# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# 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. 
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#######################################################################

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1469636'
_audit_update_record             
;
2016-03-21 deposited with the CCDC.
2016-05-05 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ALMX57
_chemical_melting_point          ?
_chemical_formula_moiety         'C38 H42 F10 P2 Pt Zn'
_chemical_formula_sum            'C38 H42 F10 P2 Pt Zn'
_chemical_formula_weight         1011.11

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'
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'
Zn Zn 0.2839 1.4301 '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/n'
_space_group_name_Hall           '-P 2yn'

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

_cell_length_a                   10.9506(3)
_cell_length_b                   19.9969(6)
_cell_length_c                   17.6775(6)
_cell_angle_alpha                90
_cell_angle_beta                 96.0540(10)
_cell_angle_gamma                90
_cell_volume                     3849.4(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9720
_cell_measurement_theta_min      2.34
_cell_measurement_theta_max      25.35

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.745
_exptl_crystal_F_000             1992
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.070
_exptl_absorpt_coefficient_mu    4.412
_shelx_estimated_absorpt_T_min   0.620
_shelx_estimated_absorpt_T_max   0.748
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.250108
_exptl_absorpt_correction_T_max  0.303439
_exptl_absorpt_process_details   TWINABS
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'microfocus sealed tube'
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean 8.366
_diffrn_reflns_number            7042
_diffrn_reflns_av_unetI/netI     0.0203
_diffrn_reflns_av_R_equivalents  ?
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         1.542
_diffrn_reflns_theta_max         25.358
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             7042
_reflns_number_gt                6365
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 _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 v. 2014.11-0'
_computing_cell_refinement       'Bruker APEX2 v. 2014.11-0'
_computing_data_reduction        'Bruker APEX2 v. 2014.11-0'
_computing_structure_solution    'SHELXT-2014/4 (Sheldrick 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick 2014)'
_computing_molecular_graphics    ORTEP-32
_computing_publication_material  WinGX

_refine_special_details          
;
 Refined as a 2-component twin.
 
 A tert-butyl moiety (C8-10) and the DMPE ligand (C33-38, P1-2) are both 
 disordered and modeled in two parts.
 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+11.0524P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7042
_refine_ls_number_parameters     558
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0315
_refine_ls_R_factor_gt           0.0252
_refine_ls_wR_factor_ref         0.0622
_refine_ls_wR_factor_gt          0.0560
_refine_ls_goodness_of_fit_ref   1.206
_refine_ls_restrained_S_all      1.206
_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
C1 C 0.6988(4) 0.84400(18) 0.2899(2) 0.0294(8) Uani 1 1 d . . . . .
C2 C 0.6878(4) 0.91380(18) 0.2784(2) 0.0320(9) Uani 1 1 d . . . . .
H2 H 0.7497 0.9421 0.3027 0.038 Uiso 1 1 calc R U . . .
C3 C 0.5918(4) 0.94261(19) 0.2336(2) 0.0348(9) Uani 1 1 d . . . . .
H3 H 0.5900 0.9898 0.2277 0.042 Uiso 1 1 calc R U . . .
C4 C 0.4966(4) 0.90434(19) 0.1966(2) 0.0343(9) Uani 1 1 d . . . . .
C5 C 0.5035(4) 0.83556(19) 0.2091(2) 0.0340(9) Uani 1 1 d . . . . .
H5 H 0.4390 0.8078 0.1868 0.041 Uiso 1 1 calc R U . . .
C6 C 0.6018(4) 0.80628(18) 0.2532(2) 0.0312(9) Uani 1 1 d . . . . .
H6 H 0.6035 0.7590 0.2588 0.037 Uiso 1 1 calc R U . . .
C7 C 0.3898(5) 0.9375(2) 0.1470(2) 0.0432(11) Uani 1 1 d . . . . .
C11 C 0.8759(3) 0.83426(18) 0.4455(2) 0.0303(8) Uani 1 1 d . . . . .
C12 C 0.8726(3) 0.90308(18) 0.4617(2) 0.0276(8) Uani 1 1 d . . . . .
H12 H 0.8463 0.9332 0.4217 0.033 Uiso 1 1 calc R U . . .
C13 C 0.9060(3) 0.92871(18) 0.5337(2) 0.0285(8) Uani 1 1 d . . . . .
H13 H 0.9037 0.9757 0.5412 0.034 Uiso 1 1 calc R U . . .
C14 C 0.9429(3) 0.8874(2) 0.5954(2) 0.0320(9) Uani 1 1 d . . . . .
C15 C 0.9481(4) 0.8190(2) 0.5803(3) 0.0366(10) Uani 1 1 d . . . . .
H15 H 0.9751 0.7894 0.6206 0.044 Uiso 1 1 calc R U . . .
C16 C 0.9149(3) 0.79299(19) 0.5083(3) 0.0349(9) Uani 1 1 d . . . . .
H16 H 0.9185 0.7460 0.5010 0.042 Uiso 1 1 calc R U . . .
C17 C 0.9748(4) 0.9138(2) 0.6756(2) 0.0366(9) Uani 1 1 d . . . . .
C18 C 0.9499(4) 0.9887(2) 0.6825(3) 0.0435(10) Uani 1 1 d . . . . .
H18A H 0.9998 1.0136 0.6492 0.065 Uiso 1 1 calc R U . . .
H18B H 0.9711 1.0029 0.7353 0.065 Uiso 1 1 calc R U . . .
H18C H 0.8627 0.9976 0.6674 0.065 Uiso 1 1 calc R U . . .
C19 C 0.8968(4) 0.8766(2) 0.7301(3) 0.0475(11) Uani 1 1 d . . . . .
H19A H 0.8094 0.8839 0.7138 0.071 Uiso 1 1 calc R U . . .
H19B H 0.9164 0.8938 0.7819 0.071 Uiso 1 1 calc R U . . .
H19C H 0.9149 0.8287 0.7291 0.071 Uiso 1 1 calc R U . . .
C20 C 1.1116(4) 0.9020(2) 0.7004(3) 0.0462(11) Uani 1 1 d . . . . .
H20A H 1.1282 0.8538 0.7024 0.069 Uiso 1 1 calc R U . . .
H20B H 1.1332 0.9216 0.7508 0.069 Uiso 1 1 calc R U . . .
H20C H 1.1608 0.9230 0.6637 0.069 Uiso 1 1 calc R U . . .
C21 C 0.6366(3) 0.69987(17) 0.4163(2) 0.0243(7) Uani 1 1 d . . . . .
C22 C 0.5208(3) 0.68011(18) 0.4325(2) 0.0265(8) Uani 1 1 d . . . . .
C23 C 0.4821(3) 0.61470(19) 0.4359(2) 0.0283(8) Uani 1 1 d . . . . .
C24 C 0.5621(4) 0.56425(17) 0.4231(2) 0.0271(8) Uani 1 1 d . . . . .
C25 C 0.6791(3) 0.58077(17) 0.4077(2) 0.0242(7) Uani 1 1 d . . . . .
C26 C 0.7126(3) 0.64694(18) 0.4044(2) 0.0272(8) Uani 1 1 d . . . . .
C27 C 0.5699(3) 0.86078(16) 0.4685(2) 0.0233(7) Uani 1 1 d . . . . .
C28 C 0.4731(3) 0.89794(17) 0.4372(2) 0.0247(7) Uani 1 1 d . . . . .
C29 C 0.3987(3) 0.93688(18) 0.4779(2) 0.0293(8) Uani 1 1 d . . . . .
C30 C 0.4208(4) 0.93820(18) 0.5560(2) 0.0319(9) Uani 1 1 d . . . . .
C31 C 0.5156(4) 0.90158(19) 0.5906(2) 0.0326(9) Uani 1 1 d . . . . .
C32 C 0.5867(3) 0.86391(18) 0.5470(2) 0.0281(8) Uani 1 1 d . . . . .
F1 F 0.4345(2) 0.72706(11) 0.44459(15) 0.0405(6) Uani 1 1 d . . . . .
F2 F 0.3664(2) 0.59942(11) 0.45024(15) 0.0418(6) Uani 1 1 d . . . . .
F3 F 0.5251(2) 0.50000(10) 0.42282(14) 0.0374(5) Uani 1 1 d . . . . .
F4 F 0.7574(2) 0.53101(11) 0.39379(14) 0.0398(6) Uani 1 1 d . . . . .
F5 F 0.8291(2) 0.65806(11) 0.38829(15) 0.0403(6) Uani 1 1 d . . . . .
F6 F 0.4421(2) 0.89775(12) 0.36090(12) 0.0370(5) Uani 1 1 d . . . . .
F7 F 0.3058(2) 0.97308(11) 0.44297(15) 0.0418(6) Uani 1 1 d . . . . .
F8 F 0.3491(2) 0.97505(12) 0.59717(15) 0.0482(7) Uani 1 1 d . . . . .
F9 F 0.5379(2) 0.90278(13) 0.66773(13) 0.0479(6) Uani 1 1 d . . . . .
F10 F 0.6771(2) 0.82669(13) 0.58567(13) 0.0418(6) Uani 1 1 d . . . . .
P1 P 1.07485(11) 0.77675(6) 0.35713(11) 0.0618(4) Uani 1 1 d . . . . .
P2 P 0.90831(16) 0.79421(6) 0.20665(9) 0.0644(5) Uani 1 1 d . . . . .
Zn1 Zn 0.67665(4) 0.79965(2) 0.41182(2) 0.02360(9) Uani 1 1 d . . . . .
Pt1 Pt 0.87484(2) 0.80808(2) 0.33005(2) 0.03221(6) Uani 1 1 d . . . . .
C8 C 0.3135(6) 0.9821(4) 0.1981(4) 0.057(2) Uani 0.753(9) 1 d . . P A 1
H8A H 0.3658 1.0180 0.2213 0.086 Uiso 0.753(9) 1 calc R U P A 1
H8B H 0.2838 0.9545 0.2382 0.086 Uiso 0.753(9) 1 calc R U P A 1
H8C H 0.2434 1.0016 0.1667 0.086 Uiso 0.753(9) 1 calc R U P A 1
C9 C 0.4307(6) 0.9783(4) 0.0853(4) 0.058(2) Uani 0.753(9) 1 d . . P A 1
H9A H 0.4874 1.0129 0.1069 0.087 Uiso 0.753(9) 1 calc R U P A 1
H9B H 0.3594 0.9995 0.0568 0.087 Uiso 0.753(9) 1 calc R U P A 1
H9C H 0.4725 0.9498 0.0510 0.087 Uiso 0.753(9) 1 calc R U P A 1
C10 C 0.2903(8) 0.8860(4) 0.1097(4) 0.055(2) Uani 0.753(9) 1 d . . P A 1
H10A H 0.2248 0.9105 0.0794 0.083 Uiso 0.753(9) 1 calc R U P A 1
H10B H 0.2553 0.8609 0.1500 0.083 Uiso 0.753(9) 1 calc R U P A 1
H10C H 0.3293 0.8548 0.0769 0.083 Uiso 0.753(9) 1 calc R U P A 1
C8A C 0.4238(17) 1.0155(8) 0.1445(12) 0.044(5) Uani 0.247(9) 1 d . . P A 2
H8A1 H 0.3569 1.0398 0.1152 0.065 Uiso 0.247(9) 1 calc R U P A 2
H8A2 H 0.4996 1.0211 0.1203 0.065 Uiso 0.247(9) 1 calc R U P A 2
H8A3 H 0.4355 1.0332 0.1964 0.065 Uiso 0.247(9) 1 calc R U P A 2
C9A C 0.442(2) 0.9188(13) 0.0627(11) 0.069(8) Uani 0.247(9) 1 d . . P A 2
H9A1 H 0.4344 0.8706 0.0536 0.104 Uiso 0.247(9) 1 calc R U P A 2
H9A2 H 0.5279 0.9322 0.0639 0.104 Uiso 0.247(9) 1 calc R U P A 2
H9A3 H 0.3925 0.9428 0.0218 0.104 Uiso 0.247(9) 1 calc R U P A 2
C10A C 0.2933(19) 0.9143(16) 0.160(2) 0.095(15) Uani 0.247(9) 1 d . . P A 2
H10D H 0.2937 0.8659 0.1508 0.143 Uiso 0.247(9) 1 calc R U P A 2
H10E H 0.2272 0.9349 0.1259 0.143 Uiso 0.247(9) 1 calc R U P A 2
H10F H 0.2801 0.9231 0.2127 0.143 Uiso 0.247(9) 1 calc R U P A 2
C33 C 1.1100(13) 0.6939(7) 0.3841(6) 0.035(2) Uani 0.631(10) 1 d . . P B 3
H33A H 1.0648 0.6632 0.3481 0.052 Uiso 0.631(10) 1 calc R U P B 3
H33B H 1.0864 0.6859 0.4353 0.052 Uiso 0.631(10) 1 calc R U P B 3
H33C H 1.1984 0.6864 0.3840 0.052 Uiso 0.631(10) 1 calc R U P B 3
C34 C 1.1743(7) 0.8273(4) 0.4378(6) 0.044(2) Uani 0.631(10) 1 d . . P B 3
H34A H 1.2602 0.8130 0.4400 0.066 Uiso 0.631(10) 1 calc R U P B 3
H34B H 1.1434 0.8187 0.4869 0.066 Uiso 0.631(10) 1 calc R U P B 3
H34C H 1.1686 0.8752 0.4264 0.066 Uiso 0.631(10) 1 calc R U P B 3
C35 C 1.1605(8) 0.7861(4) 0.2822(6) 0.047(2) Uani 0.631(10) 1 d . . P B 3
H35A H 1.1804 0.8338 0.2745 0.056 Uiso 0.631(10) 1 calc R U P B 3
H35B H 1.2380 0.7604 0.2906 0.056 Uiso 0.631(10) 1 calc R U P B 3
C36 C 1.0786(13) 0.7589(7) 0.2147(8) 0.048(4) Uani 0.631(10) 1 d . . P B 3
H36A H 1.0757 0.7096 0.2187 0.058 Uiso 0.631(10) 1 calc R U P B 3
H36B H 1.1155 0.7701 0.1675 0.058 Uiso 0.631(10) 1 calc R U P B 3
C37 C 0.833(5) 0.727(2) 0.147(3) 0.044(4) Uani 0.631(10) 1 d . . P B 3
H37A H 0.7455 0.7368 0.1366 0.066 Uiso 0.631(10) 1 calc R U P B 3
H37B H 0.8450 0.6844 0.1734 0.066 Uiso 0.631(10) 1 calc R U P B 3
H37C H 0.8701 0.7250 0.0987 0.066 Uiso 0.631(10) 1 calc R U P B 3
C38 C 0.9248(10) 0.8687(4) 0.1603(5) 0.058(3) Uani 0.631(10) 1 d . . P B 3
H38A H 0.9540 0.8601 0.1107 0.086 Uiso 0.631(10) 1 calc R U P B 3
H38B H 0.9845 0.8969 0.1908 0.086 Uiso 0.631(10) 1 calc R U P B 3
H38C H 0.8455 0.8918 0.1530 0.086 Uiso 0.631(10) 1 calc R U P B 3
C33A C 1.104(3) 0.6954(14) 0.4117(11) 0.035(2) Uani 0.369(10) 1 d . . P B 4
H33D H 1.1925 0.6871 0.4202 0.052 Uiso 0.369(10) 1 calc R U P B 4
H33E H 1.0639 0.6585 0.3822 0.052 Uiso 0.369(10) 1 calc R U P B 4
H33F H 1.0705 0.6987 0.4608 0.052 Uiso 0.369(10) 1 calc R U P B 4
C34A C 1.1686(11) 0.8346(7) 0.3857(11) 0.046(4) Uani 0.369(10) 1 d . . P B 4
H34D H 1.1491 0.8511 0.4353 0.069 Uiso 0.369(10) 1 calc R U P B 4
H34E H 1.1617 0.8715 0.3489 0.069 Uiso 0.369(10) 1 calc R U P B 4
H34F H 1.2525 0.8170 0.3906 0.069 Uiso 0.369(10) 1 calc R U P B 4
C35A C 1.1133(18) 0.7578(14) 0.2446(13) 0.045(6) Uani 0.369(10) 1 d . . P B 4
H35C H 1.2027 0.7632 0.2424 0.054 Uiso 0.369(10) 1 calc R U P B 4
H35D H 1.0928 0.7105 0.2324 0.054 Uiso 0.369(10) 1 calc R U P B 4
C36A C 1.0469(10) 0.8012(10) 0.1837(7) 0.043(4) Uani 0.369(10) 1 d . . P B 4
H36C H 1.0545 0.7837 0.1321 0.051 Uiso 0.369(10) 1 calc R U P B 4
H36D H 1.0761 0.8481 0.1872 0.051 Uiso 0.369(10) 1 calc R U P B 4
C37A C 0.822(8) 0.738(4) 0.151(6) 0.044(4) Uani 0.369(10) 1 d . . P B 4
H37D H 0.8540 0.7350 0.1017 0.066 Uiso 0.369(10) 1 calc R U P B 4
H37E H 0.7367 0.7538 0.1442 0.066 Uiso 0.369(10) 1 calc R U P B 4
H37F H 0.8261 0.6946 0.1761 0.066 Uiso 0.369(10) 1 calc R U P B 4
C38A C 0.8158(14) 0.8643(6) 0.1319(7) 0.045(4) Uani 0.369(10) 1 d . . P B 4
H38D H 0.8405 0.9097 0.1479 0.068 Uiso 0.369(10) 1 calc R U P B 4
H38E H 0.7269 0.8594 0.1329 0.068 Uiso 0.369(10) 1 calc R U P B 4
H38F H 0.8369 0.8565 0.0801 0.068 Uiso 0.369(10) 1 calc R U P B 4


_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
C1 C6 1.404(6) . ?
C1 C2 1.414(5) . ?
C1 Pt1 2.109(4) . ?
C1 Zn1 2.367(4) . ?
C2 C3 1.374(6) . ?
C2 H2 0.9500 . ?
C3 C4 1.399(6) . ?
C3 H3 0.9500 . ?
C4 C5 1.394(5) . ?
C4 C7 1.536(6) . ?
C5 C6 1.391(6) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
C7 C10A 1.20(2) . ?
C7 C9 1.470(8) . ?
C7 C8 1.572(8) . ?
C7 C10 1.591(8) . ?
C7 C8A 1.606(18) . ?
C7 C9A 1.69(2) . ?
C11 C12 1.407(5) . ?
C11 C16 1.413(6) . ?
C11 Pt1 2.106(4) . ?
C11 Zn1 2.307(4) . ?
C12 C13 1.384(5) . ?
C12 H12 0.9500 . ?
C13 C14 1.393(5) . ?
C13 H13 0.9500 . ?
C14 C15 1.396(6) . ?
C14 C17 1.519(6) . ?
C15 C16 1.387(6) . ?
C15 H15 0.9500 . ?
C16 H16 0.9500 . ?
C17 C18 1.530(6) . ?
C17 C20 1.534(6) . ?
C17 C19 1.543(6) . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 C26 1.376(5) . ?
C21 C22 1.386(5) . ?
C21 Zn1 2.046(3) . ?
C22 F1 1.365(4) . ?
C22 C23 1.378(5) . ?
C23 F2 1.353(4) . ?
C23 C24 1.371(5) . ?
C24 F3 1.347(4) . ?
C24 C25 1.378(5) . ?
C25 F4 1.352(4) . ?
C25 C26 1.376(5) . ?
C26 F5 1.355(4) . ?
C27 C28 1.363(5) . ?
C27 C32 1.381(5) . ?
C27 Zn1 2.028(3) . ?
C28 F6 1.357(4) . ?
C28 C29 1.382(5) . ?
C29 F7 1.344(4) . ?
C29 C30 1.377(6) . ?
C30 F8 1.345(4) . ?
C30 C31 1.362(6) . ?
C31 F9 1.360(4) . ?
C31 C32 1.376(5) . ?
C32 F10 1.363(4) . ?
P1 C34A 1.594(12) . ?
P1 C35 1.712(8) . ?
P1 C33 1.755(14) . ?
P1 C33A 1.90(3) . ?
P1 C34 1.978(10) . ?
P1 C35A 2.11(2) . ?
P1 Pt1 2.2799(13) . ?
P2 C36A 1.618(11) . ?
P2 C37A 1.70(9) . ?
P2 C38 1.720(7) . ?
P2 C37 1.84(5) . ?
P2 C36 1.985(14) . ?
P2 C38A 2.111(13) . ?
P2 Pt1 2.2668(13) . ?
Zn1 Pt1 2.7368(4) . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C8A H8A1 0.9800 . ?
C8A H8A2 0.9800 . ?
C8A H8A3 0.9800 . ?
C9A H9A1 0.9800 . ?
C9A H9A2 0.9800 . ?
C9A H9A3 0.9800 . ?
C10A H10D 0.9800 . ?
C10A H10E 0.9800 . ?
C10A H10F 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 C36 1.516(13) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C33A H33D 0.9800 . ?
C33A H33E 0.9800 . ?
C33A H33F 0.9800 . ?
C34A H34D 0.9800 . ?
C34A H34E 0.9800 . ?
C34A H34F 0.9800 . ?
C35A C36A 1.51(2) . ?
C35A H35C 0.9900 . ?
C35A H35D 0.9900 . ?
C36A H36C 0.9900 . ?
C36A H36D 0.9900 . ?
C37A H37D 0.9800 . ?
C37A H37E 0.9800 . ?
C37A H37F 0.9800 . ?
C38A H38D 0.9800 . ?
C38A H38E 0.9800 . ?
C38A H38F 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
C6 C1 C2 114.6(4) . . ?
C6 C1 Pt1 126.3(3) . . ?
C2 C1 Pt1 116.4(3) . . ?
C6 C1 Zn1 94.2(2) . . ?
C2 C1 Zn1 119.0(2) . . ?
Pt1 C1 Zn1 75.13(12) . . ?
C3 C2 C1 123.0(4) . . ?
C3 C2 H2 118.5 . . ?
C1 C2 H2 118.5 . . ?
C2 C3 C4 121.8(4) . . ?
C2 C3 H3 119.1 . . ?
C4 C3 H3 119.1 . . ?
C5 C4 C3 116.2(4) . . ?
C5 C4 C7 122.7(4) . . ?
C3 C4 C7 121.1(4) . . ?
C6 C5 C4 122.0(4) . . ?
C6 C5 H5 119.0 . . ?
C4 C5 H5 119.0 . . ?
C5 C6 C1 122.4(4) . . ?
C5 C6 H6 118.8 . . ?
C1 C6 H6 118.8 . . ?
C10A C7 C4 111.1(10) . . ?
C9 C7 C4 113.0(5) . . ?
C9 C7 C8 109.4(5) . . ?
C4 C7 C8 109.6(4) . . ?
C9 C7 C10 107.6(5) . . ?
C4 C7 C10 113.9(4) . . ?
C8 C7 C10 102.9(5) . . ?
C10A C7 C8A 126.4(18) . . ?
C4 C7 C8A 105.7(7) . . ?
C10A C7 C9A 118(2) . . ?
C4 C7 C9A 95.9(8) . . ?
C8A C7 C9A 95.2(12) . . ?
C12 C11 C16 115.1(4) . . ?
C12 C11 Pt1 116.3(3) . . ?
C16 C11 Pt1 125.9(3) . . ?
C12 C11 Zn1 107.6(2) . . ?
C16 C11 Zn1 103.1(2) . . ?
Pt1 C11 Zn1 76.51(13) . . ?
C13 C12 C11 122.6(4) . . ?
C13 C12 H12 118.7 . . ?
C11 C12 H12 118.7 . . ?
C12 C13 C14 121.8(4) . . ?
C12 C13 H13 119.1 . . ?
C14 C13 H13 119.1 . . ?
C13 C14 C15 116.4(4) . . ?
C13 C14 C17 123.0(4) . . ?
C15 C14 C17 120.5(4) . . ?
C16 C15 C14 122.1(4) . . ?
C16 C15 H15 119.0 . . ?
C14 C15 H15 119.0 . . ?
C15 C16 C11 122.0(4) . . ?
C15 C16 H16 119.0 . . ?
C11 C16 H16 119.0 . . ?
C14 C17 C18 112.8(3) . . ?
C14 C17 C20 109.6(4) . . ?
C18 C17 C20 107.7(4) . . ?
C14 C17 C19 109.1(3) . . ?
C18 C17 C19 107.8(4) . . ?
C20 C17 C19 109.7(3) . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C17 C19 H19A 109.5 . . ?
C17 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C17 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C17 C20 H20A 109.5 . . ?
C17 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C17 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C26 C21 C22 113.2(3) . . ?
C26 C21 Zn1 127.5(3) . . ?
C22 C21 Zn1 119.4(3) . . ?
F1 C22 C23 115.1(3) . . ?
F1 C22 C21 120.0(3) . . ?
C23 C22 C21 124.9(3) . . ?
F2 C23 C24 119.5(3) . . ?
F2 C23 C22 121.4(3) . . ?
C24 C23 C22 119.1(3) . . ?
F3 C24 C23 120.4(3) . . ?
F3 C24 C25 120.9(3) . . ?
C23 C24 C25 118.7(3) . . ?
F4 C25 C26 121.6(3) . . ?
F4 C25 C24 118.7(3) . . ?
C26 C25 C24 119.7(3) . . ?
F5 C26 C25 115.3(3) . . ?
F5 C26 C21 120.3(3) . . ?
C25 C26 C21 124.4(3) . . ?
C28 C27 C32 113.4(3) . . ?
C28 C27 Zn1 126.3(3) . . ?
C32 C27 Zn1 120.1(3) . . ?
F6 C28 C27 120.3(3) . . ?
F6 C28 C29 114.8(3) . . ?
C27 C28 C29 124.9(3) . . ?
F7 C29 C30 119.6(3) . . ?
F7 C29 C28 121.6(4) . . ?
C30 C29 C28 118.8(4) . . ?
F8 C30 C31 120.8(4) . . ?
F8 C30 C29 120.2(4) . . ?
C31 C30 C29 119.0(3) . . ?
F9 C31 C30 119.2(4) . . ?
F9 C31 C32 121.3(4) . . ?
C30 C31 C32 119.5(4) . . ?
F10 C32 C31 116.2(3) . . ?
F10 C32 C27 119.5(3) . . ?
C31 C32 C27 124.4(4) . . ?
C35 P1 C33 101.0(4) . . ?
C34A P1 C33A 113.1(11) . . ?
C35 P1 C34 101.3(4) . . ?
C33 P1 C34 101.4(5) . . ?
C34A P1 C35A 104.1(10) . . ?
C33A P1 C35A 106.6(10) . . ?
C34A P1 Pt1 116.1(5) . . ?
C35 P1 Pt1 113.6(3) . . ?
C33 P1 Pt1 119.6(5) . . ?
C33A P1 Pt1 116.6(9) . . ?
C34 P1 Pt1 117.0(2) . . ?
C35A P1 Pt1 97.7(5) . . ?
C36A P2 C37A 113(3) . . ?
C38 P2 C37 114.8(18) . . ?
C38 P2 C36 101.4(6) . . ?
C37 P2 C36 98.1(13) . . ?
C36A P2 C38A 100.8(7) . . ?
C37A P2 C38A 83(3) . . ?
C36A P2 Pt1 118.8(4) . . ?
C37A P2 Pt1 120(3) . . ?
C38 P2 Pt1 112.8(3) . . ?
C37 P2 Pt1 122.2(17) . . ?
C36 P2 Pt1 102.7(4) . . ?
C38A P2 Pt1 113.9(3) . . ?
C27 Zn1 C21 115.58(14) . . ?
C27 Zn1 C11 105.68(14) . . ?
C21 Zn1 C11 118.92(14) . . ?
C27 Zn1 C1 110.11(13) . . ?
C21 Zn1 C1 116.31(13) . . ?
C11 Zn1 C1 86.44(14) . . ?
C27 Zn1 Pt1 138.97(9) . . ?
C21 Zn1 Pt1 105.40(10) . . ?
C11 Zn1 Pt1 48.45(10) . . ?
C1 Zn1 Pt1 48.15(10) . . ?
C11 Pt1 C1 98.81(14) . . ?
C11 Pt1 P2 168.00(10) . . ?
C1 Pt1 P2 87.27(11) . . ?
C11 Pt1 P1 87.58(11) . . ?
C1 Pt1 P1 171.15(11) . . ?
P2 Pt1 P1 85.37(7) . . ?
C11 Pt1 Zn1 55.04(10) . . ?
C1 Pt1 Zn1 56.72(10) . . ?
P2 Pt1 Zn1 135.93(5) . . ?
P1 Pt1 Zn1 132.06(4) . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C7 C10 H10A 109.5 . . ?
C7 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C7 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C7 C8A H8A1 109.5 . . ?
C7 C8A H8A2 109.5 . . ?
H8A1 C8A H8A2 109.5 . . ?
C7 C8A H8A3 109.5 . . ?
H8A1 C8A H8A3 109.5 . . ?
H8A2 C8A H8A3 109.5 . . ?
C7 C9A H9A1 109.5 . . ?
C7 C9A H9A2 109.5 . . ?
H9A1 C9A H9A2 109.5 . . ?
C7 C9A H9A3 109.5 . . ?
H9A1 C9A H9A3 109.5 . . ?
H9A2 C9A H9A3 109.5 . . ?
C7 C10A H10D 109.5 . . ?
C7 C10A H10E 109.5 . . ?
H10D C10A H10E 109.5 . . ?
C7 C10A H10F 109.5 . . ?
H10D C10A H10F 109.5 . . ?
H10E C10A H10F 109.5 . . ?
P1 C33 H33A 109.5 . . ?
P1 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
P1 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
P1 C34 H34A 109.5 . . ?
P1 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
P1 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C36 C35 P1 104.0(7) . . ?
C36 C35 H35A 110.9 . . ?
P1 C35 H35A 111.0 . . ?
C36 C35 H35B 111.0 . . ?
P1 C35 H35B 111.0 . . ?
H35A C35 H35B 109.0 . . ?
C35 C36 P2 113.7(9) . . ?
C35 C36 H36A 108.8 . . ?
P2 C36 H36A 108.8 . . ?
C35 C36 H36B 108.8 . . ?
P2 C36 H36B 108.8 . . ?
H36A C36 H36B 107.7 . . ?
P2 C37 H37A 109.5 . . ?
P2 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
P2 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
P2 C38 H38A 109.5 . . ?
P2 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
P2 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
P1 C33A H33D 109.5 . . ?
P1 C33A H33E 109.5 . . ?
H33D C33A H33E 109.5 . . ?
P1 C33A H33F 109.5 . . ?
H33D C33A H33F 109.5 . . ?
H33E C33A H33F 109.5 . . ?
P1 C34A H34D 109.5 . . ?
P1 C34A H34E 109.5 . . ?
H34D C34A H34E 109.5 . . ?
P1 C34A H34F 109.5 . . ?
H34D C34A H34F 109.5 . . ?
H34E C34A H34F 109.5 . . ?
C36A C35A P1 116.1(13) . . ?
C36A C35A H35C 108.3 . . ?
P1 C35A H35C 108.3 . . ?
C36A C35A H35D 108.3 . . ?
P1 C35A H35D 108.3 . . ?
H35C C35A H35D 107.4 . . ?
C35A C36A P2 99.6(12) . . ?
C35A C36A H36C 111.9 . . ?
P2 C36A H36C 111.9 . . ?
C35A C36A H36D 111.9 . . ?
P2 C36A H36D 111.9 . . ?
H36C C36A H36D 109.6 . . ?
P2 C37A H37D 109.5 . . ?
P2 C37A H37E 109.5 . . ?
H37D C37A H37E 109.5 . . ?
P2 C37A H37F 109.5 . . ?
H37D C37A H37F 109.5 . . ?
H37E C37A H37F 109.5 . . ?
P2 C38A H38D 109.5 . . ?
P2 C38A H38E 109.5 . . ?
H38D C38A H38E 109.5 . . ?
P2 C38A H38F 109.5 . . ?
H38D C38A H38F 109.5 . . ?
H38E C38A H38F 109.5 . . ?

_refine_diff_density_max         0.823
_refine_diff_density_min         -1.459
_refine_diff_density_rms         0.088



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

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1469637'
_audit_update_record             
;
2016-05-01 deposited with the CCDC.
2016-05-05 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ALMX88
_chemical_melting_point          ?
_chemical_formula_moiety         'C44 H34 F10 N2 Pt Zn, C7 H8'
_chemical_formula_sum            'C51 H42 F10 N2 Pt Zn'
_chemical_formula_weight         1133.32

# start Validation Reply Form
_vrf_PLAT094_shelx               
;
PROBLEM: Ratio of Maximum / Minimum Residual Density ....       4.08 Report
RESPONSE: The crystal diffracted broadly, leading to a noisy Fourier 
difference map.
;
_vrf_PLAT971_shelx               
;
PROBLEM: Check Calcd Residual Density  1.74A From      C9       2.76 eA-3  
RESPONSE: The crystal diffracted broadly, leading to a noisy Fourier 
difference map.
;
# end Validation Reply Form

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 '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                   12.9950(13)
_cell_length_b                   16.7483(16)
_cell_length_c                   21.185(2)
_cell_angle_alpha                90
_cell_angle_beta                 106.136(2)
_cell_angle_gamma                90
_cell_volume                     4429.1(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9519
_cell_measurement_theta_min      2.46
_cell_measurement_theta_max      25.32

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.700
_exptl_crystal_F_000             2240
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.040
_exptl_absorpt_coefficient_mu    3.777
_shelx_estimated_absorpt_T_min   0.660
_shelx_estimated_absorpt_T_max   0.864
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.2655
_exptl_absorpt_correction_T_max  0.3529
_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                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'Bruker APEX-I CCD'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean 8.366
_diffrn_reflns_number            90981
_diffrn_reflns_av_unetI/netI     0.0167
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         1.575
_diffrn_reflns_theta_max         25.373
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             8095
_reflns_number_gt                7336
_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 v. 2014.11-0'
_computing_cell_refinement       'Bruker APEX2 v. 2014.11-0'
_computing_data_reduction        'Bruker APEX2 v. 2014.11-0'
_computing_structure_solution    'SHELXT-2014/4 (Sheldrick 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick 2014)'
_computing_molecular_graphics    ORTEP-32
_computing_publication_material  WinGX

_refine_special_details          
;
All hydrogen atoms were included at their geometrically-expected positions and 
refined using a riding model.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0354P)²+10.8891P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         8095
_refine_ls_number_parameters     593
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0355
_refine_ls_R_factor_gt           0.0312
_refine_ls_wR_factor_ref         0.0747
_refine_ls_wR_factor_gt          0.0722
_refine_ls_goodness_of_fit_ref   1.156
_refine_ls_restrained_S_all      1.156
_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
C1 C 0.4539(3) 0.4670(2) 0.76949(19) 0.0217(8) Uani 1 1 d . . . . .
H1 H 0.4908 0.4786 0.7377 0.026 Uiso 1 1 calc R U . . .
C2 C 0.4751(3) 0.3946(2) 0.80378(19) 0.0227(8) Uani 1 1 d . . . . .
H2 H 0.5247 0.3577 0.7948 0.027 Uiso 1 1 calc R U . . .
C3 C 0.4236(3) 0.3775(2) 0.8504(2) 0.0247(9) Uani 1 1 d . . . . .
H3 H 0.4379 0.3289 0.8743 0.030 Uiso 1 1 calc R U . . .
C4 C 0.3494(3) 0.4322(2) 0.86265(18) 0.0218(8) Uani 1 1 d . . . . .
C5 C 0.2892(3) 0.4190(2) 0.90914(19) 0.0254(9) Uani 1 1 d . . . . .
H5 H 0.3017 0.3720 0.9353 0.031 Uiso 1 1 calc R U . . .
C6 C 0.2155(3) 0.4718(2) 0.91640(18) 0.0244(8) Uani 1 1 d . . . . .
H6 H 0.1768 0.4614 0.9475 0.029 Uiso 1 1 calc R U . . .
C7 C 0.1940(3) 0.5437(2) 0.87798(18) 0.0233(8) Uani 1 1 d . . . . .
C8 C 0.1178(3) 0.5974(3) 0.88206(17) 0.0235(8) Uani 1 1 d . . . . .
H8 H 0.0777 0.5889 0.9127 0.028 Uiso 1 1 calc R U . . .
C9 C 0.0977(3) 0.6652(2) 0.84164(19) 0.0253(8) Uani 1 1 d . . . . .
H9 H 0.0434 0.7023 0.8437 0.030 Uiso 1 1 calc R U . . .
C10 C 0.1598(3) 0.6764(2) 0.79835(18) 0.0207(8) Uani 1 1 d . . . . .
H10 H 0.1461 0.7216 0.7702 0.025 Uiso 1 1 calc R U . . .
C11 C 0.2538(3) 0.5597(2) 0.83346(17) 0.0182(8) Uani 1 1 d . . . . .
C12 C 0.3318(3) 0.5028(2) 0.82555(17) 0.0194(8) Uani 1 1 d . . . . .
C13 C 0.4487(3) 0.6268(2) 0.68081(18) 0.0169(7) Uani 1 1 d . . . . .
C14 C 0.4362(3) 0.5817(2) 0.62392(19) 0.0250(9) Uani 1 1 d . . . . .
H14 H 0.3716 0.5527 0.6069 0.030 Uiso 1 1 calc R U . . .
C15 C 0.5147(3) 0.5779(2) 0.5915(2) 0.0249(9) Uani 1 1 d . . . . .
H15 H 0.5018 0.5470 0.5524 0.030 Uiso 1 1 calc R U . . .
C16 C 0.6122(3) 0.6178(2) 0.61405(19) 0.0198(8) Uani 1 1 d . . . . .
C17 C 0.6263(3) 0.6615(2) 0.67190(19) 0.0230(8) Uani 1 1 d . . . . .
H17 H 0.6922 0.6886 0.6899 0.028 Uiso 1 1 calc R U . . .
C18 C 0.5468(3) 0.6663(2) 0.70383(19) 0.0221(8) Uani 1 1 d . . . . .
H18 H 0.5593 0.6976 0.7427 0.026 Uiso 1 1 calc R U . . .
C19 C 0.7011(3) 0.6160(2) 0.57911(19) 0.0222(8) Uani 1 1 d . . . . .
C20 C 0.6669(3) 0.5708(2) 0.51360(19) 0.0258(9) Uani 1 1 d . . . . .
H20A H 0.6516 0.5151 0.5217 0.039 Uiso 1 1 calc R U . . .
H20B H 0.7248 0.5729 0.4923 0.039 Uiso 1 1 calc R U . . .
H20C H 0.6024 0.5957 0.4850 0.039 Uiso 1 1 calc R U . . .
C21 C 0.7271(3) 0.7021(2) 0.5634(2) 0.0286(9) Uani 1 1 d . . . . .
H21A H 0.6619 0.7281 0.5368 0.043 Uiso 1 1 calc R U . . .
H21B H 0.7811 0.7013 0.5390 0.043 Uiso 1 1 calc R U . . .
H21C H 0.7550 0.7318 0.6045 0.043 Uiso 1 1 calc R U . . .
C22 C 0.8018(3) 0.5767(3) 0.6235(2) 0.0298(9) Uani 1 1 d . . . . .
H22A H 0.8263 0.6070 0.6645 0.045 Uiso 1 1 calc R U . . .
H22B H 0.8583 0.5762 0.6010 0.045 Uiso 1 1 calc R U . . .
H22C H 0.7854 0.5218 0.6333 0.045 Uiso 1 1 calc R U . . .
C23 C 0.3054(3) 0.7430(2) 0.69864(18) 0.0185(7) Uani 1 1 d . . . . .
C24 C 0.2904(3) 0.7674(2) 0.63318(18) 0.0184(7) Uani 1 1 d . . . . .
H24 H 0.3015 0.7300 0.6020 0.022 Uiso 1 1 calc R U . . .
C25 C 0.2599(3) 0.8444(2) 0.61313(18) 0.0193(8) Uani 1 1 d . . . . .
H25 H 0.2499 0.8581 0.5683 0.023 Uiso 1 1 calc R U . . .
C26 C 0.2433(3) 0.9029(2) 0.65627(18) 0.0195(8) Uani 1 1 d . . . . .
C27 C 0.2635(3) 0.8808(2) 0.72147(19) 0.0196(8) Uani 1 1 d . . . . .
H27 H 0.2564 0.9193 0.7529 0.023 Uiso 1 1 calc R U . . .
C28 C 0.2944(3) 0.8029(2) 0.74203(18) 0.0205(8) Uani 1 1 d . . . . .
H28 H 0.3084 0.7903 0.7874 0.025 Uiso 1 1 calc R U . . .
C29 C 0.2057(3) 0.9869(2) 0.63120(19) 0.0218(8) Uani 1 1 d . . . . .
C30 C 0.1000(3) 0.9799(2) 0.5759(2) 0.0274(9) Uani 1 1 d . . . . .
H30A H 0.1120 0.9482 0.5397 0.041 Uiso 1 1 calc R U . . .
H30B H 0.0751 1.0334 0.5598 0.041 Uiso 1 1 calc R U . . .
H30C H 0.0458 0.9538 0.5929 0.041 Uiso 1 1 calc R U . . .
C31 C 0.1865(4) 1.0406(2) 0.6853(2) 0.0297(9) Uani 1 1 d . . . . .
H31A H 0.1339 1.0155 0.7043 0.045 Uiso 1 1 calc R U . . .
H31B H 0.1594 1.0925 0.6665 0.045 Uiso 1 1 calc R U . . .
H31C H 0.2540 1.0482 0.7196 0.045 Uiso 1 1 calc R U . . .
C32 C 0.2898(3) 1.0261(3) 0.6032(2) 0.0301(9) Uani 1 1 d . . . . .
H32A H 0.3550 1.0362 0.6388 0.045 Uiso 1 1 calc R U . . .
H32B H 0.2618 1.0767 0.5821 0.045 Uiso 1 1 calc R U . . .
H32C H 0.3065 0.9905 0.5707 0.045 Uiso 1 1 calc R U . . .
C33 C 0.1571(3) 0.4654(2) 0.68305(18) 0.0218(8) Uani 1 1 d . . . . .
C34 C 0.2136(3) 0.3989(2) 0.67383(18) 0.0216(8) Uani 1 1 d . . . . .
C35 C 0.2014(3) 0.3248(2) 0.69971(19) 0.0246(8) Uani 1 1 d . . . . .
C36 C 0.1292(3) 0.3165(2) 0.73634(19) 0.0264(9) Uani 1 1 d . . . . .
C37 C 0.0707(3) 0.3812(3) 0.7465(2) 0.0262(9) Uani 1 1 d . . . . .
C38 C 0.0857(3) 0.4536(2) 0.71932(19) 0.0233(8) Uani 1 1 d . . . . .
C39 C 0.0967(3) 0.6422(2) 0.57796(18) 0.0195(8) Uani 1 1 d . . . . .
C40 C 0.0978(3) 0.6290(2) 0.5140(2) 0.0219(8) Uani 1 1 d . . . . .
C41 C 0.0445(3) 0.6765(2) 0.46219(18) 0.0243(8) Uani 1 1 d . . . . .
C42 C -0.0130(3) 0.7407(2) 0.47425(19) 0.0238(8) Uani 1 1 d . . . . .
C43 C -0.0170(3) 0.7567(2) 0.5374(2) 0.0223(8) Uani 1 1 d . . . . .
C44 C 0.0369(3) 0.7068(2) 0.58712(18) 0.0224(8) Uani 1 1 d . . . . .
C45 C 0.4002(4) 0.7746(3) 0.9293(2) 0.0328(10) Uani 1 1 d . . . . .
C46 C 0.4781(4) 0.7583(3) 0.8976(2) 0.0339(10) Uani 1 1 d . . . . .
H46 H 0.4977 0.7985 0.8715 0.041 Uiso 1 1 calc R U . . .
C47 C 0.5275(4) 0.6845(3) 0.9034(2) 0.0380(11) Uani 1 1 d . . . . .
H47 H 0.5801 0.6743 0.8810 0.046 Uiso 1 1 calc R U . . .
C48 C 0.5006(4) 0.6258(3) 0.9416(2) 0.0365(11) Uani 1 1 d . . . . .
H48 H 0.5343 0.5750 0.9455 0.044 Uiso 1 1 calc R U . . .
C49 C 0.4241(4) 0.6416(3) 0.9741(2) 0.0374(11) Uani 1 1 d . . . . .
H49 H 0.4057 0.6017 1.0010 0.045 Uiso 1 1 calc R U . . .
C50 C 0.3745(4) 0.7150(3) 0.9677(2) 0.0371(11) Uani 1 1 d . . . . .
H50 H 0.3218 0.7250 0.9901 0.045 Uiso 1 1 calc R U . . .
C51 C 0.3434(4) 0.8539(3) 0.9216(3) 0.0445(12) Uani 1 1 d . . . . .
H51A H 0.2715 0.8481 0.8912 0.067 Uiso 1 1 calc R U . . .
H51B H 0.3841 0.8932 0.9040 0.067 Uiso 1 1 calc R U . . .
H51C H 0.3375 0.8720 0.9644 0.067 Uiso 1 1 calc R U . . .
N1 N 0.3845(2) 0.51980(18) 0.77967(15) 0.0187(6) Uani 1 1 d . . . . .
N2 N 0.2379(2) 0.62625(17) 0.79480(15) 0.0170(6) Uani 1 1 d . . . . .
F1 F 0.28604(19) 0.40430(15) 0.63900(11) 0.0305(5) Uani 1 1 d . . . . .
F2 F 0.25734(19) 0.26088(14) 0.68935(12) 0.0332(6) Uani 1 1 d . . . . .
F3 F 0.1146(2) 0.24481(15) 0.76118(13) 0.0374(6) Uani 1 1 d . . . . .
F4 F -0.0003(2) 0.37281(15) 0.78142(13) 0.0376(6) Uani 1 1 d . . . . .
F5 F 0.02680(18) 0.51633(14) 0.73034(12) 0.0299(5) Uani 1 1 d . . . . .
F6 F 0.15408(19) 0.56632(14) 0.50041(11) 0.0307(5) Uani 1 1 d . . . . .
F7 F 0.0486(2) 0.66129(16) 0.40043(11) 0.0343(6) Uani 1 1 d . . . . .
F8 F -0.06666(19) 0.78840(14) 0.42415(12) 0.0331(6) Uani 1 1 d . . . . .
F9 F -0.07332(19) 0.82029(14) 0.54819(12) 0.0313(5) Uani 1 1 d . . . . .
F10 F 0.0316(2) 0.72464(15) 0.64865(11) 0.0320(5) Uani 1 1 d . . . . .
Zn1 Zn 0.17811(3) 0.57381(3) 0.65054(2) 0.01975(10) Uani 1 1 d . . . . .
Pt1 Pt 0.34274(2) 0.63201(2) 0.73330(2) 0.01613(6) 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
C1 N1 1.322(5) . ?
C1 C2 1.401(5) . ?
C1 H1 0.9500 . ?
C2 C3 1.368(6) . ?
C2 H2 0.9500 . ?
C3 C4 1.405(6) . ?
C3 H3 0.9500 . ?
C4 C12 1.404(5) . ?
C4 C5 1.435(6) . ?
C5 C6 1.343(6) . ?
C5 H5 0.9500 . ?
C6 C7 1.437(5) . ?
C6 H6 0.9500 . ?
C7 C8 1.357(6) . ?
C7 C11 1.404(5) . ?
C8 C9 1.403(6) . ?
C8 H8 0.9500 . ?
C9 C10 1.393(5) . ?
C9 H9 0.9500 . ?
C10 N2 1.335(5) . ?
C10 H10 0.9500 . ?
C11 N2 1.365(5) . ?
C11 C12 1.434(5) . ?
C12 N1 1.366(5) . ?
C13 C14 1.393(5) . ?
C13 C18 1.399(5) . ?
C13 Pt1 1.997(4) . ?
C14 C15 1.381(5) . ?
C14 H14 0.9500 . ?
C15 C16 1.395(6) . ?
C15 H15 0.9500 . ?
C16 C17 1.395(5) . ?
C16 C19 1.535(5) . ?
C17 C18 1.386(5) . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C22 1.532(6) . ?
C19 C20 1.534(5) . ?
C19 C21 1.540(5) . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 C28 1.395(5) . ?
C23 C24 1.406(5) . ?
C23 Pt1 2.008(4) . ?
C24 C25 1.382(5) . ?
C24 H24 0.9500 . ?
C25 C26 1.397(5) . ?
C25 H25 0.9500 . ?
C26 C27 1.383(5) . ?
C26 C29 1.534(5) . ?
C27 C28 1.398(5) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 C32 1.529(6) . ?
C29 C31 1.531(5) . ?
C29 C30 1.542(5) . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 C38 1.373(6) . ?
C33 C34 1.378(6) . ?
C33 Zn1 1.988(4) . ?
C34 F1 1.351(5) . ?
C34 C35 1.383(6) . ?
C35 F2 1.346(5) . ?
C35 C36 1.380(6) . ?
C36 F3 1.345(5) . ?
C36 C37 1.375(6) . ?
C37 F4 1.341(5) . ?
C37 C38 1.379(6) . ?
C38 F5 1.358(5) . ?
C39 C40 1.376(6) . ?
C39 C44 1.377(5) . ?
C39 Zn1 1.972(4) . ?
C40 F6 1.356(4) . ?
C40 C41 1.376(6) . ?
C41 F7 1.348(4) . ?
C41 C42 1.374(6) . ?
C42 F8 1.356(4) . ?
C42 C43 1.378(6) . ?
C43 F9 1.347(4) . ?
C43 C44 1.375(5) . ?
C44 F10 1.358(4) . ?
C45 C50 1.385(7) . ?
C45 C46 1.389(6) . ?
C45 C51 1.506(6) . ?
C46 C47 1.382(7) . ?
C46 H46 0.9500 . ?
C47 C48 1.379(7) . ?
C47 H47 0.9500 . ?
C48 C49 1.384(7) . ?
C48 H48 0.9500 . ?
C49 C50 1.377(7) . ?
C49 H49 0.9500 . ?
C50 H50 0.9500 . ?
C51 H51A 0.9800 . ?
C51 H51B 0.9800 . ?
C51 H51C 0.9800 . ?
N1 Pt1 2.120(3) . ?
N2 Pt1 2.133(3) . ?
Zn1 Pt1 2.5526(5) . ?

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 C1 C2 122.6(4) . . ?
N1 C1 H1 118.7 . . ?
C2 C1 H1 118.7 . . ?
C3 C2 C1 119.4(4) . . ?
C3 C2 H2 120.3 . . ?
C1 C2 H2 120.3 . . ?
C2 C3 C4 119.7(4) . . ?
C2 C3 H3 120.1 . . ?
C4 C3 H3 120.1 . . ?
C12 C4 C3 117.3(4) . . ?
C12 C4 C5 118.6(4) . . ?
C3 C4 C5 124.0(4) . . ?
C6 C5 C4 121.3(4) . . ?
C6 C5 H5 119.4 . . ?
C4 C5 H5 119.4 . . ?
C5 C6 C7 121.3(4) . . ?
C5 C6 H6 119.3 . . ?
C7 C6 H6 119.3 . . ?
C8 C7 C11 117.8(4) . . ?
C8 C7 C6 123.3(4) . . ?
C11 C7 C6 118.9(4) . . ?
C7 C8 C9 120.9(4) . . ?
C7 C8 H8 119.6 . . ?
C9 C8 H8 119.6 . . ?
C10 C9 C8 117.8(4) . . ?
C10 C9 H9 121.1 . . ?
C8 C9 H9 121.1 . . ?
N2 C10 C9 122.8(4) . . ?
N2 C10 H10 118.6 . . ?
C9 C10 H10 118.6 . . ?
N2 C11 C7 122.6(3) . . ?
N2 C11 C12 117.8(3) . . ?
C7 C11 C12 119.6(3) . . ?
N1 C12 C4 122.5(3) . . ?
N1 C12 C11 117.1(3) . . ?
C4 C12 C11 120.3(3) . . ?
C14 C13 C18 115.7(3) . . ?
C14 C13 Pt1 125.0(3) . . ?
C18 C13 Pt1 119.2(3) . . ?
C15 C14 C13 122.1(4) . . ?
C15 C14 H14 118.9 . . ?
C13 C14 H14 118.9 . . ?
C14 C15 C16 122.2(4) . . ?
C14 C15 H15 118.9 . . ?
C16 C15 H15 118.9 . . ?
C15 C16 C17 116.0(3) . . ?
C15 C16 C19 124.0(3) . . ?
C17 C16 C19 120.1(3) . . ?
C18 C17 C16 121.7(4) . . ?
C18 C17 H17 119.1 . . ?
C16 C17 H17 119.1 . . ?
C17 C18 C13 122.2(4) . . ?
C17 C18 H18 118.9 . . ?
C13 C18 H18 118.9 . . ?
C22 C19 C20 109.1(3) . . ?
C22 C19 C16 110.0(3) . . ?
C20 C19 C16 112.3(3) . . ?
C22 C19 C21 109.4(3) . . ?
C20 C19 C21 107.0(3) . . ?
C16 C19 C21 109.0(3) . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C19 C22 H22A 109.5 . . ?
C19 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C19 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C28 C23 C24 115.4(3) . . ?
C28 C23 Pt1 118.9(3) . . ?
C24 C23 Pt1 125.6(3) . . ?
C25 C24 C23 121.6(3) . . ?
C25 C24 H24 119.2 . . ?
C23 C24 H24 119.2 . . ?
C24 C25 C26 122.5(3) . . ?
C24 C25 H25 118.7 . . ?
C26 C25 H25 118.7 . . ?
C27 C26 C25 116.4(3) . . ?
C27 C26 C29 123.1(3) . . ?
C25 C26 C29 120.6(3) . . ?
C26 C27 C28 121.3(4) . . ?
C26 C27 H27 119.3 . . ?
C28 C27 H27 119.3 . . ?
C23 C28 C27 122.6(3) . . ?
C23 C28 H28 118.7 . . ?
C27 C28 H28 118.7 . . ?
C32 C29 C31 108.7(3) . . ?
C32 C29 C26 109.6(3) . . ?
C31 C29 C26 112.5(3) . . ?
C32 C29 C30 108.6(3) . . ?
C31 C29 C30 108.5(3) . . ?
C26 C29 C30 109.0(3) . . ?
C29 C30 H30A 109.5 . . ?
C29 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C29 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C29 C31 H31A 109.5 . . ?
C29 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C29 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C29 C32 H32A 109.5 . . ?
C29 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C29 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C38 C33 C34 115.6(4) . . ?
C38 C33 Zn1 120.3(3) . . ?
C34 C33 Zn1 124.0(3) . . ?
F1 C34 C33 120.2(3) . . ?
F1 C34 C35 116.8(4) . . ?
C33 C34 C35 123.0(4) . . ?
F2 C35 C36 119.5(3) . . ?
F2 C35 C34 121.5(4) . . ?
C36 C35 C34 119.0(4) . . ?
F3 C36 C37 119.8(4) . . ?
F3 C36 C35 120.1(4) . . ?
C37 C36 C35 120.0(4) . . ?
F4 C37 C36 120.0(4) . . ?
F4 C37 C38 121.4(4) . . ?
C36 C37 C38 118.6(4) . . ?
F5 C38 C33 119.0(3) . . ?
F5 C38 C37 117.2(4) . . ?
C33 C38 C37 123.8(4) . . ?
C40 C39 C44 115.1(3) . . ?
C40 C39 Zn1 121.7(3) . . ?
C44 C39 Zn1 123.2(3) . . ?
F6 C40 C41 117.3(3) . . ?
F6 C40 C39 119.1(3) . . ?
C41 C40 C39 123.5(4) . . ?
F7 C41 C42 119.9(3) . . ?
F7 C41 C40 121.2(4) . . ?
C42 C41 C40 118.9(4) . . ?
F8 C42 C41 120.2(4) . . ?
F8 C42 C43 119.7(4) . . ?
C41 C42 C43 120.1(3) . . ?
F9 C43 C44 122.4(4) . . ?
F9 C43 C42 119.2(3) . . ?
C44 C43 C42 118.5(4) . . ?
F10 C44 C43 116.8(3) . . ?
F10 C44 C39 119.3(3) . . ?
C43 C44 C39 123.9(4) . . ?
C50 C45 C46 118.1(4) . . ?
C50 C45 C51 120.5(4) . . ?
C46 C45 C51 121.4(4) . . ?
C47 C46 C45 121.0(4) . . ?
C47 C46 H46 119.5 . . ?
C45 C46 H46 119.5 . . ?
C48 C47 C46 120.2(5) . . ?
C48 C47 H47 119.9 . . ?
C46 C47 H47 119.9 . . ?
C47 C48 C49 119.3(4) . . ?
C47 C48 H48 120.3 . . ?
C49 C48 H48 120.3 . . ?
C50 C49 C48 120.2(5) . . ?
C50 C49 H49 119.9 . . ?
C48 C49 H49 119.9 . . ?
C49 C50 C45 121.2(4) . . ?
C49 C50 H50 119.4 . . ?
C45 C50 H50 119.4 . . ?
C45 C51 H51A 109.5 . . ?
C45 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
C45 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
C1 N1 C12 118.5(3) . . ?
C1 N1 Pt1 128.0(3) . . ?
C12 N1 Pt1 113.5(2) . . ?
C10 N2 C11 118.1(3) . . ?
C10 N2 Pt1 129.1(3) . . ?
C11 N2 Pt1 112.8(2) . . ?
C39 Zn1 C33 134.83(15) . . ?
C39 Zn1 Pt1 118.64(11) . . ?
C33 Zn1 Pt1 106.29(11) . . ?
C13 Pt1 C23 88.35(14) . . ?
C13 Pt1 N1 95.24(13) . . ?
C23 Pt1 N1 174.13(13) . . ?
C13 Pt1 N2 173.75(12) . . ?
C23 Pt1 N2 97.74(13) . . ?
N1 Pt1 N2 78.57(11) . . ?
C13 Pt1 Zn1 100.16(11) . . ?
C23 Pt1 Zn1 91.77(10) . . ?
N1 Pt1 Zn1 92.16(8) . . ?
N2 Pt1 Zn1 81.17(8) . . ?

_refine_diff_density_max         2.648
_refine_diff_density_min         -0.649
_refine_diff_density_rms         0.119



