#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/21/7002194.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_7002194
loop_
_publ_author_name
'Bennett, Martin A.'
'Bhargava, Suresh K.'
'Mirzadeh, Nedaossadat'
'Privér, Steven H.'
'Wagler, Jörg'
'Willis, Anthony C.'
_publ_section_title
;
 Synthesis and interconversions of digold(i), tetragold(i), digold(ii),
 gold(i)--gold(iii) and digold(iii) complexes of fluorine-substituted
 aryl carbanions
;
_journal_issue                   36
_journal_name_full               'Dalton Transactions'
_journal_page_first              7537
_journal_page_last               7551
_journal_paper_doi               10.1039/b906769h
_journal_year                    2009
_chemical_formula_moiety         'C36 H20 Au2 Br4 F8 P2, C H2 Cl2'
_chemical_formula_sum            'C37 H22 Au2 Br4 Cl2 F8 P2'
_chemical_formula_weight         1464.96
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                119.3830(10)
_cell_angle_beta                 94.2110(10)
_cell_angle_gamma                92.7670(10)
_cell_formula_units_Z            2
_cell_length_a                   10.9022(3)
_cell_length_b                   14.5683(4)
_cell_length_c                   14.5702(4)
_cell_measurement_reflns_used    83882
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      35.631
_cell_measurement_theta_min      2.546
_cell_volume                     2001.51(10)
_computing_cell_refinement       DENZO-SMN
_computing_data_collection       'Nonius Collect'
_computing_data_reduction        Scalepack
_computing_molecular_graphics    'ORTEP32 for windows (Farugia)'
_computing_publication_material  'Ciftab (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Nonius Kappa CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0611
_diffrn_reflns_av_sigmaI/netI    0.0431
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            50246
_diffrn_reflns_theta_full        33.00
_diffrn_reflns_theta_max         33.00
_diffrn_reflns_theta_min         2.59
_exptl_absorpt_coefficient_mu    11.594
_exptl_absorpt_correction_T_max  0.314
_exptl_absorpt_correction_T_min  0.128
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SORTAV
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    2.431
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       polyhedron
_exptl_crystal_F_000             1356
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.10
_refine_diff_density_max         5.481
_refine_diff_density_min         -2.992
_refine_diff_density_rms         0.301
_refine_ls_extinction_coef       0.00053(11)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.123
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     497
_refine_ls_number_reflns         15094
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.123
_refine_ls_R_factor_all          0.0560
_refine_ls_R_factor_gt           0.0493
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0354P)²+28.0509P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1151
_refine_ls_wR_factor_ref         0.1174
_reflns_number_gt                13531
_reflns_number_total             15094
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b906769h.txt
_cod_data_source_block           neda01201
_cod_original_sg_symbol_Hall     -P1
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7002194
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cl1 Cl 0.9499(2) 0.39442(15) 0.54513(16) 0.0355(4) Uani 1 1 d . . .
Cl2 Cl 1.0036(2) 0.2497(2) 0.6247(2) 0.0482(6) Uani 1 1 d . . .
C37 C 0.9499(7) 0.2616(6) 0.5145(6) 0.0294(14) Uani 1 1 d . . .
H37A H 0.8649 0.2262 0.4879 0.035 Uiso 1 1 calc R . .
H37B H 1.0030 0.2248 0.4572 0.035 Uiso 1 1 calc R . .
Au1 Au 0.705720(18) 0.643814(15) 0.714118(15) 0.01202(5) Uani 1 1 d . . .
Au2 Au 0.805211(19) 1.081969(16) 0.823683(17) 0.01486(5) Uani 1 1 d . . .
Br1 Br 0.48052(5) 0.61472(5) 0.66579(5) 0.01893(11) Uani 1 1 d . . .
Br2 Br 0.93385(6) 1.25026(5) 0.89062(5) 0.02307(12) Uani 1 1 d . . .
Br3 Br 0.69251(6) 1.16153(5) 0.97811(5) 0.02323(12) Uani 1 1 d . . .
Br4 Br 0.92907(6) 0.99927(5) 0.67787(6) 0.02587(13) Uani 1 1 d . . .
P1 P 0.72328(13) 0.54287(11) 0.79775(11) 0.0127(2) Uani 1 1 d . . .
P2 P 0.67367(13) 0.92876(11) 0.76984(11) 0.0132(2) Uani 1 1 d . . .
F1 F 0.9961(4) 0.4892(3) 0.8849(3) 0.0214(7) Uani 1 1 d . . .
F2 F 1.2141(3) 0.5675(3) 0.8589(3) 0.0220(7) Uani 1 1 d . . .
F3 F 1.2167(3) 0.6871(3) 0.7643(3) 0.0236(8) Uani 1 1 d . . .
F4 F 1.0059(4) 0.7404(3) 0.7022(3) 0.0213(7) Uani 1 1 d . . .
F5 F 0.6522(4) 0.9322(3) 0.5721(3) 0.0198(7) Uani 1 1 d . . .
F6 F 0.6817(4) 0.7816(4) 0.3740(3) 0.0268(8) Uani 1 1 d . . .
F7 F 0.7357(4) 0.5866(3) 0.3355(3) 0.0242(8) Uani 1 1 d . . .
F8 F 0.7612(4) 0.5427(3) 0.4936(3) 0.0203(7) Uani 1 1 d . . .
C1 C 0.8863(5) 0.5760(4) 0.8063(4) 0.0136(9) Uani 1 1 d . . .
C2 C 0.9965(5) 0.5499(4) 0.8394(4) 0.0154(9) Uani 1 1 d . . .
C3 C 1.1073(5) 0.5897(5) 0.8262(5) 0.0165(9) Uani 1 1 d . . .
C4 C 1.1081(5) 0.6515(5) 0.7784(5) 0.0173(10) Uani 1 1 d . . .
C5 C 0.9978(5) 0.6757(5) 0.7442(5) 0.0167(9) Uani 1 1 d . . .
C6 C 0.8870(5) 0.6387(4) 0.7576(4) 0.0131(8) Uani 1 1 d . . .
C7 C 0.6834(5) 0.4032(4) 0.7096(4) 0.0147(9) Uani 1 1 d . . .
C8 C 0.7108(6) 0.3313(5) 0.7440(5) 0.0189(10) Uani 1 1 d . . .
H8 H 0.7442 0.3561 0.8152 0.023 Uiso 1 1 calc R . .
C9 C 0.6890(7) 0.2248(5) 0.6740(5) 0.0235(12) Uani 1 1 d . . .
H9 H 0.7102 0.1759 0.6966 0.028 Uiso 1 1 calc R . .
C10 C 0.6359(6) 0.1868(5) 0.5694(6) 0.0250(13) Uani 1 1 d . . .
H10 H 0.6183 0.1129 0.5224 0.030 Uiso 1 1 calc R . .
C11 C 0.6092(6) 0.2590(5) 0.5355(5) 0.0240(12) Uani 1 1 d . . .
H11 H 0.5752 0.2342 0.4645 0.029 Uiso 1 1 calc R . .
C12 C 0.6324(6) 0.3669(5) 0.6055(5) 0.0195(10) Uani 1 1 d . . .
H12 H 0.6135 0.4160 0.5826 0.023 Uiso 1 1 calc R . .
C13 C 0.6681(5) 0.5833(4) 0.9237(4) 0.0150(9) Uani 1 1 d . . .
C14 C 0.5431(6) 0.5992(5) 0.9319(5) 0.0188(10) Uani 1 1 d . . .
H14 H 0.4904 0.5876 0.8715 0.023 Uiso 1 1 calc R . .
C15 C 0.4952(6) 0.6320(5) 1.0283(5) 0.0220(11) Uani 1 1 d . . .
H15 H 0.4100 0.6418 1.0339 0.026 Uiso 1 1 calc R . .
C16 C 0.5750(6) 0.6503(5) 1.1174(5) 0.0216(11) Uani 1 1 d . . .
H16 H 0.5441 0.6745 1.1839 0.026 Uiso 1 1 calc R . .
C17 C 0.6994(7) 0.6330(5) 1.1081(5) 0.0241(12) Uani 1 1 d . . .
H17 H 0.7525 0.6436 1.1679 0.029 Uiso 1 1 calc R . .
C18 C 0.7458(6) 0.6004(5) 1.0117(5) 0.0195(10) Uani 1 1 d . . .
H18 H 0.8308 0.5898 1.0059 0.023 Uiso 1 1 calc R . .
C19 C 0.6945(5) 0.8172(4) 0.6407(4) 0.0145(9) Uani 1 1 d . . .
C20 C 0.6821(5) 0.8373(5) 0.5563(4) 0.0158(9) Uani 1 1 d . . .
C21 C 0.6971(6) 0.7608(5) 0.4544(5) 0.0180(10) Uani 1 1 d . . .
C22 C 0.7250(6) 0.6624(5) 0.4346(4) 0.0183(10) Uani 1 1 d . . .
C23 C 0.7369(6) 0.6409(4) 0.5179(5) 0.0170(10) Uani 1 1 d . . .
C24 C 0.7207(5) 0.7153(4) 0.6214(4) 0.0131(8) Uani 1 1 d . . .
C25 C 0.7139(5) 0.8943(4) 0.8704(4) 0.0163(9) Uani 1 1 d . . .
C26 C 0.6282(6) 0.8791(5) 0.9300(5) 0.0198(10) Uani 1 1 d . . .
H26 H 0.5426 0.8819 0.9150 0.024 Uiso 1 1 calc R . .
C27 C 0.6691(6) 0.8600(5) 1.0112(5) 0.0217(11) Uani 1 1 d . . .
H27 H 0.6116 0.8493 1.0518 0.026 Uiso 1 1 calc R . .
C28 C 0.7942(6) 0.8565(5) 1.0326(5) 0.0213(11) Uani 1 1 d . . .
H28 H 0.8218 0.8432 1.0879 0.026 Uiso 1 1 calc R . .
C29 C 0.8800(6) 0.8722(5) 0.9744(5) 0.0228(12) Uani 1 1 d . . .
H29 H 0.9655 0.8703 0.9905 0.027 Uiso 1 1 calc R . .
C30 C 0.8404(6) 0.8905(5) 0.8933(5) 0.0185(10) Uani 1 1 d . . .
H30 H 0.8987 0.9006 0.8529 0.022 Uiso 1 1 calc R . .
C31 C 0.5140(5) 0.9539(4) 0.7577(4) 0.0145(9) Uani 1 1 d . . .
C32 C 0.4180(5) 0.8834(5) 0.7516(5) 0.0181(10) Uani 1 1 d . . .
H32 H 0.4358 0.8253 0.7615 0.022 Uiso 1 1 calc R . .
C33 C 0.2958(6) 0.8987(5) 0.7311(5) 0.0230(12) Uani 1 1 d . . .
H33 H 0.2303 0.8519 0.7289 0.028 Uiso 1 1 calc R . .
C34 C 0.2690(6) 0.9812(5) 0.7138(5) 0.0228(12) Uani 1 1 d . . .
H34 H 0.1856 0.9902 0.6986 0.027 Uiso 1 1 calc R . .
C35 C 0.3642(6) 1.0511(5) 0.7187(5) 0.0221(11) Uani 1 1 d . . .
H35 H 0.3457 1.1074 0.7062 0.027 Uiso 1 1 calc R . .
C36 C 0.4861(5) 1.0388(5) 0.7419(5) 0.0187(10) Uani 1 1 d . . .
H36 H 0.5508 1.0878 0.7470 0.022 Uiso 1 1 calc R . .
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Br Br -0.2901 2.4595 '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'
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
Cl2 C37 Cl1 112.4(4) . . ?
Cl2 C37 H37A 109.1 . . ?
Cl1 C37 H37A 109.1 . . ?
Cl2 C37 H37B 109.1 . . ?
Cl1 C37 H37B 109.1 . . ?
H37A C37 H37B 107.9 . . ?
C6 Au1 C24 102.1(2) . . ?
C6 Au1 P1 68.91(16) . . ?
C24 Au1 P1 167.48(15) . . ?
C6 Au1 Br1 167.23(15) . . ?
C24 Au1 Br1 89.12(15) . . ?
P1 Au1 Br1 99.03(4) . . ?
P2 Au2 Br4 94.61(4) . . ?
P2 Au2 Br3 85.61(4) . . ?
Br4 Au2 Br3 175.49(3) . . ?
P2 Au2 Br2 175.79(4) . . ?
Br4 Au2 Br2 89.58(2) . . ?
Br3 Au2 Br2 90.24(2) . . ?
C13 P1 C1 113.7(3) . . ?
C13 P1 C7 110.6(3) . . ?
C1 P1 C7 110.4(3) . . ?
C13 P1 Au1 121.87(19) . . ?
C1 P1 Au1 83.79(18) . . ?
C7 P1 Au1 113.53(19) . . ?
C25 P2 C31 114.9(3) . . ?
C25 P2 C19 108.8(3) . . ?
C31 P2 C19 104.7(3) . . ?
C25 P2 Au2 103.0(2) . . ?
C31 P2 Au2 110.53(19) . . ?
C19 P2 Au2 115.25(19) . . ?
C2 C1 C6 121.2(5) . . ?
C2 C1 P1 137.4(4) . . ?
C6 C1 P1 101.2(4) . . ?
F1 C2 C3 119.9(5) . . ?
F1 C2 C1 121.4(5) . . ?
C3 C2 C1 118.7(5) . . ?
F2 C3 C2 119.9(5) . . ?
F2 C3 C4 119.9(5) . . ?
C2 C3 C4 120.1(5) . . ?
F3 C4 C3 119.0(5) . . ?
F3 C4 C5 120.3(6) . . ?
C3 C4 C5 120.7(5) . . ?
F4 C5 C6 122.2(5) . . ?
F4 C5 C4 117.4(5) . . ?
C6 C5 C4 120.4(5) . . ?
C5 C6 C1 118.8(5) . . ?
C5 C6 Au1 135.0(4) . . ?
C1 C6 Au1 106.1(4) . . ?
C12 C7 C8 120.3(5) . . ?
C12 C7 P1 119.9(4) . . ?
C8 C7 P1 119.7(4) . . ?
C9 C8 C7 119.4(6) . . ?
C9 C8 H8 120.3 . . ?
C7 C8 H8 120.3 . . ?
C8 C9 C10 121.0(6) . . ?
C8 C9 H9 119.5 . . ?
C10 C9 H9 119.5 . . ?
C11 C10 C9 119.2(6) . . ?
C11 C10 H10 120.4 . . ?
C9 C10 H10 120.4 . . ?
C12 C11 C10 120.0(6) . . ?
C12 C11 H11 120.0 . . ?
C10 C11 H11 120.0 . . ?
C11 C12 C7 119.9(6) . . ?
C11 C12 H12 120.0 . . ?
C7 C12 H12 120.0 . . ?
C18 C13 C14 120.2(5) . . ?
C18 C13 P1 122.0(5) . . ?
C14 C13 P1 117.8(4) . . ?
C15 C14 C13 120.3(6) . . ?
C15 C14 H14 119.8 . . ?
C13 C14 H14 119.8 . . ?
C14 C15 C16 119.1(6) . . ?
C14 C15 H15 120.5 . . ?
C16 C15 H15 120.5 . . ?
C17 C16 C15 120.2(6) . . ?
C17 C16 H16 119.9 . . ?
C15 C16 H16 119.9 . . ?
C18 C17 C16 120.1(6) . . ?
C18 C17 H17 120.0 . . ?
C16 C17 H17 120.0 . . ?
C17 C18 C13 120.1(6) . . ?
C17 C18 H18 119.9 . . ?
C13 C18 H18 119.9 . . ?
C20 C19 C24 119.5(5) . . ?
C20 C19 P2 115.1(4) . . ?
C24 C19 P2 125.3(4) . . ?
F5 C20 C21 117.9(5) . . ?
F5 C20 C19 120.5(5) . . ?
C21 C20 C19 121.6(5) . . ?
F6 C21 C22 120.0(5) . . ?
F6 C21 C20 120.3(5) . . ?
C22 C21 C20 119.7(5) . . ?
F7 C22 C21 120.1(5) . . ?
F7 C22 C23 120.4(5) . . ?
C21 C22 C23 119.4(5) . . ?
F8 C23 C24 120.4(5) . . ?
F8 C23 C22 116.9(5) . . ?
C24 C23 C22 122.7(5) . . ?
C23 C24 C19 117.1(5) . . ?
C23 C24 Au1 110.8(4) . . ?
C19 C24 Au1 130.9(4) . . ?
C26 C25 C30 119.9(5) . . ?
C26 C25 P2 123.7(5) . . ?
C30 C25 P2 116.2(5) . . ?
C27 C26 C25 119.6(6) . . ?
C27 C26 H26 120.2 . . ?
C25 C26 H26 120.2 . . ?
C28 C27 C26 119.7(6) . . ?
C28 C27 H27 120.2 . . ?
C26 C27 H27 120.2 . . ?
C27 C28 C29 121.1(6) . . ?
C27 C28 H28 119.4 . . ?
C29 C28 H28 119.4 . . ?
C30 C29 C28 119.7(6) . . ?
C30 C29 H29 120.1 . . ?
C28 C29 H29 120.1 . . ?
C29 C30 C25 120.0(6) . . ?
C29 C30 H30 120.0 . . ?
C25 C30 H30 120.0 . . ?
C32 C31 C36 119.5(5) . . ?
C32 C31 P2 120.8(4) . . ?
C36 C31 P2 119.4(4) . . ?
C33 C32 C31 119.6(6) . . ?
C33 C32 H32 120.2 . . ?
C31 C32 H32 120.2 . . ?
C34 C33 C32 120.7(6) . . ?
C34 C33 H33 119.7 . . ?
C32 C33 H33 119.7 . . ?
C33 C34 C35 120.0(6) . . ?
C33 C34 H34 120.0 . . ?
C35 C34 H34 120.0 . . ?
C36 C35 C34 120.1(6) . . ?
C36 C35 H35 119.9 . . ?
C34 C35 H35 119.9 . . ?
C35 C36 C31 120.1(6) . . ?
C35 C36 H36 119.9 . . ?
C31 C36 H36 119.9 . . ?
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
Cl1 C37 1.760(8) . ?
Cl2 C37 1.759(8) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
Au1 C6 2.046(5) . ?
Au1 C24 2.081(5) . ?
Au1 P1 2.3315(14) . ?
Au1 Br1 2.4609(6) . ?
Au2 P2 2.3369(14) . ?
Au2 Br4 2.4198(7) . ?
Au2 Br3 2.4290(7) . ?
Au2 Br2 2.4596(6) . ?
P1 C13 1.792(6) . ?
P1 C1 1.797(6) . ?
P1 C7 1.802(6) . ?
P2 C25 1.799(6) . ?
P2 C31 1.810(6) . ?
P2 C19 1.825(6) . ?
F1 C2 1.339(7) . ?
F2 C3 1.339(7) . ?
F3 C4 1.338(6) . ?
F4 C5 1.356(7) . ?
F5 C20 1.345(7) . ?
F6 C21 1.347(7) . ?
F7 C22 1.338(7) . ?
F8 C23 1.339(7) . ?
C1 C2 1.400(8) . ?
C1 C6 1.406(8) . ?
C2 C3 1.382(8) . ?
C3 C4 1.383(9) . ?
C4 C5 1.395(8) . ?
C5 C6 1.365(8) . ?
C7 C12 1.396(8) . ?
C7 C8 1.402(8) . ?
C8 C9 1.371(8) . ?
C8 H8 0.9500 . ?
C9 C10 1.405(10) . ?
C9 H9 0.9500 . ?
C10 C11 1.399(10) . ?
C10 H10 0.9500 . ?
C11 C12 1.387(9) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 C18 1.389(8) . ?
C13 C14 1.397(8) . ?
C14 C15 1.396(9) . ?
C14 H14 0.9500 . ?
C15 C16 1.408(10) . ?
C15 H15 0.9500 . ?
C16 C17 1.396(10) . ?
C16 H16 0.9500 . ?
C17 C18 1.388(9) . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C20 1.397(8) . ?
C19 C24 1.417(8) . ?
C20 C21 1.380(8) . ?
C21 C22 1.372(8) . ?
C22 C23 1.393(8) . ?
C23 C24 1.392(8) . ?
C25 C26 1.401(9) . ?
C25 C30 1.405(8) . ?
C26 C27 1.391(9) . ?
C26 H26 0.9500 . ?
C27 C28 1.385(10) . ?
C27 H27 0.9500 . ?
C28 C29 1.389(10) . ?
C28 H28 0.9500 . ?
C29 C30 1.379(9) . ?
C29 H29 0.9500 . ?
C30 H30 0.9500 . ?
C31 C32 1.398(8) . ?
C31 C36 1.407(8) . ?
C32 C33 1.397(8) . ?
C32 H32 0.9500 . ?
C33 C34 1.384(10) . ?
C33 H33 0.9500 . ?
C34 C35 1.390(10) . ?
C34 H34 0.9500 . ?
C35 C36 1.389(8) . ?
C35 H35 0.9500 . ?
C36 H36 0.9500 . ?
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
C6 Au1 P1 C13 113.9(3) . . . . ?
C24 Au1 P1 C13 159.6(7) . . . . ?
Br1 Au1 P1 C13 -70.4(2) . . . . ?
C6 Au1 P1 C1 -0.2(2) . . . . ?
C24 Au1 P1 C1 45.5(7) . . . . ?
Br1 Au1 P1 C1 175.50(17) . . . . ?
C6 Au1 P1 C7 -109.8(3) . . . . ?
C24 Au1 P1 C7 -64.1(7) . . . . ?
Br1 Au1 P1 C7 65.9(2) . . . . ?
Br4 Au2 P2 C25 111.0(2) . . . . ?
Br3 Au2 P2 C25 -64.5(2) . . . . ?
Br4 Au2 P2 C31 -125.8(2) . . . . ?
Br3 Au2 P2 C31 58.7(2) . . . . ?
Br4 Au2 P2 C19 -7.4(2) . . . . ?
Br3 Au2 P2 C19 177.1(2) . . . . ?
C13 P1 C1 C2 63.3(7) . . . . ?
C7 P1 C1 C2 -61.7(7) . . . . ?
Au1 P1 C1 C2 -174.5(6) . . . . ?
C13 P1 C1 C6 -121.9(4) . . . . ?
C7 P1 C1 C6 113.1(4) . . . . ?
Au1 P1 C1 C6 0.2(3) . . . . ?
C6 C1 C2 F1 -179.3(5) . . . . ?
P1 C1 C2 F1 -5.3(9) . . . . ?
C6 C1 C2 C3 1.9(8) . . . . ?
P1 C1 C2 C3 175.9(5) . . . . ?
F1 C2 C3 F2 0.0(8) . . . . ?
C1 C2 C3 F2 178.8(5) . . . . ?
F1 C2 C3 C4 179.4(5) . . . . ?
C1 C2 C3 C4 -1.8(8) . . . . ?
F2 C3 C4 F3 0.9(8) . . . . ?
C2 C3 C4 F3 -178.5(5) . . . . ?
F2 C3 C4 C5 -179.8(5) . . . . ?
C2 C3 C4 C5 0.8(9) . . . . ?
F3 C4 C5 F4 -3.5(8) . . . . ?
C3 C4 C5 F4 177.2(5) . . . . ?
F3 C4 C5 C6 179.4(5) . . . . ?
C3 C4 C5 C6 0.1(9) . . . . ?
F4 C5 C6 C1 -177.0(5) . . . . ?
C4 C5 C6 C1 0.0(8) . . . . ?
F4 C5 C6 Au1 7.7(9) . . . . ?
C4 C5 C6 Au1 -175.4(4) . . . . ?
C2 C1 C6 C5 -1.0(8) . . . . ?
P1 C1 C6 C5 -176.9(4) . . . . ?
C2 C1 C6 Au1 175.6(4) . . . . ?
P1 C1 C6 Au1 -0.3(4) . . . . ?
C24 Au1 C6 C5 5.1(6) . . . . ?
P1 Au1 C6 C5 176.0(6) . . . . ?
Br1 Au1 C6 C5 156.3(5) . . . . ?
C24 Au1 C6 C1 -170.6(4) . . . . ?
P1 Au1 C6 C1 0.2(3) . . . . ?
Br1 Au1 C6 C1 -19.5(10) . . . . ?
C13 P1 C7 C12 133.5(5) . . . . ?
C1 P1 C7 C12 -99.7(5) . . . . ?
Au1 P1 C7 C12 -7.7(5) . . . . ?
C13 P1 C7 C8 -50.4(6) . . . . ?
C1 P1 C7 C8 76.4(5) . . . . ?
Au1 P1 C7 C8 168.4(4) . . . . ?
C12 C7 C8 C9 1.1(9) . . . . ?
P1 C7 C8 C9 -175.0(5) . . . . ?
C7 C8 C9 C10 -2.1(10) . . . . ?
C8 C9 C10 C11 2.4(10) . . . . ?
C9 C10 C11 C12 -1.6(10) . . . . ?
C10 C11 C12 C7 0.6(10) . . . . ?
C8 C7 C12 C11 -0.3(9) . . . . ?
P1 C7 C12 C11 175.7(5) . . . . ?
C1 P1 C13 C18 -23.0(6) . . . . ?
C7 P1 C13 C18 101.9(5) . . . . ?
Au1 P1 C13 C18 -120.7(5) . . . . ?
C1 P1 C13 C14 156.0(4) . . . . ?
C7 P1 C13 C14 -79.1(5) . . . . ?
Au1 P1 C13 C14 58.3(5) . . . . ?
C18 C13 C14 C15 -0.2(9) . . . . ?
P1 C13 C14 C15 -179.2(5) . . . . ?
C13 C14 C15 C16 0.9(9) . . . . ?
C14 C15 C16 C17 -1.7(10) . . . . ?
C15 C16 C17 C18 1.7(10) . . . . ?
C16 C17 C18 C13 -1.0(10) . . . . ?
C14 C13 C18 C17 0.2(9) . . . . ?
P1 C13 C18 C17 179.2(5) . . . . ?
C25 P2 C19 C20 -172.1(4) . . . . ?
C31 P2 C19 C20 64.6(5) . . . . ?
Au2 P2 C19 C20 -57.0(5) . . . . ?
C25 P2 C19 C24 8.3(6) . . . . ?
C31 P2 C19 C24 -115.0(5) . . . . ?
Au2 P2 C19 C24 123.3(4) . . . . ?
C24 C19 C20 F5 177.2(5) . . . . ?
P2 C19 C20 F5 -2.5(7) . . . . ?
C24 C19 C20 C21 -1.3(9) . . . . ?
P2 C19 C20 C21 179.1(5) . . . . ?
F5 C20 C21 F6 -0.1(9) . . . . ?
C19 C20 C21 F6 178.4(5) . . . . ?
F5 C20 C21 C22 -178.6(5) . . . . ?
C19 C20 C21 C22 -0.1(9) . . . . ?
F6 C21 C22 F7 -0.7(9) . . . . ?
C20 C21 C22 F7 177.8(6) . . . . ?
F6 C21 C22 C23 -178.0(6) . . . . ?
C20 C21 C22 C23 0.4(9) . . . . ?
F7 C22 C23 F8 1.1(9) . . . . ?
C21 C22 C23 F8 178.4(5) . . . . ?
F7 C22 C23 C24 -176.8(6) . . . . ?
C21 C22 C23 C24 0.5(9) . . . . ?
F8 C23 C24 C19 -179.6(5) . . . . ?
C22 C23 C24 C19 -1.8(9) . . . . ?
F8 C23 C24 Au1 -10.9(7) . . . . ?
C22 C23 C24 Au1 166.9(5) . . . . ?
C20 C19 C24 C23 2.1(8) . . . . ?
P2 C19 C24 C23 -178.3(4) . . . . ?
C20 C19 C24 Au1 -163.8(4) . . . . ?
P2 C19 C24 Au1 15.8(8) . . . . ?
C6 Au1 C24 C23 83.8(4) . . . . ?
P1 Au1 C24 C23 40.7(10) . . . . ?
Br1 Au1 C24 C23 -90.1(4) . . . . ?
C6 Au1 C24 C19 -109.6(5) . . . . ?
P1 Au1 C24 C19 -152.7(5) . . . . ?
Br1 Au1 C24 C19 76.5(5) . . . . ?
C31 P2 C25 C26 5.0(6) . . . . ?
C19 P2 C25 C26 -112.0(5) . . . . ?
Au2 P2 C25 C26 125.2(5) . . . . ?
C31 P2 C25 C30 -170.4(4) . . . . ?
C19 P2 C25 C30 72.6(5) . . . . ?
Au2 P2 C25 C30 -50.1(5) . . . . ?
C30 C25 C26 C27 -0.3(9) . . . . ?
P2 C25 C26 C27 -175.5(5) . . . . ?
C25 C26 C27 C28 0.2(9) . . . . ?
C26 C27 C28 C29 0.2(10) . . . . ?
C27 C28 C29 C30 -0.6(10) . . . . ?
C28 C29 C30 C25 0.6(9) . . . . ?
C26 C25 C30 C29 -0.2(9) . . . . ?
P2 C25 C30 C29 175.4(5) . . . . ?
C25 P2 C31 C32 -48.5(6) . . . . ?
C19 P2 C31 C32 70.8(5) . . . . ?
Au2 P2 C31 C32 -164.5(4) . . . . ?
C25 P2 C31 C36 138.9(5) . . . . ?
C19 P2 C31 C36 -101.8(5) . . . . ?
Au2 P2 C31 C36 22.9(5) . . . . ?
C36 C31 C32 C33 -0.6(9) . . . . ?
P2 C31 C32 C33 -173.3(5) . . . . ?
C31 C32 C33 C34 1.8(10) . . . . ?
C32 C33 C34 C35 -1.2(10) . . . . ?
C33 C34 C35 C36 -0.6(10) . . . . ?
C34 C35 C36 C31 1.7(10) . . . . ?
C32 C31 C36 C35 -1.1(9) . . . . ?
P2 C31 C36 C35 171.7(5) . . . . ?
