1.386(7) . ?
C15B C16B 1.395(7) . ?
C15B H15B 0.9300 . ?
C16B C17B 1.389(7) . ?
C16B H16B 0.9300 . ?
C17B C18B 1.386(7) . ?
C17B C20B 1.496(6) . ?
C18B C19B 1.389(7) . ?
C18B H18B 0.9300 . ?
C19B H19B 0.9300 . ?
C20B C21B 1.390(7) . ?
C20B C32B 1.393(7) . ?
C21B C22B 1.411(8) . ?
C22B C24B 1.392(9) . ?
C22B C23B 1.516(9) . ?
C23B H23D 0.9600 . ?
C23B H23E 0.9600 . ?
C23B H23F 0.9600 . ?
C24B C25B 1.390(9) . ?
C24B H24B 0.9300 . ?
C25B C26B 1.502(9) . ?
C26B H26D 0.9600 . ?
C26B H26E 0.9600 . ?
C26B H26F 0.9600 . ?
C27B C29B 1.400(7) . ?
C27B C28B 1.492(7) . ?
C28B H28D 0.9600 . ?
C28B H28E 0.9600 . ?
C28B H28F 0.9600 . ?
C29B C30B 1.396(7) . ?
C29B H29B 0.9300 . ?
C30B C32B 1.423(7) . ?
C30B C31B 1.488(7) . ?
C31B H31D 0.9600 . ?
C31B H31E 0.9600 . ?
C31B H31F 0.9600 . ?
C100 C101 1.449(9) . ?
C101 N102 1.143(8) . ?
C200 C201 1.452(11) . ?
C201 N202 1.119(11) . ?

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
N3A Pt1A N1A 167.17(18) . . ?
N3A Pt1A N2A 85.01(16) . . ?
N1A Pt1A N2A 83.61(18) . . ?
N3A Pt1A Cl1A 95.86(12) . . ?
N1A Pt1A Cl1A 95.34(15) . . ?
N2A Pt1A Cl1A 178.01(11) . . ?
N1B Pt1B N3B 166.58(19) . . ?
N1B Pt1B N2B 83.3(2) . . ?
N3B Pt1B N2B 84.61(19) . . ?
N1B Pt1B Cl2B 96.31(15) . . ?
N3B Pt1B Cl2B 95.70(13) . . ?
N2B Pt1B Cl2B 178.80(11) . . ?
O3 Cl10 O4 108.4(3) . . ?
O3 Cl10 O2 109.5(3) . . ?
O4 Cl10 O2 109.1(3) . . ?
O3 Cl10 O1 109.7(3) . . ?
O4 Cl10 O1 109.9(3) . . ?
O2 Cl10 O1 110.1(3) . . ?
O10 Cl11 O12 126.4(13) . . ?
O10 Cl11 O5 40.5(8) . . ?
O12 Cl11 O5 143.4(12) . . ?
O10 Cl11 O11 87.9(14) . . ?
O12 Cl11 O11 127.7(17) . . ?
O5 Cl11 O11 47.5(12) . . ?
O10 Cl11 O8 104.1(10) . . ?
O12 Cl11 O8 103.0(12) . . ?
O5 Cl11 O8 113.3(8) . . ?
O11 Cl11 O8 104.8(13) . . ?
O10 Cl11 O7 123.5(10) . . ?
O12 Cl11 O7 88.4(12) . . ?
O5 Cl11 O7 84.2(9) . . ?
O11 Cl11 O7 40.6(12) . . ?
O8 Cl11 O7 109.4(8) . . ?
O10 Cl11 O6 120.9(10) . . ?
O12 Cl11 O6 34.6(11) . . ?
O5 Cl11 O6 113.5(9) . . ?
O11 Cl11 O6 96.0(14) . . ?
O8 Cl11 O6 130.9(9) . . ?
O7 Cl11 O6 62.1(8) . . ?
O10 Cl11 O9 55.5(9) . . ?
O12 Cl11 O9 76.8(12) . . ?
O5 Cl11 O9 94.9(9) . . ?
O11 Cl11 O9 142.0(14) . . ?
O8 Cl11 O9 94.9(8) . . ?
O7 Cl11 O9 154.0(7) . . ?
O6 Cl11 O9 95.1(9) . . ?
O10 O5 O11 133(3) . . ?
O10 O5 Cl11 66.9(15) . . ?
O11 O5 Cl11 66.4(17) . . ?
O12 O6 Cl11 64(2) . . ?
O12 O6 O7 109(3) . . ?
Cl11 O6 O7 58.4(8) . . ?
O11 O7 Cl11 66(2) . . ?
O11 O7 O6 115(2) . . ?
Cl11 O7 O6 59.5(8) . . ?
O10 O9 Cl11 47.1(8) . . ?
O5 O10 Cl11 72.6(16) . . ?
O5 O10 O9 146(2) . . ?
Cl11 O10 O9 77.4(12) . . ?
O7 O11 O5 129(3) . . ?
O7 O11 Cl11 73(2) . . ?
O5 O11 Cl11 66.1(18) . . ?
O6 O12 Cl11 81(2) . . ?
C1A N1A C5A 120.1(5) . . ?
C1A N1A Pt1A 128.5(4) . . ?
C5A N1A Pt1A 111.4(3) . . ?
C7A N2A C6A 112.7(4) . . ?
C7A N2A C13A 111.5(4) . . ?
C6A N2A C13A 108.0(4) . . ?
C7A N2A Pt1A 106.7(3) . . ?
C6A N2A Pt1A 102.2(3) . . ?
C13A N2A Pt1A 115.5(3) . . ?
C12A N3A C8A 119.7(4) . . ?
C12A N3A Pt1A 128.1(4) . . ?
C8A N3A Pt1A 112.1(3) . . ?
C25A N4A C21A 109.1(3) . . ?
C25A N4A B1A 124.9(4) . . ?
C21A N4A B1A 125.8(4) . . ?
C27A N5A C10B 108.6(4) . . ?
C27A N5A B1A 125.5(4) . . ?
C10B N5A B1A 125.7(4) . . ?
C32A N1B C4B 120.5(5) . . ?
C32A N1B Pt1B 127.5(4) . . ?
C4B N1B Pt1B 112.0(4) . . ?
C5B N2B C13B 108.6(4) . . ?
C5B N2B C6B 112.3(4) . . ?
C13B N2B C6B 110.8(4) . . ?
C5B N2B Pt1B 103.3(3) . . ?
C13B N2B Pt1B 114.9(3) . . ?
C6B N2B Pt1B 106.8(3) . . ?
C12B N3B C7B 118.3(5) . . ?
C12B N3B Pt1B 128.8(4) . . ?
C7B N3B Pt1B 112.8(4) . . ?
C25B N4B C21B 107.8(5) . . ?
C25B N4B B1B 126.0(5) . . ?
C21B N4B B1B 125.3(5) . . ?
C27B N5B C32B 108.3(4) . . ?
C27B N5B B1B 126.7(4) . . ?
C32B N5B B1B 124.9(4) . . ?
N1A C1A C2A 121.9(7) . . ?
N1A C1A H1A 119.1 . . ?
C2A C1A H1A 119.1 . . ?
C3A C2A C1A 118.4(6) . . ?
C3A C2A H2A 120.8 . . ?
C1A C2A H2A 120.8 . . ?
C2A C3A C4A 120.2(6) . . ?
C2A C3A H3A 119.9 . . ?
C4A C3A H3A 119.9 . . ?
C5A C4A C3A 118.9(7) . . ?
C5A C4A H4A 120.5 . . ?
C3A C4A H4A 120.5 . . ?
N1A C5A C4A 120.4(6) . . ?
N1A C5A C6A 115.3(4) . . ?
C4A C5A C6A 124.1(6) . . ?
C5A C6A N2A 109.7(4) . . ?
C5A C6A H6A1 109.7 . . ?
N2A C6A H6A1 109.7 . . ?
C5A C6A H6A2 109.7 . . ?
N2A C6A H6A2 109.7 . . ?
H6A1 C6A H6A2 108.2 . . ?
C8A C7A N2A 112.2(4) . . ?
C8A C7A H7A1 109.2 . . ?
N2A C7A H7A1 109.2 . . ?
C8A C7A H7A2 109.2 . . ?
N2A C7A H7A2 109.2 . . ?
H7A1 C7A H7A2 107.9 . . ?
N3A C8A C9A 120.7(5) . . ?
N3A C8A C7A 117.7(4) . . ?
C9A C8A C7A 121.5(5) . . ?
C10A C9A C8A 119.5(6) . . ?
C10A C9A H9A 120.3 . . ?
C8A C9A H9A 120.3 . . ?
C9A C10A C11A 119.5(5) . . ?
C9A C10A H10A 120.2 . . ?
C11A C10A H10A 120.2 . . ?
C12A C11A C10A 118.5(5) . . ?
C12A C11A H11A 120.8 . . ?
C10A C11A H11A 120.8 . . ?
N3A C12A C11A 122.1(5) . . ?
N3A C12A H12A 119.0 . . ?
C11A C12A H12A 119.0 . . ?
N2A C13A C14A 116.6(4) . . ?
N2A C13A H13A 108.1 . . ?
C14A C13A H13A 108.1 . . ?
N2A C13A H13B 108.1 . . ?
C14A C13A H13B 108.1 . . ?
H13A C13A H13B 107.3 . . ?
C15A C14A C19A 118.7(4) . . ?
C15A C14A C13A 121.5(4) . . ?
C19A C14A C13A 119.5(4) . . ?
C14A C15A C16A 120.8(4) . . ?
C14A C15A H15A 119.6 . . ?
C16A C15A H15A 119.6 . . ?
C17A C16A C15A 120.5(4) . . ?
C17A C16A H16A 119.8 . . ?
C15A C16A H16A 119.8 . . ?
C16A C17A C18A 119.0(4) . . ?
C16A C17A C20A 121.5(4) . . ?
C18A C17A C20A 119.4(4) . . ?
C17A C18A C19A 120.4(4) . . ?
C17A C18A H18A 119.8 . . ?
C19A C18A H18A 119.8 . . ?
C18A C19A C14A 120.5(4) . . ?
C18A C19A H19A 119.8 . . ?
C14A C19A H19A 119.8 . . ?
C21A C20A C10B 120.5(4) . . ?
C21A C20A C17A 119.3(4) . . ?
C10B C20A C17A 120.1(4) . . ?
C20A C21A N4A 120.8(4) . . ?
C20A C21A C22A 131.6(4) . . ?
N4A C21A C22A 107.6(4) . . ?
C24A C22A C21A 106.2(4) . . ?
C24A C22A C23A 124.3(4) . . ?
C21A C22A C23A 129.5(4) . . ?
C22A C23A H23A 109.5 . . ?
C22A C23A H23B 109.5 . . ?
H23A C23A H23B 109.5 . . ?
C22A C23A H23C 109.5 . . ?
H23A C23A H23C 109.5 . . ?
H23B C23A H23C 109.5 . . ?
C22A C24A C25A 108.7(4) . . ?
C22A C24A H24A 125.6 . . ?
C25A C24A H24A 125.6 . . ?
N4A C25A C24A 108.4(4) . . ?
N4A C25A C26A 123.0(4) . . ?
C24A C25A C26A 128.7(4) . . ?
C25A C26A H26A 109.5 . . ?
C25A C26A H26B 109.5 . . ?
H26A C26A H26B 109.5 . . ?
C25A C26A H26C 109.5 . . ?
H26A C26A H26C 109.5 . . ?
H26B C26A H26C 109.5 . . ?
N5A C27A C29A 108.6(4) . . ?
N5A C27A C28A 122.6(4) . . ?
C29A C27A C28A 128.8(4) . . ?
C27A C28A H28A 109.5 . . ?
C27A C28A H28B 109.5 . . ?
H28A C28A H28B 109.5 . . ?
C27A C28A H28C 109.5 . . ?
H28A C28A H28C 109.5 . . ?
H28B C28A H28C 109.5 . . ?
C30A C29A C27A 109.5(4) . . ?
C30A C29A H29A 125.3 . . ?
C27A C29A H29A 125.3 . . ?
C29A C30A C10B 105.6(4) . . ?
C29A C30A C31A 125.5(4) . . ?
C10B C30A C31A 128.9(4) . . ?
C30A C31A H31A 109.5 . . ?
C30A C31A H31B 109.5 . . ?
H31A C31A H31B 109.5 . . ?
C30A C31A H31C 109.5 . . ?
H31A C31A H31C 109.5 . . ?
H31B C31A H31C 109.5 . . ?
N1B C32A C1B 121.0(7) . . ?
N1B C32A H32A 119.5 . . ?
C1B C32A H32A 119.5 . . ?
C32A C1B C2B 117.9(8) . . ?
C32A C1B H1B 121.0 . . ?
C2B C1B H1B 121.0 . . ?
C3B C2B C1B 120.9(6) . . ?
C3B C2B H2B 119.5 . . ?
C1B C2B H2B 119.5 . . ?
C4B C3B C2B 118.3(7) . . ?
C4B C3B H3B 120.9 . . ?
C2B C3B H3B 120.9 . . ?
N1B C4B C3B 121.3(7) . . ?
N1B C4B C5B 115.4(5) . . ?
C3B C4B C5B 123.1(6) . . ?
N2B C5B C4B 109.4(4) . . ?
N2B C5B H5B1 109.8 . . ?
C4B C5B H5B1 109.8 . . ?
N2B C5B H5B2 109.8 . . ?
C4B C5B H5B2 109.8 . . ?
H5B1 C5B H5B2 108.2 . . ?
C7B C6B N2B 112.5(4) . . ?
C7B C6B H6B1 109.1 . . ?
N2B C6B H6B1 109.1 . . ?
C7B C6B H6B2 109.1 . . ?
N2B C6B H6B2 109.1 . . ?
H6B1 C6B H6B2 107.8 . . ?
N3B C7B C8B 120.8(6) . . ?
N3B C7B C6B 116.7(5) . . ?
C8B C7B C6B 122.3(6) . . ?
C9B C8B C7B 120.4(7) . . ?
C9B C8B H8B 119.8 . . ?
C7B C8B H8B 119.8 . . ?
C11B C9B C8B 118.6(6) . . ?
C11B C9B H9B 120.7 . . ?
C8B C9B H9B 120.7 . . ?
C20A C10B N5A 120.3(4) . . ?
C20A C10B C30A 131.9(4) . . ?
N5A C10B C30A 107.8(4) . . ?
C9B C11B C12B 121.0(6) . . ?
C9B C11B H11B 119.5 . . ?
C12B C11B H11B 119.5 . . ?
N3B C12B C11B 120.9(6) . . ?
N3B C12B H12B 119.5 . . ?
C11B C12B H12B 119.5 . . ?
N2B C13B C14B 116.0(4) . . ?
N2B C13B H13C 108.3 . . ?
C14B C13B H13C 108.3 . . ?
N2B C13B H13D 108.3 . . ?
C14B C13B H13D 108.3 . . ?
H13C C13B H13D 107.4 . . ?
C15B C14B C19B 118.9(4) . . ?
C15B C14B C13B 120.1(5) . . ?
C19B C14B C13B 120.8(5) . . ?
C14B C15B C16B 121.0(5) . . ?
C14B C15B H15B 119.5 . . ?
C16B C15B H15B 119.5 . . ?
C17B C16B C15B 119.6(5) . . ?
C17B C16B H16B 120.2 . . ?
C15B C16B H16B 120.2 . . ?
C18B C17B C16B 119.6(4) . . ?
C18B C17B C20B 120.8(4) . . ?
C16B C17B C20B 119.5(5) . . ?
C17B C18B C19B 120.3(5) . . ?
C17B C18B H18B 119.9 . . ?
C19B C18B H18B 119.9 . . ?
C14B C19B C18B 120.6(5) . . ?
C14B C19B H19B 119.7 . . ?
C18B C19B H19B 119.7 . . ?
C21B C20B C32B 121.1(5) . . ?
C21B C20B C17B 119.2(5) . . ?
C32B C20B C17B 119.6(4) . . ?
C20B C21B N4B 119.5(5) . . ?
C20B C21B C22B 132.2(5) . . ?
N4B C21B C22B 108.3(5) . . ?
C24B C22B C21B 106.0(5) . . ?
C24B C22B C23B 125.2(6) . . ?
C21B C22B C23B 128.8(5) . . ?
C22B C23B H23D 109.5 . . ?
C22B C23B H23E 109.5 . . ?
H23D C23B H23E 109.5 . . ?
C22B C23B H23F 109.5 . . ?
H23D C23B H23F 109.5 . . ?
H23E C23B H23F 109.5 . . ?
C25B C24B C22B 109.0(6) . . ?
C25B C24B H24B 125.5 . . ?
C22B C24B H24B 125.5 . . ?
N4B C25B C24B 108.9(6) . . ?
N4B C25B C26B 122.8(6) . . ?
C24B C25B C26B 128.3(6) . . ?
C25B C26B H26D 109.5 . . ?
C25B C26B H26E 109.5 . . ?
H26D C26B H26E 109.5 . . ?
C25B C26B H26F 109.5 . . ?
H26D C26B H26F 109.5 . . ?
H26E C26B H26F 109.5 . . ?
N5B C27B C29B 109.3(4) . . ?
N5B C27B C28B 122.1(5) . . ?
C29B C27B C28B 128.6(5) . . ?
C27B C28B H28D 109.5 . . ?
C27B C28B H28E 109.5 . . ?
H28D C28B H28E 109.5 . . ?
C27B C28B H28F 109.5 . . ?
H28D C28B H28F 109.5 . . ?
H28E C28B H28F 109.5 . . ?
C30B C29B C27B 108.3(4) . . ?
C30B C29B H29B 125.8 . . ?
C27B C29B H29B 125.8 . . ?
C29B C30B C32B 106.2(4) . . ?
C29B C30B C31B 124.6(5) . . ?
C32B C30B C31B 129.1(5) . . ?
C30B C31B H31D 109.5 . . ?
C30B C31B H31E 109.5 . . ?
H31D C31B H31E 109.5 . . ?
C30B C31B H31F 109.5 . . ?
H31D C31B H31F 109.5 . . ?
H31E C31B H31F 109.5 . . ?
C20B C32B N5B 120.3(4) . . ?
C20B C32B C30B 131.9(5) . . ?
N5B C32B C30B 107.8(4) . . ?
N102 C101 C100 179.9(8) . . ?
N202 C201 C200 177.9(11) . . ?
F2A B1A F1A 109.2(4) . . ?
F2A B1A N4A 110.7(4) . . ?
F1A B1A N4A 110.4(4) . . ?
F2A B1A N5A 110.2(4) . . ?
F1A B1A N5A 109.9(4) . . ?
N4A B1A N5A 106.3(3) . . ?
F1B B1B F2B 109.9(5) . . ?
F1B B1B N4B 111.1(6) . . ?
F2B B1B N4B 109.9(5) . . ?
F1B B1B N5B 109.8(5) . . ?
F2B B1B N5B 109.9(5) . . ?
N4B B1B N5B 106.3(4) . . ?

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
O12 Cl11 O5 O10 -87(3) . . . . ?
O11 Cl11 O5 O10 173(3) . . . . ?
O8 Cl11 O5 O10 84.5(17) . . . . ?
O7 Cl11 O5 O10 -166.8(16) . . . . ?
O6 Cl11 O5 O10 -110.6(16) . . . . ?
O9 Cl11 O5 O10 -12.9(16) . . . . ?
O10 Cl11 O5 O11 -173(3) . . . . ?
O12 Cl11 O5 O11 99(3) . . . . ?
O8 Cl11 O5 O11 -89.0(19) . . . . ?
O7 Cl11 O5 O11 19.7(19) . . . . ?
O6 Cl11 O5 O11 75.9(19) . . . . ?
O9 Cl11 O5 O11 173.6(18) . . . . ?
O10 Cl11 O6 O12 110(3) . . . . ?
O5 Cl11 O6 O12 156(2) . . . . ?
O11 Cl11 O6 O12 -158(3) . . . . ?
O8 Cl11 O6 O12 -43(3) . . . . ?
O7 Cl11 O6 O12 -135(3) . . . . ?
O9 Cl11 O6 O12 58(2) . . . . ?
O10 Cl11 O6 O7 -114.3(13) . . . . ?
O12 Cl11 O6 O7 135(3) . . . . ?
O5 Cl11 O6 O7 -69.2(11) . . . . ?
O11 Cl11 O6 O7 -23.2(15) . . . . ?
O8 Cl11 O6 O7 92.3(12) . . . . ?
O9 Cl11 O6 O7 -166.8(8) . . . . ?
O10 Cl11 O7 O11 -33(2) . . . . ?
O12 Cl11 O7 O11 -167(2) . . . . ?
O5 Cl11 O7 O11 -22(2) . . . . ?
O8 Cl11 O7 O11 90(2) . . . . ?
O6 Cl11 O7 O11 -143(2) . . . . ?
O9 Cl11 O7 O11 -112(2) . . . . ?
O10 Cl11 O7 O6 110.3(12) . . . . ?
O12 Cl11 O7 O6 -23.6(13) . . . . ?
O5 Cl11 O7 O6 120.5(10) . . . . ?
O11 Cl11 O7 O6 143(2) . . . . ?
O8 Cl11 O7 O6 -126.8(10) . . . . ?
O9 Cl11 O7 O6 31(2) . . . . ?
O12 O6 O7 O11 79(4) . . . . ?
Cl11 O6 O7 O11 37(2) . . . . ?
O12 O6 O7 Cl11 42(2) . . . . ?
O12 Cl11 O9 O10 154.0(15) . . . . ?
O5 Cl11 O9 O10 10.2(13) . . . . ?
O11 Cl11 O9 O10 18(2) . . . . ?
O8 Cl11 O9 O10 -103.7(11) . . . . ?
O7 Cl11 O9 O10 97.0(19) . . . . ?
O6 Cl11 O9 O10 124.4(12) . . . . ?
O11 O5 O10 Cl11 8(3) . . . . ?
O11 O5 O10 O9 37(6) . . . . ?
Cl11 O5 O10 O9 28(3) . . . . ?
O12 Cl11 O10 O5 132.3(19) . . . . ?
O11 Cl11 O10 O5 -4.8(19) . . . . ?
O8 Cl11 O10 O5 -109.5(15) . . . . ?
O7 Cl11 O10 O5 15.8(19) . . . . ?
O6 Cl11 O10 O5 90.9(17) . . . . ?
O9 Cl11 O10 O5 164(2) . . . . ?
O12 Cl11 O10 O9 -32.0(19) . . . . ?
O5 Cl11 O10 O9 -164(2) . . . . ?
O11 Cl11 O10 O9 -169.1(14) . . . . ?
O8 Cl11 O10 O9 86.2(10) . . . . ?
O7 Cl11 O10 O9 -148.5(9) . . . . ?
O6 Cl11 O10 O9 -73.4(14) . . . . ?
Cl11 O9 O10 O5 -28(3) . . . . ?
Cl11 O7 O11 O5 38(3) . . . . ?
O6 O7 O11 O5 3(5) . . . . ?
O6 O7 O11 Cl11 -34.9(19) . . . . ?
O10 O5 O11 O7 -48(6) . . . . ?
Cl11 O5 O11 O7 -40(3) . . . . ?
O10 O5 O11 Cl11 -8(3) . . . . ?
O10 Cl11 O11 O7 153.2(19) . . . . ?
O12 Cl11 O11 O7 17(3) . . . . ?
O5 Cl11 O11 O7 149(3) . . . . ?
O8 Cl11 O11 O7 -102.8(18) . . . . ?
O6 Cl11 O11 O7 32.3(19) . . . . ?
O9 Cl11 O11 O7 138.5(17) . . . . ?
O10 Cl11 O11 O5 4.2(17) . . . . ?
O12 Cl11 O11 O5 -131.9(19) . . . . ?
O8 Cl11 O11 O5 108.2(15) . . . . ?
O7 Cl11 O11 O5 -149(3) . . . . ?
O6 Cl11 O11 O5 -116.6(15) . . . . ?
O9 Cl11 O11 O5 -10(3) . . . . ?
O7 O6 O12 Cl11 -39.2(19) . . . . ?
O10 Cl11 O12 O6 -93(3) . . . . ?
O5 Cl11 O12 O6 -40(4) . . . . ?
O11 Cl11 O12 O6 27(3) . . . . ?
O8 Cl11 O12 O6 148(2) . . . . ?
O7 Cl11 O12 O6 38(2) . . . . ?
O9 Cl11 O12 O6 -120(2) . . . . ?
C5A N1A C1A C2A 2.8(8) . . . . ?
Pt1A N1A C1A C2A -178.2(4) . . . . ?
N1A C1A C2A C3A -1.2(9) . . . . ?
C1A C2A C3A C4A -0.9(9) . . . . ?
C2A C3A C4A C5A 1.4(9) . . . . ?
C1A N1A C5A C4A -2.4(7) . . . . ?
Pt1A N1A C5A C4A 178.5(4) . . . . ?
C1A N1A C5A C6A -178.1(4) . . . . ?
Pt1A N1A C5A C6A 2.8(5) . . . . ?
C3A C4A C5A N1A 0.3(8) . . . . ?
C3A C4A C5A C6A 175.6(5) . . . . ?
N1A C5A C6A N2A -32.7(6) . . . . ?
C4A C5A C6A N2A 151.8(5) . . . . ?
C7A N2A C6A C5A 157.8(4) . . . . ?
C13A N2A C6A C5A -78.6(5) . . . . ?
Pt1A N2A C6A C5A 43.7(4) . . . . ?
C6A N2A C7A C8A -137.2(4) . . . . ?
C13A N2A C7A C8A 101.1(5) . . . . ?
Pt1A N2A C7A C8A -25.8(4) . . . . ?
C12A N3A C8A C9A 2.3(7) . . . . ?
Pt1A N3A C8A C9A -173.7(4) . . . . ?
C12A N3A C8A C7A 178.2(4) . . . . ?
Pt1A N3A C8A C7A 2.3(5) . . . . ?
N2A C7A C8A N3A 16.6(6) . . . . ?
N2A C7A C8A C9A -167.5(4) . . . . ?
N3A C8A C9A C10A 0.1(7) . . . . ?
C7A C8A C9A C10A -175.7(5) . . . . ?
C8A C9A C10A C11A -1.5(8) . . . . ?
C9A C10A C11A C12A 0.6(7) . . . . ?
C8A N3A C12A C11A -3.3(7) . . . . ?
Pt1A N3A C12A C11A 172.0(3) . . . . ?
C10A C11A C12A N3A 1.8(7) . . . . ?
C7A N2A C13A C14A -55.9(6) . . . . ?
C6A N2A C13A C14A 179.8(5) . . . . ?
Pt1A N2A C13A C14A 66.1(5) . . . . ?
N2A C13A C14A C15A -78.5(6) . . . . ?
N2A C13A C14A C19A 107.3(5) . . . . ?
C19A C14A C15A C16A -0.3(7) . . . . ?
C13A C14A C15A C16A -174.5(5) . . . . ?
C14A C15A C16A C17A 0.9(8) . . . . ?
C15A C16A C17A C18A -1.0(7) . . . . ?
C15A C16A C17A C20A 178.9(4) . . . . ?
C16A C17A C18A C19A 0.5(7) . . . . ?
C20A C17A C18A C19A -179.4(4) . . . . ?
C17A C18A C19A C14A 0.1(7) . . . . ?
C15A C14A C19A C18A -0.2(7) . . . . ?
C13A C14A C19A C18A 174.1(4) . . . . ?
C16A C17A C20A C21A 94.4(6) . . . . ?
C18A C17A C20A C21A -85.7(5) . . . . ?
C16A C17A C20A C10B -86.3(6) . . . . ?
C18A C17A C20A C10B 93.6(6) . . . . ?
C10B C20A C21A N4A -5.1(7) . . . . ?
C17A C20A C21A N4A 174.2(4) . . . . ?
C10B C20A C21A C22A 175.3(5) . . . . ?
C17A C20A C21A C22A -5.3(8) . . . . ?
C25A N4A C21A C20A -179.1(4) . . . . ?
B1A N4A C21A C20A 5.6(7) . . . . ?
C25A N4A C21A C22A 0.6(5) . . . . ?
B1A N4A C21A C22A -174.7(4) . . . . ?
C20A C21A C22A C24A 178.7(5) . . . . ?
N4A C21A C22A C24A -0.9(5) . . . . ?
C20A C21A C22A C23A -1.5(9) . . . . ?
N4A C21A C22A C23A 178.9(5) . . . . ?
C21A C22A C24A C25A 0.8(5) . . . . ?
C23A C22A C24A C25A -178.9(5) . . . . ?
C21A N4A C25A C24A -0.1(5) . . . . ?
B1A N4A C25A C24A 175.3(4) . . . . ?
C21A N4A C25A C26A 179.5(4) . . . . ?
B1A N4A C25A C26A -5.1(7) . . . . ?
C22A C24A C25A N4A -0.5(5) . . . . ?
C22A C24A C25A C26A 180.0(5) . . . . ?
C10B N5A C27A C29A -0.1(6) . . . . ?
B1A N5A C27A C29A 175.1(5) . . . . ?
C10B N5A C27A C28A 180.0(5) . . . . ?
B1A N5A C27A C28A -4.7(8) . . . . ?
N5A C27A C29A C30A 0.2(6) . . . . ?
C28A C27A C29A C30A -180.0(5) . . . . ?
C27A C29A C30A C10B -0.2(6) . . . . ?
C27A C29A C30A C31A -179.9(5) . . . . ?
C4B N1B C32A C1B 3.0(8) . . . . ?
Pt1B N1B C32A C1B -174.9(4) . . . . ?
N1B C32A C1B C2B -0.1(9) . . . . ?
C32A C1B C2B C3B -2.5(9) . . . . ?
C1B C2B C3B C4B 2.1(9) . . . . ?
C32A N1B C4B C3B -3.4(8) . . . . ?
Pt1B N1B C4B C3B 174.8(4) . . . . ?
C32A N1B C4B C5B -178.5(5) . . . . ?
Pt1B N1B C4B C5B -0.3(5) . . . . ?
C2B C3B C4B N1B 0.8(8) . . . . ?
C2B C3B C4B C5B 175.5(5) . . . . ?
C13B N2B C5B C4B -80.6(5) . . . . ?
C6B N2B C5B C4B 156.5(4) . . . . ?
Pt1B N2B C5B C4B 41.8(5) . . . . ?
N1B C4B C5B N2B -29.2(6) . . . . ?
C3B C4B C5B N2B 155.8(5) . . . . ?
C5B N2B C6B C7B -139.7(4) . . . . ?
C13B N2B C6B C7B 98.6(5) . . . . ?
Pt1B N2B C6B C7B -27.2(5) . . . . ?
C12B N3B C7B C8B 1.4(7) . . . . ?
Pt1B N3B C7B C8B -175.1(4) . . . . ?
C12B N3B C7B C6B 176.5(4) . . . . ?
Pt1B N3B C7B C6B 0.1(5) . . . . ?
N2B C6B C7B N3B 18.9(6) . . . . ?
N2B C6B C7B C8B -166.1(5) . . . . ?
N3B C7B C8B C9B 0.5(8) . . . . ?
C6B C7B C8B C9B -174.4(5) . . . . ?
C7B C8B C9B C11B -1.4(9) . . . . ?
C21A C20A C10B N5A -0.7(7) . . . . ?
C17A C20A C10B N5A -180.0(4) . . . . ?
C21A C20A C10B C30A -178.5(5) . . . . ?
C17A C20A C10B C30A 2.2(8) . . . . ?
C27A N5A C10B C20A -178.3(4) . . . . ?
B1A N5A C10B C20A 6.5(7) . . . . ?
C27A N5A C10B C30A 0.0(5) . . . . ?
B1A N5A C10B C30A -175.2(4) . . . . ?
C29A C30A C10B C20A 178.1(5) . . . . ?
C31A C30A C10B C20A -2.1(9) . . . . ?
C29A C30A C10B N5A 0.1(6) . . . . ?
C31A C30A C10B N5A 179.8(5) . . . . ?
C8B C9B C11B C12B 0.4(9) . . . . ?
C7B N3B C12B C11B -2.3(7) . . . . ?
Pt1B N3B C12B C11B 173.5(4) . . . . ?
C9B C11B C12B N3B 1.4(8) . . . . ?
C5B N2B C13B C14B 178.4(5) . . . . ?
C6B N2B C13B C14B -57.8(6) . . . . ?
Pt1B N2B C13B C14B 63.3(6) . . . . ?
N2B C13B C14B C15B 104.1(6) . . . . ?
N2B C13B C14B C19B -81.3(6) . . . . ?
C19B C14B C15B C16B -0.3(8) . . . . ?
C13B C14B C15B C16B 174.4(5) . . . . ?
C14B C15B C16B C17B -0.7(8) . . . . ?
C15B C16B C17B C18B 1.8(8) . . . . ?
C15B C16B C17B C20B -177.1(5) . . . . ?
C16B C17B C18B C19B -1.8(8) . . . . ?
C20B C17B C18B C19B 177.0(5) . . . . ?
C15B C14B C19B C18B 0.3(8) . . . . ?
C13B C14B C19B C18B -174.4(5) . . . . ?
C17B C18B C19B C14B 0.7(8) . . . . ?
C18B C17B C20B C21B -85.0(7) . . . . ?
C16B C17B C20B C21B 93.8(7) . . . . ?
C18B C17B C20B C32B 97.7(6) . . . . ?
C16B C17B C20B C32B -83.5(6) . . . . ?
C32B C20B C21B N4B 1.0(9) . . . . ?
C17B C20B C21B N4B -176.3(5) . . . . ?
C32B C20B C21B C22B -176.8(8) . . . . ?
C17B C20B C21B C22B 5.9(11) . . . . ?
C25B N4B C21B C20B -177.3(7) . . . . ?
B1B N4B C21B C20B 13.4(10) . . . . ?
C25B N4B C21B C22B 1.0(9) . . . . ?
B1B N4B C21B C22B -168.3(7) . . . . ?
C20B C21B C22B C24B 176.1(8) . . . . ?
N4B C21B C22B C24B -1.9(10) . . . . ?
C20B C21B C22B C23B -2.8(15) . . . . ?
N4B C21B C22B C23B 179.2(9) . . . . ?
C21B C22B C24B C25B 2.1(12) . . . . ?
C23B C22B C24B C25B -179.0(9) . . . . ?
C21B N4B C25B C24B 0.3(10) . . . . ?
B1B N4B C25B C24B 169.5(8) . . . . ?
C21B N4B C25B C26B -179.7(9) . . . . ?
B1B N4B C25B C26B -10.5(14) . . . . ?
C22B C24B C25B N4B -1.5(12) . . . . ?
C22B C24B C25B C26B 178.4(10) . . . . ?
C32B N5B C27B C29B -1.6(6) . . . . ?
B1B N5B C27B C29B -179.0(5) . . . . ?
C32B N5B C27B C28B 177.3(5) . . . . ?
B1B N5B C27B C28B -0.1(8) . . . . ?
N5B C27B C29B C30B 1.1(6) . . . . ?
C28B C27B C29B C30B -177.7(5) . . . . ?
C27B C29B C30B C32B -0.2(6) . . . . ?
C27B C29B C30B C31B -176.4(5) . . . . ?
C21B C20B C32B N5B -6.1(8) . . . . ?
C17B C20B C32B N5B 171.2(5) . . . . ?
C21B C20B C32B C30B 171.8(6) . . . . ?
C17B C20B C32B C30B -10.9(9) . . . . ?
C27B N5B C32B C20B 179.9(5) . . . . ?
B1B N5B C32B C20B -2.7(8) . . . . ?
C27B N5B C32B C30B 1.5(5) . . . . ?
B1B N5B C32B C30B 179.0(5) . . . . ?
C29B C30B C32B C20B -178.9(5) . . . . ?
C31B C30B C32B C20B -2.9(9) . . . . ?
C29B C30B C32B N5B -0.8(5) . . . . ?
C31B C30B C32B N5B 175.2(5) . . . . ?
C25A N4A B1A F2A -55.3(6) . . . . ?
C21A N4A B1A F2A 119.3(5) . . . . ?
C25A N4A B1A F1A 65.8(6) . . . . ?
C21A N4A B1A F1A -119.6(5) . . . . ?
C25A N4A B1A N5A -175.0(4) . . . . ?
C21A N4A B1A N5A -0.4(6) . . . . ?
C27A N5A B1A F2A 59.9(6) . . . . ?
C10B N5A B1A F2A -125.6(4) . . . . ?
C27A N5A B1A F1A -60.5(6) . . . . ?
C10B N5A B1A F1A 113.9(5) . . . . ?
C27A N5A B1A N4A 179.9(4) . . . . ?
C10B N5A B1A N4A -5.6(6) . . . . ?
C25B N4B B1B F1B 54.1(10) . . . . ?
C21B N4B B1B F1B -138.6(6) . . . . ?
C25B N4B B1B F2B -67.7(9) . . . . ?
C21B N4B B1B F2B 99.7(7) . . . . ?
C25B N4B B1B N5B 173.4(7) . . . . ?
C21B N4B B1B N5B -19.2(9) . . . . ?
C27B N5B B1B F1B -49.1(8) . . . . ?
C32B N5B B1B F1B 134.0(5) . . . . ?
C27B N5B B1B F2B 71.9(7) . . . . ?
C32B N5B B1B F2B -105.1(6) . . . . ?
C27B N5B B1B N4B -169.3(5) . . . . ?
C32B N5B B1B N4B 13.7(8) . . . . ?

_refine_diff_density_max         3.319
_refine_diff_density_min         -3.010
_refine_diff_density_rms         0.150




