# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2020

####################################################################### 
# 
# 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_rohit23b
_database_code_depnum_ccdc_archive 'CCDC 2032090'
loop_
_audit_author_name
_audit_author_address
'Arnold L Rheingold'
;University of California, San Diego
United States of America
;
_audit_update_record             
;
2020-11-04 deposited with the CCDC.	2020-11-10 downloaded from the CCDC.
;








_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C45 H67 Cl5 N2 O4 P2 Pt Se Sn5'
_chemical_formula_weight         1806.69

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'
Sn Sn -0.6537 1.4246 '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'
Se Se -0.0929 2.2259 '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'
O O 0.0106 0.0060 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           9
_space_group_name_H-M_alt        'C 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'

_cell_length_a                   14.1404(11)
_cell_length_b                   35.420(3)
_cell_length_c                   13.8364(11)
_cell_angle_alpha                90
_cell_angle_beta                 120.445(2)
_cell_angle_gamma                90
_cell_volume                     5974.4(8)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    5586
_cell_measurement_theta_min      2.40
_cell_measurement_theta_max      25.25

_exptl_crystal_description       plate
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.009
_exptl_crystal_F_000             3440
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.020
_exptl_absorpt_coefficient_mu    5.316
_shelx_estimated_absorpt_T_min   0.416
_shelx_estimated_absorpt_T_max   0.901
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.380
_exptl_absorpt_correction_T_max  0.885
_exptl_absorpt_process_details   sadabs
_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            21288
_diffrn_reflns_av_unetI/netI     0.0616
_diffrn_reflns_av_R_equivalents  0.0426
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -42
_diffrn_reflns_limit_k_max       42
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_theta_min         2.300
_diffrn_reflns_theta_max         25.306
_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             10234
_reflns_number_gt                9423
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.996
_reflns_Friedel_fraction_max     0.994
_reflns_Friedel_fraction_full    0.994

_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    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          
; 
 Refined as a 2-component inversion twin. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0215P)²+31.3672P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     'direct methods'
_atom_sites_solution_secondary   'Fourier difference maps'
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
; 
 Refined as an inversion twin. 
;
_refine_ls_abs_structure_Flack   0.408(6)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         10234
_refine_ls_number_parameters     599
_refine_ls_number_restraints     20
_refine_ls_R_factor_all          0.0417
_refine_ls_R_factor_gt           0.0353
_refine_ls_wR_factor_ref         0.0744
_refine_ls_wR_factor_gt          0.0720
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_restrained_S_all      1.033
_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 0.25032(4) 0.94924(2) 0.72062(4) 0.01553(12) Uani 1 1 d . . . . .
Se1 Se 0.10210(11) 0.91426(4) 0.72590(12) 0.0247(3) Uani 1 1 d . . . . .
Sn1 Sn 0.43750(7) 0.73025(2) 0.38081(7) 0.0160(2) Uani 1 1 d . . . . .
Sn2 Sn 0.34821(6) 0.81644(2) 0.46494(7) 0.0162(2) Uani 1 1 d . . . . .
Sn3 Sn 0.29212(7) 0.73486(2) 0.54248(7) 0.01360(19) Uani 1 1 d . . . . .
Sn4 Sn 0.21063(7) 0.80607(2) 0.64252(7) 0.0173(2) Uani 1 1 d . . . . .
Sn5 Sn 0.14324(7) 0.71787(2) 0.70953(7) 0.0179(2) Uani 1 1 d . . . . .
P1 P 0.1407(3) 0.98094(9) 0.5623(3) 0.0165(7) Uani 1 1 d . . . . .
P2 P 0.4036(3) 0.97520(9) 0.7333(3) 0.0160(7) Uani 1 1 d . . . . .
Cl1 Cl 0.4773(3) 0.79781(9) 0.3349(3) 0.0262(8) Uani 1 1 d . . . . .
Cl2 Cl 0.3764(3) 0.66943(9) 0.4306(3) 0.0291(8) Uani 1 1 d . . . . .
Cl3 Cl 0.2813(3) 0.87921(8) 0.5233(3) 0.0190(7) Uani 1 1 d . . . . .
Cl4 Cl 0.1152(3) 0.79093(10) 0.7645(3) 0.0272(8) Uani 1 1 d . . . . .
Cl5 Cl 0.1923(3) 0.65880(9) 0.6507(3) 0.0291(8) Uani 1 1 d . . . . .
O1 O 0.3640(7) 0.7570(2) 0.4485(8) 0.018(2) Uani 1 1 d . . . . .
O2 O 0.2835(7) 0.7921(2) 0.5485(8) 0.0174(19) Uani 1 1 d . . . . .
O3 O 0.2192(7) 0.7487(2) 0.6494(8) 0.018(2) Uani 1 1 d . . . . .
O4 O 0.6404(8) 0.9777(3) 0.6172(9) 0.039(3) Uani 1 1 d . . . . .
N1 N 0.3174(9) 0.9168(3) 0.8689(10) 0.026(3) Uani 1 1 d . . . . .
N2 N 0.7542(10) 0.9301(4) 0.6315(13) 0.049(4) Uani 1 1 d . . . . .
C1 C 0.2268(11) 0.9008(4) 0.8649(12) 0.023(3) Uani 1 1 d . U . . .
C2 C 0.2332(13) 0.8784(4) 0.9471(13) 0.033(4) Uani 1 1 d . U . . .
H2A H 0.1692 0.8668 0.9398 0.039 Uiso 1 1 calc R U . . .
C3 C 0.3354(12) 0.8725(4) 1.0431(13) 0.032(4) Uani 1 1 d . . . . .
H3A H 0.3425 0.8574 1.1032 0.038 Uiso 1 1 calc R U . . .
C4 C 0.4249(12) 0.8891(4) 1.0478(13) 0.030(4) Uani 1 1 d . . . . .
H4A H 0.4955 0.8854 1.1119 0.036 Uiso 1 1 calc R U . . .
C5 C 0.4136(11) 0.9112(4) 0.9601(12) 0.027(3) Uani 1 1 d . . . . .
H5A H 0.4769 0.9227 0.9657 0.033 Uiso 1 1 calc R U . . .
C6 C 0.0098(10) 0.9587(4) 0.4676(11) 0.018(3) Uani 1 1 d . . . . .
C7 C 0.0038(10) 0.9205(4) 0.4459(11) 0.019(3) Uani 1 1 d . . . . .
H7A H 0.0670 0.9053 0.4877 0.023 Uiso 1 1 calc R U . . .
C8 C -0.0924(10) 0.9041(4) 0.3645(11) 0.025(3) Uani 1 1 d . . . . .
H8A H -0.0965 0.8777 0.3522 0.030 Uiso 1 1 calc R U . . .
C9 C -0.1844(11) 0.9273(4) 0.3000(12) 0.029(4) Uani 1 1 d . . . . .
H9A H -0.2507 0.9163 0.2430 0.034 Uiso 1 1 calc R U . . .
C10 C -0.1795(12) 0.9653(4) 0.3183(13) 0.033(4) Uani 1 1 d . . . . .
H10A H -0.2421 0.9806 0.2736 0.040 Uiso 1 1 calc R U . . .
C11 C -0.0829(10) 0.9819(4) 0.4026(12) 0.025(3) Uani 1 1 d . . . . .
H11A H -0.0795 1.0083 0.4161 0.030 Uiso 1 1 calc R U . . .
C12 C 0.1044(10) 1.0260(4) 0.5949(10) 0.017(3) Uani 1 1 d . . . . .
C13 C 0.0630(11) 1.0259(4) 0.6676(12) 0.029(4) Uani 1 1 d . . . . .
H13A H 0.0625 1.0028 0.7024 0.035 Uiso 1 1 calc R U . . .
C14 C 0.0230(11) 1.0578(4) 0.6909(13) 0.032(4) Uani 1 1 d . . . . .
H14A H -0.0052 1.0569 0.7402 0.038 Uiso 1 1 calc R U . . .
C15 C 0.0249(11) 1.0919(4) 0.6397(13) 0.028(3) Uani 1 1 d . . . . .
H15A H -0.0010 1.1146 0.6551 0.033 Uiso 1 1 calc R U . . .
C16 C 0.0645(12) 1.0921(4) 0.5674(15) 0.036(4) Uani 1 1 d . . . . .
H16A H 0.0653 1.1150 0.5321 0.044 Uiso 1 1 calc R U . . .
C17 C 0.1029(11) 1.0597(4) 0.5456(13) 0.032(4) Uani 1 1 d . . . . .
H17A H 0.1292 1.0606 0.4946 0.038 Uiso 1 1 calc R U . . .
C18 C 0.1912(10) 0.9894(4) 0.4672(10) 0.016(3) Uani 1 1 d . . . . .
H18A H 0.1885 0.9652 0.4302 0.019 Uiso 1 1 calc R U . . .
H18B H 0.1395 1.0068 0.4081 0.019 Uiso 1 1 calc R U . . .
C19 C 0.3083(9) 1.0058(3) 0.5164(11) 0.015(3) Uani 1 1 d . . . . .
H19A H 0.3215 1.0119 0.4543 0.018 Uiso 1 1 calc R U . . .
H19B H 0.3138 1.0296 0.5565 0.018 Uiso 1 1 calc R U . . .
C20 C 0.3973(10) 0.9782(3) 0.5977(11) 0.017(3) Uani 1 1 d . . . . .
H20A H 0.4695 0.9865 0.6102 0.020 Uiso 1 1 calc R U . . .
H20B H 0.3820 0.9528 0.5632 0.020 Uiso 1 1 calc R U . . .
C21 C 0.4357(10) 1.0233(3) 0.7839(11) 0.014(3) Uani 1 1 d . . . . .
C22 C 0.3728(11) 1.0420(3) 0.8204(11) 0.021(3) Uani 1 1 d . . . . .
H22A H 0.3130 1.0294 0.8195 0.025 Uiso 1 1 calc R U . . .
C23 C 0.3979(12) 1.0795(4) 0.8587(12) 0.027(3) Uani 1 1 d . . . . .
H23A H 0.3549 1.0926 0.8828 0.032 Uiso 1 1 calc R U . . .
C24 C 0.4854(12) 1.0968(4) 0.8604(12) 0.031(4) Uani 1 1 d . . . . .
H24A H 0.5032 1.1220 0.8872 0.038 Uiso 1 1 calc R U . . .
C25 C 0.5478(12) 1.0788(4) 0.8248(13) 0.032(4) Uani 1 1 d . . . . .
H25A H 0.6069 1.0915 0.8247 0.038 Uiso 1 1 calc R U . . .
C26 C 0.5234(11) 1.0416(4) 0.7887(12) 0.026(3) Uani 1 1 d . U . . .
H26A H 0.5684 1.0286 0.7669 0.031 Uiso 1 1 calc R U . . .
C27 C 0.5262(9) 0.9486(3) 0.8176(11) 0.017(3) Uani 1 1 d . . . . .
C28 C 0.6093(11) 0.9625(4) 0.9223(12) 0.031(4) Uani 1 1 d . . . . .
H28A H 0.6022 0.9866 0.9479 0.037 Uiso 1 1 calc R U . . .
C29 C 0.7027(11) 0.9401(4) 0.9881(13) 0.032(4) Uani 1 1 d . . . . .
H29A H 0.7597 0.9492 1.0582 0.038 Uiso 1 1 calc R U . . .
C30 C 0.7109(10) 0.9055(4) 0.9508(12) 0.028(3) Uani 1 1 d . . . . .
H30A H 0.7743 0.8906 0.9957 0.034 Uiso 1 1 calc R U . . .
C31 C 0.6312(10) 0.8917(4) 0.8515(12) 0.027(3) Uani 1 1 d . . . . .
H31A H 0.6395 0.8674 0.8273 0.033 Uiso 1 1 calc R U . . .
C32 C 0.5384(10) 0.9125(4) 0.7856(11) 0.020(3) Uani 1 1 d . . . . .
H32A H 0.4818 0.9021 0.7172 0.024 Uiso 1 1 calc R U . . .
C33 C 0.6047(11) 0.7222(4) 0.5058(12) 0.027(3) Uani 1 1 d . . . . .
H33D H 0.6229 0.6953 0.5112 0.041 Uiso 1 1 calc R U . . .
H33E H 0.6167 0.7311 0.5782 0.041 Uiso 1 1 calc R U . . .
H33F H 0.6516 0.7364 0.4856 0.041 Uiso 1 1 calc R U . . .
C34 C 0.3358(11) 0.7178(4) 0.2103(11) 0.022(3) Uani 1 1 d . . . . .
H34B H 0.2700 0.7047 0.1990 0.033 Uiso 1 1 calc R U . . .
H34C H 0.3754 0.7017 0.1851 0.033 Uiso 1 1 calc R U . . .
H34D H 0.3145 0.7413 0.1669 0.033 Uiso 1 1 calc R U . . .
C35 C 0.5118(10) 0.8305(4) 0.5856(12) 0.026(3) Uani 1 1 d . . . . .
H35D H 0.5622 0.8138 0.5769 0.039 Uiso 1 1 calc R U . . .
H35E H 0.5227 0.8275 0.6610 0.039 Uiso 1 1 calc R U . . .
H35F H 0.5263 0.8568 0.5748 0.039 Uiso 1 1 calc R U . . .
C36 C 0.2297(10) 0.8282(4) 0.2984(11) 0.022(3) Uani 1 1 d . . . . .
H36A H 0.2279 0.8077 0.2500 0.032 Uiso 1 1 calc R U . . .
H36B H 0.2481 0.8519 0.2753 0.032 Uiso 1 1 calc R U . . .
H36C H 0.1576 0.8305 0.2919 0.032 Uiso 1 1 calc R U . . .
C37 C 0.4331(10) 0.7117(4) 0.6801(12) 0.025(3) Uani 1 1 d . . . . .
H37A H 0.4882 0.7065 0.6588 0.037 Uiso 1 1 calc R U . . .
H37B H 0.4137 0.6881 0.7030 0.037 Uiso 1 1 calc R U . . .
H37C H 0.4631 0.7296 0.7427 0.037 Uiso 1 1 calc R U . . .
C38 C 0.1415(10) 0.7147(4) 0.4081(12) 0.022(3) Uani 1 1 d . . . . .
H38A H 0.1479 0.7116 0.3413 0.034 Uiso 1 1 calc R U . . .
H38B H 0.0831 0.7329 0.3923 0.034 Uiso 1 1 calc R U . . .
H38C H 0.1237 0.6904 0.4286 0.034 Uiso 1 1 calc R U . . .
C39 C 0.3484(10) 0.8293(4) 0.7840(11) 0.026(3) Uani 1 1 d . . . . .
H39A H 0.4141 0.8150 0.8002 0.040 Uiso 1 1 calc R U . . .
H39B H 0.3378 0.8280 0.8486 0.040 Uiso 1 1 calc R U . . .
H39C H 0.3573 0.8557 0.7690 0.040 Uiso 1 1 calc R U . . .
C40 C 0.0558(10) 0.8227(4) 0.5097(12) 0.025(3) Uani 1 1 d . . . . .
H40A H 0.0652 0.8370 0.4545 0.038 Uiso 1 1 calc R U . . .
H40B H 0.0193 0.8386 0.5389 0.038 Uiso 1 1 calc R U . . .
H40C H 0.0110 0.8003 0.4739 0.038 Uiso 1 1 calc R U . . .
C41 C 0.2459(11) 0.7077(4) 0.8811(12) 0.031(4) Uani 1 1 d . . . . .
H41A H 0.2356 0.6817 0.8982 0.046 Uiso 1 1 calc R U . . .
H41B H 0.2275 0.7253 0.9239 0.046 Uiso 1 1 calc R U . . .
H41C H 0.3224 0.7114 0.9015 0.046 Uiso 1 1 calc R U . . .
C42 C -0.0254(9) 0.7184(3) 0.5844(11) 0.016(3) Uani 1 1 d . . . . .
H42A H -0.0396 0.6988 0.5287 0.024 Uiso 1 1 calc R U . . .
H42B H -0.0446 0.7432 0.5477 0.024 Uiso 1 1 calc R U . . .
H42C H -0.0698 0.7135 0.6191 0.024 Uiso 1 1 calc R U . . .
C43 C 0.6722(13) 0.9453(5) 0.6366(14) 0.041(4) Uani 1 1 d . . . . .
H43A H 0.6330 0.9289 0.6581 0.049 Uiso 1 1 calc R U . . .
C44 C 0.7839(17) 0.8915(5) 0.650(2) 0.079(7) Uani 1 1 d . . . . .
H44A H 0.7524 0.8798 0.6920 0.119 Uiso 1 1 calc R U . . .
H44B H 0.8640 0.8892 0.6937 0.119 Uiso 1 1 calc R U . . .
H44C H 0.7557 0.8786 0.5781 0.119 Uiso 1 1 calc R U . . .
C45 C 0.8134(15) 0.9530(6) 0.5916(19) 0.072(7) Uani 1 1 d . . . . .
H45A H 0.7730 0.9765 0.5591 0.108 Uiso 1 1 calc R U . . .
H45B H 0.8202 0.9389 0.5345 0.108 Uiso 1 1 calc R U . . .
H45C H 0.8866 0.9589 0.6546 0.108 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 N1 2.112(11) . ?
Pt1 P1 2.241(3) . ?
Pt1 P2 2.277(3) . ?
Pt1 Se1 2.4674(14) . ?
Se1 C1 1.898(14) . ?
Sn1 O1 1.960(8) . ?
Sn1 C34 2.095(13) . ?
Sn1 C33 2.126(14) . ?
Sn1 Cl2 2.542(3) . ?
Sn1 Cl1 2.609(3) . ?
Sn2 O2 1.998(9) . ?
Sn2 C36 2.092(13) . ?
Sn2 C35 2.115(13) . ?
Sn2 O1 2.142(8) . ?
Sn2 Cl3 2.695(3) . ?
Sn3 O2 2.036(8) . ?
Sn3 C37 2.104(13) . ?
Sn3 C38 2.119(13) . ?
Sn3 O1 2.163(8) . ?
Sn3 O3 2.245(9) . ?
Sn4 O3 2.035(8) . ?
Sn4 O2 2.087(8) . ?
Sn4 C40 2.107(13) . ?
Sn4 C39 2.107(12) . ?
Sn4 Cl4 2.696(3) . ?
Sn5 O3 1.986(8) . ?
Sn5 C41 2.093(14) . ?
Sn5 C42 2.121(11) . ?
Sn5 Cl5 2.469(4) . ?
Sn5 Cl4 2.782(4) . ?
P1 C12 1.802(13) . ?
P1 C18 1.812(13) . ?
P1 C6 1.817(12) . ?
P2 C27 1.791(12) . ?
P2 C21 1.810(12) . ?
P2 C20 1.836(13) . ?
O4 C43 1.210(18) . ?
N1 C5 1.320(17) . ?
N1 C1 1.376(17) . ?
N2 C43 1.31(2) . ?
N2 C44 1.42(2) . ?
N2 C45 1.46(2) . ?
C1 C2 1.35(2) . ?
C2 C3 1.40(2) . ?
C2 H2A 0.9500 . ?
C3 C4 1.37(2) . ?
C3 H3A 0.9500 . ?
C4 C5 1.385(19) . ?
C4 H4A 0.9500 . ?
C5 H5A 0.9500 . ?
C6 C7 1.379(18) . ?
C6 C11 1.416(18) . ?
C7 C8 1.379(17) . ?
C7 H7A 0.9500 . ?
C8 C9 1.408(19) . ?
C8 H8A 0.9500 . ?
C9 C10 1.37(2) . ?
C9 H9A 0.9500 . ?
C10 C11 1.40(2) . ?
C10 H10A 0.9500 . ?
C11 H11A 0.9500 . ?
C12 C17 1.370(19) . ?
C12 C13 1.40(2) . ?
C13 C14 1.373(19) . ?
C13 H13A 0.9500 . ?
C14 C15 1.41(2) . ?
C14 H14A 0.9500 . ?
C15 C16 1.37(2) . ?
C15 H15A 0.9500 . ?
C16 C17 1.366(19) . ?
C16 H16A 0.9500 . ?
C17 H17A 0.9500 . ?
C18 C19 1.550(15) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 C20 1.540(17) . ?
C19 H19A 0.9900 . ?
C19 H19B 0.9900 . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C21 C26 1.370(18) . ?
C21 C22 1.393(18) . ?
C22 C23 1.409(18) . ?
C22 H22A 0.9500 . ?
C23 C24 1.370(19) . ?
C23 H23A 0.9500 . ?
C24 C25 1.37(2) . ?
C24 H24A 0.9500 . ?
C25 C26 1.389(19) . ?
C25 H25A 0.9500 . ?
C26 H26A 0.9500 . ?
C27 C32 1.392(17) . ?
C27 C28 1.413(18) . ?
C28 C29 1.408(19) . ?
C28 H28A 0.9500 . ?
C29 C30 1.358(19) . ?
C29 H29A 0.9500 . ?
C30 C31 1.352(18) . ?
C30 H30A 0.9500 . ?
C31 C32 1.373(17) . ?
C31 H31A 0.9500 . ?
C32 H32A 0.9500 . ?
C33 H33D 0.9800 . ?
C33 H33E 0.9800 . ?
C33 H33F 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C34 H34D 0.9800 . ?
C35 H35D 0.9800 . ?
C35 H35E 0.9800 . ?
C35 H35F 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C39 H39C 0.9800 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C41 H41A 0.9800 . ?
C41 H41B 0.9800 . ?
C41 H41C 0.9800 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 H43A 0.9500 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 H45A 0.9800 . ?
C45 H45B 0.9800 . ?
C45 H45C 0.9800 . ?

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
N1 Pt1 P1 166.0(3) . . ?
N1 Pt1 P2 101.7(3) . . ?
P1 Pt1 P2 91.90(12) . . ?
N1 Pt1 Se1 70.6(3) . . ?
P1 Pt1 Se1 95.93(9) . . ?
P2 Pt1 Se1 171.80(9) . . ?
C1 Se1 Pt1 77.8(4) . . ?
O1 Sn1 C34 114.3(5) . . ?
O1 Sn1 C33 108.5(5) . . ?
C34 Sn1 C33 137.2(5) . . ?
O1 Sn1 Cl2 86.8(2) . . ?
C34 Sn1 Cl2 89.6(4) . . ?
C33 Sn1 Cl2 93.2(4) . . ?
O1 Sn1 Cl1 84.6(2) . . ?
C34 Sn1 Cl1 91.6(4) . . ?
C33 Sn1 Cl1 91.9(4) . . ?
Cl2 Sn1 Cl1 171.02(11) . . ?
O2 Sn2 C36 112.2(5) . . ?
O2 Sn2 C35 106.5(5) . . ?
C36 Sn2 C35 140.1(5) . . ?
O2 Sn2 O1 75.0(3) . . ?
C36 Sn2 O1 98.5(4) . . ?
C35 Sn2 O1 100.7(4) . . ?
O2 Sn2 Cl3 81.3(2) . . ?
C36 Sn2 Cl3 87.6(4) . . ?
C35 Sn2 Cl3 88.8(4) . . ?
O1 Sn2 Cl3 156.1(2) . . ?
O2 Sn3 C37 113.6(5) . . ?
O2 Sn3 C38 108.4(4) . . ?
C37 Sn3 C38 137.2(5) . . ?
O2 Sn3 O1 73.8(3) . . ?
C37 Sn3 O1 99.6(4) . . ?
C38 Sn3 O1 99.4(5) . . ?
O2 Sn3 O3 72.4(3) . . ?
C37 Sn3 O3 91.7(4) . . ?
C38 Sn3 O3 93.4(4) . . ?
O1 Sn3 O3 146.1(3) . . ?
O3 Sn4 O2 75.9(3) . . ?
O3 Sn4 C40 109.4(4) . . ?
O2 Sn4 C40 98.4(5) . . ?
O3 Sn4 C39 110.0(5) . . ?
O2 Sn4 C39 99.0(5) . . ?
C40 Sn4 C39 139.8(5) . . ?
O3 Sn4 Cl4 79.0(3) . . ?
O2 Sn4 Cl4 154.8(2) . . ?
C40 Sn4 Cl4 88.5(4) . . ?
C39 Sn4 Cl4 90.9(4) . . ?
O3 Sn5 C41 111.0(5) . . ?
O3 Sn5 C42 106.0(4) . . ?
C41 Sn5 C42 140.7(5) . . ?
O3 Sn5 Cl5 91.5(3) . . ?
C41 Sn5 Cl5 94.6(4) . . ?
C42 Sn5 Cl5 97.2(3) . . ?
O3 Sn5 Cl4 77.6(3) . . ?
C41 Sn5 Cl4 87.8(4) . . ?
C42 Sn5 Cl4 87.6(3) . . ?
Cl5 Sn5 Cl4 168.95(11) . . ?
C12 P1 C18 107.6(6) . . ?
C12 P1 C6 104.4(6) . . ?
C18 P1 C6 100.4(6) . . ?
C12 P1 Pt1 110.0(4) . . ?
C18 P1 Pt1 117.4(4) . . ?
C6 P1 Pt1 115.8(4) . . ?
C27 P2 C21 105.9(6) . . ?
C27 P2 C20 103.0(6) . . ?
C21 P2 C20 102.3(6) . . ?
C27 P2 Pt1 114.0(4) . . ?
C21 P2 Pt1 116.9(4) . . ?
C20 P2 Pt1 113.1(4) . . ?
Sn4 Cl4 Sn5 80.08(9) . . ?
Sn1 O1 Sn2 129.4(4) . . ?
Sn1 O1 Sn3 129.6(4) . . ?
Sn2 O1 Sn3 100.7(3) . . ?
Sn2 O2 Sn3 110.6(4) . . ?
Sn2 O2 Sn4 140.7(4) . . ?
Sn3 O2 Sn4 108.7(4) . . ?
Sn5 O3 Sn4 122.5(4) . . ?
Sn5 O3 Sn3 133.0(4) . . ?
Sn4 O3 Sn3 102.9(4) . . ?
C5 N1 C1 117.7(12) . . ?
C5 N1 Pt1 138.4(10) . . ?
C1 N1 Pt1 103.6(9) . . ?
C43 N2 C44 125.1(16) . . ?
C43 N2 C45 118.9(15) . . ?
C44 N2 C45 115.7(16) . . ?
C2 C1 N1 123.0(13) . . ?
C2 C1 Se1 129.2(11) . . ?
N1 C1 Se1 107.8(9) . . ?
C1 C2 C3 118.9(15) . . ?
C1 C2 H2A 120.5 . . ?
C3 C2 H2A 120.5 . . ?
C4 C3 C2 117.9(15) . . ?
C4 C3 H3A 121.0 . . ?
C2 C3 H3A 121.0 . . ?
C3 C4 C5 120.6(14) . . ?
C3 C4 H4A 119.7 . . ?
C5 C4 H4A 119.7 . . ?
N1 C5 C4 121.8(14) . . ?
N1 C5 H5A 119.1 . . ?
C4 C5 H5A 119.1 . . ?
C7 C6 C11 119.7(12) . . ?
C7 C6 P1 120.6(10) . . ?
C11 C6 P1 118.9(10) . . ?
C8 C7 C6 121.2(12) . . ?
C8 C7 H7A 119.4 . . ?
C6 C7 H7A 119.4 . . ?
C7 C8 C9 119.0(12) . . ?
C7 C8 H8A 120.5 . . ?
C9 C8 H8A 120.5 . . ?
C10 C9 C8 120.8(12) . . ?
C10 C9 H9A 119.6 . . ?
C8 C9 H9A 119.6 . . ?
C9 C10 C11 120.3(13) . . ?
C9 C10 H10A 119.8 . . ?
C11 C10 H10A 119.8 . . ?
C10 C11 C6 119.0(13) . . ?
C10 C11 H11A 120.5 . . ?
C6 C11 H11A 120.5 . . ?
C17 C12 C13 117.0(12) . . ?
C17 C12 P1 125.5(11) . . ?
C13 C12 P1 117.0(10) . . ?
C14 C13 C12 122.6(14) . . ?
C14 C13 H13A 118.7 . . ?
C12 C13 H13A 118.7 . . ?
C13 C14 C15 118.3(15) . . ?
C13 C14 H14A 120.8 . . ?
C15 C14 H14A 120.8 . . ?
C16 C15 C14 119.2(13) . . ?
C16 C15 H15A 120.4 . . ?
C14 C15 H15A 120.4 . . ?
C17 C16 C15 120.9(14) . . ?
C17 C16 H16A 119.6 . . ?
C15 C16 H16A 119.6 . . ?
C16 C17 C12 121.9(14) . . ?
C16 C17 H17A 119.0 . . ?
C12 C17 H17A 119.0 . . ?
C19 C18 P1 118.0(9) . . ?
C19 C18 H18A 107.8 . . ?
P1 C18 H18A 107.8 . . ?
C19 C18 H18B 107.8 . . ?
P1 C18 H18B 107.8 . . ?
H18A C18 H18B 107.1 . . ?
C20 C19 C18 112.2(10) . . ?
C20 C19 H19A 109.2 . . ?
C18 C19 H19A 109.2 . . ?
C20 C19 H19B 109.2 . . ?
C18 C19 H19B 109.2 . . ?
H19A C19 H19B 107.9 . . ?
C19 C20 P2 112.5(9) . . ?
C19 C20 H20A 109.1 . . ?
P2 C20 H20A 109.1 . . ?
C19 C20 H20B 109.1 . . ?
P2 C20 H20B 109.1 . . ?
H20A C20 H20B 107.8 . . ?
C26 C21 C22 119.1(11) . . ?
C26 C21 P2 120.5(9) . . ?
C22 C21 P2 120.3(10) . . ?
C21 C22 C23 119.9(12) . . ?
C21 C22 H22A 120.0 . . ?
C23 C22 H22A 120.0 . . ?
C24 C23 C22 118.8(13) . . ?
C24 C23 H23A 120.6 . . ?
C22 C23 H23A 120.6 . . ?
C25 C24 C23 121.9(13) . . ?
C25 C24 H24A 119.1 . . ?
C23 C24 H24A 119.1 . . ?
C24 C25 C26 118.9(13) . . ?
C24 C25 H25A 120.6 . . ?
C26 C25 H25A 120.6 . . ?
C21 C26 C25 121.4(12) . . ?
C21 C26 H26A 119.3 . . ?
C25 C26 H26A 119.3 . . ?
C32 C27 C28 118.3(12) . . ?
C32 C27 P2 120.8(9) . . ?
C28 C27 P2 120.7(10) . . ?
C29 C28 C27 119.2(13) . . ?
C29 C28 H28A 120.4 . . ?
C27 C28 H28A 120.4 . . ?
C30 C29 C28 119.6(13) . . ?
C30 C29 H29A 120.2 . . ?
C28 C29 H29A 120.2 . . ?
C31 C30 C29 121.7(13) . . ?
C31 C30 H30A 119.1 . . ?
C29 C30 H30A 119.1 . . ?
C30 C31 C32 120.3(13) . . ?
C30 C31 H31A 119.8 . . ?
C32 C31 H31A 119.8 . . ?
C31 C32 C27 120.8(12) . . ?
C31 C32 H32A 119.6 . . ?
C27 C32 H32A 119.6 . . ?
Sn1 C33 H33D 109.5 . . ?
Sn1 C33 H33E 109.5 . . ?
H33D C33 H33E 109.5 . . ?
Sn1 C33 H33F 109.5 . . ?
H33D C33 H33F 109.5 . . ?
H33E C33 H33F 109.5 . . ?
Sn1 C34 H34B 109.5 . . ?
Sn1 C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
Sn1 C34 H34D 109.5 . . ?
H34B C34 H34D 109.5 . . ?
H34C C34 H34D 109.5 . . ?
Sn2 C35 H35D 109.5 . . ?
Sn2 C35 H35E 109.5 . . ?
H35D C35 H35E 109.5 . . ?
Sn2 C35 H35F 109.5 . . ?
H35D C35 H35F 109.5 . . ?
H35E C35 H35F 109.5 . . ?
Sn2 C36 H36A 109.5 . . ?
Sn2 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
Sn2 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
Sn3 C37 H37A 109.5 . . ?
Sn3 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
Sn3 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
Sn3 C38 H38A 109.5 . . ?
Sn3 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
Sn3 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
Sn4 C39 H39A 109.5 . . ?
Sn4 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
Sn4 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
Sn4 C40 H40A 109.5 . . ?
Sn4 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
Sn4 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
Sn5 C41 H41A 109.5 . . ?
Sn5 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
Sn5 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
Sn5 C42 H42A 109.5 . . ?
Sn5 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
Sn5 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
O4 C43 N2 128.0(15) . . ?
O4 C43 H43A 116.0 . . ?
N2 C43 H43A 116.0 . . ?
N2 C44 H44A 109.5 . . ?
N2 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
N2 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
N2 C45 H45A 109.5 . . ?
N2 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
N2 C45 H45C 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C5 N1 C1 C2 -3.3(19) . . . . ?
Pt1 N1 C1 C2 -177.9(11) . . . . ?
C5 N1 C1 Se1 179.2(9) . . . . ?
Pt1 N1 C1 Se1 4.6(9) . . . . ?
Pt1 Se1 C1 C2 178.8(13) . . . . ?
Pt1 Se1 C1 N1 -3.9(8) . . . . ?
N1 C1 C2 C3 3(2) . . . . ?
Se1 C1 C2 C3 180.0(11) . . . . ?
C1 C2 C3 C4 -2(2) . . . . ?
C2 C3 C4 C5 0(2) . . . . ?
C1 N1 C5 C4 2.1(19) . . . . ?
Pt1 N1 C5 C4 174.2(10) . . . . ?
C3 C4 C5 N1 -1(2) . . . . ?
C12 P1 C6 C7 -164.3(11) . . . . ?
C18 P1 C6 C7 84.3(12) . . . . ?
Pt1 P1 C6 C7 -43.2(12) . . . . ?
C12 P1 C6 C11 25.7(12) . . . . ?
C18 P1 C6 C11 -85.7(12) . . . . ?
Pt1 P1 C6 C11 146.8(10) . . . . ?
C11 C6 C7 C8 -2(2) . . . . ?
P1 C6 C7 C8 -172.3(11) . . . . ?
C6 C7 C8 C9 2(2) . . . . ?
C7 C8 C9 C10 -1(2) . . . . ?
C8 C9 C10 C11 -1(2) . . . . ?
C9 C10 C11 C6 1(2) . . . . ?
C7 C6 C11 C10 1(2) . . . . ?
P1 C6 C11 C10 170.9(11) . . . . ?
C18 P1 C12 C17 7.3(13) . . . . ?
C6 P1 C12 C17 -98.7(13) . . . . ?
Pt1 P1 C12 C17 136.4(11) . . . . ?
C18 P1 C12 C13 179.9(10) . . . . ?
C6 P1 C12 C13 73.9(11) . . . . ?
Pt1 P1 C12 C13 -51.0(11) . . . . ?
C17 C12 C13 C14 -1(2) . . . . ?
P1 C12 C13 C14 -173.8(11) . . . . ?
C12 C13 C14 C15 0(2) . . . . ?
C13 C14 C15 C16 1(2) . . . . ?
C14 C15 C16 C17 -1(2) . . . . ?
C15 C16 C17 C12 -1(2) . . . . ?
C13 C12 C17 C16 1(2) . . . . ?
P1 C12 C17 C16 173.7(12) . . . . ?
C12 P1 C18 C19 75.7(10) . . . . ?
C6 P1 C18 C19 -175.5(9) . . . . ?
Pt1 P1 C18 C19 -49.1(10) . . . . ?
P1 C18 C19 C20 65.7(12) . . . . ?
C18 C19 C20 P2 -74.5(11) . . . . ?
C27 P2 C20 C19 -170.2(8) . . . . ?
C21 P2 C20 C19 -60.4(9) . . . . ?
Pt1 P2 C20 C19 66.2(9) . . . . ?
C27 P2 C21 C26 55.0(13) . . . . ?
C20 P2 C21 C26 -52.6(12) . . . . ?
Pt1 P2 C21 C26 -176.7(10) . . . . ?
C27 P2 C21 C22 -123.8(11) . . . . ?
C20 P2 C21 C22 128.7(11) . . . . ?
Pt1 P2 C21 C22 4.5(12) . . . . ?
C26 C21 C22 C23 1.8(19) . . . . ?
P2 C21 C22 C23 -179.4(10) . . . . ?
C21 C22 C23 C24 -1(2) . . . . ?
C22 C23 C24 C25 1(2) . . . . ?
C23 C24 C25 C26 -2(2) . . . . ?
C22 C21 C26 C25 -3(2) . . . . ?
P2 C21 C26 C25 178.5(11) . . . . ?
C24 C25 C26 C21 3(2) . . . . ?
C21 P2 C27 C32 -165.5(11) . . . . ?
C20 P2 C27 C32 -58.4(12) . . . . ?
Pt1 P2 C27 C32 64.5(12) . . . . ?
C21 P2 C27 C28 19.4(13) . . . . ?
C20 P2 C27 C28 126.4(12) . . . . ?
Pt1 P2 C27 C28 -110.6(11) . . . . ?
C32 C27 C28 C29 2(2) . . . . ?
P2 C27 C28 C29 177.6(12) . . . . ?
C27 C28 C29 C30 -1(2) . . . . ?
C28 C29 C30 C31 0(2) . . . . ?
C29 C30 C31 C32 -1(2) . . . . ?
C30 C31 C32 C27 2(2) . . . . ?
C28 C27 C32 C31 -3(2) . . . . ?
P2 C27 C32 C31 -178.4(11) . . . . ?
C44 N2 C43 O4 -176.8(19) . . . . ?
C45 N2 C43 O4 -4(3) . . . . ?

_refine_diff_density_max         1.725
_refine_diff_density_min         -0.744
_refine_diff_density_rms         0.164

_shelxl_version_number           2014/6

####################################################################### 
# 
# 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_ROHIT22
_database_code_depnum_ccdc_archive 'CCDC 2032091'
loop_
_audit_author_name
_audit_author_address
'Arnold L Rheingold'
;University of California, San Diego
United States of America
;
_audit_update_record             
;
2020-11-03 deposited with the CCDC.	2020-11-10 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C52 H79 Cl6 N O3 P2 Pt Se Sn5'
_chemical_formula_weight         1908.30

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'
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'
Sn Sn -0.6537 1.4246 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Se Se -0.0929 2.2259 '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'
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'

_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                   12.2292(6)
_cell_length_b                   16.2125(9)
_cell_length_c                   17.2666(9)
_cell_angle_alpha                92.263(2)
_cell_angle_beta                 107.239(2)
_cell_angle_gamma                97.212(2)
_cell_volume                     3233.1(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9869
_cell_measurement_theta_min      2.57
_cell_measurement_theta_max      26.30

_exptl_crystal_description       BLOCK
_exptl_crystal_colour            yellow-orange
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.960
_exptl_crystal_F_000             1832
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.100
_exptl_absorpt_coefficient_mu    4.956
_shelx_estimated_absorpt_T_min   0.437
_shelx_estimated_absorpt_T_max   0.637
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.589
_exptl_absorpt_correction_T_max  0.745
_exptl_absorpt_process_details   sadabs
_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            42115
_diffrn_reflns_av_unetI/netI     0.0684
_diffrn_reflns_av_R_equivalents  0.0554
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         2.541
_diffrn_reflns_theta_max         26.415
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.948
_diffrn_measured_fraction_theta_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.948
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.948
_diffrn_reflns_point_group_measured_fraction_full 0.992
_reflns_number_total             12602
_reflns_number_gt                9213
_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    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2018 (Sheldrick, 2018)'
_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)+(0.0371P)²+25.4583P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     'direct methods'
_atom_sites_solution_secondary   'Fourier differnce maps'
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         12602
_refine_ls_number_parameters     630
_refine_ls_number_restraints     84
_refine_ls_R_factor_all          0.0888
_refine_ls_R_factor_gt           0.0546
_refine_ls_wR_factor_ref         0.1208
_refine_ls_wR_factor_gt          0.1102
_refine_ls_goodness_of_fit_ref   1.089
_refine_ls_restrained_S_all      1.088
_refine_ls_shift/su_max          0.001
_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 0.6652(2) 0.9992(2) 0.3087(2) 0.0294(9) Uani 0.58(4) 1 d . . P A 1
Pt1A Pt 0.6712(6) 0.9924(6) 0.3050(4) 0.0544(16) Uani 0.42(4) 1 d . . P A 2
P1 P 0.5993(2) 0.98599(14) 0.17026(15) 0.0323(5) Uani 1 1 d . . . . .
P2 P 0.5249(2) 1.07297(15) 0.31282(14) 0.0337(6) Uani 1 1 d . . . . .
Se1 Se 0.82362(12) 0.91769(8) 0.30012(8) 0.0371(3) Uani 0.5 1 d . . P A 1
Se2 Se 0.72929(12) 1.00246(9) 0.45700(9) 0.0434(4) Uani 0.5 1 d . . P A 1
Cl6 Cl 0.82362(12) 0.91769(8) 0.30012(8) 0.0371(3) Uani 0.5 1 d . . P A 2
Cl7 Cl 0.72929(12) 1.00246(9) 0.45700(9) 0.0434(4) Uani 0.5 1 d . . P A 2
C1 C 0.7053(8) 0.9640(6) 0.1198(6) 0.035(2) Uani 1 1 d . . . . .
C2 C 0.8036(8) 1.0234(6) 0.1313(6) 0.042(2) Uani 1 1 d . . . . .
H2 H 0.8147 1.0726 0.1660 0.051 Uiso 1 1 calc R U . . .
C3 C 0.8833(9) 1.0107(7) 0.0928(7) 0.057(3) Uani 1 1 d . . . . .
H3 H 0.9494 1.0516 0.1008 0.069 Uiso 1 1 calc R U . . .
C4 C 0.8696(9) 0.9392(8) 0.0420(8) 0.060(3) Uani 1 1 d . . . . .
H4 H 0.9262 0.9308 0.0160 0.072 Uiso 1 1 calc R U . . .
C5 C 0.7733(9) 0.8806(7) 0.0297(7) 0.050(3) Uani 1 1 d . . . . .
H5 H 0.7629 0.8319 -0.0057 0.060 Uiso 1 1 calc R U . . .
C6 C 0.6909(8) 0.8918(6) 0.0688(6) 0.041(2) Uani 1 1 d . . . . .
H6 H 0.6252 0.8506 0.0607 0.049 Uiso 1 1 calc R U . . .
C7 C 0.4803(8) 0.9000(5) 0.1343(6) 0.035(2) Uani 1 1 d . . . . .
C8 C 0.4893(9) 0.8266(6) 0.1729(6) 0.049(3) Uani 1 1 d . . . . .
H8 H 0.5557 0.8228 0.2176 0.059 Uiso 1 1 calc R U . . .
C9 C 0.4022(9) 0.7584(6) 0.1469(6) 0.052(3) Uani 1 1 d . . . . .
H9 H 0.4106 0.7072 0.1715 0.062 Uiso 1 1 calc R U . . .
C10 C 0.3048(9) 0.7661(6) 0.0856(7) 0.048(3) Uani 1 1 d . . . . .
H10 H 0.2444 0.7201 0.0682 0.058 Uiso 1 1 calc R U . . .
C11 C 0.2924(9) 0.8396(6) 0.0485(6) 0.044(3) Uani 1 1 d . . . . .
H11 H 0.2235 0.8441 0.0063 0.053 Uiso 1 1 calc R U . . .
C12 C 0.3808(8) 0.9075(6) 0.0729(6) 0.038(2) Uani 1 1 d . . . . .
H12 H 0.3725 0.9583 0.0475 0.045 Uiso 1 1 calc R U . . .
C13 C 0.5518(7) 1.0782(5) 0.1229(5) 0.031(2) Uani 1 1 d . . . . .
H13A H 0.6209 1.1206 0.1313 0.037 Uiso 1 1 calc R U . . .
H13B H 0.5187 1.0635 0.0636 0.037 Uiso 1 1 calc R U . . .
C14 C 0.4637(7) 1.1184(5) 0.1517(5) 0.031(2) Uani 1 1 d . . . . .
H14A H 0.4407 1.1649 0.1179 0.038 Uiso 1 1 calc R U . . .
H14B H 0.3938 1.0767 0.1432 0.038 Uiso 1 1 calc R U . . .
C15 C 0.5067(8) 1.1516(5) 0.2404(5) 0.031(2) Uani 1 1 d . . . . .
H15A H 0.4515 1.1872 0.2507 0.037 Uiso 1 1 calc R U . . .
H15B H 0.5820 1.1876 0.2503 0.037 Uiso 1 1 calc R U . . .
C16 C 0.3823(8) 1.0112(6) 0.2928(6) 0.040(2) Uani 1 1 d . . . . .
C17 C 0.2817(8) 1.0460(6) 0.2623(6) 0.041(2) Uani 1 1 d . . . . .
H17 H 0.2855 1.1032 0.2518 0.050 Uiso 1 1 calc R U . . .
C18 C 0.1757(9) 0.9964(7) 0.2472(7) 0.059(3) Uani 1 1 d . . . . .
H18 H 0.1064 1.0196 0.2257 0.071 Uiso 1 1 calc R U . . .
C19 C 0.1700(10) 0.9137(7) 0.2629(8) 0.069(4) Uani 1 1 d . . . . .
H19 H 0.0966 0.8808 0.2536 0.082 Uiso 1 1 calc R U . . .
C20 C 0.2685(10) 0.8783(7) 0.2919(9) 0.071(4) Uani 1 1 d . . . . .
H20 H 0.2634 0.8207 0.3009 0.085 Uiso 1 1 calc R U . . .
C21 C 0.3772(10) 0.9272(7) 0.3084(7) 0.059(3) Uani 1 1 d . . . . .
H21 H 0.4461 0.9036 0.3298 0.071 Uiso 1 1 calc R U . . .
C22 C 0.5515(8) 1.1366(6) 0.4075(5) 0.035(2) Uani 1 1 d . . . . .
C23 C 0.4762(9) 1.1296(6) 0.4532(6) 0.047(3) Uani 1 1 d . . . . .
H23 H 0.4105 1.0875 0.4382 0.057 Uiso 1 1 calc R U . . .
C24 C 0.4970(11) 1.1851(7) 0.5222(6) 0.059(3) Uani 1 1 d . . . . .
H24 H 0.4443 1.1816 0.5532 0.071 Uiso 1 1 calc R U . . .
C25 C 0.5930(12) 1.2439(7) 0.5445(6) 0.064(4) Uani 1 1 d . . . . .
H25 H 0.6067 1.2817 0.5909 0.077 Uiso 1 1 calc R U . . .
C26 C 0.6704(10) 1.2489(7) 0.5002(6) 0.058(3) Uani 1 1 d . . . . .
H26 H 0.7379 1.2893 0.5170 0.069 Uiso 1 1 calc R U . . .
C27 C 0.6504(10) 1.1963(6) 0.4328(6) 0.052(3) Uani 1 1 d . . . . .
H27 H 0.7041 1.2002 0.4026 0.063 Uiso 1 1 calc R U . . .
C28A C 0.876(2) 0.9062(18) 0.4132(10) 0.063(2) Uani 0.5 1 d G U P A 1
C29A C 0.9678(19) 0.8607(15) 0.4362(9) 0.063(2) Uani 0.5 1 d G U P A 1
H29B H 0.9925 0.8337 0.3959 0.075 Uiso 0.5 1 calc R U P A 1
C30A C 1.0235(15) 0.8548(12) 0.5182(10) 0.063(2) Uani 0.5 1 d G U P A 1
H30B H 1.0864 0.8237 0.5339 0.075 Uiso 0.5 1 calc R U P A 1
C31A C 0.9874(17) 0.8944(13) 0.5771(8) 0.063(2) Uani 0.5 1 d G U P A 1
H31B H 1.0255 0.8904 0.6332 0.075 Uiso 0.5 1 calc R U P A 1
N1A N 0.895(2) 0.9399(15) 0.5542(13) 0.114(7) Uani 0.5 1 d G U P A 1
C32A C 0.840(2) 0.9458(18) 0.4722(15) 0.063(2) Uani 0.5 1 d G U P A 1
C28 C 0.855(2) 0.9361(17) 0.4686(14) 0.063(2) Uani 0.5 1 d G U P A 2
C29 C 0.9203(18) 0.9204(14) 0.5460(11) 0.063(2) Uani 0.5 1 d G U P A 2
H29A H 0.9021 0.9405 0.5924 0.075 Uiso 0.5 1 calc R U P A 2
C30 C 1.0122(15) 0.8752(13) 0.5554(9) 0.063(2) Uani 0.5 1 d G U P A 2
H30A H 1.0567 0.8644 0.6083 0.075 Uiso 0.5 1 calc R U P A 2
C31 C 1.0389(16) 0.8457(13) 0.4875(11) 0.063(2) Uani 0.5 1 d G U P A 2
H31A H 1.1016 0.8148 0.4940 0.075 Uiso 0.5 1 calc R U P A 2
N1 N 0.974(2) 0.8615(16) 0.4101(9) 0.114(7) Uani 0.5 1 d G U P A 2
C32 C 0.882(2) 0.9067(19) 0.4007(10) 0.063(2) Uani 0.5 1 d G U P A 2
Sn1 Sn 1.17150(5) 0.37814(4) 0.73159(4) 0.03144(16) Uani 1 1 d . . . . .
Sn2 Sn 1.17864(5) 0.60855(4) 0.75685(3) 0.02748(15) Uani 1 1 d . . . . .
Sn3 Sn 0.92818(5) 0.49131(4) 0.74262(3) 0.02672(15) Uani 1 1 d . . . . .
Sn4 Sn 0.90897(5) 0.69152(4) 0.78709(4) 0.03243(16) Uani 1 1 d . . . . .
Sn5 Sn 0.64605(5) 0.55617(4) 0.76993(4) 0.03025(16) Uani 1 1 d . . . . .
Cl1 Cl 0.9636(2) 0.29997(17) 0.6951(2) 0.0574(7) Uani 1 1 d . . . . .
Cl2 Cl 1.36463(18) 0.47859(15) 0.76714(14) 0.0391(6) Uani 1 1 d . . . . .
Cl3 Cl 1.18486(19) 0.77481(14) 0.75893(15) 0.0388(6) Uani 1 1 d . . . . .
Cl4 Cl 0.72593(19) 0.73412(15) 0.82508(15) 0.0395(6) Uani 1 1 d . . . . .
Cl5 Cl 0.63558(19) 0.41268(15) 0.72153(14) 0.0396(6) Uani 1 1 d . . . . .
O1 O 1.1023(5) 0.4812(4) 0.7443(4) 0.0311(14) Uani 1 1 d . . . . .
O2 O 1.0127(4) 0.6117(3) 0.7564(3) 0.0262(13) Uani 1 1 d . . . . .
O3 O 0.8090(5) 0.5793(4) 0.7634(3) 0.0303(14) Uani 1 1 d . . . . .
C33 C 1.1852(9) 0.3505(6) 0.6130(5) 0.042(2) Uani 1 1 d . . . . .
H33A H 1.1146 0.3134 0.5803 0.050 Uiso 1 1 calc R U . . .
H33B H 1.1897 0.4029 0.5858 0.050 Uiso 1 1 calc R U . . .
C34 C 1.2923(9) 0.3080(7) 0.6156(7) 0.053(3) Uani 1 1 d . . . . .
H34A H 1.2981 0.3004 0.5605 0.079 Uiso 1 1 calc R U . . .
H34B H 1.2846 0.2535 0.6377 0.079 Uiso 1 1 calc R U . . .
H34C H 1.3621 0.3431 0.6504 0.079 Uiso 1 1 calc R U . . .
C35 C 1.2163(10) 0.3092(6) 0.8364(6) 0.050(3) Uani 1 1 d . . . . .
H35A H 1.1510 0.3050 0.8596 0.060 Uiso 1 1 calc R U . . .
H35B H 1.2223 0.2518 0.8180 0.060 Uiso 1 1 calc R U . . .
C36 C 1.3240(10) 0.3406(7) 0.9034(6) 0.057(3) Uani 1 1 d . . . . .
H36A H 1.3913 0.3364 0.8846 0.085 Uiso 1 1 calc R U . . .
H36B H 1.3284 0.3071 0.9500 0.085 Uiso 1 1 calc R U . . .
H36C H 1.3232 0.3990 0.9199 0.085 Uiso 1 1 calc R U . . .
C37 C 1.2836(7) 0.6202(6) 0.8807(5) 0.032(2) Uani 1 1 d . . . . .
H37A H 1.2385 0.6401 0.9149 0.039 Uiso 1 1 calc R U . . .
H37B H 1.3012 0.5642 0.8967 0.039 Uiso 1 1 calc R U . . .
C38 C 1.3976(8) 0.6792(7) 0.8991(6) 0.049(3) Uani 1 1 d . . . . .
H38A H 1.4390 0.6822 0.9574 0.073 Uiso 1 1 calc R U . . .
H38B H 1.3816 0.7349 0.8834 0.073 Uiso 1 1 calc R U . . .
H38C H 1.4454 0.6583 0.8682 0.073 Uiso 1 1 calc R U . . .
C39 C 1.1958(8) 0.6119(6) 0.6378(5) 0.036(2) Uani 1 1 d . . . . .
H39A H 1.2633 0.6534 0.6396 0.043 Uiso 1 1 calc R U . . .
H39B H 1.2115 0.5567 0.6209 0.043 Uiso 1 1 calc R U . . .
C40 C 1.0900(8) 0.6336(7) 0.5747(6) 0.049(3) Uani 1 1 d . . . . .
H40A H 1.1081 0.6432 0.5239 0.073 Uiso 1 1 calc R U . . .
H40B H 1.0672 0.6842 0.5945 0.073 Uiso 1 1 calc R U . . .
H40C H 1.0264 0.5874 0.5650 0.073 Uiso 1 1 calc R U . . .
C41 C 0.8419(8) 0.4670(6) 0.6154(5) 0.037(2) Uani 1 1 d . . . . .
H41A H 0.8990 0.4540 0.5881 0.045 Uiso 1 1 calc R U . . .
H41B H 0.7831 0.4168 0.6069 0.045 Uiso 1 1 calc R U . . .
C42 C 0.7833(9) 0.5371(8) 0.5753(6) 0.055(3) Uani 1 1 d . . . . .
H42A H 0.7562 0.5242 0.5162 0.083 Uiso 1 1 calc R U . . .
H42B H 0.8383 0.5888 0.5887 0.083 Uiso 1 1 calc R U . . .
H42C H 0.7173 0.5440 0.5949 0.083 Uiso 1 1 calc R U . . .
C43 C 0.9393(9) 0.4405(7) 0.8565(6) 0.048(3) Uani 1 1 d . . . . .
H43A H 0.8787 0.4598 0.8772 0.057 Uiso 1 1 calc R U . . .
H43B H 0.9218 0.3790 0.8470 0.057 Uiso 1 1 calc R U . . .
C44 C 1.0529(11) 0.4624(10) 0.9206(7) 0.084(5) Uani 1 1 d . . . . .
H44A H 1.0500 0.4357 0.9701 0.126 Uiso 1 1 calc R U . . .
H44B H 1.0698 0.5231 0.9327 0.126 Uiso 1 1 calc R U . . .
H44C H 1.1137 0.4429 0.9014 0.126 Uiso 1 1 calc R U . . .
C45 C 1.0169(9) 0.7183(9) 0.9114(7) 0.077(4) Uani 1 1 d . . . . .
H45A H 1.0475 0.6661 0.9288 0.093 Uiso 1 1 calc R U . . .
H45B H 1.0839 0.7588 0.9103 0.093 Uiso 1 1 calc R U . . .
C46 C 0.9780(10) 0.7488(10) 0.9741(7) 0.083(4) Uani 1 1 d . U . . .
H46A H 1.0366 0.7466 1.0266 0.125 Uiso 1 1 calc R U . . .
H46B H 0.9057 0.7144 0.9734 0.125 Uiso 1 1 calc R U . . .
H46C H 0.9643 0.8066 0.9663 0.125 Uiso 1 1 calc R U . . .
C47 C 0.8841(8) 0.7688(6) 0.6886(6) 0.042(2) Uani 1 1 d . U . . .
H47A H 0.9084 0.8274 0.7116 0.051 Uiso 1 1 calc R U . . .
H47B H 0.9368 0.7562 0.6574 0.051 Uiso 1 1 calc R U . . .
C48 C 0.7623(9) 0.7622(7) 0.6289(6) 0.049(3) Uani 1 1 d . . . . .
H48A H 0.7616 0.8032 0.5886 0.074 Uiso 1 1 calc R U . . .
H48B H 0.7080 0.7733 0.6586 0.074 Uiso 1 1 calc R U . . .
H48C H 0.7392 0.7060 0.6013 0.074 Uiso 1 1 calc R U . . .
C49 C 0.5315(7) 0.6074(6) 0.6718(5) 0.038(2) Uani 1 1 d . . . . .
H49A H 0.4745 0.6320 0.6924 0.046 Uiso 1 1 calc R U . . .
H49B H 0.5767 0.6533 0.6534 0.046 Uiso 1 1 calc R U . . .
C50 C 0.4663(8) 0.5469(7) 0.5988(6) 0.051(3) Uani 1 1 d . . . . .
H50A H 0.4217 0.5774 0.5553 0.076 Uiso 1 1 calc R U . . .
H50B H 0.4135 0.5049 0.6144 0.076 Uiso 1 1 calc R U . . .
H50C H 0.5214 0.5194 0.5796 0.076 Uiso 1 1 calc R U . . .
C51 C 0.6565(8) 0.5479(6) 0.8950(5) 0.037(2) Uani 1 1 d . . . . .
H51A H 0.7344 0.5743 0.9287 0.044 Uiso 1 1 calc R U . . .
H51B H 0.5997 0.5807 0.9071 0.044 Uiso 1 1 calc R U . . .
C52 C 0.6356(10) 0.4642(7) 0.9194(6) 0.051(3) Uani 1 1 d . . . . .
H52A H 0.6236 0.4673 0.9731 0.077 Uiso 1 1 calc R U . . .
H52B H 0.7026 0.4357 0.9221 0.077 Uiso 1 1 calc R U . . .
H52C H 0.5666 0.4331 0.8796 0.077 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 P2 2.228(4) . ?
Pt1 P1 2.277(4) . ?
Pt1 Se2 2.442(4) . ?
Pt1 Se1 2.513(4) . ?
Pt1A P1 2.223(6) . ?
Pt1A Cl6 2.366(12) . ?
Pt1A P2 2.376(12) . ?
Pt1A Cl7 2.501(7) . ?
P1 C13 1.810(9) . ?
P1 C1 1.825(10) . ?
P1 C7 1.826(9) . ?
P2 C15 1.809(9) . ?
P2 C22 1.819(9) . ?
P2 C16 1.827(9) . ?
Se1 C28A 1.891(15) . ?
Se2 C32A 1.690(16) . ?
Cl6 C32 1.696(15) . ?
Cl7 C28 1.954(16) . ?
C1 C6 1.397(13) . ?
C1 C2 1.401(13) . ?
C2 C3 1.363(14) . ?
C2 H2 0.9500 . ?
C3 C4 1.388(16) . ?
C3 H3 0.9500 . ?
C4 C5 1.374(15) . ?
C4 H4 0.9500 . ?
C5 C6 1.394(14) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
C7 C12 1.380(12) . ?
C7 C8 1.387(13) . ?
C8 C9 1.393(13) . ?
C8 H8 0.9500 . ?
C9 C10 1.362(14) . ?
C9 H9 0.9500 . ?
C10 C11 1.380(14) . ?
C10 H10 0.9500 . ?
C11 C12 1.397(13) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 C14 1.517(12) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C14 C15 1.516(12) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 C17 1.385(14) . ?
C16 C21 1.396(14) . ?
C17 C18 1.384(13) . ?
C17 H17 0.9500 . ?
C18 C19 1.375(15) . ?
C18 H18 0.9500 . ?
C19 C20 1.368(16) . ?
C19 H19 0.9500 . ?
C20 C21 1.403(14) . ?
C20 H20 0.9500 . ?
C21 H21 0.9500 . ?
C22 C23 1.376(13) . ?
C22 C27 1.398(13) . ?
C23 C24 1.403(14) . ?
C23 H23 0.9500 . ?
C24 C25 1.363(16) . ?
C24 H24 0.9500 . ?
C25 C26 1.379(16) . ?
C25 H25 0.9500 . ?
C26 C27 1.358(14) . ?
C26 H26 0.9500 . ?
C27 H27 0.9500 . ?
C28A C29A 1.3900 . ?
C28A C32A 1.3900 . ?
C29A C30A 1.3900 . ?
C29A H29B 0.9500 . ?
C30A C31A 1.3900 . ?
C30A H30B 0.9500 . ?
C31A N1A 1.3900 . ?
C31A H31B 0.9500 . ?
N1A C32A 1.3900 . ?
C28 C29 1.3900 . ?
C28 C32 1.3900 . ?
C29 C30 1.3900 . ?
C29 H29A 0.9500 . ?
C30 C31 1.3900 . ?
C30 H30A 0.9500 . ?
C31 N1 1.3900 . ?
C31 H31A 0.9500 . ?
N1 C32 1.3900 . ?
Sn1 O1 1.998(6) . ?
Sn1 C35 2.134(10) . ?
Sn1 C33 2.137(9) . ?
Sn1 Cl1 2.577(3) . ?
Sn1 Cl2 2.589(2) . ?
Sn2 O2 2.034(5) . ?
Sn2 C39 2.129(9) . ?
Sn2 C37 2.130(8) . ?
Sn2 O1 2.131(6) . ?
Sn2 Cl3 2.685(2) . ?
Sn3 O2 2.060(5) . ?
Sn3 C41 2.132(9) . ?
Sn3 C43 2.136(10) . ?
Sn3 O1 2.148(6) . ?
Sn3 O3 2.253(6) . ?
Sn4 O3 2.015(5) . ?
Sn4 O2 2.079(5) . ?
Sn4 C47 2.123(10) . ?
Sn4 C45 2.154(11) . ?
Sn4 Cl4 2.672(2) . ?
Sn5 O3 2.018(5) . ?
Sn5 C49 2.125(9) . ?
Sn5 C51 2.135(9) . ?
Sn5 Cl5 2.416(2) . ?
C33 C34 1.545(14) . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 C36 1.489(15) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 C38 1.530(12) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 C40 1.514(13) . ?
C39 H39A 0.9900 . ?
C39 H39B 0.9900 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C41 C42 1.502(15) . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 C44 1.488(16) . ?
C43 H43A 0.9900 . ?
C43 H43B 0.9900 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 C46 1.402(15) . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C46 H46C 0.9800 . ?
C47 C48 1.527(13) . ?
C47 H47A 0.9900 . ?
C47 H47B 0.9900 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
C49 C50 1.515(13) . ?
C49 H49A 0.9900 . ?
C49 H49B 0.9900 . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C51 C52 1.452(14) . ?
C51 H51A 0.9900 . ?
C51 H51B 0.9900 . ?
C52 H52A 0.9800 . ?
C52 H52B 0.9800 . ?
C52 H52C 0.9800 . ?

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
P2 Pt1 P1 90.58(14) . . ?
P2 Pt1 Se2 90.42(16) . . ?
P1 Pt1 Se2 175.67(19) . . ?
P2 Pt1 Se1 178.29(19) . . ?
P1 Pt1 Se1 87.96(15) . . ?
Se2 Pt1 Se1 91.10(11) . . ?
P1 Pt1A Cl6 93.0(4) . . ?
P1 Pt1A P2 88.2(3) . . ?
Cl6 Pt1A P2 177.3(3) . . ?
P1 Pt1A Cl7 173.3(5) . . ?
Cl6 Pt1A Cl7 93.2(2) . . ?
P2 Pt1A Cl7 85.7(4) . . ?
C13 P1 C1 101.2(4) . . ?
C13 P1 C7 108.2(4) . . ?
C1 P1 C7 105.3(4) . . ?
C13 P1 Pt1A 118.8(4) . . ?
C1 P1 Pt1A 112.2(4) . . ?
C7 P1 Pt1A 110.2(3) . . ?
C13 P1 Pt1 115.4(3) . . ?
C1 P1 Pt1 115.4(3) . . ?
C7 P1 Pt1 110.6(3) . . ?
C15 P2 C22 101.0(4) . . ?
C15 P2 C16 105.9(4) . . ?
C22 P2 C16 106.4(4) . . ?
C15 P2 Pt1 112.6(3) . . ?
C22 P2 Pt1 115.0(3) . . ?
C16 P2 Pt1 114.6(4) . . ?
C15 P2 Pt1A 112.1(3) . . ?
C22 P2 Pt1A 116.5(4) . . ?
C16 P2 Pt1A 113.6(4) . . ?
C28A Se1 Pt1 94.3(7) . . ?
C32A Se2 Pt1 100.7(9) . . ?
C32 Cl6 Pt1A 99.9(9) . . ?
C28 Cl7 Pt1A 94.4(8) . . ?
C6 C1 C2 119.0(9) . . ?
C6 C1 P1 122.8(7) . . ?
C2 C1 P1 118.2(7) . . ?
C3 C2 C1 120.2(10) . . ?
C3 C2 H2 119.9 . . ?
C1 C2 H2 119.9 . . ?
C2 C3 C4 121.1(10) . . ?
C2 C3 H3 119.4 . . ?
C4 C3 H3 119.4 . . ?
C5 C4 C3 119.4(10) . . ?
C5 C4 H4 120.3 . . ?
C3 C4 H4 120.3 . . ?
C4 C5 C6 120.6(10) . . ?
C4 C5 H5 119.7 . . ?
C6 C5 H5 119.7 . . ?
C5 C6 C1 119.7(9) . . ?
C5 C6 H6 120.1 . . ?
C1 C6 H6 120.1 . . ?
C12 C7 C8 119.7(8) . . ?
C12 C7 P1 121.9(7) . . ?
C8 C7 P1 118.3(7) . . ?
C7 C8 C9 120.7(10) . . ?
C7 C8 H8 119.6 . . ?
C9 C8 H8 119.6 . . ?
C10 C9 C8 119.1(10) . . ?
C10 C9 H9 120.5 . . ?
C8 C9 H9 120.5 . . ?
C9 C10 C11 121.0(9) . . ?
C9 C10 H10 119.5 . . ?
C11 C10 H10 119.5 . . ?
C10 C11 C12 120.2(10) . . ?
C10 C11 H11 119.9 . . ?
C12 C11 H11 119.9 . . ?
C7 C12 C11 119.2(9) . . ?
C7 C12 H12 120.4 . . ?
C11 C12 H12 120.4 . . ?
C14 C13 P1 117.3(6) . . ?
C14 C13 H13A 108.0 . . ?
P1 C13 H13A 108.0 . . ?
C14 C13 H13B 108.0 . . ?
P1 C13 H13B 108.0 . . ?
H13A C13 H13B 107.2 . . ?
C15 C14 C13 114.0(7) . . ?
C15 C14 H14A 108.7 . . ?
C13 C14 H14A 108.7 . . ?
C15 C14 H14B 108.7 . . ?
C13 C14 H14B 108.7 . . ?
H14A C14 H14B 107.6 . . ?
C14 C15 P2 115.2(6) . . ?
C14 C15 H15A 108.5 . . ?
P2 C15 H15A 108.5 . . ?
C14 C15 H15B 108.5 . . ?
P2 C15 H15B 108.5 . . ?
H15A C15 H15B 107.5 . . ?
C17 C16 C21 120.6(9) . . ?
C17 C16 P2 121.4(7) . . ?
C21 C16 P2 118.0(8) . . ?
C18 C17 C16 119.3(9) . . ?
C18 C17 H17 120.4 . . ?
C16 C17 H17 120.4 . . ?
C19 C18 C17 120.5(11) . . ?
C19 C18 H18 119.7 . . ?
C17 C18 H18 119.7 . . ?
C20 C19 C18 120.8(10) . . ?
C20 C19 H19 119.6 . . ?
C18 C19 H19 119.6 . . ?
C19 C20 C21 119.9(11) . . ?
C19 C20 H20 120.1 . . ?
C21 C20 H20 120.1 . . ?
C16 C21 C20 118.9(11) . . ?
C16 C21 H21 120.5 . . ?
C20 C21 H21 120.5 . . ?
C23 C22 C27 119.3(9) . . ?
C23 C22 P2 122.4(7) . . ?
C27 C22 P2 118.2(7) . . ?
C22 C23 C24 119.6(9) . . ?
C22 C23 H23 120.2 . . ?
C24 C23 H23 120.2 . . ?
C25 C24 C23 119.8(11) . . ?
C25 C24 H24 120.1 . . ?
C23 C24 H24 120.1 . . ?
C24 C25 C26 120.5(10) . . ?
C24 C25 H25 119.8 . . ?
C26 C25 H25 119.8 . . ?
C27 C26 C25 120.3(10) . . ?
C27 C26 H26 119.9 . . ?
C25 C26 H26 119.9 . . ?
C26 C27 C22 120.5(10) . . ?
C26 C27 H27 119.8 . . ?
C22 C27 H27 119.8 . . ?
C29A C28A C32A 120.0 . . ?
C29A C28A Se1 113.6(13) . . ?
C32A C28A Se1 126.0(13) . . ?
C30A C29A C28A 120.0 . . ?
C30A C29A H29B 120.0 . . ?
C28A C29A H29B 120.0 . . ?
C31A C30A C29A 120.0 . . ?
C31A C30A H30B 120.0 . . ?
C29A C30A H30B 120.0 . . ?
N1A C31A C30A 120.0 . . ?
N1A C31A H31B 120.0 . . ?
C30A C31A H31B 120.0 . . ?
C31A N1A C32A 120.0 . . ?
N1A C32A C28A 120.0 . . ?
N1A C32A Se2 112.7(14) . . ?
C28A C32A Se2 127.3(14) . . ?
C29 C28 C32 120.0 . . ?
C29 C28 Cl7 119.3(13) . . ?
C32 C28 Cl7 120.7(13) . . ?
C30 C29 C28 120.0 . . ?
C30 C29 H29A 120.0 . . ?
C28 C29 H29A 120.0 . . ?
C31 C30 C29 120.0 . . ?
C31 C30 H30A 120.0 . . ?
C29 C30 H30A 120.0 . . ?
C30 C31 N1 120.0 . . ?
C30 C31 H31A 120.0 . . ?
N1 C31 H31A 120.0 . . ?
C31 N1 C32 120.0 . . ?
N1 C32 C28 120.0 . . ?
N1 C32 Cl6 108.4(14) . . ?
C28 C32 Cl6 131.5(14) . . ?
O1 Sn1 C35 115.9(3) . . ?
O1 Sn1 C33 115.1(3) . . ?
C35 Sn1 C33 129.1(4) . . ?
O1 Sn1 Cl1 86.07(17) . . ?
C35 Sn1 Cl1 88.5(3) . . ?
C33 Sn1 Cl1 93.2(3) . . ?
O1 Sn1 Cl2 84.66(17) . . ?
C35 Sn1 Cl2 96.8(3) . . ?
C33 Sn1 Cl2 89.5(3) . . ?
Cl1 Sn1 Cl2 170.63(9) . . ?
O2 Sn2 C39 112.0(3) . . ?
O2 Sn2 C37 107.3(3) . . ?
C39 Sn2 C37 139.9(3) . . ?
O2 Sn2 O1 74.8(2) . . ?
C39 Sn2 O1 96.6(3) . . ?
C37 Sn2 O1 100.7(3) . . ?
O2 Sn2 Cl3 82.74(16) . . ?
C39 Sn2 Cl3 87.2(3) . . ?
C37 Sn2 Cl3 90.4(3) . . ?
O1 Sn2 Cl3 157.00(16) . . ?
O2 Sn3 C41 105.2(3) . . ?
O2 Sn3 C43 112.5(3) . . ?
C41 Sn3 C43 141.8(4) . . ?
O2 Sn3 O1 73.9(2) . . ?
C41 Sn3 O1 99.8(3) . . ?
C43 Sn3 O1 96.6(3) . . ?
O2 Sn3 O3 71.3(2) . . ?
C41 Sn3 O3 94.8(3) . . ?
C43 Sn3 O3 91.2(3) . . ?
O1 Sn3 O3 144.7(2) . . ?
O3 Sn4 O2 76.0(2) . . ?
O3 Sn4 C47 115.5(3) . . ?
O2 Sn4 C47 100.8(3) . . ?
O3 Sn4 C45 114.7(5) . . ?
O2 Sn4 C45 94.6(4) . . ?
C47 Sn4 C45 129.6(5) . . ?
O3 Sn4 Cl4 81.12(17) . . ?
O2 Sn4 Cl4 156.77(16) . . ?
C47 Sn4 Cl4 92.5(3) . . ?
C45 Sn4 Cl4 91.4(3) . . ?
O3 Sn5 C49 109.7(3) . . ?
O3 Sn5 C51 107.8(3) . . ?
C49 Sn5 C51 133.1(4) . . ?
O3 Sn5 Cl5 89.45(17) . . ?
C49 Sn5 Cl5 104.3(3) . . ?
C51 Sn5 Cl5 103.1(3) . . ?
Sn1 O1 Sn2 129.2(3) . . ?
Sn1 O1 Sn3 128.4(3) . . ?
Sn2 O1 Sn3 102.3(2) . . ?
Sn2 O2 Sn3 109.0(2) . . ?
Sn2 O2 Sn4 141.0(3) . . ?
Sn3 O2 Sn4 108.5(2) . . ?
Sn4 O3 Sn5 125.5(3) . . ?
Sn4 O3 Sn3 103.7(2) . . ?
Sn5 O3 Sn3 130.6(3) . . ?
C34 C33 Sn1 112.5(7) . . ?
C34 C33 H33A 109.1 . . ?
Sn1 C33 H33A 109.1 . . ?
C34 C33 H33B 109.1 . . ?
Sn1 C33 H33B 109.1 . . ?
H33A C33 H33B 107.8 . . ?
C33 C34 H34A 109.5 . . ?
C33 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
C33 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C36 C35 Sn1 118.5(7) . . ?
C36 C35 H35A 107.7 . . ?
Sn1 C35 H35A 107.7 . . ?
C36 C35 H35B 107.7 . . ?
Sn1 C35 H35B 107.7 . . ?
H35A C35 H35B 107.1 . . ?
C35 C36 H36A 109.5 . . ?
C35 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C35 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C38 C37 Sn2 114.9(6) . . ?
C38 C37 H37A 108.5 . . ?
Sn2 C37 H37A 108.5 . . ?
C38 C37 H37B 108.5 . . ?
Sn2 C37 H37B 108.5 . . ?
H37A C37 H37B 107.5 . . ?
C37 C38 H38A 109.5 . . ?
C37 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C37 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C40 C39 Sn2 113.7(6) . . ?
C40 C39 H39A 108.8 . . ?
Sn2 C39 H39A 108.8 . . ?
C40 C39 H39B 108.8 . . ?
Sn2 C39 H39B 108.8 . . ?
H39A C39 H39B 107.7 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C42 C41 Sn3 114.9(6) . . ?
C42 C41 H41A 108.5 . . ?
Sn3 C41 H41A 108.5 . . ?
C42 C41 H41B 108.5 . . ?
Sn3 C41 H41B 108.5 . . ?
H41A C41 H41B 107.5 . . ?
C41 C42 H42A 109.5 . . ?
C41 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
C41 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C44 C43 Sn3 115.4(8) . . ?
C44 C43 H43A 108.4 . . ?
Sn3 C43 H43A 108.4 . . ?
C44 C43 H43B 108.4 . . ?
Sn3 C43 H43B 108.4 . . ?
H43A C43 H43B 107.5 . . ?
C43 C44 H44A 109.5 . . ?
C43 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
C43 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
C46 C45 Sn4 123.7(9) . . ?
C46 C45 H45A 106.4 . . ?
Sn4 C45 H45A 106.4 . . ?
C46 C45 H45B 106.4 . . ?
Sn4 C45 H45B 106.4 . . ?
H45A C45 H45B 106.5 . . ?
C45 C46 H46A 109.5 . . ?
C45 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
C45 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
C48 C47 Sn4 117.6(7) . . ?
C48 C47 H47A 107.9 . . ?
Sn4 C47 H47A 107.9 . . ?
C48 C47 H47B 107.9 . . ?
Sn4 C47 H47B 107.9 . . ?
H47A C47 H47B 107.2 . . ?
C47 C48 H48A 109.5 . . ?
C47 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C47 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C50 C49 Sn5 115.8(7) . . ?
C50 C49 H49A 108.3 . . ?
Sn5 C49 H49A 108.3 . . ?
C50 C49 H49B 108.3 . . ?
Sn5 C49 H49B 108.3 . . ?
H49A C49 H49B 107.4 . . ?
C49 C50 H50A 109.5 . . ?
C49 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
C49 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
C52 C51 Sn5 115.7(7) . . ?
C52 C51 H51A 108.4 . . ?
Sn5 C51 H51A 108.4 . . ?
C52 C51 H51B 108.4 . . ?
Sn5 C51 H51B 108.4 . . ?
H51A C51 H51B 107.4 . . ?
C51 C52 H52A 109.5 . . ?
C51 C52 H52B 109.5 . . ?
H52A C52 H52B 109.5 . . ?
C51 C52 H52C 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C13 P1 C1 C6 -115.4(8) . . . . ?
C7 P1 C1 C6 -2.9(9) . . . . ?
Pt1A P1 C1 C6 117.0(8) . . . . ?
Pt1 P1 C1 C6 119.4(7) . . . . ?
C13 P1 C1 C2 62.8(8) . . . . ?
C7 P1 C1 C2 175.3(7) . . . . ?
Pt1A P1 C1 C2 -64.8(8) . . . . ?
Pt1 P1 C1 C2 -62.4(8) . . . . ?
C6 C1 C2 C3 0.3(15) . . . . ?
P1 C1 C2 C3 -178.0(8) . . . . ?
C1 C2 C3 C4 -0.3(17) . . . . ?
C2 C3 C4 C5 0.7(18) . . . . ?
C3 C4 C5 C6 -1.1(17) . . . . ?
C4 C5 C6 C1 1.1(16) . . . . ?
C2 C1 C6 C5 -0.6(14) . . . . ?
P1 C1 C6 C5 177.6(8) . . . . ?
C13 P1 C7 C12 8.0(10) . . . . ?
C1 P1 C7 C12 -99.5(9) . . . . ?
Pt1A P1 C7 C12 139.4(8) . . . . ?
Pt1 P1 C7 C12 135.2(8) . . . . ?
C13 P1 C7 C8 -169.0(8) . . . . ?
C1 P1 C7 C8 83.5(9) . . . . ?
Pt1A P1 C7 C8 -37.6(10) . . . . ?
Pt1 P1 C7 C8 -41.8(9) . . . . ?
C12 C7 C8 C9 4.3(16) . . . . ?
P1 C7 C8 C9 -178.7(9) . . . . ?
C7 C8 C9 C10 -3.5(17) . . . . ?
C8 C9 C10 C11 1.1(17) . . . . ?
C9 C10 C11 C12 0.6(17) . . . . ?
C8 C7 C12 C11 -2.5(15) . . . . ?
P1 C7 C12 C11 -179.4(7) . . . . ?
C10 C11 C12 C7 0.1(15) . . . . ?
C1 P1 C13 C14 -178.0(6) . . . . ?
C7 P1 C13 C14 71.7(7) . . . . ?
Pt1A P1 C13 C14 -54.8(7) . . . . ?
Pt1 P1 C13 C14 -52.7(7) . . . . ?
P1 C13 C14 C15 63.2(9) . . . . ?
C13 C14 C15 P2 -70.6(9) . . . . ?
C22 P2 C15 C14 -170.6(7) . . . . ?
C16 P2 C15 C14 -59.8(7) . . . . ?
Pt1 P2 C15 C14 66.3(7) . . . . ?
Pt1A P2 C15 C14 64.7(7) . . . . ?
C15 P2 C16 C17 -29.8(9) . . . . ?
C22 P2 C16 C17 77.1(9) . . . . ?
Pt1 P2 C16 C17 -154.6(7) . . . . ?
Pt1A P2 C16 C17 -153.3(8) . . . . ?
C15 P2 C16 C21 149.6(8) . . . . ?
C22 P2 C16 C21 -103.5(9) . . . . ?
Pt1 P2 C16 C21 24.8(9) . . . . ?
Pt1A P2 C16 C21 26.0(9) . . . . ?
C21 C16 C17 C18 -0.1(16) . . . . ?
P2 C16 C17 C18 179.2(8) . . . . ?
C16 C17 C18 C19 0.6(18) . . . . ?
C17 C18 C19 C20 -2(2) . . . . ?
C18 C19 C20 C21 2(2) . . . . ?
C17 C16 C21 C20 0.6(17) . . . . ?
P2 C16 C21 C20 -178.8(10) . . . . ?
C19 C20 C21 C16 -2(2) . . . . ?
C15 P2 C22 C23 114.7(9) . . . . ?
C16 P2 C22 C23 4.3(10) . . . . ?
Pt1 P2 C22 C23 -123.8(8) . . . . ?
Pt1A P2 C22 C23 -123.5(8) . . . . ?
C15 P2 C22 C27 -63.2(9) . . . . ?
C16 P2 C22 C27 -173.6(8) . . . . ?
Pt1 P2 C22 C27 58.3(9) . . . . ?
Pt1A P2 C22 C27 58.5(9) . . . . ?
C27 C22 C23 C24 3.0(16) . . . . ?
P2 C22 C23 C24 -174.9(9) . . . . ?
C22 C23 C24 C25 -1.7(18) . . . . ?
C23 C24 C25 C26 -0.5(19) . . . . ?
C24 C25 C26 C27 1(2) . . . . ?
C25 C26 C27 C22 0.0(19) . . . . ?
C23 C22 C27 C26 -2.2(17) . . . . ?
P2 C22 C27 C26 175.8(9) . . . . ?
Pt1 Se1 C28A C29A 178.9(12) . . . . ?
Pt1 Se1 C28A C32A -8.6(13) . . . . ?
C32A C28A C29A C30A 0.0 . . . . ?
Se1 C28A C29A C30A 173.0(18) . . . . ?
C28A C29A C30A C31A 0.0 . . . . ?
C29A C30A C31A N1A 0.0 . . . . ?
C30A C31A N1A C32A 0.0 . . . . ?
C31A N1A C32A C28A 0.0 . . . . ?
C31A N1A C32A Se2 179(2) . . . . ?
C29A C28A C32A N1A 0.0 . . . . ?
Se1 C28A C32A N1A -172(2) . . . . ?
C29A C28A C32A Se2 -179(2) . . . . ?
Se1 C28A C32A Se2 9.0(19) . . . . ?
Pt1 Se2 C32A N1A 178.1(10) . . . . ?
Pt1 Se2 C32A C28A -2.9(17) . . . . ?
C32 C28 C29 C30 0.0 . . . . ?
Cl7 C28 C29 C30 -178.3(19) . . . . ?
C28 C29 C30 C31 0.0 . . . . ?
C29 C30 C31 N1 0.0 . . . . ?
C30 C31 N1 C32 0.0 . . . . ?
C31 N1 C32 C28 0.0 . . . . ?
C31 N1 C32 Cl6 178.2(19) . . . . ?
C29 C28 C32 N1 0.0 . . . . ?
Cl7 C28 C32 N1 178(2) . . . . ?
C29 C28 C32 Cl6 -178(2) . . . . ?
Cl7 C28 C32 Cl6 0.6(19) . . . . ?
Pt1A Cl6 C32 N1 178.7(10) . . . . ?
Pt1A Cl6 C32 C28 -3.4(18) . . . . ?

_refine_diff_density_max         2.288
_refine_diff_density_min         -1.171
_refine_diff_density_rms         0.183

_shelxl_version_number           2014/6

