#------------------------------------------------------------------------------
#$Date: 2022-08-06 01:06:03 +0300 (Sat, 06 Aug 2022) $
#$Revision: 277082 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/74/1567428.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1567428
loop_
_publ_author_name
'Szalóki, György'
'Babinot, Julien'
'Martin-Diaconescu, Vlad'
'Mallet-Ladeira, Sonia'
'García-Rodeja, Yago'
'Karinne, Miqueu'
'Bourissou, Didier'
_publ_section_title
;
   Ligand-enabled oxidation of gold(I) complexes with
 o-quinones 
;
_journal_name_full               'Chemical Science'
_journal_paper_doi               10.1039/D2SC03724F
_journal_year                    2022
_chemical_formula_moiety         'C34 H40 Au Cl4 N O2 P, F6 Sb, 0.5 (C H2 Cl2)'
_chemical_formula_sum            'C34.5 H41 Au Cl5 F6 N O2 P Sb'
_chemical_formula_weight         1142.62
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2022-06-20 deposited with the CCDC.	2022-08-05 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 95.446(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   34.1585(18)
_cell_length_b                   9.9683(6)
_cell_length_c                   22.6313(13)
_cell_measurement_reflns_used    9754
_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      28.33
_cell_measurement_theta_min      2.92
_cell_volume                     7671.2(8)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX3'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    'SHELXT (Sheldrick 2015)'
_diffrn_ambient_temperature      193(2)
_diffrn_detector_area_resol_mean 10.4167
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker D8-Venture CMOS detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0368
_diffrn_reflns_av_unetI/netI     0.0181
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       45
_diffrn_reflns_limit_h_min       -40
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            113874
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.347
_diffrn_reflns_theta_min         2.921
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    4.978
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.6369
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker-AXS)'
_exptl_crystal_colour            grey
_exptl_crystal_density_diffrn    1.979
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             4440
_exptl_crystal_size_max          0.250
_exptl_crystal_size_mid          0.250
_exptl_crystal_size_min          0.200
_refine_diff_density_max         0.668
_refine_diff_density_min         -0.823
_refine_diff_density_rms         0.090
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     467
_refine_ls_number_reflns         9564
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.088
_refine_ls_R_factor_all          0.0275
_refine_ls_R_factor_gt           0.0211
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0144P)²+18.4739P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0398
_refine_ls_wR_factor_ref         0.0414
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8558
_reflns_number_total             9564
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2sc03724f2.cif
_cod_data_source_block           5a
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C34.50 H41 Au Cl5 F6 N O2 P Sb'
_cod_database_code               1567428
_shelx_shelxl_version_number     2017/1
_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. 
;
_shelx_estimated_absorpt_t_min   0.369
_shelx_estimated_absorpt_t_max   0.436
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
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
Au1 Au 0.38535(2) 0.55811(2) 0.61960(2) 0.01555(3) Uani 1 1 d . . . . .
Cl1 Cl 0.50899(2) 0.75482(7) 0.57100(3) 0.02956(14) Uani 1 1 d . . . . .
Cl2 Cl 0.57467(2) 0.53432(8) 0.56055(3) 0.03903(18) Uani 1 1 d . . . . .
Cl3 Cl 0.55274(2) 0.23126(8) 0.57307(3) 0.04114(18) Uani 1 1 d . . . . .
Cl4 Cl 0.46659(2) 0.15082(7) 0.59523(4) 0.04124(18) Uani 1 1 d . . . . .
P1 P 0.35376(2) 0.75393(6) 0.63624(2) 0.01227(11) Uani 1 1 d . . . . .
O1 O 0.43401(5) 0.64476(16) 0.59931(8) 0.0217(4) Uani 1 1 d . . . . .
O2 O 0.41432(5) 0.38382(17) 0.60740(8) 0.0239(4) Uani 1 1 d . . . . .
N1 N 0.33544(6) 0.45853(19) 0.64040(9) 0.0201(4) Uani 1 1 d . . . . .
C1 C 0.30841(6) 0.6857(2) 0.65880(9) 0.0142(4) Uani 1 1 d . . . . .
C2 C 0.30372(6) 0.5472(2) 0.65833(10) 0.0162(4) Uani 1 1 d . . . . .
C3 C 0.26940(7) 0.4888(3) 0.67406(11) 0.0209(5) Uani 1 1 d . . . . .
H3 H 0.266574 0.393944 0.673931 0.025 Uiso 1 1 calc R U . . .
C4 C 0.23932(7) 0.5700(3) 0.68993(10) 0.0212(5) Uani 1 1 d . . . . .
H4 H 0.215741 0.530509 0.700848 0.025 Uiso 1 1 calc R U . . .
C5 C 0.24318(7) 0.7078(3) 0.69010(10) 0.0204(5) Uani 1 1 d . . . . .
H5 H 0.222191 0.762726 0.700604 0.024 Uiso 1 1 calc R U . . .
C6 C 0.27763(6) 0.7661(2) 0.67496(10) 0.0172(5) Uani 1 1 d . . . . .
H6 H 0.280372 0.860907 0.675558 0.021 Uiso 1 1 calc R U . . .
C7 C 0.34809(8) 0.3639(3) 0.69056(15) 0.0374(7) Uani 1 1 d . . . . .
H7A H 0.356054 0.415703 0.726518 0.056 Uiso 1 1 calc R U . . .
H7B H 0.370307 0.309757 0.679938 0.056 Uiso 1 1 calc R U . . .
H7C H 0.326119 0.304880 0.697848 0.056 Uiso 1 1 calc R U . . .
C8 C 0.32098(8) 0.3798(3) 0.58592(14) 0.0355(7) Uani 1 1 d . . . . .
H8A H 0.299295 0.321266 0.595070 0.053 Uiso 1 1 calc R U . . .
H8B H 0.342495 0.325005 0.573250 0.053 Uiso 1 1 calc R U . . .
H8C H 0.311724 0.441697 0.553981 0.053 Uiso 1 1 calc R U . . .
C9 C 0.38069(6) 0.8414(2) 0.70027(10) 0.0155(4) Uani 1 1 d . . . . .
C10 C 0.41831(7) 0.9066(2) 0.68070(10) 0.0178(5) Uani 1 1 d . . . . .
H10A H 0.434251 0.838191 0.662186 0.021 Uiso 1 1 calc R U . . .
H10B H 0.411197 0.977439 0.650952 0.021 Uiso 1 1 calc R U . . .
C11 C 0.44229(7) 0.9677(3) 0.73489(11) 0.0233(5) Uani 1 1 d . . . . .
H11 H 0.466915 1.008278 0.722173 0.028 Uiso 1 1 calc R U . . .
C12 C 0.41794(8) 1.0764(3) 0.76120(12) 0.0298(6) Uani 1 1 d . . . . .
H12A H 0.410946 1.146569 0.731071 0.036 Uiso 1 1 calc R U . . .
H12B H 0.433429 1.118828 0.795406 0.036 Uiso 1 1 calc R U . . .
C13 C 0.38052(8) 1.0142(3) 0.78144(12) 0.0309(6) Uani 1 1 d . . . . .
H13 H 0.364669 1.085704 0.799032 0.037 Uiso 1 1 calc R U . . .
C14 C 0.39151(9) 0.9065(3) 0.82833(12) 0.0376(7) Uani 1 1 d . . . . .
H14A H 0.406978 0.947164 0.862992 0.045 Uiso 1 1 calc R U . . .
H14B H 0.367359 0.866954 0.842002 0.045 Uiso 1 1 calc R U . . .
C15 C 0.41558(8) 0.7979(3) 0.80158(11) 0.0300(6) Uani 1 1 d . . . . .
H15 H 0.422741 0.727512 0.832212 0.036 Uiso 1 1 calc R U . . .
C16 C 0.39156(7) 0.7332(3) 0.74802(10) 0.0229(5) Uani 1 1 d . . . . .
H16A H 0.367312 0.692601 0.760857 0.027 Uiso 1 1 calc R U . . .
H16B H 0.407176 0.661412 0.731232 0.027 Uiso 1 1 calc R U . . .
C17 C 0.35571(7) 0.9494(3) 0.72818(11) 0.0243(5) Uani 1 1 d . . . . .
H17A H 0.331788 0.907976 0.741738 0.029 Uiso 1 1 calc R U . . .
H17B H 0.347455 1.018859 0.698277 0.029 Uiso 1 1 calc R U . . .
C18 C 0.45308(8) 0.8582(3) 0.78112(12) 0.0307(6) Uani 1 1 d . . . . .
H18A H 0.468641 0.787247 0.763573 0.037 Uiso 1 1 calc R U . . .
H18B H 0.469289 0.897002 0.815500 0.037 Uiso 1 1 calc R U . . .
C19 C 0.34316(6) 0.8480(2) 0.56563(9) 0.0129(4) Uani 1 1 d . . . . .
C20 C 0.31417(7) 0.7613(2) 0.52521(10) 0.0196(5) Uani 1 1 d . . . . .
H20A H 0.326180 0.673003 0.518285 0.023 Uiso 1 1 calc R U . . .
H20B H 0.289835 0.746112 0.544793 0.023 Uiso 1 1 calc R U . . .
C21 C 0.30419(7) 0.8336(3) 0.46561(10) 0.0232(5) Uani 1 1 d . . . . .
H21 H 0.285375 0.777805 0.439487 0.028 Uiso 1 1 calc R U . . .
C22 C 0.34179(8) 0.8557(3) 0.43519(10) 0.0256(6) Uani 1 1 d . . . . .
H22A H 0.354049 0.768210 0.427566 0.031 Uiso 1 1 calc R U . . .
H22B H 0.335399 0.901382 0.396625 0.031 Uiso 1 1 calc R U . . .
C23 C 0.37040(7) 0.9415(3) 0.47502(10) 0.0219(5) Uani 1 1 d . . . . .
H23 H 0.394899 0.955879 0.454920 0.026 Uiso 1 1 calc R U . . .
C24 C 0.35168(7) 1.0774(2) 0.48606(11) 0.0228(5) Uani 1 1 d . . . . .
H24A H 0.345475 1.124941 0.447904 0.027 Uiso 1 1 calc R U . . .
H24B H 0.370267 1.133358 0.511674 0.027 Uiso 1 1 calc R U . . .
C25 C 0.31399(7) 1.0553(2) 0.51629(10) 0.0204(5) Uani 1 1 d . . . . .
H25 H 0.301557 1.144038 0.523109 0.024 Uiso 1 1 calc R U . . .
C26 C 0.32435(7) 0.9856(2) 0.57631(9) 0.0164(4) Uani 1 1 d . . . . .
H26A H 0.300284 0.973282 0.596868 0.020 Uiso 1 1 calc R U . . .
H26B H 0.342980 1.041802 0.601740 0.020 Uiso 1 1 calc R U . . .
C27 C 0.28529(7) 0.9692(3) 0.47707(11) 0.0228(5) Uani 1 1 d . . . . .
H27A H 0.278138 1.015578 0.438882 0.027 Uiso 1 1 calc R U . . .
H27B H 0.260970 0.955187 0.496835 0.027 Uiso 1 1 calc R U . . .
C28 C 0.38092(7) 0.8680(2) 0.53419(10) 0.0192(5) Uani 1 1 d . . . . .
H28A H 0.400239 0.921297 0.559734 0.023 Uiso 1 1 calc R U . . .
H28B H 0.392856 0.779809 0.526716 0.023 Uiso 1 1 calc R U . . .
C29 C 0.46160(7) 0.5493(2) 0.59150(10) 0.0186(5) Uani 1 1 d . . . . .
C30 C 0.49908(7) 0.5868(3) 0.57874(10) 0.0201(5) Uani 1 1 d . . . . .
C31 C 0.52745(7) 0.4880(3) 0.57275(10) 0.0248(5) Uani 1 1 d . . . . .
C32 C 0.51756(7) 0.3537(3) 0.57810(11) 0.0261(6) Uani 1 1 d . . . . .
C33 C 0.47965(7) 0.3171(3) 0.58900(11) 0.0241(5) Uani 1 1 d . . . . .
C34 C 0.45134(7) 0.4146(2) 0.59603(11) 0.0202(5) Uani 1 1 d . . . . .
Sb1 Sb 0.29030(2) 0.61442(2) 0.87024(2) 0.02211(4) Uani 1 1 d . . . . .
F1 F 0.23940(5) 0.61083(19) 0.83014(7) 0.0398(4) Uani 1 1 d . . . . .
F2 F 0.29997(5) 0.77252(18) 0.82966(10) 0.0561(6) Uani 1 1 d . . . . .
F3 F 0.26940(5) 0.71471(19) 0.92943(9) 0.0493(5) Uani 1 1 d . . . . .
F4 F 0.33992(5) 0.6215(2) 0.91111(10) 0.0579(6) Uani 1 1 d . . . . .
F5 F 0.27893(6) 0.45664(16) 0.90945(8) 0.0444(4) Uani 1 1 d . . . . .
F6 F 0.30938(6) 0.5144(2) 0.80946(9) 0.0533(5) Uani 1 1 d . . . . .
C35 C 0.500000 0.3457(5) 0.750000 0.0599(15) Uani 1 2 d S T P . .
H35A H 0.492609 0.287101 0.715413 0.072 Uiso 0.5 1 calc R U P . .
H35B H 0.507391 0.287106 0.784589 0.072 Uiso 0.5 1 calc R U P . .
Cl5 Cl 0.45930(4) 0.44127(13) 0.76442(6) 0.0840(4) Uani 1 1 d . . . . .
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'
Au Au -2.0133 8.8022 '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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
O1 Au1 O2 84.86(7) . . ?
O1 Au1 N1 177.33(7) . . ?
O2 Au1 N1 92.48(7) . . ?
O1 Au1 P1 94.95(5) . . ?
O2 Au1 P1 178.22(5) . . ?
N1 Au1 P1 87.71(5) . . ?
C1 P1 C9 109.29(10) . . ?
C1 P1 C19 109.28(10) . . ?
C9 P1 C19 118.37(10) . . ?
C1 P1 Au1 98.97(7) . . ?
C9 P1 Au1 108.89(7) . . ?
C19 P1 Au1 110.28(7) . . ?
C29 O1 Au1 109.51(14) . . ?
C34 O2 Au1 107.99(14) . . ?
C2 N1 C8 110.07(19) . . ?
C2 N1 C7 109.33(19) . . ?
C8 N1 C7 109.8(2) . . ?
C2 N1 Au1 114.58(14) . . ?
C8 N1 Au1 106.14(15) . . ?
C7 N1 Au1 106.77(15) . . ?
C2 C1 C6 118.8(2) . . ?
C2 C1 P1 118.21(16) . . ?
C6 C1 P1 122.92(17) . . ?
C3 C2 C1 121.0(2) . . ?
C3 C2 N1 118.5(2) . . ?
C1 C2 N1 120.45(19) . . ?
C4 C3 C2 119.2(2) . . ?
C4 C3 H3 120.4 . . ?
C2 C3 H3 120.4 . . ?
C5 C4 C3 120.7(2) . . ?
C5 C4 H4 119.6 . . ?
C3 C4 H4 119.6 . . ?
C4 C5 C6 120.0(2) . . ?
C4 C5 H5 120.0 . . ?
C6 C5 H5 120.0 . . ?
C5 C6 C1 120.2(2) . . ?
C5 C6 H6 119.9 . . ?
C1 C6 H6 119.9 . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C10 C9 C17 109.37(19) . . ?
C10 C9 C16 110.07(18) . . ?
C17 C9 C16 107.77(19) . . ?
C10 C9 P1 109.77(15) . . ?
C17 C9 P1 113.20(15) . . ?
C16 C9 P1 106.59(16) . . ?
C11 C10 C9 109.50(18) . . ?
C11 C10 H10A 109.8 . . ?
C9 C10 H10A 109.8 . . ?
C11 C10 H10B 109.8 . . ?
C9 C10 H10B 109.8 . . ?
H10A C10 H10B 108.2 . . ?
C12 C11 C18 110.2(2) . . ?
C12 C11 C10 109.0(2) . . ?
C18 C11 C10 109.8(2) . . ?
C12 C11 H11 109.3 . . ?
C18 C11 H11 109.3 . . ?
C10 C11 H11 109.3 . . ?
C11 C12 C13 109.4(2) . . ?
C11 C12 H12A 109.8 . . ?
C13 C12 H12A 109.8 . . ?
C11 C12 H12B 109.8 . . ?
C13 C12 H12B 109.8 . . ?
H12A C12 H12B 108.2 . . ?
C12 C13 C14 109.6(2) . . ?
C12 C13 C17 110.3(2) . . ?
C14 C13 C17 109.1(2) . . ?
C12 C13 H13 109.3 . . ?
C14 C13 H13 109.3 . . ?
C17 C13 H13 109.3 . . ?
C15 C14 C13 109.3(2) . . ?
C15 C14 H14A 109.8 . . ?
C13 C14 H14A 109.8 . . ?
C15 C14 H14B 109.8 . . ?
C13 C14 H14B 109.8 . . ?
H14A C14 H14B 108.3 . . ?
C14 C15 C18 110.0(2) . . ?
C14 C15 C16 110.1(2) . . ?
C18 C15 C16 109.0(2) . . ?
C14 C15 H15 109.2 . . ?
C18 C15 H15 109.2 . . ?
C16 C15 H15 109.2 . . ?
C15 C16 C9 109.5(2) . . ?
C15 C16 H16A 109.8 . . ?
C9 C16 H16A 109.8 . . ?
C15 C16 H16B 109.8 . . ?
C9 C16 H16B 109.8 . . ?
H16A C16 H16B 108.2 . . ?
C9 C17 C13 109.0(2) . . ?
C9 C17 H17A 109.9 . . ?
C13 C17 H17A 109.9 . . ?
C9 C17 H17B 109.9 . . ?
C13 C17 H17B 109.9 . . ?
H17A C17 H17B 108.3 . . ?
C15 C18 C11 109.5(2) . . ?
C15 C18 H18A 109.8 . . ?
C11 C18 H18A 109.8 . . ?
C15 C18 H18B 109.8 . . ?
C11 C18 H18B 109.8 . . ?
H18A C18 H18B 108.2 . . ?
C28 C19 C26 109.62(18) . . ?
C28 C19 C20 108.40(18) . . ?
C26 C19 C20 109.66(18) . . ?
C28 C19 P1 111.00(15) . . ?
C26 C19 P1 111.32(14) . . ?
C20 C19 P1 106.76(15) . . ?
C21 C20 C19 109.44(19) . . ?
C21 C20 H20A 109.8 . . ?
C19 C20 H20A 109.8 . . ?
C21 C20 H20B 109.8 . . ?
C19 C20 H20B 109.8 . . ?
H20A C20 H20B 108.2 . . ?
C22 C21 C27 109.6(2) . . ?
C22 C21 C20 109.7(2) . . ?
C27 C21 C20 109.09(19) . . ?
C22 C21 H21 109.5 . . ?
C27 C21 H21 109.5 . . ?
C20 C21 H21 109.5 . . ?
C23 C22 C21 109.43(19) . . ?
C23 C22 H22A 109.8 . . ?
C21 C22 H22A 109.8 . . ?
C23 C22 H22B 109.8 . . ?
C21 C22 H22B 109.8 . . ?
H22A C22 H22B 108.2 . . ?
C22 C23 C24 109.8(2) . . ?
C22 C23 C28 109.3(2) . . ?
C24 C23 C28 110.28(19) . . ?
C22 C23 H23 109.2 . . ?
C24 C23 H23 109.2 . . ?
C28 C23 H23 109.2 . . ?
C23 C24 C25 109.1(2) . . ?
C23 C24 H24A 109.9 . . ?
C25 C24 H24A 109.9 . . ?
C23 C24 H24B 109.9 . . ?
C25 C24 H24B 109.9 . . ?
H24A C24 H24B 108.3 . . ?
C27 C25 C24 110.1(2) . . ?
C27 C25 C26 110.0(2) . . ?
C24 C25 C26 109.13(19) . . ?
C27 C25 H25 109.2 . . ?
C24 C25 H25 109.2 . . ?
C26 C25 H25 109.2 . . ?
C25 C26 C19 109.11(17) . . ?
C25 C26 H26A 109.9 . . ?
C19 C26 H26A 109.9 . . ?
C25 C26 H26B 109.9 . . ?
C19 C26 H26B 109.9 . . ?
H26A C26 H26B 108.3 . . ?
C25 C27 C21 109.72(19) . . ?
C25 C27 H27A 109.7 . . ?
C21 C27 H27A 109.7 . . ?
C25 C27 H27B 109.7 . . ?
C21 C27 H27B 109.7 . . ?
H27A C27 H27B 108.2 . . ?
C23 C28 C19 109.04(18) . . ?
C23 C28 H28A 109.9 . . ?
C19 C28 H28A 109.9 . . ?
C23 C28 H28B 109.9 . . ?
C19 C28 H28B 109.9 . . ?
H28A C28 H28B 108.3 . . ?
O1 C29 C30 120.1(2) . . ?
O1 C29 C34 118.8(2) . . ?
C30 C29 C34 121.1(2) . . ?
C29 C30 C31 119.5(2) . . ?
C29 C30 Cl1 118.47(19) . . ?
C31 C30 Cl1 122.07(19) . . ?
C32 C31 C30 119.6(2) . . ?
C32 C31 Cl2 120.72(19) . . ?
C30 C31 Cl2 119.7(2) . . ?
C31 C32 C33 120.5(2) . . ?
C31 C32 Cl3 120.0(2) . . ?
C33 C32 Cl3 119.5(2) . . ?
C32 C33 C34 120.4(2) . . ?
C32 C33 Cl4 121.27(19) . . ?
C34 C33 Cl4 118.3(2) . . ?
O2 C34 C33 122.5(2) . . ?
O2 C34 C29 118.7(2) . . ?
C33 C34 C29 118.8(2) . . ?
F4 Sb1 F5 90.95(9) . . ?
F4 Sb1 F6 91.23(9) . . ?
F5 Sb1 F6 90.18(9) . . ?
F4 Sb1 F3 90.89(9) . . ?
F5 Sb1 F3 89.95(9) . . ?
F6 Sb1 F3 177.88(9) . . ?
F4 Sb1 F2 90.98(9) . . ?
F5 Sb1 F2 178.06(9) . . ?
F6 Sb1 F2 89.89(10) . . ?
F3 Sb1 F2 89.91(9) . . ?
F4 Sb1 F1 178.41(9) . . ?
F5 Sb1 F1 89.36(8) . . ?
F6 Sb1 F1 90.33(9) . . ?
F3 Sb1 F1 87.56(8) . . ?
F2 Sb1 F1 88.70(8) . . ?
Cl5 C35 Cl5 113.7(3) . 2_656 ?
Cl5 C35 H35A 108.8 . . ?
Cl5 C35 H35A 108.8 2_656 . ?
Cl5 C35 H35B 108.8 . . ?
Cl5 C35 H35B 108.8 2_656 . ?
H35A C35 H35B 107.7 . . ?
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
Au1 O1 1.9659(16) . ?
Au1 O2 2.0314(16) . ?
Au1 N1 2.0652(19) . ?
Au1 P1 2.2788(6) . ?
Cl1 C30 1.721(3) . ?
Cl2 C31 1.725(2) . ?
Cl3 C32 1.724(2) . ?
Cl4 C33 1.726(3) . ?
P1 C1 1.809(2) . ?
P1 C9 1.858(2) . ?
P1 C19 1.859(2) . ?
O1 C29 1.363(3) . ?
O2 C34 1.350(3) . ?
N1 C2 1.484(3) . ?
N1 C8 1.505(3) . ?
N1 C7 1.507(3) . ?
C1 C2 1.390(3) . ?
C1 C6 1.398(3) . ?
C2 C3 1.385(3) . ?
C3 C4 1.382(3) . ?
C3 H3 0.9500 . ?
C4 C5 1.380(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.384(3) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 C10 1.542(3) . ?
C9 C17 1.546(3) . ?
C9 C16 1.547(3) . ?
C10 C11 1.535(3) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.522(4) . ?
C11 C18 1.533(4) . ?
C11 H11 1.0000 . ?
C12 C13 1.529(4) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 C14 1.531(4) . ?
C13 C17 1.548(3) . ?
C13 H13 1.0000 . ?
C14 C15 1.520(4) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 C18 1.526(4) . ?
C15 C16 1.539(3) . ?
C15 H15 1.0000 . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 C28 1.544(3) . ?
C19 C26 1.544(3) . ?
C19 C20 1.547(3) . ?
C20 C21 1.539(3) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C21 C22 1.530(4) . ?
C21 C27 1.530(3) . ?
C21 H21 1.0000 . ?
C22 C23 1.527(4) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 C24 1.529(3) . ?
C23 C28 1.539(3) . ?
C23 H23 1.0000 . ?
C24 C25 1.530(3) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 C27 1.523(3) . ?
C25 C26 1.537(3) . ?
C25 H25 1.0000 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C29 C30 1.390(3) . ?
C29 C34 1.394(3) . ?
C30 C31 1.397(3) . ?
C31 C32 1.390(4) . ?
C32 C33 1.390(4) . ?
C33 C34 1.391(3) . ?
Sb1 F4 1.8535(17) . ?
Sb1 F5 1.8648(16) . ?
Sb1 F6 1.8659(18) . ?
Sb1 F3 1.8668(17) . ?
Sb1 F2 1.8692(17) . ?
Sb1 F1 1.8838(16) . ?
C35 Cl5 1.742(3) . ?
C35 Cl5 1.742(3) 2_656 ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
