# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2021

####################################################################### 
# 
# 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_1_CH2Cl2
_database_code_depnum_ccdc_archive 'CCDC 1908774'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C108 H98 Ag2 Cl8 F6 N2 O18 P4 Pt2 S2'
_chemical_formula_weight         2903.40

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'
P P 0.1023 0.0942 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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'

_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                   14.5178(2)
_cell_length_b                   15.031
_cell_length_c                   16.7816(3)
_cell_angle_alpha                115.005(4)
_cell_angle_beta                 111.540(7)
_cell_angle_gamma                92.567(6)
_cell_volume                     2998.87(17)
_cell_formula_units_Z            1
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    8396
_cell_measurement_theta_min      3.225
_cell_measurement_theta_max      27.4975

_exptl_crystal_description       Bloc
_exptl_crystal_colour            Red
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.608
_exptl_crystal_F_000             1436
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.68
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.40
_exptl_absorpt_coefficient_mu    2.984
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.248
_exptl_absorpt_correction_T_max  0.303
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  
;
Mercury70 (2x2 bin mode)
;
_diffrn_measurement_method       CCD_Profile_fitting
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            31649
_diffrn_reflns_av_unetI/netI     0.0426
_diffrn_reflns_av_R_equivalents  0.0342
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         3.106
_diffrn_reflns_theta_max         27.489
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measured_fraction_theta_full 0.990
_diffrn_reflns_Laue_measured_fraction_max 0.985
_diffrn_reflns_Laue_measured_fraction_full 0.990
_diffrn_reflns_point_group_measured_fraction_max 0.985
_diffrn_reflns_point_group_measured_fraction_full 0.990
_reflns_number_total             13559
_reflns_number_gt                12110
_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.
 
 _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    ?
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_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)+(0.0894P)²+0.4351P] 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         13559
_refine_ls_number_parameters     670
_refine_ls_number_restraints     96
_refine_ls_R_factor_all          0.0483
_refine_ls_R_factor_gt           0.0438
_refine_ls_wR_factor_ref         0.1308
_refine_ls_wR_factor_gt          0.1252
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_restrained_S_all      1.064
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.66536(2) 0.96566(2) 0.51400(2) 0.03328(7) Uani 1 1 d . . . . .
Ag1 Ag 0.50991(3) 0.95125(4) 0.58971(3) 0.06271(13) Uani 1 1 d . . . . .
P1 P 0.59947(8) 0.80764(8) 0.37984(8) 0.0361(2) Uani 1 1 d . . . . .
P2 P 0.75613(8) 1.12088(8) 0.64826(8) 0.0382(2) Uani 1 1 d . . . . .
N1 N 0.4127(3) 0.8160(3) 0.3650(3) 0.0384(7) Uani 1 1 d . . . . .
Cl01 Cl 1.0600(14) 1.4074(17) 1.0240(14) 0.725(16) Uani 1 1 d D U . . .
Cl02 Cl 1.2380(13) 1.5020(13) 1.0220(14) 0.669(16) Uani 1 1 d D U . . .
Cl03 Cl 1.0275(9) 1.5268(11) 0.7462(10) 0.446(6) Uiso 1 1 d D U . . .
Cl04 Cl 0.8493(8) 1.5858(8) 0.6788(8) 0.361(5) Uiso 1 1 d D U . . .
C1 C 0.6798(4) 0.7202(3) 0.3877(4) 0.0454(10) Uani 1 1 d . . . . .
C01 C 0.8888(10) 1.0361(8) 0.2315(8) 0.165(3) Uani 1 1 d D U . . .
C2 C 0.7668(4) 0.7460(4) 0.4722(4) 0.0557(12) Uani 1 1 d . . . . .
H2A H 0.784473 0.809311 0.525683 0.067 Uiso 1 1 calc R U . . .
C02 C 1.182(2) 1.495(3) 1.0984(15) 0.703(17) Uani 1 1 d D U . . .
H02A H 1.225326 1.473313 1.142669 0.844 Uiso 1 1 calc R U . . .
H02B H 1.173482 1.561333 1.136703 0.844 Uiso 1 1 calc R U . . .
C3 C 0.8273(5) 0.6782(6) 0.4774(6) 0.0769(18) Uani 1 1 d . . . . .
H3A H 0.885326 0.696133 0.534322 0.092 Uiso 1 1 calc R U . . .
C03 C 0.9782(12) 1.6377(13) 0.7675(19) 0.391(12) Uiso 1 1 d D U . . .
H03A H 0.982505 1.671510 0.832825 0.469 Uiso 1 1 calc R U . . .
H03B H 1.013880 1.684815 0.756917 0.469 Uiso 1 1 calc R U . . .
C4 C 0.8019(6) 0.5847(5) 0.3990(7) 0.081(2) Uani 1 1 d . . . . .
H4A H 0.842481 0.539209 0.402986 0.097 Uiso 1 1 calc R U . . .
C5 C 0.7165(6) 0.5580(4) 0.3143(6) 0.081(2) Uani 1 1 d . . . . .
H5A H 0.700056 0.494987 0.260705 0.098 Uiso 1 1 calc R U . . .
C6 C 0.6552(5) 0.6255(4) 0.3094(5) 0.0699(16) Uani 1 1 d . . . . .
H6A H 0.596681 0.606725 0.252652 0.084 Uiso 1 1 calc R U . . .
C7 C 0.5755(4) 0.8024(4) 0.2635(3) 0.0506(11) Uani 1 1 d . . . . .
C8 C 0.6554(6) 0.8249(7) 0.2447(6) 0.096(3) Uani 1 1 d . . . . .
H8A H 0.722011 0.841809 0.291297 0.116 Uiso 1 1 calc R U . . .
C9 C 0.6376(8) 0.8225(7) 0.1566(6) 0.104(3) Uani 1 1 d . . . . .
H9A H 0.693480 0.834391 0.144782 0.125 Uiso 1 1 calc R U . . .
C10 C 0.5482(9) 0.8049(9) 0.0906(6) 0.117(3) Uani 1 1 d . . . . .
H10A H 0.537882 0.804682 0.032490 0.140 Uiso 1 1 calc R U . . .
C11 C 0.4724(10) 0.787(2) 0.1108(10) 0.270(13) Uani 1 1 d . . . . .
H11A H 0.406393 0.770323 0.063327 0.324 Uiso 1 1 calc R U . . .
C12 C 0.4849(7) 0.7921(14) 0.1988(7) 0.197(8) Uani 1 1 d . . . . .
H12A H 0.428498 0.788109 0.212081 0.237 Uiso 1 1 calc R U . . .
C13 C 0.4750(3) 0.7521(3) 0.3643(3) 0.0369(8) Uani 1 1 d . . . . .
C14 C 0.4466(4) 0.6574(4) 0.3547(4) 0.0471(10) Uani 1 1 d . . . . .
H14A H 0.491225 0.614899 0.353834 0.057 Uiso 1 1 calc R U . . .
C15 C 0.3519(4) 0.6278(4) 0.3465(4) 0.0534(11) Uani 1 1 d . . . . .
H15A H 0.331550 0.565072 0.340823 0.064 Uiso 1 1 calc R U . . .
C16 C 0.7894(4) 1.1334(4) 0.7690(4) 0.0494(11) Uani 1 1 d . . . . .
C17 C 0.8404(4) 1.0673(4) 0.7944(4) 0.0601(13) Uani 1 1 d . . . . .
H17A H 0.854681 1.015343 0.748662 0.072 Uiso 1 1 calc R U . . .
C18 C 0.8704(5) 1.0769(5) 0.8857(5) 0.0749(18) Uani 1 1 d . . . . .
H18A H 0.903201 1.030955 0.901496 0.090 Uiso 1 1 calc R U . . .
C19 C 0.8518(7) 1.1535(9) 0.9523(6) 0.109(3) Uani 1 1 d . . . . .
H19A H 0.867302 1.156498 1.012440 0.131 Uiso 1 1 calc R U . . .
C20 C 0.8094(7) 1.2295(9) 0.9340(5) 0.123(4) Uani 1 1 d . . . . .
H20A H 0.803151 1.285383 0.982891 0.147 Uiso 1 1 calc R U . . .
C21 C 0.7774(6) 1.2179(7) 0.8406(5) 0.092(2) Uani 1 1 d . . . . .
H21A H 0.748121 1.265865 0.825617 0.111 Uiso 1 1 calc R U . . .
C22 C 0.8766(4) 1.1672(4) 0.6525(4) 0.0523(11) Uani 1 1 d . . . . .
C23 C 0.9482(5) 1.2440(6) 0.7344(6) 0.095(2) Uani 1 1 d . . . . .
H23A H 0.936181 1.272156 0.789764 0.115 Uiso 1 1 calc R U . . .
C24 C 1.0406(6) 1.2827(8) 0.7387(8) 0.127(4) Uani 1 1 d . . . . .
H24A H 1.088341 1.337137 0.795655 0.153 Uiso 1 1 calc R U . . .
C25 C 1.0601(5) 1.2399(8) 0.6584(8) 0.106(3) Uani 1 1 d . . . . .
H25A H 1.122307 1.263363 0.661439 0.127 Uiso 1 1 calc R U . . .
C26 C 0.9900(6) 1.1647(8) 0.5761(7) 0.112(3) Uani 1 1 d . . . . .
H26A H 1.001797 1.138762 0.520591 0.134 Uiso 1 1 calc R U . . .
C27 C 0.8974(4) 1.1235(6) 0.5717(5) 0.082(2) Uani 1 1 d . . . . .
H27A H 0.850977 1.067597 0.515251 0.099 Uiso 1 1 calc R U . . .
C28 C 0.6807(3) 1.2150(3) 0.6451(3) 0.0392(9) Uani 1 1 d . . . . .
C29 C 0.7147(4) 1.3073(4) 0.6534(4) 0.0498(11) Uani 1 1 d . . . . .
H29A H 0.779545 1.325758 0.658752 0.060 Uiso 1 1 calc R U . . .
C30 C 0.6543(3) 0.8975(3) 0.5914(3) 0.0379(8) Uani 1 1 d . . . . .
C31 C 0.6370(3) 0.8469(3) 0.6268(3) 0.0422(9) Uani 1 1 d . . . . .
C32 C 0.6299(4) 0.7842(3) 0.6707(3) 0.0433(9) Uani 1 1 d . . . . .
C33 C 0.5464(4) 0.7006(4) 0.6223(3) 0.0460(10) Uani 1 1 d . . . . .
H33A H 0.494165 0.686816 0.563115 0.055 Uiso 1 1 calc R U . . .
C34 C 0.5434(4) 0.6389(4) 0.6644(4) 0.0466(10) Uani 1 1 d . . . . .
C35 C 0.6210(4) 0.6594(4) 0.7534(3) 0.0476(10) Uani 1 1 d . . . . .
C36 C 0.7023(4) 0.7446(4) 0.8012(4) 0.0575(13) Uani 1 1 d . . . . .
C37 C 0.7071(4) 0.8053(4) 0.7612(4) 0.0563(12) Uani 1 1 d . . . . .
H37A H 0.761590 0.861113 0.793738 0.068 Uiso 1 1 calc R U . . .
C38 C 0.3833(5) 0.5331(5) 0.5376(5) 0.0700(16) Uani 1 1 d . . . . .
H38A H 0.336868 0.472129 0.517083 0.105 Uiso 1 1 calc R U . . .
H38B H 0.349808 0.587899 0.549168 0.105 Uiso 1 1 calc R U . . .
H38C H 0.405022 0.524528 0.487740 0.105 Uiso 1 1 calc R U . . .
C39 C 0.5662(8) 0.6245(7) 0.8538(7) 0.100(3) Uani 1 1 d . . . . .
H39A H 0.566224 0.577985 0.879176 0.151 Uiso 1 1 calc R U . . .
H39B H 0.600396 0.691415 0.906630 0.151 Uiso 1 1 calc R U . . .
H39C H 0.497249 0.623523 0.817010 0.151 Uiso 1 1 calc R U . . .
C40 C 0.8546(6) 0.8470(7) 0.9450(6) 0.112(3) Uani 1 1 d . . . . .
H40A H 0.898778 0.848679 1.004703 0.168 Uiso 1 1 calc R U . . .
H40B H 0.892510 0.845926 0.908388 0.168 Uiso 1 1 calc R U . . .
H40C H 0.827243 0.905963 0.959162 0.168 Uiso 1 1 calc R U . . .
C41 C 0.6535(3) 1.0344(3) 0.4323(3) 0.0371(8) Uani 1 1 d . . . . .
C42 C 0.3611(3) 0.9230(4) 0.6168(3) 0.0445(10) Uani 1 1 d . . . . .
C43 C 0.3599(4) 0.8683(3) 0.6683(3) 0.0420(9) Uani 1 1 d . . . . .
C44 C 0.4370(4) 0.8956(4) 0.7601(3) 0.0470(10) Uani 1 1 d . . . . .
H44A H 0.492339 0.949669 0.788623 0.056 Uiso 1 1 calc R U . . .
C45 C 0.4308(4) 0.8422(4) 0.8084(3) 0.0503(11) Uani 1 1 d . . . . .
C46 C 0.3493(4) 0.7613(4) 0.7675(4) 0.0504(11) Uani 1 1 d . . . . .
C47 C 0.2722(4) 0.7332(3) 0.6757(4) 0.0487(10) Uani 1 1 d . . . . .
C48 C 0.2781(4) 0.7860(4) 0.6264(4) 0.0469(10) Uani 1 1 d . . . . .
H48A H 0.227077 0.766523 0.564792 0.056 Uiso 1 1 calc R U . . .
C49 C 0.5894(5) 0.9451(6) 0.9442(5) 0.084(2) Uani 1 1 d . . . . .
H49A H 0.633287 0.952679 1.006722 0.127 Uiso 1 1 calc R U . . .
H49B H 0.625629 0.930791 0.904216 0.127 Uiso 1 1 calc R U . . .
H49C H 0.567692 1.006523 0.952092 0.127 Uiso 1 1 calc R U . . .
C50 C 0.2788(6) 0.7358(6) 0.8628(5) 0.0789(19) Uani 1 1 d . . . . .
H50A H 0.278669 0.696493 0.895333 0.118 Uiso 1 1 calc R U . . .
H50B H 0.302156 0.806297 0.909374 0.118 Uiso 1 1 calc R U . . .
H50C H 0.210897 0.723226 0.815226 0.118 Uiso 1 1 calc R U . . .
C51 C 0.1082(6) 0.6314(6) 0.5547(6) 0.090(2) Uani 1 1 d . . . . .
H51A H 0.059602 0.573173 0.536929 0.135 Uiso 1 1 calc R U . . .
H51B H 0.078009 0.688491 0.566366 0.135 Uiso 1 1 calc R U . . .
H51C H 0.128000 0.618410 0.502926 0.135 Uiso 1 1 calc R U . . .
F1 F 0.7934(7) 1.0348(8) 0.1659(8) 0.242(4) Uani 1 1 d D U . . .
F2 F 0.8783(9) 1.0523(7) 0.3143(7) 0.215(3) Uani 1 1 d D U . . .
F3 F 0.9027(7) 0.9380(5) 0.1954(7) 0.191(3) Uani 1 1 d D U . . .
S1 S 0.9653(3) 1.1211(2) 0.2295(3) 0.1385(10) Uani 1 1 d D U . . .
O1 O 0.4682(3) 0.5549(3) 0.6233(3) 0.0673(11) Uani 1 1 d . . . . .
O2 O 0.6182(3) 0.5956(3) 0.7922(3) 0.0640(10) Uani 1 1 d . . . . .
O3 O 0.7722(4) 0.7576(4) 0.8890(3) 0.0889(16) Uani 1 1 d . . . . .
O4 O 0.5027(3) 0.8642(3) 0.8992(3) 0.0702(11) Uani 1 1 d . . . . .
O5 O 0.3447(3) 0.7084(3) 0.8160(3) 0.0673(10) Uani 1 1 d . . . . .
O6 O 0.1951(3) 0.6522(3) 0.6402(3) 0.0678(10) Uani 1 1 d . . . . .
O7 O 1.0589(8) 1.1115(9) 0.3029(7) 0.290(7) Uani 1 1 d D U . . .
O8 O 0.9735(9) 1.0830(7) 0.1419(7) 0.206(4) Uani 1 1 d D U . . .
O9 O 0.9450(7) 1.2130(5) 0.2785(7) 0.174(4) Uani 1 1 d 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 C41 2.004(4) . ?
Pt1 C30 2.006(4) . ?
Pt1 P1 2.3064(11) . ?
Pt1 P2 2.3145(11) . ?
Pt1 Ag1 3.0080(4) . ?
Pt1 Ag1 3.1518(5) 2_676 ?
Ag1 C30 2.275(4) . ?
Ag1 C41 2.298(4) 2_676 ?
Ag1 C42 2.420(5) . ?
Ag1 C31 2.548(4) . ?
P1 C1 1.810(5) . ?
P1 C7 1.818(5) . ?
P1 C13 1.835(4) . ?
P2 C22 1.818(5) . ?
P2 C16 1.823(5) . ?
P2 C28 1.833(4) . ?
N1 C28 1.339(6) 2_676 ?
N1 C13 1.347(5) . ?
Cl01 C02 1.788(10) . ?
Cl02 C02 1.790(10) . ?
Cl03 C03 1.791(10) . ?
Cl04 C03 1.780(10) . ?
C1 C6 1.381(7) . ?
C1 C2 1.390(7) . ?
C01 F2 1.372(9) . ?
C01 F3 1.394(8) . ?
C01 F1 1.410(9) . ?
C01 S1 1.674(13) . ?
C2 C3 1.385(7) . ?
C3 C4 1.369(11) . ?
C4 C5 1.377(11) . ?
C5 C6 1.389(8) . ?
C7 C12 1.312(10) . ?
C7 C8 1.373(9) . ?
C8 C9 1.388(10) . ?
C9 C10 1.283(12) . ?
C10 C11 1.311(16) . ?
C11 C12 1.390(12) . ?
C13 C14 1.388(6) . ?
C14 C15 1.364(7) . ?
C15 C29 1.403(7) 2_676 ?
C16 C17 1.383(8) . ?
C16 C21 1.405(9) . ?
C17 C18 1.370(8) . ?
C18 C19 1.345(12) . ?
C19 C20 1.414(13) . ?
C20 C21 1.390(10) . ?
C22 C23 1.343(9) . ?
C22 C27 1.387(8) . ?
C23 C24 1.404(10) . ?
C24 C25 1.368(14) . ?
C25 C26 1.329(13) . ?
C26 C27 1.419(9) . ?
C28 C29 1.383(6) . ?
C30 C31 1.212(6) . ?
C31 C32 1.440(6) . ?
C32 C37 1.405(7) . ?
C32 C33 1.409(7) . ?
C33 C34 1.389(6) . ?
C34 O1 1.360(6) . ?
C34 C35 1.392(7) . ?
C35 O2 1.374(5) . ?
C35 C36 1.407(7) . ?
C36 C37 1.354(7) . ?
C36 O3 1.371(6) . ?
C38 O1 1.400(7) . ?
C39 O2 1.432(8) . ?
C40 O3 1.444(9) . ?
C41 C42 1.210(6) 2_676 ?
C42 C43 1.427(6) . ?
C43 C48 1.397(7) . ?
C43 C44 1.398(7) . ?
C44 C45 1.382(7) . ?
C45 O4 1.376(6) . ?
C45 C46 1.385(8) . ?
C46 O5 1.372(6) . ?
C46 C47 1.394(7) . ?
C47 O6 1.366(6) . ?
C47 C48 1.387(7) . ?
C49 O4 1.421(8) . ?
C50 O5 1.420(8) . ?
C51 O6 1.416(8) . ?
S1 O9 1.387(6) . ?
S1 O8 1.388(7) . ?
S1 O7 1.524(7) . ?

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
C41 Pt1 C30 170.98(16) . . ?
C41 Pt1 P1 92.39(12) . . ?
C30 Pt1 P1 86.84(13) . . ?
C41 Pt1 P2 87.23(12) . . ?
C30 Pt1 P2 94.94(13) . . ?
P1 Pt1 P2 170.94(4) . . ?
C41 Pt1 Ag1 122.17(12) . . ?
C30 Pt1 Ag1 49.13(12) . . ?
P1 Pt1 Ag1 96.51(3) . . ?
P2 Pt1 Ag1 91.34(3) . . ?
C41 Pt1 Ag1 46.65(12) . 2_676 ?
C30 Pt1 Ag1 124.35(12) . 2_676 ?
P1 Pt1 Ag1 90.83(3) . 2_676 ?
P2 Pt1 Ag1 95.46(3) . 2_676 ?
Ag1 Pt1 Ag1 76.105(14) . 2_676 ?
C30 Ag1 C41 166.53(17) . 2_676 ?
C30 Ag1 C42 142.68(15) . . ?
C41 Ag1 C42 29.58(15) 2_676 . ?
C30 Ag1 C31 28.39(15) . . ?
C41 Ag1 C31 142.42(15) 2_676 . ?
C42 Ag1 C31 114.48(15) . . ?
C30 Ag1 Pt1 41.83(11) . . ?
C41 Ag1 Pt1 142.54(11) 2_676 . ?
C42 Ag1 Pt1 168.56(11) . . ?
C31 Ag1 Pt1 70.02(10) . . ?
C30 Ag1 Pt1 144.60(11) . 2_676 ?
C41 Ag1 Pt1 39.36(10) 2_676 2_676 ?
C42 Ag1 Pt1 68.94(11) . 2_676 ?
C31 Ag1 Pt1 164.56(10) . 2_676 ?
Pt1 Ag1 Pt1 103.897(13) . 2_676 ?
C1 P1 C7 104.1(2) . . ?
C1 P1 C13 107.6(2) . . ?
C7 P1 C13 104.6(2) . . ?
C1 P1 Pt1 113.57(17) . . ?
C7 P1 Pt1 116.44(18) . . ?
C13 P1 Pt1 109.75(14) . . ?
C22 P2 C16 104.4(2) . . ?
C22 P2 C28 107.0(2) . . ?
C16 P2 C28 103.4(2) . . ?
C22 P2 Pt1 113.10(19) . . ?
C16 P2 Pt1 118.65(19) . . ?
C28 P2 Pt1 109.32(14) . . ?
C28 N1 C13 117.7(4) 2_676 . ?
C6 C1 C2 118.5(5) . . ?
C6 C1 P1 120.3(4) . . ?
C2 C1 P1 121.2(4) . . ?
F2 C01 F3 103.7(9) . . ?
F2 C01 F1 106.2(10) . . ?
F3 C01 F1 107.5(10) . . ?
F2 C01 S1 122.2(9) . . ?
F3 C01 S1 115.9(8) . . ?
F1 C01 S1 100.2(8) . . ?
C3 C2 C1 120.6(6) . . ?
Cl01 C02 Cl02 109.0(12) . . ?
C4 C3 C2 120.1(6) . . ?
Cl04 C03 Cl03 101.6(9) . . ?
C3 C4 C5 120.2(5) . . ?
C4 C5 C6 119.7(6) . . ?
C1 C6 C5 120.8(6) . . ?
C12 C7 C8 115.0(6) . . ?
C12 C7 P1 124.1(5) . . ?
C8 C7 P1 120.2(5) . . ?
C7 C8 C9 120.5(8) . . ?
C10 C9 C8 123.6(8) . . ?
C9 C10 C11 115.4(8) . . ?
C10 C11 C12 123.9(10) . . ?
C7 C12 C11 120.7(9) . . ?
N1 C13 C14 122.9(4) . . ?
N1 C13 P1 111.4(3) . . ?
C14 C13 P1 125.7(3) . . ?
C15 C14 C13 118.8(4) . . ?
C14 C15 C29 119.6(4) . 2_676 ?
C17 C16 C21 119.4(5) . . ?
C17 C16 P2 119.5(4) . . ?
C21 C16 P2 120.5(5) . . ?
C18 C17 C16 121.1(6) . . ?
C19 C18 C17 119.3(6) . . ?
C18 C19 C20 122.3(7) . . ?
C21 C20 C19 117.7(8) . . ?
C20 C21 C16 119.6(7) . . ?
C23 C22 C27 118.4(6) . . ?
C23 C22 P2 120.7(5) . . ?
C27 C22 P2 120.9(4) . . ?
C22 C23 C24 121.7(8) . . ?
C25 C24 C23 119.6(8) . . ?
C26 C25 C24 119.9(6) . . ?
C25 C26 C27 120.9(8) . . ?
C22 C27 C26 119.4(7) . . ?
N1 C28 C29 123.3(4) 2_676 . ?
N1 C28 P2 111.4(3) 2_676 . ?
C29 C28 P2 125.3(4) . . ?
C28 C29 C15 117.8(4) . 2_676 ?
C31 C30 Pt1 171.3(4) . . ?
C31 C30 Ag1 88.4(3) . . ?
Pt1 C30 Ag1 89.04(16) . . ?
C30 C31 C32 172.3(5) . . ?
C30 C31 Ag1 63.2(3) . . ?
C32 C31 Ag1 124.5(3) . . ?
C37 C32 C33 119.7(4) . . ?
C37 C32 C31 120.1(4) . . ?
C33 C32 C31 120.2(4) . . ?
C34 C33 C32 119.1(4) . . ?
O1 C34 C33 124.2(4) . . ?
O1 C34 C35 114.9(4) . . ?
C33 C34 C35 120.9(5) . . ?
O2 C35 C34 119.9(5) . . ?
O2 C35 C36 121.1(4) . . ?
C34 C35 C36 119.0(4) . . ?
C37 C36 O3 125.7(5) . . ?
C37 C36 C35 121.1(5) . . ?
O3 C36 C35 113.2(4) . . ?
C36 C37 C32 120.3(5) . . ?
C42 C41 Pt1 174.7(4) 2_676 . ?
C42 C41 Ag1 80.8(3) 2_676 2_676 ?
Pt1 C41 Ag1 93.98(16) . 2_676 ?
C41 C42 C43 170.3(5) 2_676 . ?
C41 C42 Ag1 69.6(3) 2_676 . ?
C43 C42 Ag1 119.6(3) . . ?
C48 C43 C44 119.1(4) . . ?
C48 C43 C42 118.9(4) . . ?
C44 C43 C42 122.0(4) . . ?
C45 C44 C43 119.8(5) . . ?
O4 C45 C44 123.8(5) . . ?
O4 C45 C46 115.0(4) . . ?
C44 C45 C46 121.2(5) . . ?
O5 C46 C45 120.5(5) . . ?
O5 C46 C47 120.1(5) . . ?
C45 C46 C47 119.3(4) . . ?
O6 C47 C48 124.5(5) . . ?
O6 C47 C46 115.7(4) . . ?
C48 C47 C46 119.9(5) . . ?
C47 C48 C43 120.7(4) . . ?
O9 S1 O8 128.0(7) . . ?
O9 S1 O7 107.1(6) . . ?
O8 S1 O7 107.7(7) . . ?
O9 S1 C01 104.9(6) . . ?
O8 S1 C01 111.7(6) . . ?
O7 S1 C01 91.4(8) . . ?
C34 O1 C38 118.6(4) . . ?
C35 O2 C39 112.4(4) . . ?
C36 O3 C40 116.3(5) . . ?
C45 O4 C49 117.7(5) . . ?
C46 O5 C50 113.3(4) . . ?
C47 O6 C51 117.1(4) . . ?

_refine_diff_density_max         2.815
_refine_diff_density_min         -2.135
_refine_diff_density_rms         0.126



# start Validation Reply Form
_vrf_PLAT973_1_CH2Cl2            
; 
PROBLEM: Check Calcd Positive Resid. Density on       Pt2       2.47 eA-3  
RESPONSE: Residual electron density does not make chemical sence. Residual 
electron resides too close to heavy metal atom center.
;
# END Validation Reply Form
####################################################################### 
# 
# 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_z
_database_code_depnum_ccdc_archive 'CCDC 2058498'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C92 H70 Cl4 N2 O0 P4 Pt2'
_chemical_formula_weight         1859.36

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'
P P 0.1023 0.0942 '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'

_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                   11.29550(10)
_cell_length_b                   12.26980(10)
_cell_length_c                   15.674
_cell_angle_alpha                74.078(9)
_cell_angle_beta                 73.050(8)
_cell_angle_gamma                78.311(10)
_cell_volume                     1980.36(14)
_cell_formula_units_Z            1
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    6701
_cell_measurement_theta_min      2.4017
_cell_measurement_theta_max      27.4778

_exptl_crystal_description       Prism
_exptl_crystal_colour            Colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.559
_exptl_crystal_F_000             920
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_exptl_absorpt_coefficient_mu    3.792
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.5535
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  MM007-Saturn724+
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            19160
_diffrn_reflns_av_unetI/netI     0.1126
_diffrn_reflns_av_R_equivalents  0.0493
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.958
_diffrn_reflns_theta_max         27.475
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measured_fraction_theta_full 0.986
_diffrn_reflns_Laue_measured_fraction_max 0.984
_diffrn_reflns_Laue_measured_fraction_full 0.986
_diffrn_reflns_point_group_measured_fraction_max 0.984
_diffrn_reflns_point_group_measured_fraction_full 0.986
_reflns_number_total             8928
_reflns_number_gt                6273
_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.
 
 _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-2016/6 (Sheldrick, 2016)'
_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)+(0.0059P)²] 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         8928
_refine_ls_number_parameters     469
_refine_ls_number_restraints     54
_refine_ls_R_factor_all          0.0532
_refine_ls_R_factor_gt           0.0360
_refine_ls_wR_factor_ref         0.0588
_refine_ls_wR_factor_gt          0.0539
_refine_ls_goodness_of_fit_ref   0.773
_refine_ls_restrained_S_all      0.779
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.30844(2) 0.47851(2) 0.31278(2) 0.03981(6) Uani 1 1 d . . . . .
Cl1 Cl 0.48734(16) 0.33274(16) 0.04313(13) 0.1281(7) Uani 1 1 d . . . . .
Cl2 Cl 0.24033(17) 0.30070(15) 0.05079(13) 0.1246(7) Uani 1 1 d . . . . .
P1 P 0.44187(10) 0.60237(9) 0.30488(8) 0.0390(3) Uani 1 1 d . . . . .
P2 P 0.63718(10) 0.66745(9) 0.57059(8) 0.0374(3) Uani 1 1 d . . . . .
N1 N 0.5250(3) 0.6377(2) 0.4462(2) 0.0340(8) Uani 1 1 d . . . . .
C1 C 0.4265(4) 0.6195(3) 0.4212(3) 0.0376(10) Uani 1 1 d . . . . .
C2 C 0.3072(4) 0.6210(3) 0.4780(3) 0.0447(12) Uani 1 1 d . . . . .
H2 H 0.242603 0.605445 0.459337 0.054 Uiso 1 1 calc R U . . .
C3 C 0.2847(4) 0.6456(3) 0.5621(3) 0.0475(12) Uani 1 1 d . . . . .
H3 H 0.204719 0.649087 0.600803 0.057 Uiso 1 1 calc R U . . .
C4 C 0.3834(4) 0.6648(3) 0.5873(3) 0.0433(11) Uani 1 1 d . . . . .
H4 H 0.370432 0.682984 0.643434 0.052 Uiso 1 1 calc R U . . .
C5 C 0.5029(3) 0.6574(3) 0.5297(3) 0.0344(10) Uani 1 1 d . . . . .
C6 C 0.4111(5) 0.7524(4) 0.2430(3) 0.0509(13) Uani 1 1 d . . . . .
C7 C 0.2979(5) 0.8152(4) 0.2718(4) 0.0704(16) Uani 1 1 d . . . . .
H7 H 0.238082 0.780149 0.320727 0.084 Uiso 1 1 calc R U . . .
C8 C 0.2703(6) 0.9289(4) 0.2301(5) 0.092(2) Uani 1 1 d . . . . .
H8 H 0.193951 0.970312 0.251890 0.111 Uiso 1 1 calc R U . . .
C9 C 0.3555(8) 0.9788(5) 0.1577(5) 0.101(3) Uani 1 1 d . . . . .
H9 H 0.338070 1.054918 0.128481 0.121 Uiso 1 1 calc R U . . .
C10 C 0.4681(6) 0.9166(5) 0.1273(4) 0.093(2) Uani 1 1 d . . . . .
H10 H 0.526523 0.951768 0.077247 0.111 Uiso 1 1 calc R U . . .
C11 C 0.4976(5) 0.8028(4) 0.1689(3) 0.0665(16) Uani 1 1 d . . . . .
H11 H 0.574147 0.761787 0.146936 0.080 Uiso 1 1 calc R U . . .
C12 C 0.6038(4) 0.5562(3) 0.2480(3) 0.0463(12) Uani 1 1 d . . . . .
C13 C 0.6171(4) 0.4936(4) 0.1825(3) 0.0619(15) Uani 1 1 d . . . . .
H13 H 0.546822 0.478109 0.170837 0.074 Uiso 1 1 calc R U . . .
C14 C 0.7339(5) 0.4554(4) 0.1359(4) 0.0763(18) Uani 1 1 d . . . . .
H14 H 0.742873 0.413554 0.092617 0.092 Uiso 1 1 calc R U . . .
C15 C 0.8382(5) 0.4784(5) 0.1525(4) 0.0774(19) Uani 1 1 d . . . . .
H15 H 0.917313 0.450364 0.121672 0.093 Uiso 1 1 calc R U . . .
C16 C 0.8253(4) 0.5432(4) 0.2151(4) 0.0743(18) Uani 1 1 d . . . . .
H16 H 0.896185 0.560859 0.224372 0.089 Uiso 1 1 calc R U . . .
C17 C 0.7089(4) 0.5821(4) 0.2638(3) 0.0591(14) Uani 1 1 d . . . . .
H17 H 0.700685 0.624708 0.306430 0.071 Uiso 1 1 calc R U . . .
C18 C 0.7586(4) 0.6979(3) 0.4657(3) 0.0397(11) Uani 1 1 d . . . . .
C19 C 0.8754(4) 0.6343(4) 0.4584(3) 0.0506(13) Uani 1 1 d . . . . .
H19 H 0.892216 0.575883 0.507226 0.061 Uiso 1 1 calc R U . . .
C20 C 0.9675(4) 0.6582(4) 0.3774(4) 0.0655(16) Uani 1 1 d . . . . .
H20 H 1.045726 0.614542 0.372185 0.079 Uiso 1 1 calc R U . . .
C21 C 0.9451(5) 0.7449(4) 0.3053(4) 0.0667(16) Uani 1 1 d . . . . .
H21 H 1.008196 0.760296 0.251866 0.080 Uiso 1 1 calc R U . . .
C22 C 0.8294(5) 0.8092(4) 0.3119(3) 0.0633(15) Uani 1 1 d . . . . .
H22 H 0.813851 0.868649 0.263283 0.076 Uiso 1 1 calc R U . . .
C23 C 0.7362(4) 0.7847(3) 0.3916(3) 0.0510(13) Uani 1 1 d . . . . .
H23 H 0.657353 0.827013 0.395683 0.061 Uiso 1 1 calc R U . . .
C24 C 0.5860(4) 0.7980(3) 0.6131(3) 0.0404(11) Uani 1 1 d . . . . .
C25 C 0.5078(4) 0.7927(4) 0.6999(3) 0.0609(14) Uani 1 1 d . . . . .
H25 H 0.482731 0.722772 0.734618 0.073 Uiso 1 1 calc R U . . .
C26 C 0.4651(5) 0.8886(4) 0.7372(4) 0.0748(17) Uani 1 1 d . . . . .
H26 H 0.412548 0.882920 0.795818 0.090 Uiso 1 1 calc R U . . .
C27 C 0.5017(5) 0.9905(4) 0.6863(4) 0.0722(17) Uani 1 1 d . . . . .
H27 H 0.473742 1.055242 0.710259 0.087 Uiso 1 1 calc R U . . .
C28 C 0.5783(5) 0.9992(4) 0.6009(4) 0.0789(18) Uani 1 1 d . . . . .
H28 H 0.602902 1.069513 0.566700 0.095 Uiso 1 1 calc R U . . .
C29 C 0.6202(4) 0.9028(4) 0.5644(3) 0.0603(15) Uani 1 1 d . . . . .
H29 H 0.672594 0.909626 0.505652 0.072 Uiso 1 1 calc R U . . .
C30 C 0.2530(4) 0.5861(3) 0.2069(3) 0.0403(11) Uani 1 1 d . . . . .
C31 C 0.2202(4) 0.6494(4) 0.1452(3) 0.0498(12) Uani 1 1 d . . . . .
C32 C 0.1763(4) 0.7361(4) 0.0709(3) 0.0470(12) Uani 1 1 d . . . . .
C33 C 0.2308(5) 0.8337(4) 0.0317(3) 0.0652(15) Uani 1 1 d . . . . .
H33 H 0.297089 0.844456 0.051134 0.078 Uiso 1 1 calc R U . . .
C34 C 0.1885(6) 0.9165(5) -0.0364(4) 0.0843(19) Uani 1 1 d . . . . .
H34 H 0.227673 0.981851 -0.062459 0.101 Uiso 1 1 calc R U . . .
C35 C 0.0915(6) 0.9054(5) -0.0664(4) 0.091(2) Uani 1 1 d . . . . .
H35 H 0.062841 0.961947 -0.111804 0.109 Uiso 1 1 calc R U . . .
C36 C 0.0378(5) 0.8074(6) -0.0271(4) 0.091(2) Uani 1 1 d . . . . .
H36 H -0.028418 0.797302 -0.046876 0.110 Uiso 1 1 calc R U . . .
C37 C 0.0779(5) 0.7233(5) 0.0403(4) 0.0698(16) Uani 1 1 d . . . . .
H37 H 0.038954 0.657745 0.065561 0.084 Uiso 1 1 calc R U . . .
C38 C 0.1882(3) 0.3737(3) 0.3191(3) 0.0364(10) Uani 1 1 d . . . . .
C39 C 0.1193(4) 0.3093(4) 0.3283(3) 0.0498(13) Uani 1 1 d . . . . .
C40 C 0.0330(4) 0.2306(4) 0.3439(3) 0.0566(13) Uani 1 1 d D U . . .
C41 C -0.0132(4) 0.1694(4) 0.4314(4) 0.0782(16) Uani 1 1 d D U . . .
H41 H 0.016498 0.176060 0.478905 0.094 Uiso 1 1 calc R U . . .
C42 C -0.1038(5) 0.0973(4) 0.4507(4) 0.0918(19) Uani 1 1 d D U . . .
H42 H -0.136371 0.057832 0.510247 0.110 Uiso 1 1 calc R U . . .
C43 C -0.1429(6) 0.0869(5) 0.3784(4) 0.102(2) Uani 1 1 d D U . . .
H43 H -0.199194 0.035770 0.389592 0.122 Uiso 1 1 calc R U . . .
C44 C -0.1029(5) 0.1480(5) 0.2911(4) 0.0999(19) Uani 1 1 d D U . . .
H44 H -0.133347 0.141836 0.243771 0.120 Uiso 1 1 calc R U . . .
C45 C -0.0148(5) 0.2201(4) 0.2757(4) 0.0780(16) Uani 1 1 d D U . . .
H45 H 0.013043 0.263098 0.216619 0.094 Uiso 1 1 calc R U . . .
C46 C 0.3343(5) 0.3572(5) 0.0934(4) 0.115(2) Uani 1 1 d . . . . .
H46A H 0.309105 0.439028 0.085019 0.138 Uiso 1 1 calc R U . . .
H46B H 0.320846 0.324366 0.158750 0.138 Uiso 1 1 calc R 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 C30 1.989(4) . ?
Pt1 C38 2.017(4) . ?
Pt1 P1 2.3049(11) . ?
Pt1 P2 2.3107(12) 2_666 ?
Cl1 C46 1.681(5) . ?
Cl2 C46 1.737(6) . ?
P1 C12 1.835(4) . ?
P1 C6 1.846(4) . ?
P1 C1 1.847(4) . ?
P2 C18 1.811(4) . ?
P2 C24 1.825(4) . ?
P2 C5 1.848(4) . ?
N1 C5 1.338(5) . ?
N1 C1 1.358(5) . ?
C1 C2 1.380(5) . ?
C2 C3 1.374(5) . ?
C2 H2 0.9300 . ?
C3 C4 1.366(5) . ?
C3 H3 0.9300 . ?
C4 C5 1.390(5) . ?
C4 H4 0.9300 . ?
C6 C11 1.370(6) . ?
C6 C7 1.373(6) . ?
C7 C8 1.383(6) . ?
C7 H7 0.9300 . ?
C8 C9 1.344(7) . ?
C8 H8 0.9300 . ?
C9 C10 1.372(7) . ?
C9 H9 0.9300 . ?
C10 C11 1.387(6) . ?
C10 H10 0.9300 . ?
C11 H11 0.9300 . ?
C12 C17 1.392(6) . ?
C12 C13 1.400(6) . ?
C13 C14 1.368(6) . ?
C13 H13 0.9300 . ?
C14 C15 1.373(7) . ?
C14 H14 0.9300 . ?
C15 C16 1.384(7) . ?
C15 H15 0.9300 . ?
C16 C17 1.378(6) . ?
C16 H16 0.9300 . ?
C17 H17 0.9300 . ?
C18 C19 1.381(5) . ?
C18 C23 1.389(5) . ?
C19 C20 1.388(5) . ?
C19 H19 0.9300 . ?
C20 C21 1.367(6) . ?
C20 H20 0.9300 . ?
C21 C22 1.376(6) . ?
C21 H21 0.9300 . ?
C22 C23 1.383(5) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 C29 1.369(5) . ?
C24 C25 1.382(6) . ?
C25 C26 1.394(6) . ?
C25 H25 0.9300 . ?
C26 C27 1.356(6) . ?
C26 H26 0.9300 . ?
C27 C28 1.355(6) . ?
C27 H27 0.9300 . ?
C28 C29 1.392(6) . ?
C28 H28 0.9300 . ?
C29 H29 0.9300 . ?
C30 C31 1.165(6) . ?
C31 C32 1.476(6) . ?
C32 C33 1.365(5) . ?
C32 C37 1.382(6) . ?
C33 C34 1.381(6) . ?
C33 H33 0.9300 . ?
C34 C35 1.355(7) . ?
C34 H34 0.9300 . ?
C35 C36 1.365(7) . ?
C35 H35 0.9300 . ?
C36 C37 1.371(7) . ?
C36 H36 0.9300 . ?
C37 H37 0.9300 . ?
C38 C39 1.171(5) . ?
C39 C40 1.433(6) . ?
C40 C45 1.376(5) . ?
C40 C41 1.376(5) . ?
C41 C42 1.401(5) . ?
C41 H41 0.9300 . ?
C42 C43 1.374(6) . ?
C42 H42 0.9300 . ?
C43 C44 1.360(5) . ?
C43 H43 0.9300 . ?
C44 C45 1.389(5) . ?
C44 H44 0.9300 . ?
C45 H45 0.9300 . ?
C46 H46A 0.9700 . ?
C46 H46B 0.9700 . ?

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
C30 Pt1 C38 89.29(16) . . ?
C30 Pt1 P1 89.57(12) . . ?
C38 Pt1 P1 178.48(11) . . ?
C30 Pt1 P2 171.34(12) . 2_666 ?
C38 Pt1 P2 82.82(12) . 2_666 ?
P1 Pt1 P2 98.38(4) . 2_666 ?
C12 P1 C6 104.0(2) . . ?
C12 P1 C1 112.2(2) . . ?
C6 P1 C1 101.38(19) . . ?
C12 P1 Pt1 112.02(15) . . ?
C6 P1 Pt1 117.55(15) . . ?
C1 P1 Pt1 109.23(13) . . ?
C18 P2 C24 107.58(19) . . ?
C18 P2 C5 103.14(19) . . ?
C24 P2 C5 102.30(18) . . ?
C18 P2 Pt1 116.27(15) . 2_666 ?
C24 P2 Pt1 108.09(15) . 2_666 ?
C5 P2 Pt1 118.20(12) . 2_666 ?
C5 N1 C1 117.3(3) . . ?
N1 C1 C2 122.7(4) . . ?
N1 C1 P1 121.6(3) . . ?
C2 C1 P1 115.6(3) . . ?
C3 C2 C1 119.5(4) . . ?
C3 C2 H2 120.3 . . ?
C1 C2 H2 120.3 . . ?
C4 C3 C2 118.0(4) . . ?
C4 C3 H3 121.0 . . ?
C2 C3 H3 121.0 . . ?
C3 C4 C5 120.5(4) . . ?
C3 C4 H4 119.7 . . ?
C5 C4 H4 119.7 . . ?
N1 C5 C4 121.9(4) . . ?
N1 C5 P2 118.4(3) . . ?
C4 C5 P2 119.6(3) . . ?
C11 C6 C7 119.0(4) . . ?
C11 C6 P1 122.0(4) . . ?
C7 C6 P1 119.1(4) . . ?
C6 C7 C8 122.0(5) . . ?
C6 C7 H7 119.0 . . ?
C8 C7 H7 119.0 . . ?
C9 C8 C7 119.1(6) . . ?
C9 C8 H8 120.5 . . ?
C7 C8 H8 120.5 . . ?
C8 C9 C10 119.6(6) . . ?
C8 C9 H9 120.2 . . ?
C10 C9 H9 120.2 . . ?
C9 C10 C11 122.0(6) . . ?
C9 C10 H10 119.0 . . ?
C11 C10 H10 119.0 . . ?
C6 C11 C10 118.4(5) . . ?
C6 C11 H11 120.8 . . ?
C10 C11 H11 120.8 . . ?
C17 C12 C13 120.2(4) . . ?
C17 C12 P1 124.8(4) . . ?
C13 C12 P1 114.9(4) . . ?
C14 C13 C12 119.6(5) . . ?
C14 C13 H13 120.2 . . ?
C12 C13 H13 120.2 . . ?
C13 C14 C15 120.6(5) . . ?
C13 C14 H14 119.7 . . ?
C15 C14 H14 119.7 . . ?
C14 C15 C16 119.9(5) . . ?
C14 C15 H15 120.1 . . ?
C16 C15 H15 120.1 . . ?
C17 C16 C15 120.9(5) . . ?
C17 C16 H16 119.5 . . ?
C15 C16 H16 119.5 . . ?
C16 C17 C12 118.7(5) . . ?
C16 C17 H17 120.6 . . ?
C12 C17 H17 120.6 . . ?
C19 C18 C23 119.0(4) . . ?
C19 C18 P2 120.0(3) . . ?
C23 C18 P2 121.0(3) . . ?
C18 C19 C20 119.4(4) . . ?
C18 C19 H19 120.3 . . ?
C20 C19 H19 120.3 . . ?
C21 C20 C19 121.1(5) . . ?
C21 C20 H20 119.4 . . ?
C19 C20 H20 119.4 . . ?
C20 C21 C22 120.0(5) . . ?
C20 C21 H21 120.0 . . ?
C22 C21 H21 120.0 . . ?
C21 C22 C23 119.4(5) . . ?
C21 C22 H22 120.3 . . ?
C23 C22 H22 120.3 . . ?
C22 C23 C18 121.0(4) . . ?
C22 C23 H23 119.5 . . ?
C18 C23 H23 119.5 . . ?
C29 C24 C25 116.9(4) . . ?
C29 C24 P2 124.2(4) . . ?
C25 C24 P2 118.9(3) . . ?
C24 C25 C26 122.2(5) . . ?
C24 C25 H25 118.9 . . ?
C26 C25 H25 118.9 . . ?
C27 C26 C25 118.7(5) . . ?
C27 C26 H26 120.7 . . ?
C25 C26 H26 120.7 . . ?
C28 C27 C26 120.9(5) . . ?
C28 C27 H27 119.6 . . ?
C26 C27 H27 119.6 . . ?
C27 C28 C29 119.9(5) . . ?
C27 C28 H28 120.1 . . ?
C29 C28 H28 120.1 . . ?
C24 C29 C28 121.5(5) . . ?
C24 C29 H29 119.3 . . ?
C28 C29 H29 119.3 . . ?
C31 C30 Pt1 179.7(5) . . ?
C30 C31 C32 175.8(5) . . ?
C33 C32 C37 118.0(5) . . ?
C33 C32 C31 120.2(5) . . ?
C37 C32 C31 121.8(4) . . ?
C32 C33 C34 120.6(5) . . ?
C32 C33 H33 119.7 . . ?
C34 C33 H33 119.7 . . ?
C35 C34 C33 122.0(6) . . ?
C35 C34 H34 119.0 . . ?
C33 C34 H34 119.0 . . ?
C34 C35 C36 117.0(6) . . ?
C34 C35 H35 121.5 . . ?
C36 C35 H35 121.5 . . ?
C35 C36 C37 122.5(6) . . ?
C35 C36 H36 118.8 . . ?
C37 C36 H36 118.8 . . ?
C36 C37 C32 119.9(5) . . ?
C36 C37 H37 120.0 . . ?
C32 C37 H37 120.0 . . ?
C39 C38 Pt1 175.6(4) . . ?
C38 C39 C40 177.4(5) . . ?
C45 C40 C41 117.4(5) . . ?
C45 C40 C39 122.6(4) . . ?
C41 C40 C39 119.8(5) . . ?
C40 C41 C42 121.7(5) . . ?
C40 C41 H41 119.1 . . ?
C42 C41 H41 119.1 . . ?
C43 C42 C41 117.5(5) . . ?
C43 C42 H42 121.2 . . ?
C41 C42 H42 121.2 . . ?
C44 C43 C42 123.0(6) . . ?
C44 C43 H43 118.5 . . ?
C42 C43 H43 118.5 . . ?
C43 C44 C45 117.2(6) . . ?
C43 C44 H44 121.4 . . ?
C45 C44 H44 121.4 . . ?
C40 C45 C44 123.0(5) . . ?
C40 C45 H45 118.5 . . ?
C44 C45 H45 118.5 . . ?
Cl1 C46 Cl2 113.5(3) . . ?
Cl1 C46 H46A 108.9 . . ?
Cl2 C46 H46A 108.9 . . ?
Cl1 C46 H46B 108.9 . . ?
Cl2 C46 H46B 108.9 . . ?
H46A C46 H46B 107.7 . . ?

_refine_diff_density_max         1.139
_refine_diff_density_min         -1.512
_refine_diff_density_rms         0.106



####################################################################### 
# 
# 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_z_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 2058499'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C95 H64 Cl2 F12 N2 O0 P4 Pt2'
_chemical_formula_weight         2046.44

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'
P P 0.1023 0.0942 '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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 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+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   31.1374(14)
_cell_length_b                   13.5008(4)
_cell_length_c                   21.6946(10)
_cell_angle_alpha                90
_cell_angle_beta                 106.303(3)
_cell_angle_gamma                90
_cell_volume                     8753.3(6)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    10554
_cell_measurement_theta_min      2.5075
_cell_measurement_theta_max      27.5010

_exptl_crystal_description       Block
_exptl_crystal_colour            Colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.553
_exptl_crystal_F_000             4024
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.80
_exptl_crystal_size_mid          0.45
_exptl_crystal_size_min          0.40
_exptl_absorpt_coefficient_mu    3.399
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.4983
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  MM007-Saturn724+
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            37051
_diffrn_reflns_av_unetI/netI     0.0679
_diffrn_reflns_av_R_equivalents  0.0653
_diffrn_reflns_limit_h_min       -40
_diffrn_reflns_limit_h_max       40
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         3.728
_diffrn_reflns_theta_max         27.493
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.973
_diffrn_measured_fraction_theta_full 0.969
_diffrn_reflns_Laue_measured_fraction_max 0.973
_diffrn_reflns_Laue_measured_fraction_full 0.969
_diffrn_reflns_point_group_measured_fraction_max 0.973
_diffrn_reflns_point_group_measured_fraction_full 0.969
_reflns_number_total             9761
_reflns_number_gt                8214
_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.
 
 _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-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.500 0.000 0.007 550 89 ' '
2 0.000 0.500 0.734 550 89 ' '
_platon_squeeze_void_probe_radius 1.20
_platon_squeeze_details          
;
The unit cell contains 4 methylene chloride molecules which have been treated
as a diffuse contribution to the overall scattering without specific atom
positions by SQUEEZE/PLATON.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0384P)²] 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         9761
_refine_ls_number_parameters     568
_refine_ls_number_restraints     275
_refine_ls_R_factor_all          0.0489
_refine_ls_R_factor_gt           0.0406
_refine_ls_wR_factor_ref         0.0975
_refine_ls_wR_factor_gt          0.0921
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_restrained_S_all      1.070
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.73292(2) 0.49014(2) 0.58842(2) 0.03498(7) Uani 1 1 d . . . . .
P1 P 0.69766(3) 0.64217(8) 0.57726(5) 0.0378(2) Uani 1 1 d . . . . .
P2 P 0.69717(3) 0.95342(8) 0.41509(5) 0.0351(2) Uani 1 1 d . . . . .
N1 N 0.69676(10) 0.7885(2) 0.48659(14) 0.0327(7) Uani 1 1 d . . . . .
C1 C 0.69460(12) 0.6911(3) 0.49714(18) 0.0346(8) Uani 1 1 d . . . . .
C2 C 0.68702(15) 0.6225(3) 0.4471(2) 0.0455(10) Uani 1 1 d . . . . .
H2A H 0.687976 0.555009 0.455801 0.055 Uiso 1 1 calc R U . . .
C3 C 0.67818(17) 0.6552(3) 0.3851(2) 0.0534(12) Uani 1 1 d . . . . .
H3A H 0.672088 0.610519 0.351166 0.064 Uiso 1 1 calc R U . . .
C4 C 0.67845(15) 0.7548(3) 0.3741(2) 0.0481(11) Uani 1 1 d . . . . .
H4A H 0.671490 0.779053 0.332363 0.058 Uiso 1 1 calc R U . . .
C5 C 0.68926(12) 0.8193(3) 0.42604(18) 0.0346(8) Uani 1 1 d . . . . .
C6 C 0.63864(15) 0.6436(4) 0.5769(2) 0.0543(11) Uani 1 1 d . U . . .
C7 C 0.6264(2) 0.6765(6) 0.6297(3) 0.0926(18) Uani 1 1 d . U . . .
H7A H 0.648078 0.702755 0.664512 0.111 Uiso 1 1 calc R U . . .
C8 C 0.5824(2) 0.6710(7) 0.6318(4) 0.118(2) Uani 1 1 d . U . . .
H8A H 0.574181 0.694091 0.667224 0.142 Uiso 1 1 calc R U . . .
C9 C 0.5500(2) 0.6288(7) 0.5779(4) 0.111(2) Uani 1 1 d . U . . .
H9A H 0.520726 0.619657 0.579361 0.134 Uiso 1 1 calc R U . . .
C10 C 0.56161(19) 0.6028(6) 0.5261(4) 0.0969(18) Uani 1 1 d . U . . .
H10A H 0.539895 0.581257 0.489787 0.116 Uiso 1 1 calc R U . . .
C11 C 0.60651(17) 0.6076(5) 0.5257(3) 0.0745(14) Uani 1 1 d . U . . .
H11A H 0.614438 0.585791 0.489722 0.089 Uiso 1 1 calc R U . . .
C12 C 0.72287(14) 0.7307(4) 0.6396(2) 0.0468(10) Uani 1 1 d . . . . .
C13 C 0.74727(17) 0.6938(4) 0.6991(2) 0.0612(13) Uani 1 1 d . . . . .
H13A H 0.750563 0.625757 0.705073 0.073 Uiso 1 1 calc R U . . .
C14 C 0.7667(2) 0.7572(5) 0.7494(2) 0.0716(16) Uani 1 1 d . . . . .
H14A H 0.782901 0.731401 0.788778 0.086 Uiso 1 1 calc R U . . .
C15 C 0.7623(2) 0.8560(6) 0.7415(3) 0.0807(18) Uani 1 1 d . . . . .
H15A H 0.776037 0.898062 0.775184 0.097 Uiso 1 1 calc R U . . .
C16 C 0.73757(19) 0.8951(5) 0.6837(2) 0.0718(15) Uani 1 1 d . . . . .
H16A H 0.734146 0.963361 0.678938 0.086 Uiso 1 1 calc R U . . .
C17 C 0.71774(17) 0.8330(4) 0.6327(2) 0.0594(13) Uani 1 1 d . . . . .
H17A H 0.701031 0.859677 0.593799 0.071 Uiso 1 1 calc R U . . .
C18 C 0.67773(15) 1.0060(3) 0.4801(2) 0.0409(10) Uani 1 1 d . . . . .
C19 C 0.63845(17) 0.9734(4) 0.4921(3) 0.0615(14) Uani 1 1 d . . . . .
H19A H 0.621539 0.923965 0.466558 0.074 Uiso 1 1 calc R U . . .
C20 C 0.6244(2) 1.0136(4) 0.5415(3) 0.0751(18) Uani 1 1 d . . . . .
H20A H 0.597767 0.992127 0.548392 0.090 Uiso 1 1 calc R U . . .
C21 C 0.6492(2) 1.0848(5) 0.5805(3) 0.0730(16) Uani 1 1 d . . . . .
H21A H 0.639430 1.111840 0.613632 0.088 Uiso 1 1 calc R U . . .
C22 C 0.6882(2) 1.1156(4) 0.5703(3) 0.0773(17) Uani 1 1 d . . . . .
H22A H 0.705245 1.163759 0.596841 0.093 Uiso 1 1 calc R U . . .
C23 C 0.70280(17) 1.0758(4) 0.5208(2) 0.0595(13) Uani 1 1 d . . . . .
H23A H 0.729893 1.096619 0.515060 0.071 Uiso 1 1 calc R U . . .
C24 C 0.65502(14) 0.9765(3) 0.3385(2) 0.0453(10) Uani 1 1 d . . . . .
C25 C 0.61215(17) 0.9371(6) 0.3243(3) 0.0839(19) Uani 1 1 d . . . . .
H25A H 0.604004 0.900137 0.355364 0.101 Uiso 1 1 calc R U . . .
C26 C 0.5816(2) 0.9512(7) 0.2661(3) 0.108(3) Uani 1 1 d . . . . .
H26A H 0.552838 0.925794 0.258462 0.130 Uiso 1 1 calc R U . . .
C27 C 0.5933(2) 1.0028(5) 0.2186(3) 0.091(2) Uani 1 1 d . . . . .
H27A H 0.572678 1.012417 0.178762 0.109 Uiso 1 1 calc R U . . .
C28 C 0.63538(18) 1.0395(5) 0.2306(2) 0.0700(15) Uani 1 1 d . . . . .
H28A H 0.643438 1.075186 0.198898 0.084 Uiso 1 1 calc R U . . .
C29 C 0.66631(17) 1.0245(4) 0.2891(2) 0.0533(12) Uani 1 1 d . . . . .
H29A H 0.695425 1.047248 0.295480 0.064 Uiso 1 1 calc R U . . .
C30 C 0.76283(13) 0.3558(3) 0.5984(2) 0.0395(9) Uani 1 1 d . . . . .
C31 C 0.78500(15) 0.2837(3) 0.6068(2) 0.0474(10) Uani 1 1 d . . . . .
C32 C 0.81796(15) 0.2066(3) 0.6195(2) 0.0489(11) Uani 1 1 d . . . . .
C33 C 0.83744(17) 0.1748(4) 0.5730(3) 0.0595(13) Uani 1 1 d . . . . .
H33A H 0.826359 0.196778 0.530907 0.071 Uiso 1 1 calc R U . . .
C34 C 0.87350(18) 0.1100(4) 0.5891(3) 0.0673(14) Uani 1 1 d . . . . .
H34A H 0.887070 0.090526 0.557955 0.081 Uiso 1 1 calc R U . . .
C35 C 0.88923(16) 0.0748(4) 0.6504(3) 0.0624(13) Uani 1 1 d D . . . .
C36 C 0.8682(2) 0.1000(5) 0.6951(3) 0.0842(18) Uani 1 1 d . . . . .
H36A H 0.877856 0.072999 0.736084 0.101 Uiso 1 1 calc R U . . .
C37 C 0.8331(2) 0.1644(5) 0.6804(3) 0.0764(17) Uani 1 1 d . . . . .
H37A H 0.818961 0.180556 0.711623 0.092 Uiso 1 1 calc R U . . .
C38 C 0.9286(2) 0.0062(4) 0.6674(3) 0.088(2) Uani 1 1 d D . . . .
F1 F 0.9428(4) -0.0193(10) 0.7277(4) 0.126(4) Uani 0.5 1 d D U P A 1
F2 F 0.9646(3) 0.0485(10) 0.6567(8) 0.143(4) Uani 0.5 1 d D U P A 1
F3 F 0.9236(4) -0.0758(8) 0.6350(7) 0.135(4) Uani 0.5 1 d D U P A 1
F1' F 0.9483(5) -0.0069(12) 0.6231(6) 0.141(5) Uani 0.5 1 d D U P A 2
F2' F 0.9179(3) -0.0848(7) 0.6820(8) 0.135(4) Uani 0.5 1 d D U P A 2
F3' F 0.9579(4) 0.0352(11) 0.7184(6) 0.163(6) Uani 0.5 1 d D U P A 2
C39 C 0.67703(14) 0.4247(3) 0.5949(2) 0.0474(10) Uani 1 1 d . . . . .
C40 C 0.64383(15) 0.3846(4) 0.5996(2) 0.0541(12) Uani 1 1 d . . . . .
C41 C 0.60333(17) 0.3374(4) 0.6039(3) 0.0627(13) Uani 1 1 d . U . . .
C42 C 0.5762(2) 0.2878(5) 0.5547(3) 0.0924(18) Uani 1 1 d . U . . .
H42A H 0.583431 0.286099 0.515905 0.111 Uiso 1 1 calc R U . . .
C43 C 0.5372(2) 0.2379(6) 0.5588(4) 0.106(2) Uani 1 1 d . U . . .
H43A H 0.519923 0.201125 0.524496 0.127 Uiso 1 1 calc R U . . .
C44 C 0.5260(2) 0.2458(6) 0.6148(4) 0.1015(19) Uani 1 1 d D U . . .
C45 C 0.5531(3) 0.2945(6) 0.6661(5) 0.121(2) Uani 1 1 d . U . . .
H45A H 0.546017 0.298346 0.704844 0.145 Uiso 1 1 calc R U . . .
C46 C 0.5915(2) 0.3379(6) 0.6588(4) 0.109(2) Uani 1 1 d . U . . .
H46A H 0.610354 0.369507 0.694249 0.130 Uiso 1 1 calc R U . . .
C47 C 0.4848(2) 0.1967(5) 0.6230(4) 0.132(2) Uani 1 1 d D U . . .
F4 F 0.4598(3) 0.1658(10) 0.5631(4) 0.166(4) Uani 0.5 1 d D U P B 1
F5 F 0.4573(4) 0.2474(9) 0.6445(8) 0.174(4) Uani 0.5 1 d D U P B 1
F6 F 0.4942(4) 0.1146(7) 0.6552(5) 0.131(4) Uani 0.5 1 d D U P B 1
F4' F 0.4794(3) 0.2143(9) 0.6831(4) 0.148(3) Uani 0.5 1 d D U P B 2
F5' F 0.4862(5) 0.1019(6) 0.6194(6) 0.154(4) Uani 0.5 1 d D U P B 2
F6' F 0.4470(2) 0.2293(9) 0.5852(5) 0.128(4) Uani 0.5 1 d D U P B 2


_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 C39 1.991(4) . ?
Pt1 C30 2.022(4) . ?
Pt1 P1 2.3082(11) . ?
Pt1 P2 2.3274(9) 7_666 ?
P1 C12 1.810(5) . ?
P1 C6 1.835(4) . ?
P1 C1 1.837(4) . ?
P2 C18 1.827(4) . ?
P2 C24 1.832(5) . ?
P2 C5 1.852(4) . ?
N1 C5 1.334(5) . ?
N1 C1 1.340(5) . ?
C1 C2 1.396(6) . ?
C2 C3 1.367(6) . ?
C2 H2A 0.9300 . ?
C3 C4 1.366(6) . ?
C3 H3A 0.9300 . ?
C4 C5 1.388(6) . ?
C4 H4A 0.9300 . ?
C6 C11 1.359(7) . ?
C6 C7 1.378(7) . ?
C7 C8 1.386(8) . ?
C7 H7A 0.9300 . ?
C8 C9 1.430(11) . ?
C8 H8A 0.9300 . ?
C9 C10 1.320(9) . ?
C9 H9A 0.9300 . ?
C10 C11 1.402(7) . ?
C10 H10A 0.9300 . ?
C11 H11A 0.9300 . ?
C12 C13 1.392(6) . ?
C12 C17 1.394(7) . ?
C13 C14 1.385(8) . ?
C13 H13A 0.9300 . ?
C14 C15 1.347(9) . ?
C14 H14A 0.9300 . ?
C15 C16 1.379(8) . ?
C15 H15A 0.9300 . ?
C16 C17 1.388(7) . ?
C16 H16A 0.9300 . ?
C17 H17A 0.9300 . ?
C18 C23 1.375(6) . ?
C18 C19 1.392(6) . ?
C19 C20 1.378(7) . ?
C19 H19A 0.9300 . ?
C20 C21 1.366(8) . ?
C20 H20A 0.9300 . ?
C21 C22 1.359(8) . ?
C21 H21A 0.9300 . ?
C22 C23 1.387(6) . ?
C22 H22A 0.9300 . ?
C23 H23A 0.9300 . ?
C24 C29 1.380(6) . ?
C24 C25 1.388(6) . ?
C25 C26 1.364(8) . ?
C25 H25A 0.9300 . ?
C26 C27 1.375(9) . ?
C26 H26A 0.9300 . ?
C27 C28 1.355(8) . ?
C27 H27A 0.9300 . ?
C28 C29 1.376(7) . ?
C28 H28A 0.9300 . ?
C29 H29A 0.9300 . ?
C30 C31 1.177(6) . ?
C31 C32 1.434(6) . ?
C32 C33 1.383(6) . ?
C32 C37 1.394(7) . ?
C33 C34 1.388(7) . ?
C33 H33A 0.9300 . ?
C34 C35 1.367(7) . ?
C34 H34A 0.9300 . ?
C35 C36 1.356(7) . ?
C35 C38 1.497(6) . ?
C36 C37 1.364(8) . ?
C36 H36A 0.9300 . ?
C37 H37A 0.9300 . ?
C38 F3' 1.282(8) . ?
C38 F1' 1.289(8) . ?
C38 F3 1.297(7) . ?
C38 F1 1.304(8) . ?
C38 F2' 1.334(7) . ?
C38 F2 1.335(8) . ?
C39 C40 1.197(5) . ?
C40 C41 1.439(6) . ?
C41 C42 1.341(8) . ?
C41 C46 1.342(8) . ?
C42 C43 1.413(8) . ?
C42 H42A 0.9300 . ?
C43 C44 1.360(10) . ?
C43 H43A 0.9300 . ?
C44 C45 1.362(11) . ?
C44 C47 1.497(7) . ?
C45 C46 1.377(8) . ?
C45 H45A 0.9300 . ?
C46 H46A 0.9300 . ?
C47 F5 1.284(8) . ?
C47 F5' 1.284(8) . ?
C47 F6 1.299(8) . ?
C47 F6' 1.308(7) . ?
C47 F4 1.379(8) . ?
C47 F4' 1.383(8) . ?

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
C39 Pt1 C30 88.83(17) . . ?
C39 Pt1 P1 90.15(13) . . ?
C30 Pt1 P1 178.97(11) . . ?
C39 Pt1 P2 172.44(13) . 7_666 ?
C30 Pt1 P2 83.72(11) . 7_666 ?
P1 Pt1 P2 97.31(4) . 7_666 ?
C12 P1 C6 102.7(2) . . ?
C12 P1 C1 111.47(19) . . ?
C6 P1 C1 101.89(18) . . ?
C12 P1 Pt1 114.51(15) . . ?
C6 P1 Pt1 117.14(17) . . ?
C1 P1 Pt1 108.40(13) . . ?
C18 P2 C24 109.0(2) . . ?
C18 P2 C5 101.31(17) . . ?
C24 P2 C5 101.25(19) . . ?
C18 P2 Pt1 114.43(15) . 7_666 ?
C24 P2 Pt1 110.68(14) . 7_666 ?
C5 P2 Pt1 118.92(12) . 7_666 ?
C5 N1 C1 118.1(3) . . ?
N1 C1 C2 121.6(3) . . ?
N1 C1 P1 121.5(3) . . ?
C2 C1 P1 116.8(3) . . ?
C3 C2 C1 119.6(4) . . ?
C3 C2 H2A 120.2 . . ?
C1 C2 H2A 120.2 . . ?
C4 C3 C2 118.7(4) . . ?
C4 C3 H3A 120.6 . . ?
C2 C3 H3A 120.6 . . ?
C3 C4 C5 119.2(4) . . ?
C3 C4 H4A 120.4 . . ?
C5 C4 H4A 120.4 . . ?
N1 C5 C4 122.6(4) . . ?
N1 C5 P2 116.0(3) . . ?
C4 C5 P2 121.3(3) . . ?
C11 C6 C7 118.9(5) . . ?
C11 C6 P1 120.4(4) . . ?
C7 C6 P1 120.6(4) . . ?
C6 C7 C8 121.1(7) . . ?
C6 C7 H7A 119.5 . . ?
C8 C7 H7A 119.5 . . ?
C7 C8 C9 118.1(7) . . ?
C7 C8 H8A 120.9 . . ?
C9 C8 H8A 120.9 . . ?
C10 C9 C8 120.2(6) . . ?
C10 C9 H9A 119.9 . . ?
C8 C9 H9A 119.9 . . ?
C9 C10 C11 120.3(7) . . ?
C9 C10 H10A 119.8 . . ?
C11 C10 H10A 119.8 . . ?
C6 C11 C10 121.2(6) . . ?
C6 C11 H11A 119.4 . . ?
C10 C11 H11A 119.4 . . ?
C13 C12 C17 118.1(5) . . ?
C13 C12 P1 117.8(4) . . ?
C17 C12 P1 124.1(3) . . ?
C14 C13 C12 120.9(5) . . ?
C14 C13 H13A 119.6 . . ?
C12 C13 H13A 119.6 . . ?
C15 C14 C13 120.3(5) . . ?
C15 C14 H14A 119.8 . . ?
C13 C14 H14A 119.8 . . ?
C14 C15 C16 120.4(5) . . ?
C14 C15 H15A 119.8 . . ?
C16 C15 H15A 119.8 . . ?
C15 C16 C17 120.2(6) . . ?
C15 C16 H16A 119.9 . . ?
C17 C16 H16A 119.9 . . ?
C16 C17 C12 120.0(5) . . ?
C16 C17 H17A 120.0 . . ?
C12 C17 H17A 120.0 . . ?
C23 C18 C19 117.8(4) . . ?
C23 C18 P2 120.7(3) . . ?
C19 C18 P2 121.4(4) . . ?
C20 C19 C18 120.5(5) . . ?
C20 C19 H19A 119.7 . . ?
C18 C19 H19A 119.7 . . ?
C21 C20 C19 120.8(5) . . ?
C21 C20 H20A 119.6 . . ?
C19 C20 H20A 119.6 . . ?
C22 C21 C20 119.3(5) . . ?
C22 C21 H21A 120.4 . . ?
C20 C21 H21A 120.4 . . ?
C21 C22 C23 120.6(5) . . ?
C21 C22 H22A 119.7 . . ?
C23 C22 H22A 119.7 . . ?
C18 C23 C22 120.8(5) . . ?
C18 C23 H23A 119.6 . . ?
C22 C23 H23A 119.6 . . ?
C29 C24 C25 116.5(4) . . ?
C29 C24 P2 120.7(3) . . ?
C25 C24 P2 122.4(4) . . ?
C26 C25 C24 122.0(5) . . ?
C26 C25 H25A 119.0 . . ?
C24 C25 H25A 119.0 . . ?
C25 C26 C27 120.1(6) . . ?
C25 C26 H26A 119.9 . . ?
C27 C26 H26A 119.9 . . ?
C28 C27 C26 119.1(6) . . ?
C28 C27 H27A 120.4 . . ?
C26 C27 H27A 120.4 . . ?
C27 C28 C29 120.8(5) . . ?
C27 C28 H28A 119.6 . . ?
C29 C28 H28A 119.6 . . ?
C28 C29 C24 121.4(5) . . ?
C28 C29 H29A 119.3 . . ?
C24 C29 H29A 119.3 . . ?
C31 C30 Pt1 172.0(4) . . ?
C30 C31 C32 170.8(5) . . ?
C33 C32 C37 117.7(5) . . ?
C33 C32 C31 121.5(4) . . ?
C37 C32 C31 120.7(4) . . ?
C32 C33 C34 120.1(5) . . ?
C32 C33 H33A 120.0 . . ?
C34 C33 H33A 120.0 . . ?
C35 C34 C33 120.5(5) . . ?
C35 C34 H34A 119.7 . . ?
C33 C34 H34A 119.7 . . ?
C36 C35 C34 119.7(5) . . ?
C36 C35 C38 120.3(5) . . ?
C34 C35 C38 120.0(5) . . ?
C35 C36 C37 120.7(5) . . ?
C35 C36 H36A 119.7 . . ?
C37 C36 H36A 119.7 . . ?
C36 C37 C32 121.1(5) . . ?
C36 C37 H37A 119.5 . . ?
C32 C37 H37A 119.5 . . ?
F3' C38 F1' 108.2(7) . . ?
F3 C38 F1 105.9(7) . . ?
F3' C38 F2' 104.0(7) . . ?
F1' C38 F2' 104.6(6) . . ?
F3 C38 F2 104.4(7) . . ?
F1 C38 F2 102.8(6) . . ?
F3' C38 C35 111.0(7) . . ?
F1' C38 C35 115.4(7) . . ?
F3 C38 C35 115.4(7) . . ?
F1 C38 C35 115.8(7) . . ?
F2' C38 C35 112.8(7) . . ?
F2 C38 C35 111.1(7) . . ?
C40 C39 Pt1 179.0(4) . . ?
C39 C40 C41 178.7(6) . . ?
C42 C41 C46 116.2(5) . . ?
C42 C41 C40 122.4(5) . . ?
C46 C41 C40 121.4(6) . . ?
C41 C42 C43 123.2(7) . . ?
C41 C42 H42A 118.4 . . ?
C43 C42 H42A 118.4 . . ?
C44 C43 C42 117.4(7) . . ?
C44 C43 H43A 121.3 . . ?
C42 C43 H43A 121.3 . . ?
C43 C44 C45 120.7(6) . . ?
C43 C44 C47 121.0(8) . . ?
C45 C44 C47 118.2(7) . . ?
C44 C45 C46 118.1(7) . . ?
C44 C45 H45A 120.9 . . ?
C46 C45 H45A 120.9 . . ?
C41 C46 C45 124.2(7) . . ?
C41 C46 H46A 117.9 . . ?
C45 C46 H46A 117.9 . . ?
F5 C47 F6 109.4(7) . . ?
F5' C47 F6' 109.7(7) . . ?
F5 C47 F4 104.2(6) . . ?
F6 C47 F4 103.3(7) . . ?
F5' C47 F4' 104.1(7) . . ?
F6' C47 F4' 101.9(6) . . ?
F5 C47 C44 119.3(8) . . ?
F5' C47 C44 112.9(9) . . ?
F6 C47 C44 111.9(8) . . ?
F6' C47 C44 115.3(7) . . ?
F4 C47 C44 107.3(7) . . ?
F4' C47 C44 111.9(7) . . ?

_refine_diff_density_max         1.035
_refine_diff_density_min         -1.502
_refine_diff_density_rms         0.105



####################################################################### 
# 
# 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_4b
_database_code_depnum_ccdc_archive 'CCDC 1908777'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;
# start Validation Reply Form
_vrf_PLAT971_4b                  
;
PROBLEM: Check Calcd Resid. Dens.  0.88A   From Ag4             3.86 eA-3
RESPONSE: Author Response: Residual electron density does not make chemical sence. Residual electron resides too close to heavy metal atom center.
;
_vrf_PLAT973_4b                  
;
PROBLEM: Check Calcd Positive Resid. Density on       Pt2       2.28 eA-3
RESPONSE: Author Response: Residual electron density does not make chemical sence. Residual electron resides too close to heavy metal atom center.
;
# Added during the CSD deposition process: Saturday 23 January 2021 09:26 AM
# end Validation Reply Form


_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C100 H58 Ag2 Cl0 F30 N2 O6 P4 Pt2 S2'
_chemical_formula_weight         2747.40

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'
P P 0.1023 0.0942 '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'
Ag Ag -0.8971 1.1015 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

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

_cell_length_a                   27.930(4)
_cell_length_b                   13.1649(16)
_cell_length_c                   26.744(4)
_cell_angle_alpha                90
_cell_angle_beta                 104.657(2)
_cell_angle_gamma                90
_cell_volume                     9514(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    298(2)
_cell_measurement_reflns_used    24602
_cell_measurement_theta_min      2.1597
_cell_measurement_theta_max      27.4778

_exptl_crystal_description       Bloc
_exptl_crystal_colour            Yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.918
_exptl_crystal_F_000             5328
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.35
_exptl_crystal_size_min          0.30
_exptl_absorpt_coefficient_mu    3.565
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.233
_exptl_absorpt_correction_T_max  0.343
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_method       CCD_Profile_fitting
_diffrn_detector_area_resol_mean 28.5714
_diffrn_reflns_number            68257
_diffrn_reflns_av_unetI/netI     0.0393
_diffrn_reflns_av_R_equivalents  0.0435
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_h_max       33
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         2.160
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.994
_reflns_number_total             16669
_reflns_number_gt                15531
_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.
 
 _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    ?
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_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)+(0.1015P)²+26.4651P] 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         16669
_refine_ls_number_parameters     1333
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0416
_refine_ls_R_factor_gt           0.0374
_refine_ls_wR_factor_ref         0.1202
_refine_ls_wR_factor_gt          0.1128
_refine_ls_goodness_of_fit_ref   0.849
_refine_ls_restrained_S_all      0.849
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.22861(2) 0.54119(2) 0.46416(2) 0.01464(7) Uani 1 1 d . . . . .
Pt2 Pt 0.26723(2) 0.87200(2) 0.54474(2) 0.01467(7) Uani 1 1 d . . . . .
Ag3 Ag 0.20582(2) 0.75937(3) 0.45528(2) 0.02647(11) Uani 1 1 d . . . . .
Ag4 Ag 0.29099(2) 0.65377(3) 0.55385(2) 0.03172(12) Uani 1 1 d . . . . .
P5 P 0.25452(5) 0.58382(9) 0.39112(5) 0.0160(3) Uani 1 1 d . . . . .
P6 P 0.30363(5) 0.93769(10) 0.48318(5) 0.0163(3) Uani 1 1 d . . . . .
P7 P 0.19876(5) 0.47499(9) 0.53074(5) 0.0166(3) Uani 1 1 d . . . . .
P8 P 0.23376(5) 0.83854(9) 0.61370(5) 0.0153(3) Uani 1 1 d . . . . .
C19 C 0.17324(18) 0.5773(4) 0.56242(18) 0.0148(10) Uani 1 1 d . . . . .
C21 C 0.1503(2) 0.3826(4) 0.5079(2) 0.0205(11) Uani 1 1 d . . . . .
C45 C 0.46082(19) 0.7377(4) 0.6270(2) 0.0194(10) Uani 1 1 d . . . . .
C40 C 0.20807(18) 0.6389(4) 0.33805(18) 0.0169(10) Uani 1 1 d . . . . .
C30 C 0.0679(2) 0.9510(4) 0.4493(2) 0.0216(11) Uani 1 1 d . . . . .
C6 C 0.27858(19) 0.4785(4) 0.3612(2) 0.0202(11) Uani 1 1 d . . . . .
C18 C 0.18769(18) 0.7378(4) 0.59764(18) 0.0157(10) Uani 1 1 d . . . . .
C29 C 0.0259(2) 0.9948(4) 0.4178(2) 0.0245(12) Uani 1 1 d . . . . .
H29 H -0.005387 0.983481 0.424694 0.029 Uiso 1 1 calc R U . . .
C16 C 0.14160(19) 0.7405(4) 0.60852(19) 0.0195(10) Uani 1 1 d . . . . .
H16 H 0.131418 0.798216 0.624527 0.023 Uiso 1 1 calc R U . . .
C20 C 0.1310(2) 0.3653(4) 0.4550(2) 0.0245(12) Uani 1 1 d . . . . .
H20 H 0.142848 0.403025 0.430340 0.029 Uiso 1 1 calc R U . . .
C14 C 0.34829(19) 0.6705(4) 0.39620(19) 0.0192(10) Uani 1 1 d . . . . .
H14 H 0.355415 0.613261 0.377659 0.023 Uiso 1 1 calc R U . . .
C12 C 0.3830(2) 0.7471(4) 0.41252(19) 0.0222(11) Uani 1 1 d . . . . .
H12 H 0.414644 0.742593 0.405502 0.027 Uiso 1 1 calc R U . . .
C43 C 0.5029(2) 0.6858(4) 0.7120(2) 0.0238(11) Uani 1 1 d . . . . .
C47 C 0.4731(2) 0.4283(4) 0.5845(2) 0.0262(12) Uani 1 1 d . . . . .
H47 H 0.501827 0.412097 0.573322 0.031 Uiso 1 1 calc R U . . .
C13 C 0.37124(19) 0.8306(4) 0.43924(19) 0.0200(10) Uani 1 1 d . . . . .
H13 H 0.394477 0.883656 0.450723 0.024 Uiso 1 1 calc R U . . .
C22 C 0.0954(2) 0.2557(4) 0.5269(2) 0.0336(14) Uani 1 1 d . . . . .
H22 H 0.083434 0.217288 0.551258 0.040 Uiso 1 1 calc R U . . .
C32 C 0.0307(2) 0.6657(4) 0.3862(2) 0.0227(11) Uani 1 1 d . . . . .
C28 C 0.0293(2) 1.0550(4) 0.3762(2) 0.0232(11) Uani 1 1 d . . . . .
C11 C 0.3733(2) 1.0363(4) 0.5624(2) 0.0225(11) Uani 1 1 d . . . . .
H11 H 0.359008 1.001092 0.586041 0.027 Uiso 1 1 calc R U . . .
C49 C 0.3899(2) 0.4743(4) 0.6181(2) 0.0246(12) Uani 1 1 d . . . . .
H49 H 0.361372 0.490410 0.629793 0.030 Uiso 1 1 calc R U . . .
C17 C 0.12685(19) 0.5742(4) 0.57222(19) 0.0184(10) Uani 1 1 d . . . . .
H17 H 0.106326 0.516031 0.563164 0.022 Uiso 1 1 calc R U . . .
C48 C 0.4341(2) 0.4513(4) 0.6546(2) 0.0257(12) Uani 1 1 d . . . . .
H48 H 0.435842 0.450380 0.690489 0.031 Uiso 1 1 calc R U . . .
C9 C 0.4327(2) 1.1546(4) 0.5462(3) 0.0346(14) Uani 1 1 d . . . . .
H9 H 0.459578 1.199843 0.558871 0.041 Uiso 1 1 calc R U . . .
C37 C 0.1295(2) 0.6194(4) 0.2756(2) 0.0248(12) Uani 1 1 d . . . . .
H37 H 0.100387 0.580981 0.261877 0.030 Uiso 1 1 calc R U . . .
C25 C 0.1145(2) 0.9663(4) 0.4391(2) 0.0199(11) Uani 1 1 d . . . . .
C36 C 0.1798(2) 0.7669(4) 0.2729(2) 0.0240(11) Uani 1 1 d . . . . .
H36 H 0.184833 0.829488 0.257240 0.029 Uiso 1 1 calc R U . . .
C8 C 0.4151(2) 1.1400(4) 0.4939(3) 0.0352(14) Uani 1 1 d . . . . .
H8 H 0.430005 1.175046 0.470683 0.042 Uiso 1 1 calc R U . . .
C7 C 0.3761(2) 1.0753(4) 0.4747(2) 0.0264(12) Uani 1 1 d . . . . .
H7 H 0.362994 1.068166 0.438467 0.032 Uiso 1 1 calc R U . . .
C38 C 0.1651(2) 0.5842(4) 0.31806(19) 0.0209(11) Uani 1 1 d . . . . .
H38 H 0.159972 0.521711 0.333660 0.025 Uiso 1 1 calc R U . . .
C41 C 0.4148(2) 0.6938(4) 0.6883(2) 0.0235(11) Uani 1 1 d . . . . .
H41 H 0.383985 0.683925 0.696628 0.028 Uiso 1 1 calc R U . . .
C1 C 0.2949(2) 0.3902(4) 0.3880(2) 0.0255(12) Uani 1 1 d . . . . .
H1 H 0.292534 0.382787 0.422639 0.031 Uiso 1 1 calc R U . . .
C50 C 0.4292(2) 0.4499(4) 0.5486(2) 0.0237(12) Uani 1 1 d . . . . .
C15 C 0.11095(19) 0.6569(4) 0.5954(2) 0.0202(11) Uani 1 1 d . . . . .
H15 H 0.079202 0.656496 0.602232 0.024 Uiso 1 1 calc R U . . .
C26 C 0.1168(2) 1.0221(4) 0.3958(2) 0.0229(11) Uani 1 1 d . . . . .
H26 H 0.147562 1.029605 0.387141 0.028 Uiso 1 1 calc R U . . .
C42 C 0.4580(2) 0.6711(4) 0.7246(2) 0.0261(12) Uani 1 1 d . . . . .
H42 H 0.457251 0.645672 0.757588 0.031 Uiso 1 1 calc R U . . .
C5 C 0.2809(2) 0.4878(4) 0.3096(2) 0.0299(13) Uani 1 1 d . . . . .
H5 H 0.269420 0.547675 0.290546 0.036 Uiso 1 1 calc R U . . .
C51 C 0.38631(19) 0.4742(4) 0.5652(2) 0.0208(11) Uani 1 1 d . . . . .
C24 C 0.0941(2) 0.2922(4) 0.4388(2) 0.0326(13) Uani 1 1 d . . . . .
H24 H 0.081395 0.278486 0.402986 0.039 Uiso 1 1 calc R U . . .
C2 C 0.3146(2) 0.3125(4) 0.3646(2) 0.0249(12) Uani 1 1 d . . . . .
H2 H 0.326633 0.252928 0.383698 0.030 Uiso 1 1 calc R U . . .
C34 C -0.0029(2) 0.7833(4) 0.3180(2) 0.0256(12) Uani 1 1 d . . . . .
C27 C 0.0744(2) 1.0676(4) 0.3646(2) 0.0257(12) Uani 1 1 d . . . . .
H27 H 0.076605 1.107074 0.335578 0.031 Uiso 1 1 calc R U . . .
C46 C 0.4752(2) 0.4301(4) 0.6365(2) 0.0253(12) Uani 1 1 d . . . . .
C10 C 0.4117(2) 1.1041(4) 0.5805(2) 0.0291(12) Uani 1 1 d . . . . .
H10 H 0.423563 1.115821 0.616528 0.035 Uiso 1 1 calc R U . . .
C33 C -0.0101(2) 0.7103(4) 0.3530(2) 0.0241(11) Uani 1 1 d . . . . .
H33 H -0.042580 0.691277 0.354104 0.029 Uiso 1 1 calc R U . . .
C39 C 0.2151(2) 0.7307(4) 0.31510(19) 0.0208(11) Uani 1 1 d . . . . .
H39 H 0.244488 0.768735 0.328528 0.025 Uiso 1 1 calc R U . . .
C44 C 0.41523(19) 0.7312(4) 0.6396(2) 0.0204(11) Uani 1 1 d . . . . .
C4 C 0.3003(2) 0.4082(5) 0.2869(2) 0.0352(14) Uani 1 1 d . . . . .
H4 H 0.302104 0.414403 0.252019 0.042 Uiso 1 1 calc R U . . .
C35 C 0.1370(2) 0.7114(4) 0.2535(2) 0.0259(12) Uani 1 1 d . . . . .
H35 H 0.112455 0.736604 0.224778 0.031 Uiso 1 1 calc R U . . .
C3 C 0.3170(2) 0.3206(4) 0.3136(2) 0.0308(13) Uani 1 1 d . . . . .
H3 H 0.329856 0.266558 0.297413 0.037 Uiso 1 1 calc R U . . .
C23 C 0.1322(2) 0.3272(4) 0.5436(2) 0.0264(12) Uani 1 1 d . . . . .
H23 H 0.145151 0.338690 0.579547 0.032 Uiso 1 1 calc R U . . .
C31 C 0.07927(19) 0.6944(4) 0.38553(19) 0.0214(11) Uani 1 1 d . . . . .
N2 N 0.29042(16) 0.7593(3) 0.43369(15) 0.0184(9) Uani 1 1 d . . . . .
N1 N 0.20383(16) 0.6581(3) 0.57448(15) 0.0164(8) Uani 1 1 d . . . . .
C57 C 0.29832(18) 0.5094(4) 0.50151(18) 0.0159(10) Uani 1 1 d . . . . .
C54 C 0.26572(19) 1.0167(4) 0.4334(2) 0.0194(10) Uani 1 1 d . . . . .
C56 C 0.30275(18) 0.6804(4) 0.40796(18) 0.0163(10) Uani 1 1 d . . . . .
C62 C 0.16167(19) 0.6014(4) 0.43391(19) 0.0184(10) Uani 1 1 d . . . . .
C60 C 0.20020(19) 0.9110(4) 0.50156(18) 0.0174(10) Uani 1 1 d . . . . .
C59 C 0.15926(18) 0.9282(4) 0.47235(19) 0.0177(10) Uani 1 1 d . . . . .
C55 C 0.32457(19) 0.8340(4) 0.44855(18) 0.0177(10) Uani 1 1 d . . . . .
C53 C 0.35575(19) 1.0200(4) 0.5093(2) 0.0184(10) Uani 1 1 d . . . . .
C61 C 0.33126(18) 0.8094(3) 0.58251(19) 0.0160(10) Uani 1 1 d . . . . .
C58 C 0.3392(2) 0.4978(4) 0.5301(2) 0.0221(11) Uani 1 1 d . . . . .
F1 F 0.44350(13) 0.8615(2) 0.55945(13) 0.0311(8) Uani 1 1 d . . . . .
F2 F 0.50764(13) 0.7677(3) 0.56649(14) 0.0392(9) Uani 1 1 d . . . . .
F3 F 0.43495(14) 0.7042(3) 0.53732(12) 0.0349(8) Uani 1 1 d . . . . .
C65 C 0.2458(2) 1.1053(4) 0.4490(2) 0.0248(11) Uani 1 1 d . . . . .
H65 H 0.249852 1.118112 0.484752 0.030 Uiso 1 1 calc R U . . .
C63 C 0.24298(19) 0.4088(4) 0.5818(2) 0.0200(11) Uani 1 1 d . . . . .
C64 C 0.27476(19) 0.7946(4) 0.67370(19) 0.0203(11) Uani 1 1 d . . . . .
C67 C 0.4617(2) 0.7683(4) 0.5727(2) 0.0247(12) Uani 1 1 d . . . . .
C66 C 0.2206(2) 1.1739(4) 0.4132(2) 0.0286(12) Uani 1 1 d . . . . .
H66 H 0.207138 1.233483 0.424404 0.034 Uiso 1 1 calc R U . . .
C101 C 0.2703(2) 0.3295(4) 0.5686(2) 0.0274(12) Uani 1 1 d . . . . .
H101 H 0.265880 0.312263 0.533269 0.033 Uiso 1 1 calc R U . . .
C69 C 0.3116(2) 0.8605(4) 0.6999(2) 0.0227(11) Uani 1 1 d . . . . .
H69 H 0.315985 0.924286 0.685094 0.027 Uiso 1 1 calc R U . . .
C103 C 0.1233(2) 0.6469(4) 0.4161(2) 0.0207(11) Uani 1 1 d . . . . .
C102 C 0.2598(2) 0.9999(4) 0.3805(2) 0.0240(11) Uani 1 1 d . . . . .
H102 H 0.273204 0.940354 0.369273 0.029 Uiso 1 1 calc R U . . .
F11 F 0.08463(13) 0.7979(2) 0.49662(13) 0.0338(8) Uani 1 1 d . . . . .
F7 F 0.46928(13) 0.4111(3) 0.48333(13) 0.0386(8) Uani 1 1 d . . . . .
F10 F 0.01644(13) 0.8745(3) 0.49635(15) 0.0453(10) Uani 1 1 d . . . . .
F12 F 0.08560(14) 0.9362(3) 0.54013(12) 0.0364(8) Uani 1 1 d . . . . .
F9 F 0.41673(14) 0.5337(3) 0.46809(13) 0.0374(9) Uani 1 1 d . . . . .
F8 F 0.39152(14) 0.3784(3) 0.46743(14) 0.0408(9) Uani 1 1 d . . . . .
F14 F 0.05041(16) 0.5877(4) 0.46864(15) 0.0578(12) Uani 1 1 d . . . . .
F6 F 0.54746(14) 0.5919(3) 0.78390(15) 0.0493(10) Uani 1 1 d . . . . .
F13 F -0.02357(14) 0.5767(4) 0.4248(2) 0.0690(15) Uani 1 1 d . . . . .
C114 C 0.1920(2) 0.9560(4) 0.6787(2) 0.0253(12) Uani 1 1 d . . . . .
H114 H 0.190370 0.894728 0.696949 0.030 Uiso 1 1 calc R U . . .
F4 F 0.58853(14) 0.6501(4) 0.73421(15) 0.0568(12) Uani 1 1 d . . . . .
F5 F 0.56158(16) 0.7487(3) 0.78417(19) 0.0668(15) Uani 1 1 d . . . . .
C70 C 0.3005(2) 0.6722(5) 0.7431(2) 0.0279(12) Uani 1 1 d . . . . .
H70 H 0.297233 0.607348 0.757447 0.033 Uiso 1 1 calc R U . . .
C71 C 0.2688(2) 0.7008(4) 0.6953(2) 0.0231(11) Uani 1 1 d . . . . .
H71 H 0.243349 0.656047 0.677795 0.028 Uiso 1 1 calc R U . . .
C72 C 0.3364(2) 0.7393(5) 0.7689(2) 0.0324(14) Uani 1 1 d . . . . .
H72 H 0.357485 0.720865 0.801457 0.039 Uiso 1 1 calc R U . . .
C107 C 0.5044(2) 0.7177(4) 0.6630(2) 0.0235(11) Uani 1 1 d . . . . .
H107 H 0.535187 0.725566 0.654508 0.028 Uiso 1 1 calc R U . . .
C115 C 0.2113(2) 1.0446(4) 0.6081(2) 0.0269(13) Uani 1 1 d . . . . .
H115 H 0.222387 1.044818 0.577306 0.032 Uiso 1 1 calc R U . . .
C122 C 0.3096(2) 0.3003(5) 0.6573(3) 0.0376(15) Uani 1 1 d . . . . .
H122 H 0.332638 0.263470 0.683186 0.045 Uiso 1 1 calc R U . . .
C124 C 0.2346(2) 1.0688(4) 0.3446(2) 0.0297(13) Uani 1 1 d . . . . .
H124 H 0.230707 1.056873 0.308804 0.036 Uiso 1 1 calc R U . . .
C105 C 0.0442(2) 0.8140(4) 0.3176(2) 0.0257(12) Uani 1 1 d . . . . .
H105 H 0.048733 0.865130 0.294125 0.031 Uiso 1 1 calc R U . . .
C118 C 0.4265(2) 0.4434(4) 0.4925(2) 0.0265(12) Uani 1 1 d . . . . .
C117 C 0.0221(2) 0.5818(5) 0.4211(2) 0.0318(13) Uani 1 1 d . . . . .
C120 C 0.2489(2) 0.4327(4) 0.6338(2) 0.0261(12) Uani 1 1 d . . . . .
H120 H 0.230165 0.486109 0.643441 0.031 Uiso 1 1 calc R U . . .
C113 C 0.20823(19) 0.9538(4) 0.6337(2) 0.0174(10) Uani 1 1 d . . . . .
C108 C 0.5505(2) 0.6698(4) 0.7527(2) 0.0300(13) Uani 1 1 d . . . . .
F15 F 0.0325(2) 0.4918(3) 0.4036(2) 0.0729(15) Uani 1 1 d . . . . .
C123 C 0.2147(2) 1.1564(4) 0.3611(2) 0.0312(13) Uani 1 1 d . . . . .
H123 H 0.197184 1.203934 0.336404 0.037 Uiso 1 1 calc R U . . .
C104 C 0.0762(2) 0.2404(5) 0.4745(2) 0.0360(14) Uani 1 1 d . . . . .
H104 H 0.050140 0.192920 0.463108 0.043 Uiso 1 1 calc R U . . .
C121 C 0.3038(2) 0.2754(4) 0.6061(3) 0.0348(14) Uani 1 1 d . . . . .
H121 H 0.322459 0.221715 0.596582 0.042 Uiso 1 1 calc R U . . .
C106 C 0.0847(2) 0.7707(4) 0.3509(2) 0.0240(11) Uani 1 1 d . . . . .
H106 H 0.116924 0.792932 0.350480 0.029 Uiso 1 1 calc R U . . .
C73 C 0.3419(2) 0.8331(5) 0.7477(2) 0.0309(13) Uani 1 1 d . . . . .
H73 H 0.366397 0.879065 0.765872 0.037 Uiso 1 1 calc R U . . .
C116 C 0.0636(2) 0.8900(5) 0.4949(2) 0.0300(13) Uani 1 1 d . . . . .
C119 C 0.2826(2) 0.3778(5) 0.6717(2) 0.0344(14) Uani 1 1 d . . . . .
H119 H 0.286854 0.393734 0.707255 0.041 Uiso 1 1 calc R U . . .
F24 F -0.01469(13) 1.1285(3) 0.29756(14) 0.0382(9) Uani 1 1 d . . . . .
F16 F 0.53866(14) 0.3111(3) 0.66672(15) 0.0459(10) Uani 1 1 d . . . . .
F23 F -0.05765(13) 1.0613(4) 0.34550(15) 0.0480(10) Uani 1 1 d . . . . .
F18 F 0.52364(14) 0.4125(3) 0.72280(14) 0.0497(10) Uani 1 1 d . . . . .
F19 F -0.03820(15) 0.9209(3) 0.26566(17) 0.0519(11) Uani 1 1 d . . . . .
F21 F -0.05593(18) 0.7738(3) 0.23425(17) 0.0659(14) Uani 1 1 d . . . . .
F22 F -0.02004(18) 1.2010(3) 0.36752(18) 0.0714(16) Uani 1 1 d . . . . .
F20 F -0.08675(15) 0.8257(4) 0.2937(2) 0.0735(16) Uani 1 1 d . . . . .
F17 F 0.56056(15) 0.4648(4) 0.6665(2) 0.0666(14) Uani 1 1 d . . . . .
C130 C 0.1980(3) 1.1346(4) 0.6276(2) 0.0320(14) Uani 1 1 d . . . . .
H130 H 0.199972 1.196314 0.609844 0.038 Uiso 1 1 calc R U . . .
C128 C 0.1782(2) 1.0466(4) 0.6972(2) 0.0302(13) Uani 1 1 d . . . . .
H128 H 0.166050 1.046895 0.727318 0.036 Uiso 1 1 calc R U . . .
C129 C 0.1820(2) 1.1369(4) 0.6718(2) 0.0308(13) Uani 1 1 d . . . . .
H129 H 0.173599 1.199560 0.685043 0.037 Uiso 1 1 calc R U . . .
C127 C -0.0162(2) 1.1103(5) 0.3467(2) 0.0343(14) Uani 1 1 d . . . . .
C131 C 0.5239(2) 0.4042(5) 0.6733(2) 0.0332(14) Uani 1 1 d . . . . .
C126 C -0.0465(2) 0.8255(4) 0.2781(2) 0.0321(13) Uani 1 1 d . . . . .
C132 C 0.3688(2) 0.7655(4) 0.6053(2) 0.0219(11) Uani 1 1 d . . . . .
S1 S 0.14830(5) 0.43553(11) 0.70438(5) 0.0271(3) Uani 1 1 d . . . . .
S2 S 0.39281(6) 0.46711(11) 0.82201(6) 0.0331(3) Uani 1 1 d . . . . .
F25 F 0.12000(15) 0.5306(3) 0.77810(13) 0.0395(9) Uani 1 1 d . . . . .
F26 F 0.48983(14) 0.4638(3) 0.84590(17) 0.0443(10) Uani 1 1 d . . . . .
F27 F 0.45838(15) 0.6105(3) 0.85259(14) 0.0415(9) Uani 1 1 d . . . . .
F28 F 0.08064(15) 0.5761(3) 0.70133(16) 0.0475(10) Uani 1 1 d . . . . .
F29 F 0.45897(15) 0.4974(3) 0.90997(14) 0.0478(10) Uani 1 1 d . . . . .
F30 F 0.06392(15) 0.4335(3) 0.73179(16) 0.0496(10) Uani 1 1 d . . . . .
O9 O 0.12165(15) 0.4045(3) 0.65310(15) 0.0311(9) Uani 1 1 d . . . . .
O10 O 0.35892(16) 0.5285(3) 0.84206(17) 0.0381(10) Uani 1 1 d . . . . .
O11 O 0.39361(18) 0.4893(4) 0.76937(19) 0.0509(13) Uani 1 1 d . . . . .
O12 O 0.16506(19) 0.3538(3) 0.74014(18) 0.0456(12) Uani 1 1 d . . . . .
O13 O 0.18275(17) 0.5173(3) 0.70602(17) 0.0408(11) Uani 1 1 d . . . . .
C52 C 0.4530(2) 0.5118(4) 0.8595(2) 0.0314(13) Uani 1 1 d . . . . .
O15 O 0.3936(2) 0.3627(4) 0.8363(3) 0.0658(18) Uani 1 1 d . . . . .
C68 C 0.1006(2) 0.4962(5) 0.7301(2) 0.0340(14) 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
Pt1 C62 2.003(5) . ?
Pt1 C57 1.995(5) . ?
Pt1 P5 2.3172(13) . ?
Pt1 P7 2.3187(13) . ?
Pt1 Ag3 2.9385(6) . ?
Pt1 Ag4 2.9784(5) . ?
Pt2 C61 1.996(5) . ?
Pt2 C60 2.002(5) . ?
Pt2 P6 2.3106(13) . ?
Pt2 P8 2.3112(13) . ?
Pt2 Ag4 2.9449(6) . ?
Pt2 Ag3 2.9645(5) . ?
Ag3 C60 2.374(5) . ?
Ag3 C62 2.411(5) . ?
Ag3 N2 2.571(4) . ?
Ag3 C59 2.672(5) . ?
Ag3 Ag4 3.3716(7) . ?
Ag4 C61 2.369(5) . ?
Ag4 C57 2.400(5) . ?
Ag4 C58 2.621(5) . ?
Ag4 N1 2.630(4) . ?
Ag4 C132 2.695(5) . ?
P5 C40 1.814(5) . ?
P5 C6 1.812(5) . ?
P5 C56 1.824(5) . ?
P6 C53 1.807(5) . ?
P6 C54 1.806(5) . ?
P6 C55 1.827(5) . ?
P7 C63 1.816(5) . ?
P7 C21 1.807(5) . ?
P7 C19 1.829(5) . ?
P8 C113 1.814(5) . ?
P8 C64 1.814(5) . ?
P8 C18 1.822(5) . ?
C19 N1 1.352(6) . ?
C19 C17 1.386(7) . ?
C21 C23 1.394(7) . ?
C21 C20 1.399(8) . ?
C45 C107 1.373(8) . ?
C45 C44 1.400(7) . ?
C45 C67 1.513(7) . ?
C40 C39 1.392(7) . ?
C40 C38 1.385(7) . ?
C30 C29 1.384(8) . ?
C30 C25 1.411(8) . ?
C30 C116 1.491(8) . ?
C6 C5 1.403(7) . ?
C6 C1 1.381(8) . ?
C18 N1 1.352(6) . ?
C18 C16 1.390(7) . ?
C29 C28 1.389(8) . ?
C16 C15 1.384(7) . ?
C20 C24 1.397(8) . ?
C14 C12 1.391(7) . ?
C14 C56 1.391(7) . ?
C12 C13 1.395(7) . ?
C43 C107 1.386(8) . ?
C43 C42 1.390(8) . ?
C43 C108 1.505(8) . ?
C47 C50 1.382(8) . ?
C47 C46 1.376(8) . ?
C13 C55 1.388(7) . ?
C22 C104 1.383(9) . ?
C22 C23 1.381(8) . ?
C32 C31 1.414(7) . ?
C32 C33 1.385(8) . ?
C32 C117 1.504(8) . ?
C28 C27 1.381(8) . ?
C28 C127 1.502(8) . ?
C11 C10 1.384(8) . ?
C11 C53 1.396(7) . ?
C49 C48 1.400(8) . ?
C49 C51 1.391(8) . ?
C17 C15 1.381(7) . ?
C48 C46 1.380(8) . ?
C9 C10 1.377(9) . ?
C9 C8 1.375(9) . ?
C37 C38 1.385(7) . ?
C37 C35 1.386(8) . ?
C25 C26 1.387(7) . ?
C25 C59 1.429(7) . ?
C36 C39 1.384(7) . ?
C36 C35 1.385(8) . ?
C8 C7 1.376(8) . ?
C7 C53 1.406(7) . ?
C41 C44 1.396(7) . ?
C41 C42 1.378(8) . ?
C1 C2 1.385(8) . ?
C50 C51 1.415(8) . ?
C50 C118 1.487(8) . ?
C26 C27 1.398(8) . ?
C5 C4 1.389(8) . ?
C51 C58 1.445(7) . ?
C24 C104 1.366(9) . ?
C2 C3 1.386(8) . ?
C34 C105 1.379(8) . ?
C34 C33 1.391(8) . ?
C34 C126 1.509(8) . ?
C46 C131 1.503(8) . ?
C44 C132 1.458(7) . ?
C4 C3 1.374(9) . ?
C31 C106 1.399(8) . ?
C31 C103 1.436(7) . ?
N2 C56 1.338(7) . ?
N2 C55 1.357(7) . ?
C57 C58 1.212(7) . ?
C54 C102 1.399(7) . ?
C54 C65 1.400(8) . ?
C62 C103 1.215(8) . ?
C60 C59 1.232(7) . ?
C61 C132 1.217(7) . ?
F1 C67 1.341(6) . ?
F2 C67 1.334(6) . ?
F3 C67 1.344(7) . ?
C65 C66 1.373(8) . ?
C63 C101 1.389(8) . ?
C63 C120 1.396(8) . ?
C64 C69 1.391(7) . ?
C64 C71 1.391(7) . ?
C66 C123 1.382(8) . ?
C101 C121 1.382(8) . ?
C69 C73 1.390(8) . ?
C102 C124 1.378(8) . ?
F11 C116 1.343(7) . ?
F7 C118 1.348(6) . ?
F10 C116 1.342(7) . ?
F12 C116 1.354(7) . ?
F9 C118 1.350(7) . ?
F8 C118 1.343(6) . ?
F14 C117 1.319(7) . ?
F6 C108 1.338(7) . ?
F13 C117 1.305(7) . ?
C114 C113 1.389(7) . ?
C114 C128 1.382(8) . ?
F4 C108 1.308(7) . ?
F5 C108 1.324(7) . ?
C70 C72 1.383(9) . ?
C70 C71 1.411(7) . ?
C72 C73 1.384(9) . ?
C115 C130 1.383(8) . ?
C115 C113 1.392(7) . ?
C122 C119 1.381(9) . ?
C122 C121 1.379(9) . ?
C124 C123 1.398(9) . ?
C105 C106 1.373(8) . ?
C117 F15 1.333(8) . ?
C120 C119 1.397(8) . ?
F24 C127 1.346(7) . ?
F16 C131 1.319(7) . ?
F23 C127 1.319(8) . ?
F18 C131 1.330(7) . ?
F19 C126 1.333(7) . ?
F21 C126 1.324(7) . ?
F22 C127 1.333(7) . ?
F20 C126 1.294(7) . ?
F17 C131 1.347(8) . ?
C130 C129 1.366(8) . ?
C128 C129 1.386(8) . ?
S1 O12 1.436(5) . ?
S1 O13 1.437(5) . ?
S1 O9 1.444(4) . ?
S1 C68 1.829(6) . ?
S2 O15 1.426(5) . ?
S2 O10 1.447(4) . ?
S2 O11 1.444(5) . ?
S2 C52 1.822(6) . ?
F25 C68 1.339(7) . ?
F26 C52 1.334(7) . ?
F27 C52 1.326(7) . ?
F28 C68 1.340(7) . ?
F29 C52 1.332(7) . ?
F30 C68 1.326(7) . ?

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
C62 Pt1 C57 168.0(2) . . ?
C62 Pt1 P5 91.28(14) . . ?
C57 Pt1 P5 89.97(14) . . ?
C62 Pt1 P7 88.78(14) . . ?
C57 Pt1 P7 91.80(14) . . ?
P5 Pt1 P7 171.13(4) . . ?
C62 Pt1 Ag3 54.51(14) . . ?
C57 Pt1 Ag3 114.19(14) . . ?
P5 Pt1 Ag3 78.62(3) . . ?
P7 Pt1 Ag3 108.47(3) . . ?
C62 Pt1 Ag4 115.10(14) . . ?
C57 Pt1 Ag4 53.37(14) . . ?
P5 Pt1 Ag4 108.33(3) . . ?
P7 Pt1 Ag4 79.59(3) . . ?
Ag3 Pt1 Ag4 69.472(13) . . ?
C61 Pt2 C60 170.10(19) . . ?
C61 Pt2 P6 90.91(14) . . ?
C60 Pt2 P6 90.52(14) . . ?
C61 Pt2 P8 90.51(14) . . ?
C60 Pt2 P8 90.06(14) . . ?
P6 Pt2 P8 168.41(5) . . ?
C61 Pt2 Ag4 53.19(13) . . ?
C60 Pt2 Ag4 117.12(14) . . ?
P6 Pt2 Ag4 107.07(3) . . ?
P8 Pt2 Ag4 82.89(3) . . ?
C61 Pt2 Ag3 117.59(14) . . ?
C60 Pt2 Ag3 52.91(14) . . ?
P6 Pt2 Ag3 83.18(3) . . ?
P8 Pt2 Ag3 106.28(3) . . ?
Ag4 Pt2 Ag3 69.577(13) . . ?
C60 Ag3 C62 138.68(17) . . ?
C60 Ag3 N2 107.65(15) . . ?
C62 Ag3 N2 112.98(15) . . ?
C60 Ag3 C59 27.45(16) . . ?
C62 Ag3 C59 121.07(16) . . ?
N2 Ag3 C59 123.60(14) . . ?
C60 Ag3 Pt1 145.18(12) . . ?
C62 Ag3 Pt1 42.58(12) . . ?
N2 Ag3 Pt1 79.92(9) . . ?
C59 Ag3 Pt1 154.71(11) . . ?
C60 Ag3 Pt2 42.26(12) . . ?
C62 Ag3 Pt2 141.21(12) . . ?
N2 Ag3 Pt2 78.72(9) . . ?
C59 Ag3 Pt2 69.71(11) . . ?
Pt1 Ag3 Pt2 110.757(15) . . ?
C60 Ag3 Ag4 93.76(12) . . ?
C62 Ag3 Ag4 92.70(12) . . ?
N2 Ag3 Ag4 70.64(9) . . ?
C59 Ag3 Ag4 119.14(11) . . ?
Pt1 Ag3 Ag4 55.821(11) . . ?
Pt2 Ag3 Ag4 54.938(13) . . ?
C61 Ag4 C57 140.36(17) . . ?
C61 Ag4 C58 121.67(16) . . ?
C57 Ag4 C58 27.49(16) . . ?
C61 Ag4 N1 107.59(15) . . ?
C57 Ag4 N1 111.08(15) . . ?
C58 Ag4 N1 128.89(14) . . ?
C61 Ag4 C132 26.83(16) . . ?
C57 Ag4 C132 123.58(16) . . ?
C58 Ag4 C132 98.86(16) . . ?
N1 Ag4 C132 123.42(14) . . ?
C61 Ag4 Pt2 42.42(12) . . ?
C57 Ag4 Pt2 140.83(12) . . ?
C58 Ag4 Pt2 149.68(11) . . ?
N1 Ag4 Pt2 78.17(9) . . ?
C132 Ag4 Pt2 69.25(11) . . ?
C61 Ag4 Pt1 145.48(12) . . ?
C57 Ag4 Pt1 41.84(11) . . ?
C58 Ag4 Pt1 69.30(12) . . ?
N1 Ag4 Pt1 78.21(9) . . ?
C132 Ag4 Pt1 156.12(11) . . ?
Pt2 Ag4 Pt1 110.191(15) . . ?
C61 Ag4 Ag3 94.57(12) . . ?
C57 Ag4 Ag3 91.03(11) . . ?
C58 Ag4 Ag3 115.95(12) . . ?
N1 Ag4 Ag3 69.36(9) . . ?
C132 Ag4 Ag3 119.50(11) . . ?
Pt2 Ag4 Ag3 55.485(11) . . ?
Pt1 Ag4 Ag3 54.707(13) . . ?
C40 P5 C6 103.4(2) . . ?
C40 P5 C56 104.6(2) . . ?
C6 P5 C56 108.0(2) . . ?
C40 P5 Pt1 116.24(17) . . ?
C6 P5 Pt1 114.61(18) . . ?
C56 P5 Pt1 109.23(16) . . ?
C53 P6 C54 101.8(2) . . ?
C53 P6 C55 108.3(2) . . ?
C54 P6 C55 105.1(2) . . ?
C53 P6 Pt2 113.89(17) . . ?
C54 P6 Pt2 117.32(17) . . ?
C55 P6 Pt2 109.65(16) . . ?
C63 P7 C21 103.9(2) . . ?
C63 P7 C19 106.0(2) . . ?
C21 P7 C19 107.8(2) . . ?
C63 P7 Pt1 116.72(17) . . ?
C21 P7 Pt1 112.18(18) . . ?
C19 P7 Pt1 109.70(16) . . ?
C113 P8 C64 102.3(2) . . ?
C113 P8 C18 111.8(2) . . ?
C64 P8 C18 103.1(2) . . ?
C113 P8 Pt2 110.17(17) . . ?
C64 P8 Pt2 118.32(17) . . ?
C18 P8 Pt2 110.78(16) . . ?
N1 C19 C17 122.9(4) . . ?
N1 C19 P7 113.2(4) . . ?
C17 C19 P7 123.9(4) . . ?
C23 C21 C20 119.5(5) . . ?
C23 C21 P7 119.4(4) . . ?
C20 C21 P7 121.0(4) . . ?
C107 C45 C44 121.2(5) . . ?
C107 C45 C67 119.9(5) . . ?
C44 C45 C67 119.0(5) . . ?
C39 C40 C38 119.1(5) . . ?
C39 C40 P5 122.6(4) . . ?
C38 C40 P5 118.2(4) . . ?
C29 C30 C25 120.2(5) . . ?
C29 C30 C116 119.4(5) . . ?
C25 C30 C116 120.4(5) . . ?
C5 C6 C1 119.5(5) . . ?
C5 C6 P5 118.8(4) . . ?
C1 C6 P5 121.7(4) . . ?
N1 C18 C16 123.3(5) . . ?
N1 C18 P8 112.0(4) . . ?
C16 C18 P8 124.6(4) . . ?
C28 C29 C30 120.5(5) . . ?
C15 C16 C18 118.2(5) . . ?
C24 C20 C21 119.5(5) . . ?
C12 C14 C56 117.7(5) . . ?
C13 C12 C14 119.7(5) . . ?
C107 C43 C42 121.0(5) . . ?
C107 C43 C108 119.6(5) . . ?
C42 C43 C108 119.3(5) . . ?
C50 C47 C46 120.1(5) . . ?
C12 C13 C55 118.1(5) . . ?
C104 C22 C23 119.5(6) . . ?
C31 C32 C33 120.9(5) . . ?
C31 C32 C117 120.6(5) . . ?
C33 C32 C117 118.4(5) . . ?
C27 C28 C29 119.8(5) . . ?
C27 C28 C127 121.5(5) . . ?
C29 C28 C127 118.6(5) . . ?
C10 C11 C53 119.7(5) . . ?
C48 C49 C51 122.1(5) . . ?
C15 C17 C19 118.9(5) . . ?
C46 C48 C49 117.7(5) . . ?
C10 C9 C8 120.4(5) . . ?
C38 C37 C35 119.2(5) . . ?
C26 C25 C30 118.5(5) . . ?
C26 C25 C59 119.2(5) . . ?
C30 C25 C59 122.3(5) . . ?
C39 C36 C35 119.6(5) . . ?
C9 C8 C7 120.8(6) . . ?
C8 C7 C53 119.3(5) . . ?
C37 C38 C40 121.0(5) . . ?
C44 C41 C42 121.3(5) . . ?
C2 C1 C6 120.3(5) . . ?
C47 C50 C51 120.0(5) . . ?
C47 C50 C118 119.9(5) . . ?
C51 C50 C118 120.0(5) . . ?
C17 C15 C16 119.5(5) . . ?
C27 C26 C25 120.9(5) . . ?
C43 C42 C41 118.9(5) . . ?
C4 C5 C6 119.0(5) . . ?
C50 C51 C49 118.1(5) . . ?
C50 C51 C58 123.2(5) . . ?
C49 C51 C58 118.7(5) . . ?
C104 C24 C20 119.8(6) . . ?
C1 C2 C3 120.8(5) . . ?
C105 C34 C33 120.6(5) . . ?
C105 C34 C126 119.2(5) . . ?
C33 C34 C126 120.2(5) . . ?
C26 C27 C28 119.9(5) . . ?
C48 C46 C47 122.0(5) . . ?
C48 C46 C131 120.8(5) . . ?
C47 C46 C131 117.2(5) . . ?
C11 C10 C9 120.2(6) . . ?
C32 C33 C34 119.3(5) . . ?
C36 C39 C40 120.5(5) . . ?
C41 C44 C45 118.1(5) . . ?
C41 C44 C132 118.6(5) . . ?
C45 C44 C132 123.3(5) . . ?
C3 C4 C5 121.6(5) . . ?
C37 C35 C36 120.6(5) . . ?
C4 C3 C2 118.8(5) . . ?
C21 C23 C22 120.3(5) . . ?
C32 C31 C106 117.7(5) . . ?
C32 C31 C103 124.2(5) . . ?
C106 C31 C103 118.0(5) . . ?
C56 N2 C55 117.3(4) . . ?
C56 N2 Ag3 119.1(3) . . ?
C55 N2 Ag3 123.5(3) . . ?
C19 N1 C18 117.1(4) . . ?
C19 N1 Ag4 119.7(3) . . ?
C18 N1 Ag4 123.1(3) . . ?
C58 C57 Pt1 170.6(4) . . ?
C58 C57 Ag4 86.4(3) . . ?
Pt1 C57 Ag4 84.79(17) . . ?
C102 C54 C65 118.5(5) . . ?
C102 C54 P6 123.5(4) . . ?
C65 C54 P6 117.6(4) . . ?
N2 C56 C14 123.9(5) . . ?
N2 C56 P5 113.4(4) . . ?
C14 C56 P5 122.6(4) . . ?
C103 C62 Pt1 173.8(4) . . ?
C103 C62 Ag3 90.9(4) . . ?
Pt1 C62 Ag3 82.91(18) . . ?
C59 C60 Pt2 174.7(4) . . ?
C59 C60 Ag3 89.9(3) . . ?
Pt2 C60 Ag3 84.83(17) . . ?
C60 C59 C25 170.0(5) . . ?
C60 C59 Ag3 62.7(3) . . ?
C25 C59 Ag3 124.9(3) . . ?
N2 C55 C13 123.1(5) . . ?
N2 C55 P6 113.5(4) . . ?
C13 C55 P6 123.4(4) . . ?
C7 C53 C11 119.5(5) . . ?
C7 C53 P6 118.4(4) . . ?
C11 C53 P6 121.9(4) . . ?
C132 C61 Pt2 176.0(4) . . ?
C132 C61 Ag4 91.7(3) . . ?
Pt2 C61 Ag4 84.39(17) . . ?
C57 C58 C51 174.3(5) . . ?
C57 C58 Ag4 66.1(3) . . ?
C51 C58 Ag4 116.7(3) . . ?
C66 C65 C54 120.9(5) . . ?
C101 C63 C120 119.2(5) . . ?
C101 C63 P7 118.9(4) . . ?
C120 C63 P7 121.9(4) . . ?
C69 C64 C71 119.7(5) . . ?
C69 C64 P8 117.9(4) . . ?
C71 C64 P8 122.3(4) . . ?
F2 C67 F1 106.5(4) . . ?
F2 C67 F3 106.9(4) . . ?
F1 C67 F3 106.4(4) . . ?
F2 C67 C45 111.5(4) . . ?
F1 C67 C45 113.5(4) . . ?
F3 C67 C45 111.5(4) . . ?
C123 C66 C65 120.1(5) . . ?
C121 C101 C63 121.2(6) . . ?
C64 C69 C73 120.1(5) . . ?
C62 C103 C31 168.9(5) . . ?
C54 C102 C124 120.6(5) . . ?
C113 C114 C128 120.7(5) . . ?
C72 C70 C71 119.5(5) . . ?
C64 C71 C70 120.0(5) . . ?
C70 C72 C73 120.4(5) . . ?
C43 C107 C45 119.2(5) . . ?
C130 C115 C113 119.6(5) . . ?
C119 C122 C121 121.2(6) . . ?
C102 C124 C123 119.9(5) . . ?
C106 C105 C34 120.2(5) . . ?
F8 C118 F7 106.0(4) . . ?
F8 C118 F9 106.7(5) . . ?
F7 C118 F9 105.7(5) . . ?
F8 C118 C50 112.6(5) . . ?
F7 C118 C50 112.4(5) . . ?
F9 C118 C50 112.9(4) . . ?
F13 C117 F14 106.8(5) . . ?
F13 C117 F15 106.6(6) . . ?
F14 C117 F15 105.0(5) . . ?
F13 C117 C32 113.4(5) . . ?
F14 C117 C32 113.8(5) . . ?
F15 C117 C32 110.6(5) . . ?
C119 C120 C63 119.7(6) . . ?
C114 C113 C115 118.8(5) . . ?
C114 C113 P8 120.8(4) . . ?
C115 C113 P8 119.7(4) . . ?
F4 C108 F5 108.3(5) . . ?
F4 C108 F6 105.6(5) . . ?
F5 C108 F6 104.4(5) . . ?
F4 C108 C43 114.1(5) . . ?
F5 C108 C43 111.8(5) . . ?
F6 C108 C43 112.1(5) . . ?
C66 C123 C124 120.0(5) . . ?
C24 C104 C22 121.3(6) . . ?
C101 C121 C122 119.0(6) . . ?
C105 C106 C31 121.2(5) . . ?
C72 C73 C69 120.3(5) . . ?
F10 C116 F11 106.6(5) . . ?
F10 C116 F12 105.7(5) . . ?
F11 C116 F12 106.2(5) . . ?
F10 C116 C30 112.8(5) . . ?
F11 C116 C30 112.8(5) . . ?
F12 C116 C30 112.1(5) . . ?
C122 C119 C120 119.6(6) . . ?
C115 C130 C129 121.6(5) . . ?
C129 C128 C114 120.1(5) . . ?
C130 C129 C128 119.1(5) . . ?
F23 C127 F22 106.5(6) . . ?
F23 C127 F24 107.9(5) . . ?
F22 C127 F24 105.9(5) . . ?
F23 C127 C28 113.3(5) . . ?
F22 C127 C28 111.1(5) . . ?
F24 C127 C28 111.6(5) . . ?
F16 C131 F18 106.8(5) . . ?
F16 C131 F17 105.0(5) . . ?
F18 C131 F17 106.4(5) . . ?
F16 C131 C46 112.7(5) . . ?
F18 C131 C46 113.7(5) . . ?
F17 C131 C46 111.7(5) . . ?
F20 C126 F21 106.9(6) . . ?
F20 C126 F19 107.4(5) . . ?
F21 C126 F19 105.8(5) . . ?
F20 C126 C34 112.6(5) . . ?
F21 C126 C34 112.4(5) . . ?
F19 C126 C34 111.3(5) . . ?
C61 C132 C44 168.1(5) . . ?
C61 C132 Ag4 61.5(3) . . ?
C44 C132 Ag4 128.8(4) . . ?
O12 S1 O13 116.0(3) . . ?
O12 S1 O9 115.1(3) . . ?
O13 S1 O9 114.9(3) . . ?
O12 S1 C68 102.8(3) . . ?
O13 S1 C68 101.9(3) . . ?
O9 S1 C68 103.4(3) . . ?
O15 S2 O10 114.0(3) . . ?
O15 S2 O11 116.9(4) . . ?
O10 S2 O11 114.9(3) . . ?
O15 S2 C52 102.4(3) . . ?
O10 S2 C52 102.4(3) . . ?
O11 S2 C52 103.4(3) . . ?
F29 C52 F27 106.9(5) . . ?
F29 C52 F26 107.5(5) . . ?
F27 C52 F26 107.7(5) . . ?
F29 C52 S2 111.9(4) . . ?
F27 C52 S2 111.2(4) . . ?
F26 C52 S2 111.4(4) . . ?
F28 C68 F30 107.1(5) . . ?
F28 C68 F25 107.0(5) . . ?
F30 C68 F25 107.9(5) . . ?
F28 C68 S1 111.3(4) . . ?
F30 C68 S1 112.6(4) . . ?
F25 C68 S1 110.6(4) . . ?

_refine_diff_density_max         3.847
_refine_diff_density_min         -2.756
_refine_diff_density_rms         0.148



# start Validation Reply Form
_vrf_PLAT971_5                   
;
PROBLEM: Check Calcd Resid. Dens.  0.88A   From Ag4             3.86 eA-3  
RESPONSE: Residual electron density does not make chemical sence. Residual electron
resides too close to heavy metal atom center.
;
_vrf_PLAT973_5                   
;
PROBLEM: Check Calcd Positive Resid. Density on       Pt2       2.28 eA-3  
PROBLEM: Check Calcd Positive Resid. Density on       Pt1       2.28 eA-3  
RESPONSE: Residual electron density does not make chemical sence. Residual electron
resides too close to heavy metal atom center.
;
# END Validation Reply Form

####################################################################### 
# 
# 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_Pt4
_database_code_depnum_ccdc_archive 'CCDC 2058500'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C200 H124 Cl8 F48 N4 O0 P8 Pt4'
_chemical_formula_weight         4806.74

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'
P P 0.1023 0.0942 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 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+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   38.598(5)
_cell_length_b                   17.384(2)
_cell_length_c                   32.592(4)
_cell_angle_alpha                90
_cell_angle_beta                 111.235(2)
_cell_angle_gamma                90
_cell_volume                     20383(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    26724
_cell_measurement_theta_min      2.0100
_cell_measurement_theta_max      27.5631

_exptl_crystal_description       Prism
_exptl_crystal_colour            Colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.566
_exptl_crystal_F_000             9408
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_exptl_absorpt_coefficient_mu    2.999
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.8152
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  MM007-Saturn724+
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            75721
_diffrn_reflns_av_unetI/netI     0.0391
_diffrn_reflns_av_R_equivalents  0.0362
_diffrn_reflns_limit_h_min       -47
_diffrn_reflns_limit_h_max       50
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -41
_diffrn_reflns_limit_l_max       41
_diffrn_reflns_theta_min         2.562
_diffrn_reflns_theta_max         27.490
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.954
_diffrn_measured_fraction_theta_full 0.950
_diffrn_reflns_Laue_measured_fraction_max 0.954
_diffrn_reflns_Laue_measured_fraction_full 0.950
_diffrn_reflns_point_group_measured_fraction_max 0.954
_diffrn_reflns_point_group_measured_fraction_full 0.950
_reflns_number_total             22341
_reflns_number_gt                20067
_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    ?
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.000 0.500 0.000 156 40 ' '
2 0.000 0.565 -0.250 748 236 ' '
3 0.500 0.935 0.250 749 236 ' '
4 0.500 0.000 0.000 156 40 ' '
5 0.500 0.065 -0.250 748 236 ' '
6 1.000 0.435 0.250 749 236 ' '
7 0.500 0.000 0.500 156 40 ' '
8 1.000 0.500 0.500 156 40 ' '
_platon_squeeze_void_probe_radius 1.20
_platon_squeeze_details          
;
The unit cell contains 16 methylene chloride molecules which have been 
treated as a diffuse contribution to the overall scattering without 
specific atom positions by SQUEEZE/PLATON.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0771P)²+74.5219P] 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         22341
_refine_ls_number_parameters     1198
_refine_ls_number_restraints     57
_refine_ls_R_factor_all          0.0587
_refine_ls_R_factor_gt           0.0498
_refine_ls_wR_factor_ref         0.1446
_refine_ls_wR_factor_gt          0.1364
_refine_ls_goodness_of_fit_ref   1.055
_refine_ls_restrained_S_all      1.056
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.41156(2) 0.67761(2) 0.62312(2) 0.04325(7) Uani 1 1 d . . . . .
Pt2 Pt 0.66525(2) 0.61366(2) 0.71213(2) 0.04275(7) Uani 1 1 d . . . . .
P1 P 0.46048(3) 0.64301(7) 0.60260(4) 0.0421(2) Uani 1 1 d . . . . .
P2 P 0.60874(3) 0.61108(7) 0.65469(4) 0.0422(3) Uani 1 1 d . . . . .
P3 P 0.35941(3) 0.71651(7) 0.63666(4) 0.0429(3) Uani 1 1 d . . . . .
P4 P 0.65551(3) 0.51093(7) 0.75210(4) 0.0419(2) Uani 1 1 d . . . . .
F1 F 0.5118(3) 0.8810(5) 0.6910(3) 0.210(6) Uani 1 1 d . . . . .
F2 F 0.5159(2) 0.8546(4) 0.6286(5) 0.224(6) Uani 1 1 d . . . . .
F3 F 0.54534(18) 0.9509(4) 0.6642(4) 0.253(7) Uani 1 1 d . . . . .
F4 F 0.4958(3) 1.1917(7) 0.6095(7) 0.140(5) Uani 0.5 1 d D U P A 1
F5 F 0.4456(5) 1.2148(6) 0.6181(6) 0.138(5) Uani 0.5 1 d D U P A 1
F6 F 0.4455(6) 1.1880(7) 0.5555(3) 0.157(6) Uani 0.5 1 d D U P A 1
F4' F 0.4303(3) 1.2095(7) 0.5820(7) 0.130(5) Uani 0.5 1 d D U P A 2
F5' F 0.4775(5) 1.1789(7) 0.5685(6) 0.136(4) Uani 0.5 1 d D U P A 2
F6' F 0.4825(5) 1.2037(7) 0.6332(4) 0.154(6) Uani 0.5 1 d D U P A 2
F7 F 0.3048(4) 0.4465(4) 0.4741(2) 0.232(6) Uani 1 1 d . . . . .
F8 F 0.3548(3) 0.5051(6) 0.5041(3) 0.201(4) Uani 1 1 d . . . . .
F9 F 0.3097(3) 0.5329(4) 0.5209(2) 0.161(3) Uani 1 1 d . . . . .
F10 F 0.2881(2) 0.1981(4) 0.5297(3) 0.172(3) Uani 1 1 d . . . . .
F11 F 0.3262(4) 0.1600(4) 0.5890(3) 0.278(8) Uani 1 1 d . . . . .
F12 F 0.3403(2) 0.1689(4) 0.5349(4) 0.196(5) Uani 1 1 d . . . . .
F13 F 0.7607(2) 0.7668(4) 0.8377(2) 0.135(2) Uani 1 1 d . . . . .
F14 F 0.76554(18) 0.6736(4) 0.8786(2) 0.127(2) Uani 1 1 d . . . . .
F15 F 0.80676(15) 0.7558(4) 0.89848(19) 0.124(2) Uani 1 1 d . . . . .
F16 F 0.92163(19) 0.6285(10) 0.8283(4) 0.276(8) Uani 1 1 d . . . . .
F17 F 0.9222(2) 0.6132(10) 0.8862(5) 0.265(7) Uani 1 1 d . . . . .
F18 F 0.9188(2) 0.7168(6) 0.8705(5) 0.236(6) Uani 1 1 d . . . . .
F19 F 0.74887(19) 0.7286(5) 0.6346(2) 0.149(3) Uani 1 1 d . . . . .
F20 F 0.7347(3) 0.7596(7) 0.5673(3) 0.223(5) Uani 1 1 d . . . . .
F21 F 0.7003(3) 0.6907(4) 0.5854(3) 0.162(3) Uani 1 1 d . . . . .
F22 F 0.6958(4) 1.0227(11) 0.5353(6) 0.340(12) Uani 1 1 d . . . . .
F23 F 0.6441(4) 0.9965(5) 0.5134(3) 0.253(7) Uani 1 1 d . . . . .
F24 F 0.6648(6) 1.0747(4) 0.5623(3) 0.316(11) Uani 1 1 d . . . . .
N1 N 0.53517(11) 0.6280(2) 0.63905(13) 0.0428(8) Uani 1 1 d . . . . .
N2 N 0.65543(11) 0.6040(2) 0.81672(13) 0.0426(8) Uani 1 1 d . . . . .
C1 C 0.50573(14) 0.6522(3) 0.64794(16) 0.0444(10) Uani 1 1 d . . . . .
C2 C 0.50884(16) 0.6817(3) 0.68813(19) 0.0544(12) Uani 1 1 d . . . . .
H2A H 0.487936 0.698619 0.693311 0.065 Uiso 1 1 calc R U . . .
C3 C 0.54404(18) 0.6858(4) 0.72112(19) 0.0646(16) Uani 1 1 d . . . . .
H3A H 0.546801 0.704985 0.748771 0.077 Uiso 1 1 calc R U . . .
C4 C 0.57445(15) 0.6615(3) 0.71255(17) 0.0513(11) Uani 1 1 d . . . . .
H4A H 0.598124 0.664154 0.734071 0.062 Uiso 1 1 calc R U . . .
C5 C 0.56911(14) 0.6327(3) 0.67083(16) 0.0435(10) Uani 1 1 d . . . . .
C6 C 0.46130(15) 0.5442(3) 0.58471(18) 0.0505(11) Uani 1 1 d . . . . .
C7 C 0.46968(18) 0.4855(3) 0.6157(2) 0.0621(14) Uani 1 1 d . . . . .
H7A H 0.476841 0.497153 0.645458 0.074 Uiso 1 1 calc R U . . .
C8 C 0.4674(2) 0.4098(3) 0.6022(3) 0.0772(19) Uani 1 1 d . . . . .
H8A H 0.472900 0.370757 0.623074 0.093 Uiso 1 1 calc R U . . .
C9 C 0.4572(3) 0.3914(4) 0.5590(3) 0.094(3) Uani 1 1 d . . . . .
H9A H 0.455627 0.340174 0.550262 0.113 Uiso 1 1 calc R U . . .
C10 C 0.4492(3) 0.4485(5) 0.5286(3) 0.110(3) Uani 1 1 d . . . . .
H10A H 0.442508 0.436060 0.498924 0.132 Uiso 1 1 calc R U . . .
C11 C 0.4510(2) 0.5256(4) 0.5412(2) 0.079(2) Uani 1 1 d . . . . .
H11A H 0.445250 0.564166 0.519996 0.094 Uiso 1 1 calc R U . . .
C12 C 0.46338(14) 0.7008(3) 0.55719(17) 0.0461(10) Uani 1 1 d . . . . .
C13 C 0.43361(19) 0.7469(4) 0.5330(2) 0.0646(15) Uani 1 1 d . . . . .
H13A H 0.412570 0.748937 0.540536 0.078 Uiso 1 1 calc R U . . .
C14 C 0.4349(2) 0.7894(4) 0.4982(2) 0.080(2) Uani 1 1 d . . . . .
H14A H 0.414715 0.819706 0.481973 0.096 Uiso 1 1 calc R U . . .
C15 C 0.4658(3) 0.7873(4) 0.4872(2) 0.085(2) Uani 1 1 d . . . . .
H15A H 0.466998 0.817691 0.464281 0.102 Uiso 1 1 calc R U . . .
C16 C 0.4950(2) 0.7408(5) 0.5098(2) 0.085(2) Uani 1 1 d . . . . .
H16A H 0.515618 0.738120 0.501438 0.102 Uiso 1 1 calc R U . . .
C17 C 0.49407(18) 0.6978(4) 0.5450(2) 0.0666(15) Uani 1 1 d . . . . .
H17A H 0.514140 0.666628 0.560513 0.080 Uiso 1 1 calc R U . . .
C18 C 0.60189(15) 0.6824(3) 0.61153(18) 0.0539(12) Uani 1 1 d . . . . .
C19 C 0.6116(2) 0.6659(4) 0.5748(2) 0.0719(17) Uani 1 1 d . . . . .
H19A H 0.619903 0.617067 0.571071 0.086 Uiso 1 1 calc R U . . .
C20 C 0.6087(3) 0.7236(6) 0.5444(2) 0.096(3) Uani 1 1 d . . . . .
H20A H 0.615494 0.712598 0.520465 0.116 Uiso 1 1 calc R U . . .
C21 C 0.5966(3) 0.7933(7) 0.5479(3) 0.111(4) Uani 1 1 d . . . . .
H21A H 0.594354 0.829913 0.526264 0.134 Uiso 1 1 calc R U . . .
C22 C 0.5871(2) 0.8121(5) 0.5849(4) 0.103(3) Uani 1 1 d . . . . .
H22A H 0.579279 0.861664 0.588060 0.124 Uiso 1 1 calc R U . . .
C23 C 0.5894(2) 0.7562(4) 0.6166(3) 0.0736(18) Uani 1 1 d . . . . .
H23A H 0.582711 0.767769 0.640593 0.088 Uiso 1 1 calc R U . . .
C24 C 0.60089(15) 0.5206(3) 0.62485(17) 0.0489(11) Uani 1 1 d . . . . .
C25 C 0.56664(18) 0.4903(3) 0.6009(2) 0.0611(14) Uani 1 1 d . . . . .
H25A H 0.545227 0.515916 0.599971 0.073 Uiso 1 1 calc R U . . .
C26 C 0.5637(2) 0.4218(4) 0.5780(2) 0.0763(18) Uani 1 1 d . . . . .
H26A H 0.540358 0.401794 0.561936 0.092 Uiso 1 1 calc R U . . .
C27 C 0.5945(3) 0.3841(4) 0.5790(3) 0.095(3) Uani 1 1 d . . . . .
H27A H 0.592410 0.338370 0.563517 0.114 Uiso 1 1 calc R U . . .
C28 C 0.6285(3) 0.4125(5) 0.6025(3) 0.103(3) Uani 1 1 d . . . . .
H28A H 0.649483 0.385346 0.603362 0.124 Uiso 1 1 calc R U . . .
C29 C 0.63282(19) 0.4819(4) 0.6255(2) 0.0733(18) Uani 1 1 d . . . . .
H29A H 0.656339 0.501829 0.640750 0.088 Uiso 1 1 calc R U . . .
C30 C 0.66791(12) 0.6343(3) 0.85687(16) 0.0437(10) Uani 1 1 d . . . . .
C31 C 0.69734(15) 0.6035(3) 0.89200(18) 0.0549(13) Uani 1 1 d . . . . .
H31A H 0.705734 0.627097 0.919468 0.066 Uiso 1 1 calc R U . . .
C32 C 0.71359(16) 0.5367(4) 0.88461(19) 0.0620(14) Uani 1 1 d . . . . .
H32A H 0.732934 0.513971 0.907464 0.074 Uiso 1 1 calc R U . . .
C33 C 0.70115(15) 0.5037(3) 0.84340(18) 0.0537(12) Uani 1 1 d . . . . .
H33A H 0.711706 0.458667 0.837919 0.064 Uiso 1 1 calc R U . . .
C34 C 0.67229(13) 0.5400(3) 0.81020(16) 0.0439(10) Uani 1 1 d . . . . .
C35 C 0.32817(15) 0.7680(3) 0.58897(18) 0.0572(13) Uani 1 1 d . . . . .
C36 C 0.3288(2) 0.7515(6) 0.5486(2) 0.095(3) Uani 1 1 d . . . . .
H36A H 0.345452 0.714937 0.545911 0.114 Uiso 1 1 calc R U . . .
C37 C 0.3047(3) 0.7886(9) 0.5108(3) 0.131(5) Uani 1 1 d . . . . .
H37A H 0.305630 0.777804 0.483224 0.157 Uiso 1 1 calc R U . . .
C38 C 0.2799(3) 0.8413(8) 0.5153(5) 0.146(6) Uani 1 1 d . . . . .
H38A H 0.263374 0.865893 0.490603 0.176 Uiso 1 1 calc R U . . .
C39 C 0.2793(4) 0.8571(8) 0.5551(5) 0.160(6) Uani 1 1 d . . . . .
H39A H 0.262566 0.893445 0.557790 0.192 Uiso 1 1 calc R U . . .
C40 C 0.3030(3) 0.8208(5) 0.5925(3) 0.109(3) Uani 1 1 d . . . . .
H40A H 0.301860 0.832164 0.619862 0.131 Uiso 1 1 calc R U . . .
C41 C 0.36440(16) 0.7764(3) 0.68461(18) 0.0519(12) Uani 1 1 d . . . . .
C42 C 0.33817(19) 0.7736(3) 0.7050(2) 0.0654(15) Uani 1 1 d . . . . .
H42A H 0.318186 0.739847 0.694522 0.078 Uiso 1 1 calc R U . . .
C43 C 0.3417(3) 0.8206(4) 0.7406(3) 0.083(2) Uani 1 1 d . . . . .
H43A H 0.324411 0.817890 0.754361 0.099 Uiso 1 1 calc R U . . .
C44 C 0.3708(3) 0.8712(5) 0.7553(3) 0.105(3) Uani 1 1 d . . . . .
H44A H 0.372856 0.903901 0.778634 0.126 Uiso 1 1 calc R U . . .
C45 C 0.3970(3) 0.8741(6) 0.7358(3) 0.108(3) Uani 1 1 d . . . . .
H45A H 0.416829 0.908394 0.746149 0.130 Uiso 1 1 calc R U . . .
C46 C 0.3938(2) 0.8254(4) 0.7005(3) 0.082(2) Uani 1 1 d . . . . .
H46A H 0.411830 0.826405 0.687812 0.098 Uiso 1 1 calc R U . . .
C47 C 0.68186(16) 0.4251(3) 0.75211(18) 0.0553(13) Uani 1 1 d . . . . .
C48 C 0.6744(2) 0.3573(4) 0.7692(3) 0.080(2) Uani 1 1 d . . . . .
H48A H 0.654382 0.354114 0.778637 0.096 Uiso 1 1 calc R U . . .
C49 C 0.6971(3) 0.2929(5) 0.7721(3) 0.108(4) Uani 1 1 d . . . . .
H49A H 0.691556 0.246814 0.782772 0.130 Uiso 1 1 calc R U . . .
C50 C 0.7259(3) 0.2963(6) 0.7603(3) 0.122(5) Uani 1 1 d . . . . .
H50A H 0.740899 0.253166 0.763322 0.146 Uiso 1 1 calc R U . . .
C51 C 0.7345(2) 0.3651(7) 0.7428(4) 0.118(4) Uani 1 1 d . . . . .
H51A H 0.755096 0.367685 0.734407 0.141 Uiso 1 1 calc R U . . .
C52 C 0.71152(18) 0.4291(4) 0.7384(3) 0.078(2) Uani 1 1 d . . . . .
H52A H 0.716313 0.474419 0.726260 0.094 Uiso 1 1 calc R U . . .
C53 C 0.60867(14) 0.4732(3) 0.74176(17) 0.0471(11) Uani 1 1 d . . . . .
C54 C 0.58768(17) 0.4965(4) 0.7665(2) 0.0601(13) Uani 1 1 d . . . . .
H54A H 0.597346 0.532311 0.788948 0.072 Uiso 1 1 calc R U . . .
C55 C 0.55237(18) 0.4665(4) 0.7577(2) 0.0743(18) Uani 1 1 d . . . . .
H55A H 0.538425 0.482057 0.774230 0.089 Uiso 1 1 calc R U . . .
C56 C 0.53802(19) 0.4134(4) 0.7243(2) 0.0755(18) Uani 1 1 d . . . . .
H56A H 0.514660 0.392181 0.718911 0.091 Uiso 1 1 calc R U . . .
C57 C 0.5583(2) 0.3916(4) 0.6988(2) 0.0727(17) Uani 1 1 d . . . . .
H57A H 0.548182 0.357416 0.675601 0.087 Uiso 1 1 calc R U . . .
C58 C 0.59352(16) 0.4208(3) 0.70806(19) 0.0565(12) Uani 1 1 d . . . . .
H58A H 0.607317 0.404941 0.691380 0.068 Uiso 1 1 calc R U . . .
C59 C 0.42976(16) 0.7866(3) 0.6268(2) 0.0547(12) Uani 1 1 d . . . . .
C60 C 0.43859(18) 0.8513(3) 0.6239(2) 0.0618(14) Uani 1 1 d . . . . .
C61 C 0.44579(18) 0.9304(3) 0.6182(2) 0.0602(14) Uani 1 1 d . . . . .
C62 C 0.48125(19) 0.9624(4) 0.6319(3) 0.0732(18) Uani 1 1 d . . . . .
C63 C 0.4858(2) 1.0398(4) 0.6253(3) 0.083(2) Uani 1 1 d . . . . .
H63A H 0.509623 1.060769 0.635039 0.099 Uiso 1 1 calc R U . . .
C64 C 0.4560(2) 1.0856(4) 0.6048(3) 0.0758(19) Uani 1 1 d . . . . .
C65 C 0.4212(3) 1.0555(5) 0.5897(4) 0.119(4) Uani 1 1 d . . . . .
H65A H 0.400948 1.086467 0.574629 0.142 Uiso 1 1 calc R U . . .
C66 C 0.4159(2) 0.9786(4) 0.5968(4) 0.106(3) Uani 1 1 d . . . . .
H66A H 0.391922 0.958730 0.587079 0.128 Uiso 1 1 calc R U . . .
C67 C 0.5133(3) 0.9130(6) 0.6528(7) 0.167(7) Uani 1 1 d . . . . .
C68 C 0.4612(2) 1.1697(4) 0.5970(3) 0.097(3) Uani 1 1 d D . . . .
C69 C 0.39154(16) 0.5705(3) 0.6134(2) 0.0561(12) Uani 1 1 d . . . . .
C70 C 0.37803(18) 0.5089(3) 0.6023(2) 0.0646(15) Uani 1 1 d . . . . .
C71 C 0.36333(19) 0.4332(3) 0.5902(2) 0.0653(15) Uani 1 1 d . . . . .
C72 C 0.3387(2) 0.4149(4) 0.5472(2) 0.0743(18) Uani 1 1 d . . . . .
C73 C 0.3250(3) 0.3409(4) 0.5371(3) 0.094(3) Uani 1 1 d . . . . .
H73A H 0.308366 0.329888 0.508902 0.113 Uiso 1 1 calc R U . . .
C74 C 0.3356(2) 0.2840(4) 0.5679(3) 0.084(2) Uani 1 1 d . . . . .
C75 C 0.3595(3) 0.3000(4) 0.6102(3) 0.096(3) Uani 1 1 d . . . . .
H75A H 0.366397 0.261501 0.631386 0.115 Uiso 1 1 calc R U . . .
C76 C 0.3732(3) 0.3752(4) 0.6208(3) 0.088(2) Uani 1 1 d . . . . .
H76A H 0.389381 0.385807 0.649225 0.106 Uiso 1 1 calc R U . . .
C77 C 0.3261(4) 0.4734(5) 0.5125(3) 0.110(3) Uani 1 1 d . . . . .
C78 C 0.3220(4) 0.2028(5) 0.5569(5) 0.123(4) Uani 1 1 d . . . . .
C79 C 0.71654(15) 0.6203(3) 0.75757(18) 0.0538(12) Uani 1 1 d . . . . .
C80 C 0.74817(16) 0.6252(3) 0.7821(2) 0.0606(14) Uani 1 1 d . . . . .
C81 C 0.78799(15) 0.6295(3) 0.8034(2) 0.0565(13) Uani 1 1 d . . . . .
C82 C 0.80631(16) 0.6752(3) 0.8394(2) 0.0610(14) Uani 1 1 d . . . . .
C83 C 0.84488(17) 0.6827(4) 0.8550(2) 0.0739(18) Uani 1 1 d . . . . .
H83A H 0.856754 0.714123 0.879107 0.089 Uiso 1 1 calc R U . . .
C84 C 0.86503(18) 0.6449(5) 0.8353(3) 0.083(2) Uani 1 1 d . . . . .
C85 C 0.8475(2) 0.5972(5) 0.7994(3) 0.089(2) Uani 1 1 d . . . . .
H85A H 0.861458 0.570544 0.785969 0.107 Uiso 1 1 calc R U . . .
C86 C 0.80940(19) 0.5900(4) 0.7839(2) 0.0767(18) Uani 1 1 d . . . . .
H86A H 0.797735 0.558055 0.760019 0.092 Uiso 1 1 calc R U . . .
C87 C 0.7851(2) 0.7176(5) 0.8627(2) 0.0745(17) Uani 1 1 d . . . . .
C88 C 0.9059(2) 0.6556(10) 0.8505(5) 0.145(6) Uani 1 1 d . . . . .
C89 C 0.67913(15) 0.7033(3) 0.68306(18) 0.0531(12) Uani 1 1 d . . . . .
C90 C 0.68611(17) 0.7565(4) 0.6643(2) 0.0612(14) Uani 1 1 d . . . . .
C91 C 0.68699(19) 0.8222(4) 0.6382(2) 0.0645(16) Uani 1 1 d . . . . .
C92 C 0.7019(2) 0.8216(4) 0.6048(2) 0.0727(18) Uani 1 1 d . . . . .
C93 C 0.6970(3) 0.8832(5) 0.5771(2) 0.089(3) Uani 1 1 d . . . . .
H93A H 0.706685 0.881420 0.554752 0.107 Uiso 1 1 calc R U . . .
C94 C 0.6780(3) 0.9479(5) 0.5816(3) 0.090(2) Uani 1 1 d . . . . .
C95 C 0.6652(3) 0.9523(5) 0.6158(3) 0.096(3) Uani 1 1 d . . . . .
H95A H 0.653471 0.996765 0.620029 0.116 Uiso 1 1 calc R U . . .
C96 C 0.6696(3) 0.8909(4) 0.6436(3) 0.091(2) Uani 1 1 d . . . . .
H96A H 0.660923 0.894612 0.666734 0.109 Uiso 1 1 calc R U . . .
C97 C 0.7215(3) 0.7533(7) 0.5980(3) 0.105(3) Uani 1 1 d . . . . .
C98 C 0.6660(6) 1.0116(7) 0.5472(4) 0.170(7) 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
Pt1 C69 1.996(5) . ?
Pt1 C59 2.009(5) . ?
Pt1 P1 2.2999(13) . ?
Pt1 P3 2.3122(13) . ?
Pt2 C89 1.995(5) . ?
Pt2 C79 2.000(5) . ?
Pt2 P2 2.3037(12) . ?
Pt2 P4 2.3200(13) . ?
P1 C6 1.817(5) . ?
P1 C12 1.826(5) . ?
P1 C1 1.841(5) . ?
P2 C24 1.816(5) . ?
P2 C18 1.820(6) . ?
P2 C5 1.828(5) . ?
P3 C35 1.820(5) . ?
P3 C41 1.829(6) . ?
P3 C30 1.833(5) 2_656 ?
P4 C47 1.806(5) . ?
P4 C53 1.836(5) . ?
P4 C34 1.836(5) . ?
F1 C67 1.38(2) . ?
F2 C67 1.31(2) . ?
F3 C67 1.331(11) . ?
F4 C68 1.304(8) . ?
F5 C68 1.323(8) . ?
F6 C68 1.304(8) . ?
F4' C68 1.311(8) . ?
F5' C68 1.306(8) . ?
F6' C68 1.309(8) . ?
F7 C77 1.308(11) . ?
F8 C77 1.351(14) . ?
F9 C77 1.292(12) . ?
F10 C78 1.290(13) . ?
F11 C78 1.245(15) . ?
F12 C78 1.314(16) . ?
F13 C87 1.312(9) . ?
F14 C87 1.307(9) . ?
F15 C87 1.340(8) . ?
F16 C88 1.197(13) . ?
F17 C88 1.33(2) . ?
F18 C88 1.253(15) . ?
F19 C97 1.346(11) . ?
F20 C97 1.283(11) . ?
F21 C97 1.334(14) . ?
F22 C98 1.36(2) . ?
F23 C98 1.149(13) . ?
F24 C98 1.208(15) . ?
N1 C1 1.338(6) . ?
N1 C5 1.346(6) . ?
N2 C30 1.328(6) . ?
N2 C34 1.345(6) . ?
C1 C2 1.371(7) . ?
C2 C3 1.396(8) . ?
C3 C4 1.368(8) . ?
C4 C5 1.393(7) . ?
C6 C11 1.367(9) . ?
C6 C7 1.389(7) . ?
C7 C8 1.380(8) . ?
C8 C9 1.356(11) . ?
C9 C10 1.356(12) . ?
C10 C11 1.397(10) . ?
C12 C17 1.380(8) . ?
C12 C13 1.388(8) . ?
C13 C14 1.372(9) . ?
C14 C15 1.363(12) . ?
C15 C16 1.366(11) . ?
C16 C17 1.382(9) . ?
C18 C23 1.402(9) . ?
C18 C19 1.407(9) . ?
C19 C20 1.386(10) . ?
C20 C21 1.318(15) . ?
C21 C22 1.422(16) . ?
C22 C23 1.396(10) . ?
C24 C25 1.374(8) . ?
C24 C29 1.398(8) . ?
C25 C26 1.387(8) . ?
C26 C27 1.349(11) . ?
C27 C28 1.348(13) . ?
C28 C29 1.397(10) . ?
C30 C31 1.395(7) . ?
C31 C32 1.382(8) . ?
C32 C33 1.377(8) . ?
C33 C34 1.391(7) . ?
C35 C36 1.356(10) . ?
C35 C40 1.372(10) . ?
C36 C37 1.404(11) . ?
C37 C38 1.373(19) . ?
C38 C39 1.33(2) . ?
C39 C40 1.382(12) . ?
C41 C46 1.363(9) . ?
C41 C42 1.398(8) . ?
C42 C43 1.386(10) . ?
C43 C44 1.369(12) . ?
C44 C45 1.377(13) . ?
C45 C46 1.398(11) . ?
C47 C52 1.373(10) . ?
C47 C48 1.378(10) . ?
C48 C49 1.404(10) . ?
C49 C50 1.302(17) . ?
C50 C51 1.415(18) . ?
C51 C52 1.399(10) . ?
C53 C58 1.384(7) . ?
C53 C54 1.393(8) . ?
C54 C55 1.389(8) . ?
C55 C56 1.380(10) . ?
C56 C57 1.383(10) . ?
C57 C58 1.379(9) . ?
C59 C60 1.190(8) . ?
C60 C61 1.428(7) . ?
C61 C66 1.390(10) . ?
C61 C62 1.393(9) . ?
C62 C63 1.384(8) . ?
C62 C67 1.456(13) . ?
C63 C64 1.360(10) . ?
C64 C65 1.357(12) . ?
C64 C68 1.509(9) . ?
C65 C66 1.385(10) . ?
C69 C70 1.189(8) . ?
C70 C71 1.431(8) . ?
C71 C76 1.372(10) . ?
C71 C72 1.416(10) . ?
C72 C73 1.384(10) . ?
C72 C77 1.467(12) . ?
C73 C74 1.362(12) . ?
C74 C75 1.380(12) . ?
C74 C78 1.504(11) . ?
C75 C76 1.405(10) . ?
C79 C80 1.196(8) . ?
C80 C81 1.441(8) . ?
C81 C82 1.382(8) . ?
C81 C86 1.391(10) . ?
C82 C83 1.394(8) . ?
C82 C87 1.498(10) . ?
C83 C84 1.345(11) . ?
C84 C85 1.393(11) . ?
C84 C88 1.484(11) . ?
C85 C86 1.378(10) . ?
C89 C90 1.192(8) . ?
C90 C91 1.431(8) . ?
C91 C92 1.402(10) . ?
C91 C96 1.413(11) . ?
C92 C93 1.372(10) . ?
C92 C97 1.467(13) . ?
C93 C94 1.380(13) . ?
C94 C95 1.377(13) . ?
C94 C98 1.524(14) . ?
C95 C96 1.370(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
C69 Pt1 C59 174.7(2) . . ?
C69 Pt1 P1 91.24(17) . . ?
C59 Pt1 P1 87.57(16) . . ?
C69 Pt1 P3 89.37(17) . . ?
C59 Pt1 P3 91.31(16) . . ?
P1 Pt1 P3 174.32(4) . . ?
C89 Pt2 C79 86.7(2) . . ?
C89 Pt2 P2 88.12(16) . . ?
C79 Pt2 P2 174.06(16) . . ?
C89 Pt2 P4 173.66(16) . . ?
C79 Pt2 P4 86.95(16) . . ?
P2 Pt2 P4 98.22(4) . . ?
C6 P1 C12 104.3(2) . . ?
C6 P1 C1 102.6(2) . . ?
C12 P1 C1 106.5(2) . . ?
C6 P1 Pt1 116.87(18) . . ?
C12 P1 Pt1 112.93(17) . . ?
C1 P1 Pt1 112.59(17) . . ?
C24 P2 C18 103.1(3) . . ?
C24 P2 C5 109.7(2) . . ?
C18 P2 C5 100.4(2) . . ?
C24 P2 Pt2 112.16(18) . . ?
C18 P2 Pt2 116.39(18) . . ?
C5 P2 Pt2 114.01(16) . . ?
C35 P3 C41 106.4(3) . . ?
C35 P3 C30 104.5(2) . 2_656 ?
C41 P3 C30 103.4(2) . 2_656 ?
C35 P3 Pt1 109.5(2) . . ?
C41 P3 Pt1 120.00(19) . . ?
C30 P3 Pt1 111.75(16) 2_656 . ?
C47 P4 C53 102.8(3) . . ?
C47 P4 C34 103.8(2) . . ?
C53 P4 C34 104.1(2) . . ?
C47 P4 Pt2 115.5(2) . . ?
C53 P4 Pt2 121.39(16) . . ?
C34 P4 Pt2 107.40(16) . . ?
C1 N1 C5 118.7(4) . . ?
C30 N2 C34 117.4(4) . . ?
N1 C1 C2 122.5(5) . . ?
N1 C1 P1 115.6(4) . . ?
C2 C1 P1 121.9(4) . . ?
C1 C2 C3 118.6(5) . . ?
C4 C3 C2 119.6(5) . . ?
C3 C4 C5 118.4(5) . . ?
N1 C5 C4 122.1(5) . . ?
N1 C5 P2 116.7(4) . . ?
C4 C5 P2 120.8(4) . . ?
C11 C6 C7 118.9(5) . . ?
C11 C6 P1 121.7(4) . . ?
C7 C6 P1 119.2(4) . . ?
C8 C7 C6 119.9(6) . . ?
C9 C8 C7 121.1(7) . . ?
C10 C9 C8 119.3(6) . . ?
C9 C10 C11 120.8(8) . . ?
C6 C11 C10 119.9(7) . . ?
C17 C12 C13 118.6(5) . . ?
C17 C12 P1 121.5(4) . . ?
C13 C12 P1 119.8(4) . . ?
C14 C13 C12 120.7(7) . . ?
C15 C14 C13 120.0(7) . . ?
C14 C15 C16 120.3(6) . . ?
C15 C16 C17 120.2(7) . . ?
C12 C17 C16 120.1(6) . . ?
C23 C18 C19 119.7(6) . . ?
C23 C18 P2 119.5(5) . . ?
C19 C18 P2 120.6(5) . . ?
C20 C19 C18 118.8(8) . . ?
C21 C20 C19 123.0(9) . . ?
C20 C21 C22 119.5(8) . . ?
C23 C22 C21 120.0(9) . . ?
C22 C23 C18 118.9(8) . . ?
C25 C24 C29 119.0(5) . . ?
C25 C24 P2 125.2(4) . . ?
C29 C24 P2 115.7(4) . . ?
C24 C25 C26 120.6(6) . . ?
C27 C26 C25 120.2(7) . . ?
C28 C27 C26 120.2(7) . . ?
C27 C28 C29 121.6(8) . . ?
C28 C29 C24 118.3(7) . . ?
N2 C30 C31 123.6(5) . . ?
N2 C30 P3 113.8(3) . 2_656 ?
C31 C30 P3 122.4(4) . 2_656 ?
C32 C31 C30 117.7(5) . . ?
C33 C32 C31 120.0(5) . . ?
C32 C33 C34 118.0(5) . . ?
N2 C34 C33 123.3(5) . . ?
N2 C34 P4 112.4(3) . . ?
C33 C34 P4 124.2(4) . . ?
C36 C35 C40 119.0(6) . . ?
C36 C35 P3 119.1(5) . . ?
C40 C35 P3 121.9(6) . . ?
C35 C36 C37 121.1(10) . . ?
C38 C37 C36 118.6(11) . . ?
C39 C38 C37 120.0(9) . . ?
C38 C39 C40 121.6(12) . . ?
C35 C40 C39 119.6(11) . . ?
C46 C41 C42 119.2(6) . . ?
C46 C41 P3 119.8(5) . . ?
C42 C41 P3 121.1(5) . . ?
C43 C42 C41 120.6(7) . . ?
C44 C43 C42 119.4(7) . . ?
C43 C44 C45 120.7(8) . . ?
C44 C45 C46 119.7(8) . . ?
C41 C46 C45 120.4(8) . . ?
C52 C47 C48 119.8(6) . . ?
C52 C47 P4 119.6(5) . . ?
C48 C47 P4 120.4(5) . . ?
C47 C48 C49 119.4(9) . . ?
C50 C49 C48 121.6(10) . . ?
C49 C50 C51 120.5(7) . . ?
C52 C51 C50 118.7(10) . . ?
C47 C52 C51 120.0(9) . . ?
C58 C53 C54 118.9(5) . . ?
C58 C53 P4 119.1(4) . . ?
C54 C53 P4 122.0(4) . . ?
C55 C54 C53 120.2(6) . . ?
C56 C55 C54 119.9(7) . . ?
C55 C56 C57 120.2(6) . . ?
C58 C57 C56 119.7(6) . . ?
C57 C58 C53 121.0(6) . . ?
C60 C59 Pt1 172.6(6) . . ?
C59 C60 C61 174.9(7) . . ?
C66 C61 C62 117.4(6) . . ?
C66 C61 C60 118.7(6) . . ?
C62 C61 C60 123.9(6) . . ?
C63 C62 C61 120.3(6) . . ?
C63 C62 C67 120.8(7) . . ?
C61 C62 C67 118.9(6) . . ?
C64 C63 C62 120.8(7) . . ?
C65 C64 C63 120.2(6) . . ?
C65 C64 C68 119.2(7) . . ?
C63 C64 C68 120.6(7) . . ?
C64 C65 C66 119.9(8) . . ?
C65 C66 C61 121.3(8) . . ?
F2 C67 F3 106.5(15) . . ?
F2 C67 F1 105.4(9) . . ?
F3 C67 F1 106.5(13) . . ?
F2 C67 C62 114.4(14) . . ?
F3 C67 C62 112.6(8) . . ?
F1 C67 C62 110.7(14) . . ?
F4 C68 F6 106.9(7) . . ?
F5' C68 F6' 106.2(7) . . ?
F5' C68 F4' 106.0(7) . . ?
F6' C68 F4' 106.7(7) . . ?
F4 C68 F5 105.7(7) . . ?
F6 C68 F5 105.5(7) . . ?
F4 C68 C64 114.6(8) . . ?
F6 C68 C64 111.8(8) . . ?
F5' C68 C64 111.6(8) . . ?
F6' C68 C64 111.3(8) . . ?
F4' C68 C64 114.5(8) . . ?
F5 C68 C64 111.8(8) . . ?
C70 C69 Pt1 172.0(6) . . ?
C69 C70 C71 177.4(8) . . ?
C76 C71 C72 117.7(6) . . ?
C76 C71 C70 119.9(7) . . ?
C72 C71 C70 122.5(6) . . ?
C73 C72 C71 120.4(7) . . ?
C73 C72 C77 118.0(7) . . ?
C71 C72 C77 121.6(7) . . ?
C74 C73 C72 120.8(8) . . ?
C73 C74 C75 120.2(7) . . ?
C73 C74 C78 121.4(9) . . ?
C75 C74 C78 118.4(9) . . ?
C74 C75 C76 119.3(8) . . ?
C71 C76 C75 121.6(8) . . ?
F9 C77 F7 107.6(11) . . ?
F9 C77 F8 102.5(9) . . ?
F7 C77 F8 103.2(10) . . ?
F9 C77 C72 116.3(9) . . ?
F7 C77 C72 114.0(8) . . ?
F8 C77 C72 111.8(11) . . ?
F11 C78 F10 109.3(13) . . ?
F11 C78 F12 104.9(12) . . ?
F10 C78 F12 101.9(10) . . ?
F11 C78 C74 115.8(11) . . ?
F10 C78 C74 113.8(9) . . ?
F12 C78 C74 109.9(11) . . ?
C80 C79 Pt2 174.9(5) . . ?
C79 C80 C81 168.0(7) . . ?
C82 C81 C86 117.7(6) . . ?
C82 C81 C80 124.6(6) . . ?
C86 C81 C80 117.5(6) . . ?
C81 C82 C83 120.9(6) . . ?
C81 C82 C87 120.6(6) . . ?
C83 C82 C87 118.5(6) . . ?
C84 C83 C82 120.4(6) . . ?
C83 C84 C85 120.3(7) . . ?
C83 C84 C88 120.5(8) . . ?
C85 C84 C88 119.2(8) . . ?
C86 C85 C84 119.3(8) . . ?
C85 C86 C81 121.4(7) . . ?
F14 C87 F13 104.0(7) . . ?
F14 C87 F15 102.2(7) . . ?
F13 C87 F15 107.4(7) . . ?
F14 C87 C82 114.4(7) . . ?
F13 C87 C82 114.1(6) . . ?
F15 C87 C82 113.6(6) . . ?
F16 C88 F18 117.1(15) . . ?
F16 C88 F17 97.3(14) . . ?
F18 C88 F17 92.5(11) . . ?
F16 C88 C84 117.3(10) . . ?
F18 C88 C84 117.1(10) . . ?
F17 C88 C84 109.3(14) . . ?
C90 C89 Pt2 177.4(5) . . ?
C89 C90 C91 169.1(7) . . ?
C92 C91 C96 116.8(6) . . ?
C92 C91 C90 124.1(6) . . ?
C96 C91 C90 119.0(6) . . ?
C93 C92 C91 120.6(8) . . ?
C93 C92 C97 119.1(8) . . ?
C91 C92 C97 120.2(7) . . ?
C92 C93 C94 121.1(8) . . ?
C95 C94 C93 119.6(7) . . ?
C95 C94 C98 116.9(11) . . ?
C93 C94 C98 123.0(10) . . ?
C96 C95 C94 119.8(9) . . ?
C95 C96 C91 121.8(8) . . ?
F20 C97 F21 101.7(10) . . ?
F20 C97 F19 108.1(10) . . ?
F21 C97 F19 102.1(10) . . ?
F20 C97 C92 115.1(10) . . ?
F21 C97 C92 114.5(9) . . ?
F19 C97 C92 114.0(8) . . ?
F23 C98 F24 118(2) . . ?
F23 C98 F22 99.3(15) . . ?
F24 C98 F22 98.5(13) . . ?
F23 C98 C94 117.5(9) . . ?
F24 C98 C94 114.0(10) . . ?
F22 C98 C94 104.5(15) . . ?

_refine_diff_density_max         1.206
_refine_diff_density_min         -1.389
_refine_diff_density_rms         0.116




####################################################################### 
# 
# 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_2b
_database_code_depnum_ccdc_archive 'CCDC 1908775'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C92 H66 Ag2 F6 N2 O6 P4 Pt2 S2'
_chemical_formula_weight         2203.38

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'
P P 0.1023 0.0942 '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'
Ag Ag -0.8971 1.1015 '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'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           20
_space_group_name_H-M_alt        'C 2 2 21'
_space_group_name_Hall           'C 2c 2'

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

_cell_length_a                   19.271(2)
_cell_length_b                   19.620(2)
_cell_length_c                   22.773(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     8610.0(17)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    14245
_cell_measurement_theta_min      2.0761
_cell_measurement_theta_max      27.5049

_exptl_crystal_description       Bloc
_exptl_crystal_colour            Yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.700
_exptl_crystal_F_000             4304
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.22
_exptl_absorpt_coefficient_mu    3.878
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.325
_exptl_absorpt_correction_T_max  0.426
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_method       CCD_Profile_fitting
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            30885
_diffrn_reflns_av_unetI/netI     0.0398
_diffrn_reflns_av_R_equivalents  0.0558
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_theta_min         2.261
_diffrn_reflns_theta_max         27.483
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.971
_diffrn_measured_fraction_theta_full 0.964
_diffrn_reflns_Laue_measured_fraction_max 0.971
_diffrn_reflns_Laue_measured_fraction_full 0.964
_diffrn_reflns_point_group_measured_fraction_max 0.964
_diffrn_reflns_point_group_measured_fraction_full 0.956
_reflns_number_total             9534
_reflns_number_gt                9354
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.834
_reflns_Friedel_fraction_max     0.957
_reflns_Friedel_fraction_full    0.947

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _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    ?
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_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)+(0.0562P)²+16.3392P] 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_abs_structure_details 
;
 Flack x determined using 4036 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.060(4)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         9534
_refine_ls_number_parameters     524
_refine_ls_number_restraints     48
_refine_ls_R_factor_all          0.0359
_refine_ls_R_factor_gt           0.0352
_refine_ls_wR_factor_ref         0.0904
_refine_ls_wR_factor_gt          0.0898
_refine_ls_goodness_of_fit_ref   1.036
_refine_ls_restrained_S_all      1.051
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.47318(2) 0.500000 0.000000 0.01516(9) Uani 1 2 d S T P . .
Pt2 Pt 0.22734(2) 0.500000 0.000000 0.01803(9) Uani 1 2 d S T P . .
Ag1 Ag 0.35139(2) 0.40878(3) -0.01230(2) 0.02665(12) Uani 1 1 d . . . . .
S1 S 0.8182(3) -0.4727(2) 0.1656(3) 0.128(3) Uani 1 1 d . . . . .
P1 P 0.48244(8) 0.49315(10) 0.10089(7) 0.0193(3) Uani 1 1 d . . . . .
P2 P 0.21767(10) 0.42662(8) 0.07870(8) 0.0231(3) Uani 1 1 d . . . . .
F1 F 0.8160(6) -0.4395(5) 0.0571(6) 0.124(4) Uani 1 1 d . . . . .
F2 F 0.7631(7) -0.5332(8) 0.0792(11) 0.217(10) Uani 1 1 d . . . . .
F3 F 0.8736(5) -0.5279(4) 0.0750(5) 0.110(4) Uani 1 1 d . . . . .
O1 O 0.7563(8) -0.4362(7) 0.1781(9) 0.184(10) Uani 1 1 d . . . . .
O2 O 0.8777(9) -0.4283(6) 0.1706(7) 0.132(6) Uani 1 1 d . . . . .
O3 O 0.8277(8) -0.5380(6) 0.1954(7) 0.143(7) Uani 1 1 d . . . . .
N1 N 0.3477(3) 0.4558(3) 0.1053(2) 0.0223(11) Uani 1 1 d . . . . .
C1 C 0.2859(4) 0.4468(3) 0.1312(3) 0.0240(14) Uani 1 1 d . . . . .
C2 C 0.2741(5) 0.4566(4) 0.1912(4) 0.0327(17) Uani 1 1 d . . . . .
H2A H 0.230458 0.449207 0.207413 0.039 Uiso 1 1 calc R U . . .
C3 C 0.3290(5) 0.4777(4) 0.2257(3) 0.0367(18) Uani 1 1 d . . . . .
H3A H 0.323454 0.483722 0.265937 0.044 Uiso 1 1 calc R U . . .
C4 C 0.3932(4) 0.4897(4) 0.1990(3) 0.0339(17) Uani 1 1 d . . . . .
H4A H 0.430632 0.505400 0.220912 0.041 Uiso 1 1 calc R U . . .
C5 C 0.4001(4) 0.4777(3) 0.1383(3) 0.0240(14) Uani 1 1 d . . . . .
C6 C 0.5148(4) 0.5697(3) 0.1364(3) 0.0261(15) Uani 1 1 d . . . . .
C7 C 0.4690(4) 0.6239(4) 0.1476(3) 0.0305(16) Uani 1 1 d . . . . .
H7A H 0.422112 0.620163 0.138499 0.037 Uiso 1 1 calc R U . . .
C8 C 0.4954(5) 0.6833(4) 0.1725(4) 0.039(2) Uani 1 1 d . . . . .
H8A H 0.465525 0.719126 0.180998 0.047 Uiso 1 1 calc R U . . .
C9 C 0.5652(5) 0.6899(4) 0.1847(4) 0.041(2) Uani 1 1 d . . . . .
H9A H 0.582097 0.730305 0.200539 0.049 Uiso 1 1 calc R U . . .
C10 C 0.6091(5) 0.6379(4) 0.1738(4) 0.0371(19) Uani 1 1 d . . . . .
H10A H 0.655876 0.642314 0.183015 0.044 Uiso 1 1 calc R U . . .
C11 C 0.5845(4) 0.5764(4) 0.1486(3) 0.0283(15) Uani 1 1 d . . . . .
H11A H 0.615084 0.541067 0.140283 0.034 Uiso 1 1 calc R U . . .
C12 C 0.5400(4) 0.4254(4) 0.1240(3) 0.0261(15) Uani 1 1 d . . . . .
C13 C 0.5269(5) 0.3850(4) 0.1720(4) 0.038(2) Uani 1 1 d . . . . .
H13A H 0.486866 0.392568 0.193834 0.046 Uiso 1 1 calc R U . . .
C14 C 0.5715(7) 0.3335(5) 0.1888(5) 0.058(3) Uani 1 1 d . . . . .
H14A H 0.560698 0.305775 0.220620 0.070 Uiso 1 1 calc R U . . .
C15 C 0.6330(6) 0.3232(5) 0.1575(5) 0.054(3) Uani 1 1 d . . . . .
H15A H 0.663556 0.288786 0.168398 0.065 Uiso 1 1 calc R U . . .
C16 C 0.6478(5) 0.3651(5) 0.1101(5) 0.053(2) Uani 1 1 d . . . . .
H16A H 0.688945 0.359209 0.089403 0.064 Uiso 1 1 calc R U . . .
C17 C 0.6018(4) 0.4156(4) 0.0934(4) 0.0388(19) Uani 1 1 d . . . . .
H17A H 0.612189 0.443189 0.061378 0.047 Uiso 1 1 calc R U . . .
C18 C 0.2247(4) 0.3353(4) 0.0659(4) 0.0318(17) Uani 1 1 d . . . . .
C19 C 0.1732(5) 0.3053(4) 0.0312(4) 0.0399(19) Uani 1 1 d . . . . .
H19A H 0.139713 0.332536 0.013456 0.048 Uiso 1 1 calc R U . . .
C20 C 0.1716(6) 0.2357(4) 0.0231(6) 0.056(3) Uani 1 1 d . . . . .
H20A H 0.137574 0.215766 -0.000163 0.067 Uiso 1 1 calc R U . . .
C21 C 0.2225(7) 0.1954(5) 0.0507(8) 0.075(4) Uani 1 1 d . . . . .
H21A H 0.220108 0.148150 0.047889 0.090 Uiso 1 1 calc R U . . .
C22 C 0.2745(8) 0.2243(6) 0.0812(9) 0.092(6) Uani 1 1 d . . . . .
H22A H 0.309796 0.197239 0.096424 0.110 Uiso 1 1 calc R U . . .
C23 C 0.2761(6) 0.2957(5) 0.0902(6) 0.055(3) Uani 1 1 d . . . . .
H23A H 0.311386 0.315477 0.112243 0.067 Uiso 1 1 calc R U . . .
C24 C 0.1357(4) 0.4347(4) 0.1170(4) 0.0321(17) Uani 1 1 d . . . . .
C25 C 0.1125(5) 0.3807(4) 0.1519(4) 0.040(2) Uani 1 1 d . . . . .
H25A H 0.139138 0.341438 0.156132 0.048 Uiso 1 1 calc R U . . .
C26 C 0.0485(5) 0.3869(5) 0.1802(5) 0.052(3) Uani 1 1 d . . . . .
H26A H 0.032597 0.350979 0.203201 0.063 Uiso 1 1 calc R U . . .
C27 C 0.0090(5) 0.4435(5) 0.1753(5) 0.054(3) Uani 1 1 d . . . . .
H27A H -0.033194 0.446895 0.194905 0.065 Uiso 1 1 calc R U . . .
C28 C 0.0323(5) 0.4959(6) 0.1407(5) 0.055(3) Uani 1 1 d . . . . .
H28A H 0.005453 0.534949 0.136803 0.066 Uiso 1 1 calc R U . . .
C29 C 0.0950(4) 0.4917(4) 0.1116(4) 0.039(2) Uani 1 1 d . . . . .
H29A H 0.109740 0.527769 0.088123 0.047 Uiso 1 1 calc R U . . .
C30 C 0.4689(3) 0.3975(3) -0.0005(3) 0.0197(11) Uani 1 1 d . . . . .
C31 C 0.4656(3) 0.3364(3) 0.0026(3) 0.0227(12) Uani 1 1 d . . . . .
C32 C 0.4694(4) 0.2634(3) 0.0084(4) 0.0292(15) Uani 1 1 d . U . . .
C33 C 0.4776(7) 0.2199(5) -0.0368(5) 0.054(2) Uani 1 1 d . U . . .
H33A H 0.481978 0.237708 -0.074456 0.065 Uiso 1 1 calc R U . . .
C34 C 0.4799(7) 0.1497(5) -0.0297(5) 0.059(2) Uani 1 1 d . U . . .
H34A H 0.485706 0.121777 -0.062310 0.071 Uiso 1 1 calc R U . . .
C35 C 0.4741(7) 0.1227(5) 0.0221(6) 0.070(3) Uani 1 1 d . U . . .
H35A H 0.477483 0.075683 0.026577 0.084 Uiso 1 1 calc R U . . .
C36 C 0.4629(10) 0.1632(6) 0.0702(7) 0.097(4) Uani 1 1 d . U . . .
H36A H 0.455383 0.143734 0.106874 0.117 Uiso 1 1 calc R U . . .
C37 C 0.4628(9) 0.2351(6) 0.0636(6) 0.080(3) Uani 1 1 d . U . . .
H37A H 0.458229 0.263050 0.096330 0.096 Uiso 1 1 calc R U . . .
C38 C 0.2412(3) 0.4223(3) -0.0560(3) 0.0221(13) Uani 1 1 d . . . . .
C39 C 0.2611(4) 0.3760(3) -0.0865(3) 0.0261(14) Uani 1 1 d . . . . .
C40 C 0.2788(4) 0.3192(4) -0.1250(4) 0.0315(16) Uani 1 1 d . . . . .
C41 C 0.3073(5) 0.2590(4) -0.1020(5) 0.044(2) Uani 1 1 d . . . . .
H41A H 0.315539 0.255375 -0.061907 0.052 Uiso 1 1 calc R U . . .
C42 C 0.3232(6) 0.2054(5) -0.1383(6) 0.056(3) Uani 1 1 d . . . . .
H42A H 0.340862 0.165264 -0.122587 0.067 Uiso 1 1 calc R U . . .
C43 C 0.3129(7) 0.2109(6) -0.1985(6) 0.068(4) Uani 1 1 d . . . . .
H43A H 0.325282 0.175056 -0.223132 0.081 Uiso 1 1 calc R U . . .
C44 C 0.2849(7) 0.2684(6) -0.2212(5) 0.060(3) Uani 1 1 d . . . . .
H44A H 0.276599 0.270692 -0.261384 0.072 Uiso 1 1 calc R U . . .
C45 C 0.2677(6) 0.3260(5) -0.1851(4) 0.047(2) Uani 1 1 d . . . . .
H45A H 0.250044 0.365924 -0.201165 0.057 Uiso 1 1 calc R U . . .
C46 C 0.8161(7) -0.4936(9) 0.0914(11) 0.119(8) 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
Pt1 C30 2.013(6) 3_565 ?
Pt1 C30 2.013(6) . ?
Pt1 P1 2.3082(16) 3_565 ?
Pt1 P1 2.3083(16) . ?
Pt1 Ag1 2.9648(6) . ?
Pt1 Ag1 2.9648(6) 3_565 ?
Pt2 C38 2.006(7) 3_565 ?
Pt2 C38 2.006(7) . ?
Pt2 P2 2.3063(18) . ?
Pt2 P2 2.3064(18) 3_565 ?
Pt2 Ag1 2.9992(6) 3_565 ?
Pt2 Ag1 2.9993(6) . ?
Ag1 C30 2.290(5) . ?
Ag1 C38 2.359(7) . ?
Ag1 C39 2.508(7) . ?
Ag1 C31 2.641(6) . ?
S1 O1 1.419(10) . ?
S1 O2 1.444(18) . ?
S1 O3 1.461(9) . ?
S1 C46 1.74(3) . ?
P1 C12 1.810(7) . ?
P1 C6 1.816(7) . ?
P1 C5 1.827(8) . ?
P2 C24 1.811(7) . ?
P2 C18 1.820(8) . ?
P2 C1 1.820(8) . ?
F1 C46 1.317(18) . ?
F2 C46 1.31(2) . ?
F3 C46 1.349(18) . ?
N1 C5 1.330(9) . ?
N1 C1 1.341(9) . ?
C1 C2 1.398(10) . ?
C2 C3 1.382(13) . ?
C3 C4 1.398(12) . ?
C4 C5 1.408(10) . ?
C6 C11 1.378(11) . ?
C6 C7 1.405(10) . ?
C7 C8 1.393(11) . ?
C8 C9 1.380(14) . ?
C9 C10 1.347(13) . ?
C10 C11 1.417(10) . ?
C12 C13 1.374(11) . ?
C12 C17 1.393(12) . ?
C13 C14 1.381(12) . ?
C14 C15 1.396(17) . ?
C15 C16 1.387(16) . ?
C16 C17 1.382(11) . ?
C18 C23 1.376(13) . ?
C18 C19 1.399(12) . ?
C19 C20 1.378(12) . ?
C20 C21 1.409(18) . ?
C21 C22 1.345(19) . ?
C22 C23 1.415(14) . ?
C24 C29 1.372(11) . ?
C24 C25 1.398(11) . ?
C25 C26 1.398(12) . ?
C26 C27 1.352(15) . ?
C27 C28 1.370(16) . ?
C28 C29 1.381(11) . ?
C30 C31 1.203(9) . ?
C31 C32 1.439(9) . ?
C32 C33 1.347(12) . ?
C32 C37 1.380(14) . ?
C33 C34 1.387(13) . ?
C34 C35 1.298(17) . ?
C35 C36 1.371(19) . ?
C36 C37 1.418(16) . ?
C38 C39 1.204(10) . ?
C39 C40 1.459(10) . ?
C40 C45 1.392(13) . ?
C40 C41 1.404(13) . ?
C41 C42 1.372(13) . ?
C42 C43 1.388(19) . ?
C43 C44 1.35(2) . ?
C44 C45 1.436(14) . ?

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
C30 Pt1 C30 175.3(3) 3_565 . ?
C30 Pt1 P1 87.2(2) 3_565 3_565 ?
C30 Pt1 P1 93.2(2) . 3_565 ?
C30 Pt1 P1 93.2(2) 3_565 . ?
C30 Pt1 P1 87.2(2) . . ?
P1 Pt1 P1 171.14(8) 3_565 . ?
C30 Pt1 Ag1 124.82(16) 3_565 . ?
C30 Pt1 Ag1 50.48(15) . . ?
P1 Pt1 Ag1 90.13(4) 3_565 . ?
P1 Pt1 Ag1 96.90(5) . . ?
C30 Pt1 Ag1 50.48(15) 3_565 3_565 ?
C30 Pt1 Ag1 124.81(16) . 3_565 ?
P1 Pt1 Ag1 96.90(5) 3_565 3_565 ?
P1 Pt1 Ag1 90.13(4) . 3_565 ?
Ag1 Pt1 Ag1 75.32(2) . 3_565 ?
C38 Pt2 C38 164.7(4) 3_565 . ?
C38 Pt2 P2 89.50(19) 3_565 . ?
C38 Pt2 P2 91.73(19) . . ?
C38 Pt2 P2 91.73(19) 3_565 3_565 ?
C38 Pt2 P2 89.50(19) . 3_565 ?
P2 Pt2 P2 170.73(9) . 3_565 ?
C38 Pt2 Ag1 51.73(19) 3_565 3_565 ?
C38 Pt2 Ag1 114.00(19) . 3_565 ?
P2 Pt2 Ag1 111.36(5) . 3_565 ?
P2 Pt2 Ag1 76.38(5) 3_565 3_565 ?
C38 Pt2 Ag1 114.00(19) 3_565 . ?
C38 Pt2 Ag1 51.73(19) . . ?
P2 Pt2 Ag1 76.38(5) . . ?
P2 Pt2 Ag1 111.36(5) 3_565 . ?
Ag1 Pt2 Ag1 74.31(2) 3_565 . ?
C30 Ag1 C38 161.7(2) . . ?
C30 Ag1 C39 137.7(2) . . ?
C38 Ag1 C39 28.4(2) . . ?
C30 Ag1 C31 27.1(2) . . ?
C38 Ag1 C31 149.8(2) . . ?
C39 Ag1 C31 121.8(2) . . ?
C30 Ag1 Pt1 42.68(14) . . ?
C38 Ag1 Pt1 133.19(16) . . ?
C39 Ag1 Pt1 140.12(17) . . ?
C31 Ag1 Pt1 69.69(13) . . ?
C30 Ag1 Pt2 146.56(15) . . ?
C38 Ag1 Pt2 41.87(16) . . ?
C39 Ag1 Pt2 70.30(16) . . ?
C31 Ag1 Pt2 166.64(16) . . ?
Pt1 Ag1 Pt2 105.183(19) . . ?
O1 S1 O2 110.4(9) . . ?
O1 S1 O3 117.1(7) . . ?
O2 S1 O3 113.1(10) . . ?
O1 S1 C46 107.1(11) . . ?
O2 S1 C46 103.6(7) . . ?
O3 S1 C46 104.3(9) . . ?
C12 P1 C6 105.5(3) . . ?
C12 P1 C5 105.9(3) . . ?
C6 P1 C5 103.2(3) . . ?
C12 P1 Pt1 112.3(2) . . ?
C6 P1 Pt1 114.9(2) . . ?
C5 P1 Pt1 114.0(2) . . ?
C24 P2 C18 103.2(3) . . ?
C24 P2 C1 107.1(4) . . ?
C18 P2 C1 105.4(4) . . ?
C24 P2 Pt2 113.0(3) . . ?
C18 P2 Pt2 118.9(3) . . ?
C1 P2 Pt2 108.5(2) . . ?
C5 N1 C1 117.9(6) . . ?
N1 C1 C2 123.8(7) . . ?
N1 C1 P2 112.4(5) . . ?
C2 C1 P2 123.7(6) . . ?
C3 C2 C1 118.2(7) . . ?
C2 C3 C4 118.7(7) . . ?
C3 C4 C5 118.9(8) . . ?
N1 C5 C4 122.5(7) . . ?
N1 C5 P1 116.7(5) . . ?
C4 C5 P1 120.8(6) . . ?
C11 C6 C7 120.2(7) . . ?
C11 C6 P1 120.3(6) . . ?
C7 C6 P1 119.4(6) . . ?
C8 C7 C6 118.5(8) . . ?
C9 C8 C7 121.1(8) . . ?
C10 C9 C8 120.2(8) . . ?
C9 C10 C11 120.6(8) . . ?
C6 C11 C10 119.3(8) . . ?
C13 C12 C17 118.4(7) . . ?
C13 C12 P1 122.8(6) . . ?
C17 C12 P1 118.7(6) . . ?
C12 C13 C14 121.9(9) . . ?
C13 C14 C15 119.5(10) . . ?
C16 C15 C14 119.1(9) . . ?
C17 C16 C15 120.5(10) . . ?
C16 C17 C12 120.6(9) . . ?
C23 C18 C19 120.0(8) . . ?
C23 C18 P2 123.1(7) . . ?
C19 C18 P2 116.9(6) . . ?
C20 C19 C18 120.6(9) . . ?
C19 C20 C21 118.8(10) . . ?
C22 C21 C20 120.8(10) . . ?
C21 C22 C23 120.6(11) . . ?
C18 C23 C22 119.0(10) . . ?
C29 C24 C25 119.2(7) . . ?
C29 C24 P2 121.7(6) . . ?
C25 C24 P2 119.1(6) . . ?
C24 C25 C26 118.6(8) . . ?
C27 C26 C25 122.1(9) . . ?
C26 C27 C28 118.6(8) . . ?
C27 C28 C29 121.3(11) . . ?
C24 C29 C28 120.3(9) . . ?
C31 C30 Pt1 176.2(6) . . ?
C31 C30 Ag1 93.0(4) . . ?
Pt1 C30 Ag1 86.8(2) . . ?
C30 C31 C32 173.8(7) . . ?
C30 C31 Ag1 60.0(4) . . ?
C32 C31 Ag1 126.1(4) . . ?
C33 C32 C37 116.8(8) . . ?
C33 C32 C31 124.5(8) . . ?
C37 C32 C31 118.6(8) . . ?
C32 C33 C34 122.9(10) . . ?
C35 C34 C33 120.6(10) . . ?
C34 C35 C36 120.2(9) . . ?
C35 C36 C37 119.5(13) . . ?
C32 C37 C36 119.8(12) . . ?
C39 C38 Pt2 168.8(6) . . ?
C39 C38 Ag1 82.7(5) . . ?
Pt2 C38 Ag1 86.4(2) . . ?
C38 C39 C40 174.9(8) . . ?
C38 C39 Ag1 68.9(5) . . ?
C40 C39 Ag1 116.0(5) . . ?
C45 C40 C41 120.4(8) . . ?
C45 C40 C39 118.9(8) . . ?
C41 C40 C39 120.7(8) . . ?
C42 C41 C40 120.5(11) . . ?
C41 C42 C43 120.3(11) . . ?
C44 C43 C42 119.9(9) . . ?
C43 C44 C45 121.9(10) . . ?
C40 C45 C44 117.0(10) . . ?
F2 C46 F1 110.4(19) . . ?
F2 C46 F3 106.6(18) . . ?
F1 C46 F3 103.8(13) . . ?
F2 C46 S1 111.2(15) . . ?
F1 C46 S1 112.7(16) . . ?
F3 C46 S1 111.7(14) . . ?

_refine_diff_density_max         1.326
_refine_diff_density_min         -2.897
_refine_diff_density_rms         0.129



####################################################################### 
# 
# 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_2b_CH2Cl2
_database_code_depnum_ccdc_archive 'CCDC 1908776'
loop_
_audit_author_name
_audit_author_address
'Zhong-Ning Chen'
;Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences
China
;
_audit_update_record             
;
2021-01-23 deposited with the CCDC.	2021-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C95 H72 Ag2 Cl6 F6 N2 O6 P4 Pt2 S2'
_chemical_formula_weight         2458.16

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'
P P 0.1023 0.0942 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

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

_cell_length_a                   14.8764(6)
_cell_length_b                   41.6942(17)
_cell_length_c                   16.0997(6)
_cell_angle_alpha                90
_cell_angle_beta                 116.1220(10)
_cell_angle_gamma                90
_cell_volume                     8966.0(6)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9785
_cell_measurement_theta_min      2.48
_cell_measurement_theta_max      28.29

_exptl_crystal_description       Bloc
_exptl_crystal_colour            Yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.821
_exptl_crystal_F_000             4808
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.26
_exptl_absorpt_coefficient_mu    3.907
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.348
_exptl_absorpt_correction_T_max  0.362
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            150586
_diffrn_reflns_av_unetI/netI     0.0323
_diffrn_reflns_av_R_equivalents  0.0480
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -55
_diffrn_reflns_limit_k_max       55
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         2.593
_diffrn_reflns_theta_max         28.319
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             22284
_reflns_number_gt                20125
_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.
 
 _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 APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_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)+(0.0410P)²+242.2250P] 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         22284
_refine_ls_number_parameters     1263
_refine_ls_number_restraints     325
_refine_ls_R_factor_all          0.0814
_refine_ls_R_factor_gt           0.0741
_refine_ls_wR_factor_ref         0.1764
_refine_ls_wR_factor_gt          0.1724
_refine_ls_goodness_of_fit_ref   1.169
_refine_ls_restrained_S_all      1.198
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.19228(2) 0.43642(2) 0.76670(2) 0.01586(8) Uani 1 1 d . . . . .
Pt2 Pt 0.16115(3) 0.32353(2) 0.69811(2) 0.01638(8) Uani 1 1 d . . . . .
Ag1 Ag 0.11602(6) 0.39060(2) 0.61255(5) 0.02309(15) Uani 1 1 d . . . . .
Ag2 Ag 0.23275(6) 0.37108(2) 0.85267(5) 0.02412(15) Uani 1 1 d . . . . .
P1 P 0.08499(17) 0.43408(6) 0.83520(15) 0.0176(4) Uani 1 1 d . . . . .
P2 P 0.30357(17) 0.44583(5) 0.70461(15) 0.0171(4) Uani 1 1 d . . . . .
P3 P -0.00080(17) 0.31831(6) 0.68093(16) 0.0185(4) Uani 1 1 d . . . . .
P4 P 0.31953(17) 0.31850(6) 0.70622(16) 0.0187(4) Uani 1 1 d . . . . .
O1 O 0.5515(14) 0.3430(4) 0.3751(9) 0.114(6) Uani 1 1 d . . . . .
O2 O 0.6403(7) 0.3841(3) 0.5024(8) 0.074(4) Uani 1 1 d . . . . .
O3 O 0.5839(10) 0.3340(4) 0.5359(10) 0.101(5) Uani 1 1 d . . . . .
C1 C 0.1415(7) 0.4230(2) 0.9566(6) 0.0206(17) Uani 1 1 d . . . . .
C2 C 0.2065(7) 0.4449(3) 1.0199(7) 0.0249(19) Uani 1 1 d . . . . .
H2A H 0.220252 0.464771 0.999017 0.030 Uiso 1 1 calc R U . . .
C3 C 0.2513(7) 0.4377(3) 1.1139(7) 0.029(2) Uani 1 1 d . . . . .
H3A H 0.294985 0.452695 1.157252 0.034 Uiso 1 1 calc R U . . .
C4 C 0.2320(8) 0.4084(3) 1.1442(7) 0.031(2) Uani 1 1 d . . . . .
H4A H 0.262733 0.403525 1.208389 0.038 Uiso 1 1 calc R U . . .
C5 C 0.1685(9) 0.3864(3) 1.0819(7) 0.034(2) Uani 1 1 d . . . . .
H5A H 0.156750 0.366313 1.103215 0.041 Uiso 1 1 calc R U . . .
C6 C 0.1216(8) 0.3936(3) 0.9876(7) 0.027(2) Uani 1 1 d . . . . .
H6A H 0.076594 0.378678 0.944787 0.032 Uiso 1 1 calc R U . . .
C7 C 0.0282(7) 0.4725(2) 0.8353(6) 0.0231(19) Uani 1 1 d . . . . .
C8 C 0.0497(8) 0.4991(2) 0.7947(8) 0.028(2) Uani 1 1 d . . . . .
H8A H 0.088878 0.496586 0.761783 0.034 Uiso 1 1 calc R U . . .
C9 C 0.0139(9) 0.5294(3) 0.8022(9) 0.036(3) Uani 1 1 d . . . . .
H9A H 0.028809 0.547486 0.774637 0.043 Uiso 1 1 calc R U . . .
C10 C -0.0430(8) 0.5328(3) 0.8497(8) 0.034(2) Uani 1 1 d . . . . .
H10A H -0.065497 0.553503 0.856530 0.041 Uiso 1 1 calc R U . . .
C11 C -0.0680(9) 0.5064(3) 0.8877(7) 0.037(3) Uani 1 1 d . . . . .
H11A H -0.110397 0.508789 0.917438 0.045 Uiso 1 1 calc R U . . .
C12 C -0.0306(8) 0.4764(3) 0.8819(7) 0.032(2) Uani 1 1 d . . . . .
H12A H -0.045240 0.458418 0.909953 0.039 Uiso 1 1 calc R U . . .
C13 C -0.0130(6) 0.4046(2) 0.7785(6) 0.0194(17) Uani 1 1 d . . . . .
C14 C -0.1148(8) 0.4100(3) 0.7544(7) 0.029(2) Uani 1 1 d . . . . .
H14A H -0.136758 0.429966 0.767080 0.034 Uiso 1 1 calc R U . . .
C15 C -0.1827(7) 0.3853(3) 0.7115(8) 0.032(2) Uani 1 1 d . . . . .
H15A H -0.251735 0.388154 0.695629 0.039 Uiso 1 1 calc R U . . .
C16 C -0.1499(7) 0.3575(3) 0.6928(7) 0.029(2) Uani 1 1 d . . . . .
H16A H -0.195437 0.340482 0.663509 0.034 Uiso 1 1 calc R U . . .
C17 C -0.0467(7) 0.3537(2) 0.7173(6) 0.0213(18) Uani 1 1 d . . . . .
C18 C -0.0996(7) 0.3127(3) 0.5643(7) 0.026(2) Uani 1 1 d . . . . .
C19 C -0.1472(8) 0.2833(3) 0.5330(7) 0.031(2) Uani 1 1 d . . . . .
H19A H -0.127700 0.265108 0.572585 0.037 Uiso 1 1 calc R U . . .
C20 C -0.2225(9) 0.2807(3) 0.4445(8) 0.042(3) Uani 1 1 d . . . . .
H20A H -0.254940 0.260698 0.423256 0.051 Uiso 1 1 calc R U . . .
C21 C -0.2518(10) 0.3071(4) 0.3860(8) 0.048(3) Uani 1 1 d . . . . .
H21A H -0.303357 0.305016 0.324787 0.058 Uiso 1 1 calc R U . . .
C22 C -0.2053(10) 0.3367(4) 0.4172(8) 0.047(3) Uani 1 1 d . . . . .
H22A H -0.226698 0.355080 0.378376 0.057 Uiso 1 1 calc R U . . .
C23 C -0.1282(8) 0.3390(3) 0.5050(7) 0.033(2) Uani 1 1 d . . . . .
H23A H -0.093893 0.358825 0.525350 0.040 Uiso 1 1 calc R U . . .
C24 C -0.0115(7) 0.2841(2) 0.7457(6) 0.0233(19) Uani 1 1 d . . . . .
C25 C -0.0566(9) 0.2857(3) 0.8045(8) 0.033(2) Uani 1 1 d . . . . .
H25A H -0.081992 0.305470 0.814333 0.040 Uiso 1 1 calc R U . . .
C26 C -0.0644(10) 0.2579(3) 0.8492(9) 0.042(3) Uani 1 1 d . . . . .
H26A H -0.094325 0.258999 0.890463 0.050 Uiso 1 1 calc R U . . .
C27 C -0.0294(10) 0.2288(3) 0.8346(9) 0.042(3) Uani 1 1 d . . . . .
H27A H -0.036970 0.209957 0.864130 0.050 Uiso 1 1 calc R U . . .
C28 C 0.0168(9) 0.2274(3) 0.7767(8) 0.033(2) Uani 1 1 d . . . . .
H28A H 0.041319 0.207435 0.766606 0.040 Uiso 1 1 calc R U . . .
C29 C 0.0276(9) 0.2546(2) 0.7334(7) 0.030(2) Uani 1 1 d . . . . .
H29A H 0.061436 0.253540 0.695251 0.036 Uiso 1 1 calc R U . . .
C30 C 0.2556(7) 0.4527(2) 0.5813(6) 0.0225(18) Uani 1 1 d . . . . .
C31 C 0.2090(9) 0.4817(3) 0.5447(8) 0.036(3) Uani 1 1 d . . . . .
H31A H 0.195764 0.496562 0.582582 0.043 Uiso 1 1 calc R U . . .
C32 C 0.1820(9) 0.4888(3) 0.4523(7) 0.039(3) Uani 1 1 d . . . . .
H32A H 0.153501 0.509082 0.428300 0.046 Uiso 1 1 calc R U . . .
C33 C 0.1954(10) 0.4673(3) 0.3962(7) 0.039(3) Uani 1 1 d . . . . .
H33A H 0.177339 0.472645 0.333457 0.047 Uiso 1 1 calc R U . . .
C34 C 0.2355(13) 0.4376(3) 0.4300(8) 0.053(4) Uani 1 1 d . . . . .
H34A H 0.241943 0.422036 0.389704 0.064 Uiso 1 1 calc R U . . .
C35 C 0.2666(12) 0.4302(3) 0.5231(8) 0.047(3) Uani 1 1 d . . . . .
H35A H 0.295312 0.409870 0.546501 0.056 Uiso 1 1 calc R U . . .
C36 C 0.3840(6) 0.4800(2) 0.7574(6) 0.0192(17) Uani 1 1 d . . . . .
C37 C 0.4367(7) 0.4947(2) 0.7122(7) 0.026(2) Uani 1 1 d . . . . .
H37A H 0.428393 0.487083 0.653685 0.031 Uiso 1 1 calc R U . . .
C38 C 0.5004(8) 0.5205(3) 0.7541(8) 0.033(2) Uani 1 1 d . . . . .
H38A H 0.536573 0.530223 0.724752 0.039 Uiso 1 1 calc R U . . .
C39 C 0.5109(8) 0.5317(3) 0.8387(8) 0.032(2) Uani 1 1 d . . . . .
H39A H 0.554053 0.549347 0.867047 0.038 Uiso 1 1 calc R U . . .
C40 C 0.4592(8) 0.5176(3) 0.8822(7) 0.031(2) Uani 1 1 d . . . . .
H40A H 0.468118 0.525383 0.940776 0.037 Uiso 1 1 calc R U . . .
C41 C 0.3945(7) 0.4922(2) 0.8418(7) 0.0249(19) Uani 1 1 d . . . . .
H41A H 0.357496 0.483132 0.871366 0.030 Uiso 1 1 calc R U . . .
C42 C 0.3858(7) 0.4111(2) 0.7250(6) 0.0190(17) Uani 1 1 d . . . . .
C43 C 0.4873(7) 0.4133(2) 0.7513(7) 0.0236(19) Uani 1 1 d . . . . .
H43A H 0.518868 0.433677 0.759460 0.028 Uiso 1 1 calc R U . . .
C44 C 0.5418(7) 0.3856(3) 0.7655(8) 0.032(2) Uani 1 1 d . . . . .
H44A H 0.611648 0.386118 0.782808 0.038 Uiso 1 1 calc R U . . .
C45 C 0.4913(7) 0.3566(2) 0.7537(7) 0.0252(19) Uani 1 1 d . . . . .
H45A H 0.527294 0.336981 0.765878 0.030 Uiso 1 1 calc R U . . .
C46 C 0.3887(7) 0.3562(2) 0.7244(6) 0.0214(18) Uani 1 1 d . . . . .
C47 C 0.3162(7) 0.3010(2) 0.6014(6) 0.0202(17) Uani 1 1 d . . . . .
C48 C 0.2410(8) 0.2786(2) 0.5527(7) 0.027(2) Uani 1 1 d . . . . .
H48A H 0.192548 0.273227 0.573829 0.032 Uiso 1 1 calc R U . . .
C49 C 0.2378(9) 0.2644(3) 0.4737(7) 0.032(2) Uani 1 1 d . . . . .
H49A H 0.185132 0.249964 0.439291 0.039 Uiso 1 1 calc R U . . .
C50 C 0.3090(10) 0.2710(3) 0.4447(8) 0.041(3) Uani 1 1 d . . . . .
H50A H 0.307303 0.260338 0.391924 0.050 Uiso 1 1 calc R U . . .
C51 C 0.3825(11) 0.2926(4) 0.4907(9) 0.054(4) Uani 1 1 d . . . . .
H51A H 0.430123 0.297614 0.468208 0.065 Uiso 1 1 calc R U . . .
C52 C 0.3888(8) 0.3077(3) 0.5708(8) 0.035(2) Uani 1 1 d . . . . .
H52A H 0.441748 0.322228 0.604015 0.042 Uiso 1 1 calc R U . . .
C53 C 0.4087(7) 0.2942(2) 0.7998(7) 0.0238(19) Uani 1 1 d . . . . .
C54 C 0.4333(8) 0.2637(2) 0.7836(7) 0.029(2) Uani 1 1 d . . . . .
H54A H 0.403428 0.254694 0.723195 0.034 Uiso 1 1 calc R U . . .
C55 C 0.5033(9) 0.2465(3) 0.8581(9) 0.040(3) Uani 1 1 d . . . . .
H55A H 0.521537 0.225490 0.848239 0.048 Uiso 1 1 calc R U . . .
C56 C 0.5452(10) 0.2589(3) 0.9433(8) 0.045(3) Uani 1 1 d . . . . .
H56A H 0.593729 0.246780 0.992635 0.054 Uiso 1 1 calc R U . . .
C57 C 0.5195(10) 0.2889(3) 0.9607(9) 0.045(3) Uani 1 1 d . . . . .
H57A H 0.549498 0.297267 1.021832 0.054 Uiso 1 1 calc R U . . .
C58 C 0.4505(9) 0.3069(3) 0.8900(7) 0.036(3) Uani 1 1 d . . . . .
H58A H 0.431409 0.327476 0.901760 0.043 Uiso 1 1 calc R U . . .
C59 C 0.0741(7) 0.4414(2) 0.6434(6) 0.0205(17) Uani 1 1 d . . . . .
C60 C 0.0001(7) 0.4392(2) 0.5687(6) 0.0188(17) Uani 1 1 d . . . . .
C61 C -0.0870(7) 0.4387(2) 0.4814(6) 0.0212(18) Uani 1 1 d . . . . .
C62 C -0.1778(8) 0.4265(3) 0.4751(7) 0.033(2) Uani 1 1 d . . . . .
H62A H -0.181830 0.419139 0.529238 0.040 Uiso 1 1 calc R U . . .
C63 C -0.2623(8) 0.4251(3) 0.3896(9) 0.043(3) Uani 1 1 d . . . . .
H63A H -0.322972 0.416193 0.385420 0.051 Uiso 1 1 calc R U . . .
C64 C -0.2575(8) 0.4364(3) 0.3122(8) 0.034(2) Uani 1 1 d . . . . .
H64A H -0.315209 0.435825 0.254181 0.041 Uiso 1 1 calc R U . . .
C65 C -0.1692(9) 0.4487(3) 0.3182(7) 0.036(3) Uani 1 1 d . . . . .
H65A H -0.166676 0.456715 0.263988 0.043 Uiso 1 1 calc R U . . .
C66 C -0.0843(7) 0.4497(3) 0.4010(6) 0.026(2) Uani 1 1 d . . . . .
H66A H -0.023637 0.457887 0.403216 0.031 Uiso 1 1 calc R U . . .
C67 C 0.3093(7) 0.4215(2) 0.8825(6) 0.0193(17) Uani 1 1 d . . . . .
C68 C 0.3766(7) 0.4080(2) 0.9462(6) 0.0215(18) Uani 1 1 d . . . . .
C69 C 0.4642(7) 0.3939(2) 1.0211(7) 0.0240(19) Uani 1 1 d . . . . .
C70 C 0.4648(10) 0.3850(3) 1.1059(8) 0.038(3) Uani 1 1 d . . . . .
H70A H 0.407053 0.388447 1.115557 0.045 Uiso 1 1 calc R U . . .
C71 C 0.5487(12) 0.3714(3) 1.1744(9) 0.052(4) Uani 1 1 d . . . . .
H71A H 0.548442 0.365358 1.231182 0.062 Uiso 1 1 calc R U . . .
C72 C 0.6339(10) 0.3664(3) 1.1615(9) 0.053(4) Uani 1 1 d . . . . .
H72A H 0.691809 0.356945 1.209112 0.063 Uiso 1 1 calc R U . . .
C73 C 0.6339(10) 0.3751(4) 1.0804(9) 0.050(3) Uani 1 1 d . . . . .
H73A H 0.692003 0.371667 1.071129 0.060 Uiso 1 1 calc R U . . .
C74 C 0.5496(9) 0.3889(3) 1.0107(8) 0.038(3) Uani 1 1 d . . . . .
H74A H 0.551232 0.395106 0.954571 0.045 Uiso 1 1 calc R U . . .
C75 C 0.1160(7) 0.3383(2) 0.5681(6) 0.0181(16) Uani 1 1 d . . . . .
C76 C 0.0932(7) 0.3501(2) 0.4920(6) 0.0218(18) Uani 1 1 d . . . . .
C77 C 0.0703(7) 0.3594(2) 0.3986(6) 0.0209(18) Uani 1 1 d . . . . .
C78 C -0.0213(9) 0.3741(3) 0.3399(7) 0.033(2) Uani 1 1 d . . . . .
H78A H -0.069982 0.378440 0.361656 0.040 Uiso 1 1 calc R U . . .
C79 C -0.0396(10) 0.3821(3) 0.2500(8) 0.040(3) Uani 1 1 d . . . . .
H79A H -0.101378 0.391902 0.210303 0.048 Uiso 1 1 calc R U . . .
C80 C 0.0301(10) 0.3760(3) 0.2176(7) 0.035(3) Uani 1 1 d . . . . .
H80A H 0.015727 0.381252 0.155607 0.042 Uiso 1 1 calc R U . . .
C81 C 0.1218(9) 0.3623(3) 0.2754(7) 0.035(2) Uani 1 1 d . . . . .
H81A H 0.170688 0.358812 0.253341 0.042 Uiso 1 1 calc R U . . .
C82 C 0.1423(8) 0.3535(3) 0.3658(7) 0.030(2) Uani 1 1 d . . . . .
H82A H 0.204235 0.343636 0.404787 0.035 Uiso 1 1 calc R U . . .
C83 C 0.2029(7) 0.3161(2) 0.8344(7) 0.0230(19) Uani 1 1 d . . . . .
C84 C 0.2239(8) 0.3165(2) 0.9163(7) 0.0251(19) Uani 1 1 d . . . . .
C85 C 0.2427(9) 0.3126(2) 1.0107(7) 0.032(2) Uani 1 1 d . . . . .
C86 C 0.3378(10) 0.3160(3) 1.0821(8) 0.040(3) Uani 1 1 d . . . . .
H86A H 0.392049 0.320386 1.067729 0.048 Uiso 1 1 calc R U . . .
C87 C 0.3566(14) 0.3132(3) 1.1741(9) 0.061(5) Uani 1 1 d . . . . .
H87A H 0.422307 0.316111 1.222136 0.073 Uiso 1 1 calc R U . . .
C88 C 0.2785(16) 0.3063(3) 1.1946(9) 0.063(5) Uani 1 1 d . . . . .
H88A H 0.290466 0.304701 1.257519 0.076 Uiso 1 1 calc R U . . .
C89 C 0.1830(16) 0.3016(4) 1.1259(11) 0.063(5) Uani 1 1 d . . . . .
H89A H 0.130347 0.295727 1.141197 0.076 Uiso 1 1 calc R U . . .
C90 C 0.1644(12) 0.3054(3) 1.0335(9) 0.047(3) Uani 1 1 d . . . . .
H90A H 0.098181 0.303178 0.985889 0.056 Uiso 1 1 calc R U . . .
N1 N 0.0201(5) 0.37711(19) 0.7600(5) 0.0177(14) Uani 1 1 d . . . . .
N2 N 0.3352(5) 0.38315(18) 0.7102(5) 0.0185(14) Uani 1 1 d . . . . .
S1 S 0.5733(3) 0.35561(11) 0.4632(3) 0.0578(9) Uani 1 1 d D U . . .
Cl5 Cl 0.6085(7) 0.24401(18) 0.6892(4) 0.123(2) Uani 1 1 d D U . . .
Cl6 Cl 0.6988(5) 0.30368(19) 0.7825(5) 0.116(2) Uani 1 1 d D U . . .
C03 C 0.666(2) 0.2803(5) 0.6837(14) 0.161(12) Uani 1 1 d D U . . .
H03A H 0.726338 0.275590 0.675339 0.193 Uiso 1 1 calc R U . . .
H03B H 0.619031 0.292618 0.629123 0.193 Uiso 1 1 calc R U . . .
C2' C 0.7400(9) 0.4493(3) 0.9819(8) 0.061(3) Uani 0.642(12) 1 d D U P A 1
F4 F 0.7204(7) 0.4612(2) 0.8747(7) 0.039(2) Uani 0.642(12) 1 d D U P A 1
F5 F 0.7149(7) 0.4650(2) 1.0439(7) 0.035(2) Uani 0.642(12) 1 d D U P A 1
F6 F 0.6353(9) 0.4479(4) 0.9406(10) 0.061(3) Uani 0.642(12) 1 d D U P A 1
C2'' C 0.7400(9) 0.4493(3) 0.9819(8) 0.061(3) Uani 0.358(12) 1 d D U P A 2
F4' F 0.7833(14) 0.4766(4) 0.9930(12) 0.038(4) Uani 0.358(12) 1 d D U P A 2
F5' F 0.7559(14) 0.4427(4) 1.0770(10) 0.036(4) Uani 0.358(12) 1 d D U P A 2
F6' F 0.6496(15) 0.4630(7) 0.967(2) 0.080(6) Uani 0.358(12) 1 d D U P A 2
C02 C 0.857(2) 0.3185(12) 1.011(4) 0.142(9) Uani 0.500(9) 1 d D U P B 1
H02A H 0.883497 0.300840 0.986948 0.170 Uiso 0.500(9) 1 calc R U P B 1
H02B H 0.906272 0.323510 1.074673 0.170 Uiso 0.500(9) 1 calc R U P B 1
Cl3 Cl 0.8342(7) 0.3532(2) 0.9387(6) 0.081(4) Uani 0.500(9) 1 d D U P B 1
Cl4 Cl 0.7448(19) 0.3074(6) 1.0089(18) 0.197(8) Uani 0.500(9) 1 d D U P B 1
C02' C 0.848(2) 0.3268(5) 1.079(2) 0.065(5) Uani 0.500(9) 1 d D U P B 2
H02C H 0.891208 0.341525 1.128826 0.078 Uiso 0.500(9) 1 calc R U P B 2
H02D H 0.795379 0.339953 1.030805 0.078 Uiso 0.500(9) 1 calc R U P B 2
Cl3' Cl 0.7903(7) 0.3011(2) 1.1245(8) 0.086(3) Uani 0.500(9) 1 d D U P B 2
Cl4' Cl 0.9209(9) 0.3086(3) 1.0304(7) 0.093(4) Uani 0.500(9) 1 d D U P B 2
C1' C 0.4556(11) 0.3704(4) 0.4344(10) 0.080(3) Uani 0.244(14) 1 d D U P C 1
F1 F 0.482(2) 0.3792(10) 0.369(2) 0.069(4) Uani 0.244(14) 1 d D U P C 1
F2 F 0.3580(16) 0.3776(11) 0.387(3) 0.076(7) Uani 0.244(14) 1 d D U P C 1
F3 F 0.512(3) 0.3901(10) 0.510(2) 0.090(6) Uani 0.244(14) 1 d D U P C 1
C1'' C 0.4556(11) 0.3704(4) 0.4344(10) 0.080(3) Uani 0.756(14) 1 d D U P C 2
F1' F 0.4419(9) 0.3936(4) 0.3738(7) 0.086(4) Uani 0.756(14) 1 d D U P C 2
F2' F 0.3764(8) 0.3512(4) 0.3859(10) 0.089(4) Uani 0.756(14) 1 d D U P C 2
F3' F 0.4422(11) 0.3818(4) 0.5070(10) 0.090(4) Uani 0.756(14) 1 d D U P C 2
C01 C 0.5963(11) 0.4599(6) 0.5287(11) 0.041(4) Uani 0.539(12) 1 d D U P D 1
H01A H 0.616458 0.440633 0.505176 0.050 Uiso 0.539(12) 1 calc R U P D 1
H01B H 0.616244 0.479122 0.504659 0.050 Uiso 0.539(12) 1 calc R U P D 1
Cl1 Cl 0.4647(5) 0.45987(17) 0.4904(6) 0.058(2) Uani 0.539(12) 1 d D U P D 1
Cl2 Cl 0.6563(5) 0.46012(17) 0.6509(5) 0.0467(19) Uani 0.539(12) 1 d D U P D 1
C01' C 0.549(5) 0.4628(10) 0.555(7) 0.40(2) Uani 0.461(12) 1 d D U P D 2
H01C H 0.502008 0.453415 0.576213 0.475 Uiso 0.461(12) 1 calc R U P D 2
H01D H 0.552593 0.447963 0.508062 0.475 Uiso 0.461(12) 1 calc R U P D 2
Cl1' Cl 0.500000 0.500000 0.500000 0.39(2) Uani 0.92(2) 2 d DS U P D 2
Cl2' Cl 0.668(3) 0.4647(16) 0.649(4) 0.42(2) Uani 0.461(12) 1 d D U P D 2
S2 S 0.7878(4) 0.41623(14) 0.9460(4) 0.0793(13) Uani 0.29(2) 1 d D U P A 1
O4 O 0.845(4) 0.4323(8) 0.900(4) 0.25(3) Uani 0.29(2) 1 d D U P A 1
O5 O 0.852(3) 0.3993(7) 1.0347(14) 0.27(4) Uani 0.29(2) 1 d D U P A 1
O6 O 0.7040(12) 0.3968(3) 0.886(2) 0.26(4) Uani 0.29(2) 1 d D U P A 1
S2' S 0.7878(4) 0.41623(14) 0.9460(4) 0.0793(13) Uani 0.71(2) 1 d D U P A 2
O4' O 0.8958(10) 0.4182(5) 1.0037(13) 0.086(6) Uani 0.71(2) 1 d D U P A 2
O5' O 0.7502(16) 0.3845(4) 0.9584(11) 0.090(6) Uani 0.71(2) 1 d D U P A 2
O6' O 0.7491(12) 0.4279(4) 0.8491(9) 0.072(5) Uani 0.71(2) 1 d D U P A 2


_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 C59 2.001(9) . ?
Pt1 C67 2.008(9) . ?
Pt1 P1 2.307(2) . ?
Pt1 P2 2.313(2) . ?
Pt1 Ag1 2.9352(7) . ?
Pt1 Ag2 2.9942(8) . ?
Pt2 C75 1.994(9) . ?
Pt2 C83 2.024(10) . ?
Pt2 P3 2.311(2) . ?
Pt2 P4 2.311(2) . ?
Pt2 Ag2 2.9873(8) . ?
Pt2 Ag1 3.0587(8) . ?
Ag1 C75 2.296(9) . ?
Ag1 C59 2.323(9) . ?
Ag1 C76 2.480(9) . ?
Ag1 C60 2.551(8) . ?
Ag2 C83 2.329(9) . ?
Ag2 C67 2.338(9) . ?
Ag2 C84 2.524(10) . ?
Ag2 C68 2.527(9) . ?
P1 C7 1.813(10) . ?
P1 C1 1.814(9) . ?
P1 C13 1.815(10) . ?
P2 C30 1.812(9) . ?
P2 C36 1.814(9) . ?
P2 C42 1.831(9) . ?
P3 C24 1.814(10) . ?
P3 C18 1.819(10) . ?
P3 C17 1.829(10) . ?
P4 C53 1.815(10) . ?
P4 C47 1.819(9) . ?
P4 C46 1.831(10) . ?
O1 S1 1.410(14) . ?
O2 S1 1.499(12) . ?
O3 S1 1.430(12) . ?
C1 C2 1.392(14) . ?
C1 C6 1.406(14) . ?
C2 C3 1.391(13) . ?
C3 C4 1.390(17) . ?
C4 C5 1.381(17) . ?
C5 C6 1.395(14) . ?
C7 C12 1.390(14) . ?
C7 C8 1.392(15) . ?
C8 C9 1.395(14) . ?
C9 C10 1.376(16) . ?
C10 C11 1.388(18) . ?
C11 C12 1.388(15) . ?
C13 N1 1.333(11) . ?
C13 C14 1.405(13) . ?
C14 C15 1.393(16) . ?
C15 C16 1.344(16) . ?
C16 C17 1.416(13) . ?
C17 N1 1.345(12) . ?
C18 C23 1.392(15) . ?
C18 C19 1.396(15) . ?
C19 C20 1.374(15) . ?
C20 C21 1.387(19) . ?
C21 C22 1.396(19) . ?
C22 C23 1.376(15) . ?
C24 C25 1.381(13) . ?
C24 C29 1.411(14) . ?
C25 C26 1.397(15) . ?
C26 C27 1.379(18) . ?
C27 C28 1.383(17) . ?
C28 C29 1.379(15) . ?
C30 C35 1.384(15) . ?
C30 C31 1.389(15) . ?
C31 C32 1.392(15) . ?
C32 C33 1.347(17) . ?
C33 C34 1.380(18) . ?
C34 C35 1.394(16) . ?
C36 C41 1.393(13) . ?
C36 C37 1.422(13) . ?
C37 C38 1.394(13) . ?
C38 C39 1.382(16) . ?
C39 C40 1.380(16) . ?
C40 C41 1.386(14) . ?
C42 N2 1.350(11) . ?
C42 C43 1.380(12) . ?
C43 C44 1.374(14) . ?
C44 C45 1.391(14) . ?
C45 C46 1.384(13) . ?
C46 N2 1.337(12) . ?
C47 C52 1.397(14) . ?
C47 C48 1.402(13) . ?
C48 C49 1.384(14) . ?
C49 C50 1.360(17) . ?
C50 C51 1.358(19) . ?
C51 C52 1.400(16) . ?
C53 C54 1.381(13) . ?
C53 C58 1.407(14) . ?
C54 C55 1.393(16) . ?
C55 C56 1.336(18) . ?
C56 C57 1.374(18) . ?
C57 C58 1.370(16) . ?
C59 C60 1.225(13) . ?
C60 C61 1.432(12) . ?
C61 C66 1.390(13) . ?
C61 C62 1.407(14) . ?
C62 C63 1.398(15) . ?
C63 C64 1.364(17) . ?
C64 C65 1.374(17) . ?
C65 C66 1.375(14) . ?
C67 C68 1.211(13) . ?
C68 C69 1.454(13) . ?
C69 C74 1.369(14) . ?
C69 C70 1.410(14) . ?
C70 C71 1.373(17) . ?
C71 C72 1.39(2) . ?
C72 C73 1.36(2) . ?
C73 C74 1.388(16) . ?
C75 C76 1.221(13) . ?
C76 C77 1.442(13) . ?
C77 C82 1.408(13) . ?
C77 C78 1.412(14) . ?
C78 C79 1.391(14) . ?
C79 C80 1.374(17) . ?
C80 C81 1.392(17) . ?
C81 C82 1.398(14) . ?
C83 C84 1.213(14) . ?
C84 C85 1.428(14) . ?
C85 C86 1.383(17) . ?
C85 C90 1.400(18) . ?
C86 C87 1.386(17) . ?
C87 C88 1.37(3) . ?
C88 C89 1.38(3) . ?
C89 C90 1.398(18) . ?
S1 C1'' 1.716(16) . ?
S1 C1' 1.716(16) . ?
S1 F1 1.81(3) . ?
S1 F3 2.01(4) . ?
Cl5 C03 1.757(17) . ?
Cl6 C03 1.741(17) . ?
C2' F5 1.374(12) . ?
C2' F6 1.399(14) . ?
C2' F4 1.692(13) . ?
C2' S2 1.763(12) . ?
F5 F6 1.716(15) . ?
C2'' F4' 1.280(15) . ?
C2'' F6' 1.380(17) . ?
C2'' F5' 1.469(15) . ?
C2'' S2' 1.763(12) . ?
C02 Cl4 1.72(2) . ?
C02 Cl3 1.790(19) . ?
C02' Cl3' 1.721(17) . ?
C02' Cl4' 1.767(17) . ?
C1' F1 1.320(19) . ?
C1' F2 1.343(18) . ?
C1' F3 1.404(18) . ?
C1'' F1' 1.328(16) . ?
C1'' F2' 1.351(15) . ?
C1'' F3' 1.356(15) . ?
C01 Cl2 1.766(16) . ?
C01 Cl1 1.775(15) . ?
C01' Cl2' 1.76(2) . ?
C01' Cl1' 1.78(2) . ?
S2 O6 1.446(14) . ?
S2 O5 1.501(17) . ?
S2 O4 1.510(17) . ?
S2' O4' 1.461(13) . ?
S2' O5' 1.484(13) . ?
S2' O6' 1.488(12) . ?

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
C59 Pt1 C67 167.7(4) . . ?
C59 Pt1 P1 89.3(3) . . ?
C67 Pt1 P1 92.5(3) . . ?
C59 Pt1 P2 92.1(3) . . ?
C67 Pt1 P2 87.7(3) . . ?
P1 Pt1 P2 172.32(8) . . ?
C59 Pt1 Ag1 52.0(3) . . ?
C67 Pt1 Ag1 115.9(3) . . ?
P1 Pt1 Ag1 106.58(6) . . ?
P2 Pt1 Ag1 80.14(6) . . ?
C59 Pt1 Ag2 117.6(3) . . ?
C67 Pt1 Ag2 51.2(3) . . ?
P1 Pt1 Ag2 77.36(6) . . ?
P2 Pt1 Ag2 108.52(6) . . ?
Ag1 Pt1 Ag2 73.92(2) . . ?
C75 Pt2 C83 170.5(4) . . ?
C75 Pt2 P3 93.0(3) . . ?
C83 Pt2 P3 85.5(3) . . ?
C75 Pt2 P4 87.2(3) . . ?
C83 Pt2 P4 96.1(3) . . ?
P3 Pt2 P4 168.90(8) . . ?
C75 Pt2 Ag2 120.1(3) . . ?
C83 Pt2 Ag2 51.1(3) . . ?
P3 Pt2 Ag2 97.63(6) . . ?
P4 Pt2 Ag2 91.85(6) . . ?
C75 Pt2 Ag1 48.6(3) . . ?
C83 Pt2 Ag1 122.0(3) . . ?
P3 Pt2 Ag1 91.24(6) . . ?
P4 Pt2 Ag1 97.15(6) . . ?
Ag2 Pt2 Ag1 72.26(2) . . ?
C75 Ag1 C59 165.9(3) . . ?
C75 Ag1 C76 29.3(3) . . ?
C59 Ag1 C76 146.2(3) . . ?
C75 Ag1 C60 139.6(3) . . ?
C59 Ag1 C60 28.6(3) . . ?
C76 Ag1 C60 118.8(3) . . ?
C75 Ag1 Pt1 146.0(2) . . ?
C59 Ag1 Pt1 42.8(2) . . ?
C76 Ag1 Pt1 166.8(2) . . ?
C60 Ag1 Pt1 71.3(2) . . ?
C75 Ag1 Pt2 40.7(2) . . ?
C59 Ag1 Pt2 139.8(2) . . ?
C76 Ag1 Pt2 69.9(2) . . ?
C60 Ag1 Pt2 147.0(2) . . ?
Pt1 Ag1 Pt2 106.72(2) . . ?
C83 Ag2 C67 163.7(3) . . ?
C83 Ag2 C84 28.6(3) . . ?
C67 Ag2 C84 146.7(3) . . ?
C83 Ag2 C68 137.7(3) . . ?
C67 Ag2 C68 28.5(3) . . ?
C84 Ag2 C68 119.4(3) . . ?
C83 Ag2 Pt2 42.6(2) . . ?
C67 Ag2 Pt2 136.9(2) . . ?
C84 Ag2 Pt2 71.1(2) . . ?
C68 Ag2 Pt2 143.0(2) . . ?
C83 Ag2 Pt1 148.1(2) . . ?
C67 Ag2 Pt1 42.0(2) . . ?
C84 Ag2 Pt1 166.6(2) . . ?
C68 Ag2 Pt1 70.5(2) . . ?
Pt2 Ag2 Pt1 107.06(2) . . ?
C7 P1 C1 102.7(4) . . ?
C7 P1 C13 109.1(4) . . ?
C1 P1 C13 105.0(4) . . ?
C7 P1 Pt1 112.5(3) . . ?
C1 P1 Pt1 115.8(3) . . ?
C13 P1 Pt1 111.1(3) . . ?
C30 P2 C36 104.5(4) . . ?
C30 P2 C42 103.3(4) . . ?
C36 P2 C42 106.7(4) . . ?
C30 P2 Pt1 119.2(3) . . ?
C36 P2 Pt1 112.4(3) . . ?
C42 P2 Pt1 109.7(3) . . ?
C24 P3 C18 104.9(5) . . ?
C24 P3 C17 108.2(4) . . ?
C18 P3 C17 100.8(5) . . ?
C24 P3 Pt2 110.8(3) . . ?
C18 P3 Pt2 117.5(3) . . ?
C17 P3 Pt2 113.7(3) . . ?
C53 P4 C47 105.0(4) . . ?
C53 P4 C46 101.1(4) . . ?
C47 P4 C46 106.0(4) . . ?
C53 P4 Pt2 116.8(3) . . ?
C47 P4 Pt2 111.9(3) . . ?
C46 P4 Pt2 114.7(3) . . ?
C2 C1 C6 119.9(9) . . ?
C2 C1 P1 117.8(7) . . ?
C6 C1 P1 122.3(7) . . ?
C3 C2 C1 120.0(10) . . ?
C4 C3 C2 119.9(10) . . ?
C5 C4 C3 120.6(9) . . ?
C4 C5 C6 120.1(11) . . ?
C5 C6 C1 119.4(10) . . ?
C12 C7 C8 119.3(9) . . ?
C12 C7 P1 120.5(8) . . ?
C8 C7 P1 120.0(7) . . ?
C7 C8 C9 120.2(10) . . ?
C10 C9 C8 119.6(12) . . ?
C9 C10 C11 120.9(10) . . ?
C12 C11 C10 119.4(10) . . ?
C11 C12 C7 120.5(11) . . ?
N1 C13 C14 122.3(9) . . ?
N1 C13 P1 113.6(6) . . ?
C14 C13 P1 124.1(7) . . ?
C15 C14 C13 118.6(9) . . ?
C16 C15 C14 119.5(9) . . ?
C15 C16 C17 119.3(10) . . ?
N1 C17 C16 122.0(9) . . ?
N1 C17 P3 117.0(7) . . ?
C16 C17 P3 120.8(8) . . ?
C23 C18 C19 119.4(9) . . ?
C23 C18 P3 118.1(8) . . ?
C19 C18 P3 122.4(8) . . ?
C20 C19 C18 119.7(11) . . ?
C19 C20 C21 120.7(11) . . ?
C20 C21 C22 120.0(11) . . ?
C23 C22 C21 119.2(12) . . ?
C22 C23 C18 121.0(11) . . ?
C25 C24 C29 119.5(10) . . ?
C25 C24 P3 123.3(8) . . ?
C29 C24 P3 117.3(7) . . ?
C24 C25 C26 119.3(11) . . ?
C27 C26 C25 121.2(11) . . ?
C26 C27 C28 119.3(11) . . ?
C29 C28 C27 120.6(10) . . ?
C28 C29 C24 119.9(10) . . ?
C35 C30 C31 119.1(10) . . ?
C35 C30 P2 121.9(8) . . ?
C31 C30 P2 118.9(8) . . ?
C30 C31 C32 119.6(10) . . ?
C33 C32 C31 121.1(11) . . ?
C32 C33 C34 119.9(11) . . ?
C33 C34 C35 120.1(11) . . ?
C30 C35 C34 119.9(12) . . ?
C41 C36 C37 119.5(8) . . ?
C41 C36 P2 120.7(7) . . ?
C37 C36 P2 119.9(7) . . ?
C38 C37 C36 119.7(10) . . ?
C39 C38 C37 119.7(10) . . ?
C40 C39 C38 120.6(9) . . ?
C39 C40 C41 121.0(10) . . ?
C40 C41 C36 119.5(10) . . ?
N2 C42 C43 124.2(8) . . ?
N2 C42 P2 112.0(6) . . ?
C43 C42 P2 123.8(7) . . ?
C44 C43 C42 118.6(9) . . ?
C43 C44 C45 117.7(9) . . ?
C46 C45 C44 120.3(9) . . ?
N2 C46 C45 122.2(9) . . ?
N2 C46 P4 116.3(7) . . ?
C45 C46 P4 121.5(7) . . ?
C52 C47 C48 119.1(9) . . ?
C52 C47 P4 122.5(7) . . ?
C48 C47 P4 118.3(7) . . ?
C49 C48 C47 119.7(10) . . ?
C50 C49 C48 120.8(11) . . ?
C51 C50 C49 120.6(11) . . ?
C50 C51 C52 120.7(12) . . ?
C47 C52 C51 119.1(10) . . ?
C54 C53 C58 120.5(9) . . ?
C54 C53 P4 121.0(8) . . ?
C58 C53 P4 118.5(7) . . ?
C53 C54 C55 118.1(10) . . ?
C56 C55 C54 121.3(12) . . ?
C55 C56 C57 121.1(12) . . ?
C58 C57 C56 120.1(12) . . ?
C57 C58 C53 118.8(10) . . ?
C60 C59 Pt1 169.6(8) . . ?
C60 C59 Ag1 86.1(6) . . ?
Pt1 C59 Ag1 85.2(3) . . ?
C59 C60 C61 176.4(10) . . ?
C59 C60 Ag1 65.3(6) . . ?
C61 C60 Ag1 118.0(6) . . ?
C66 C61 C62 118.3(9) . . ?
C66 C61 C60 121.7(9) . . ?
C62 C61 C60 120.0(9) . . ?
C63 C62 C61 120.3(10) . . ?
C64 C63 C62 120.0(11) . . ?
C63 C64 C65 119.9(10) . . ?
C64 C65 C66 121.4(10) . . ?
C65 C66 C61 120.1(9) . . ?
C68 C67 Pt1 170.2(8) . . ?
C68 C67 Ag2 84.4(6) . . ?
Pt1 C67 Ag2 86.7(3) . . ?
C67 C68 C69 174.4(10) . . ?
C67 C68 Ag2 67.1(6) . . ?
C69 C68 Ag2 117.5(6) . . ?
C74 C69 C70 117.9(10) . . ?
C74 C69 C68 120.0(9) . . ?
C70 C69 C68 122.1(10) . . ?
C71 C70 C69 120.2(13) . . ?
C70 C71 C72 120.6(13) . . ?
C73 C72 C71 119.4(12) . . ?
C72 C73 C74 120.5(13) . . ?
C69 C74 C73 121.4(11) . . ?
C76 C75 Pt2 173.6(8) . . ?
C76 C75 Ag1 83.7(6) . . ?
Pt2 C75 Ag1 90.7(3) . . ?
C75 C76 C77 171.2(10) . . ?
C75 C76 Ag1 67.0(6) . . ?
C77 C76 Ag1 121.5(6) . . ?
C82 C77 C78 119.7(9) . . ?
C82 C77 C76 118.4(9) . . ?
C78 C77 C76 121.9(9) . . ?
C79 C78 C77 119.3(10) . . ?
C80 C79 C78 121.1(11) . . ?
C79 C80 C81 120.3(10) . . ?
C80 C81 C82 120.2(10) . . ?
C81 C82 C77 119.4(10) . . ?
C84 C83 Pt2 170.1(9) . . ?
C84 C83 Ag2 84.7(7) . . ?
Pt2 C83 Ag2 86.4(3) . . ?
C83 C84 C85 172.2(10) . . ?
C83 C84 Ag2 66.7(6) . . ?
C85 C84 Ag2 120.8(7) . . ?
C86 C85 C90 117.9(11) . . ?
C86 C85 C84 121.6(11) . . ?
C90 C85 C84 120.5(11) . . ?
C85 C86 C87 122.1(15) . . ?
C88 C87 C86 118.8(15) . . ?
C87 C88 C89 121.4(12) . . ?
C88 C89 C90 119.3(16) . . ?
C89 C90 C85 120.5(15) . . ?
C13 N1 C17 118.4(8) . . ?
C46 N2 C42 116.8(8) . . ?
O1 S1 O3 118.7(11) . . ?
O1 S1 O2 122.3(10) . . ?
O3 S1 O2 110.0(8) . . ?
O1 S1 C1'' 96.1(9) . . ?
O3 S1 C1'' 100.3(8) . . ?
O2 S1 C1'' 103.9(8) . . ?
O1 S1 C1' 96.1(9) . . ?
O3 S1 C1' 100.3(8) . . ?
O2 S1 C1' 103.9(8) . . ?
O1 S1 F1 67.0(13) . . ?
O3 S1 F1 142.7(10) . . ?
O2 S1 F1 92.1(14) . . ?
C1' S1 F1 43.8(7) . . ?
O1 S1 F3 134.6(13) . . ?
O3 S1 F3 92.8(16) . . ?
O2 S1 F3 66.6(13) . . ?
C1' S1 F3 43.3(8) . . ?
F1 S1 F3 68.3(13) . . ?
Cl6 C03 Cl5 112.7(13) . . ?
F5 C2' F6 76.4(9) . . ?
F5 C2' F4 128.5(10) . . ?
F6 C2' F4 82.7(9) . . ?
F5 C2' S2 152.5(10) . . ?
F6 C2' S2 109.6(9) . . ?
F4 C2' S2 78.9(6) . . ?
C2' F5 F6 52.4(7) . . ?
C2' F6 F5 51.1(6) . . ?
F4' C2'' F6' 92.8(16) . . ?
F4' C2'' F5' 100.5(12) . . ?
F6' C2'' F5' 87.7(15) . . ?
F4' C2'' S2' 119.3(12) . . ?
F6' C2'' S2' 140.2(16) . . ?
F5' C2'' S2' 106.9(10) . . ?
Cl4 C02 Cl3 107.6(17) . . ?
Cl3' C02' Cl4' 116.1(14) . . ?
F1 C1' F2 96(2) . . ?
F1 C1' F3 104(2) . . ?
F2 C1' F3 117(2) . . ?
F1 C1' S1 71.9(17) . . ?
F2 C1' S1 162.3(19) . . ?
F3 C1' S1 79.7(19) . . ?
C1' F1 S1 64.2(14) . . ?
C1' F3 S1 57.0(14) . . ?
F1' C1'' F2' 101.3(13) . . ?
F1' C1'' F3' 110.1(14) . . ?
F2' C1'' F3' 106.5(14) . . ?
F1' C1'' S1 105.5(12) . . ?
F2' C1'' S1 118.0(12) . . ?
F3' C1'' S1 114.4(11) . . ?
Cl2 C01 Cl1 109.1(9) . . ?
Cl2' C01' Cl1' 115(2) . . ?
C01' Cl1' C01' 180.00(2) . 3_666 ?
O6 S2 O5 112.1(18) . . ?
O6 S2 O4 115(2) . . ?
O5 S2 O4 115(2) . . ?
O6 S2 C2' 107.8(9) . . ?
O5 S2 C2' 103.8(10) . . ?
O4 S2 C2' 102.1(13) . . ?
O4' S2' O5' 109.8(11) . . ?
O4' S2' O6' 117.2(10) . . ?
O5' S2' O6' 116.0(10) . . ?
O4' S2' C2'' 103.7(10) . . ?
O5' S2' C2'' 115.1(11) . . ?
O6' S2' C2'' 93.5(9) . . ?

_refine_diff_density_max         4.599
_refine_diff_density_min         -3.929
_refine_diff_density_rms         0.249


