#------------------------------------------------------------------------------
#$Date: 2016-03-26 00:18:19 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180071 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/17/7051792.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_7051792
loop_
_publ_author_name
'Strasser, Christoph E.'
'Gabrielli, William F.'
'Esterhuysen, Catharine'
'Schuster, Oliver B.'
'Nogai, Stefan D.'
'Cronje, Stephanie'
'Raubenheimer, Helgard G.'
_publ_section_title
;
 Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i)
 coordination and variation in solid state intermolecular interactions
;
_journal_issue                   1
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              138
_journal_paper_doi               10.1039/b709896k
_journal_volume                  32
_journal_year                    2008
_chemical_formula_moiety         '(C24 H15 Au2 F10 N6 P), 0.83(C D Cl3)'
_chemical_formula_sum            'C24.83 H15 Au2 Cl2.5 D0.83 F10 N6 P'
_chemical_formula_weight         1103
_chemical_name_common
;bis(pentafluorophenyl)-μ-[tris(1-methylimidazol-2-yl)phosphine]digold(I)
5/6 deuteriochloroform solvate
;
_chemical_name_systematic
;bis(pentafluorophenyl)-μ-[tris(1-methylimidazol-2-yl)phosphane-κ²P:N]
digold(I) 5/6 deuteriotrichloromethane solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_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                101.251(2)
_cell_angle_beta                 98.052(2)
_cell_angle_gamma                100.106(2)
_cell_formula_units_Z            6
_cell_length_a                   12.3247(12)
_cell_length_b                   19.1230(19)
_cell_length_c                   20.242(2)
_cell_measurement_reflns_used    9212
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.427
_cell_measurement_theta_min      2.221
_cell_volume                     4530.8(8)
_computing_cell_refinement       'SAINT (Bruker, 2003)'
_computing_data_collection       'SMART (Bruker, 2002)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'X-Seed (Barbour, 2001)'
_computing_publication_material  X-Seed
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  'Bruker APEX CCD area detector'
_diffrn_measurement_method       ω-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  0.0334
_diffrn_reflns_av_sigmaI/netI    0.0441
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            47479
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         26.47
_diffrn_reflns_theta_min         1.69
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    10.069
_exptl_absorpt_correction_T_max  0.331
_exptl_absorpt_correction_T_min  0.240
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2002)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.425
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             3074
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.11
_refine_diff_density_max         1.525
_refine_diff_density_min         -1.451
_refine_diff_density_rms         0.212
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.083
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1270
_refine_ls_number_reflns         18211
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.083
_refine_ls_R_factor_all          0.0450
_refine_ls_R_factor_gt           0.0288
_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)+(0.0324P)²+5.4135P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0622
_refine_ls_wR_factor_ref         0.0761
_reflns_number_gt                14419
_reflns_number_total             18211
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b709896k.txt
_cod_data_source_block           Compound4CDCl3
_cod_original_cell_volume        4530.7(8)
_cod_database_code               7051792
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
Au1 Au 0.705083(19) 0.010434(12) 0.638503(12) 0.01722(6) Uani 1 1 d . . .
Au2 Au 0.722697(19) 0.060164(12) 0.791603(12) 0.01797(6) Uani 1 1 d . . .
Au3 Au 0.635380(19) 0.420708(12) 0.100117(12) 0.01734(6) Uani 1 1 d . . .
Au4 Au 0.76453(2) 0.367458(12) -0.008751(12) 0.01745(6) Uani 1 1 d . . .
Au5 Au 0.566704(19) 0.321232(12) 0.270285(12) 0.01647(6) Uani 1 1 d . . .
Au6 Au 0.587107(19) 0.368865(12) 0.422053(12) 0.01739(6) Uani 1 1 d . . .
Cl11 Cl 0.90331(16) 0.97286(9) 0.05626(9) 0.0374(4) Uani 1 1 d . . .
Cl12 Cl 0.74536(19) 0.87868(14) 0.10917(11) 0.0640(7) Uani 1 1 d . . .
Cl13 Cl 0.9745(2) 0.85957(11) 0.11455(13) 0.0621(7) Uani 1 1 d . . .
Cl21 Cl 1.1163(3) 0.71884(14) 0.3644(2) 0.147(2) Uani 1 1 d . . .
Cl22 Cl 1.02398(18) 0.80437(11) 0.27915(11) 0.0488(5) Uani 1 1 d . . .
Cl23 Cl 0.8886(3) 0.73526(14) 0.36244(13) 0.0926(11) Uani 1 1 d . . .
Cl31 Cl 0.9559(4) 0.6012(2) 0.47155(19) 0.0452(10) Uani 0.50 1 d P . .
Cl32 Cl 0.8882(2) 0.45911(16) 0.47003(16) 0.0905(10) Uani 1 1 d . . .
P1 P 0.85082(13) -0.04105(8) 0.66925(8) 0.0167(3) Uani 1 1 d . . .
P3 P 0.77261(13) 0.52337(8) 0.12553(8) 0.0170(3) Uani 1 1 d . . .
P5 P 0.70557(13) 0.26226(8) 0.29630(8) 0.0155(3) Uani 1 1 d . . .
F12 F 0.4515(3) -0.07091(18) 0.58932(19) 0.0264(9) Uani 1 1 d . . .
F13 F 0.2671(3) -0.0284(2) 0.53781(19) 0.0280(9) Uani 1 1 d . . .
F14 F 0.2786(3) 0.1103(2) 0.52280(19) 0.0308(9) Uani 1 1 d . . .
F15 F 0.4792(3) 0.2064(2) 0.5574(2) 0.0341(10) Uani 1 1 d . . .
F16 F 0.6660(3) 0.1650(2) 0.6067(2) 0.0307(9) Uani 1 1 d . . .
F22 F 0.4708(3) 0.07283(18) 0.73726(19) 0.0266(9) Uani 1 1 d . . .
F23 F 0.3903(3) 0.1860(2) 0.7064(2) 0.0359(10) Uani 1 1 d . . .
F24 F 0.5253(4) 0.3218(2) 0.7371(2) 0.0440(11) Uani 1 1 d . . .
F25 F 0.7417(4) 0.3424(2) 0.8017(2) 0.0439(11) Uani 1 1 d . . .
F26 F 0.8243(3) 0.2296(2) 0.8305(2) 0.0319(9) Uani 1 1 d . . .
F32 F 0.6111(3) 0.25209(19) 0.11072(18) 0.0256(8) Uani 1 1 d . . .
F33 F 0.4316(3) 0.14274(19) 0.08881(19) 0.0307(9) Uani 1 1 d . . .
F34 F 0.2233(3) 0.1656(2) 0.04756(19) 0.0326(10) Uani 1 1 d . . .
F35 F 0.1968(3) 0.2976(2) 0.0261(2) 0.0310(9) Uani 1 1 d . . .
F36 F 0.3743(3) 0.40755(19) 0.04749(19) 0.0277(9) Uani 1 1 d . . .
F42 F 0.9194(3) 0.2660(2) 0.0405(2) 0.0352(10) Uani 1 1 d . . .
F43 F 0.8831(3) 0.1226(2) 0.0319(2) 0.0471(12) Uani 1 1 d . . .
F44 F 0.6785(4) 0.0361(2) -0.0280(2) 0.0458(12) Uani 1 1 d . . .
F45 F 0.5116(4) 0.0967(2) -0.0796(2) 0.0451(11) Uani 1 1 d . . .
F46 F 0.5464(3) 0.2399(2) -0.07258(19) 0.0327(9) Uani 1 1 d . . .
F52 F 0.3158(3) 0.23784(18) 0.22420(18) 0.0248(8) Uani 1 1 d . . .
F53 F 0.1270(3) 0.27722(19) 0.17564(19) 0.0288(9) Uani 1 1 d . . .
F54 F 0.1296(3) 0.41645(19) 0.16683(18) 0.0250(8) Uani 1 1 d . . .
F55 F 0.3257(3) 0.51743(19) 0.2023(2) 0.0290(9) Uani 1 1 d . . .
F56 F 0.5169(3) 0.47937(19) 0.24761(18) 0.0258(8) Uani 1 1 d . . .
F62 F 0.3293(3) 0.37382(19) 0.3897(2) 0.0304(9) Uani 1 1 d . . .
F63 F 0.2261(3) 0.4819(2) 0.3693(2) 0.0372(10) Uani 1 1 d . . .
F64 F 0.3465(3) 0.6190(2) 0.3832(2) 0.0362(10) Uani 1 1 d . . .
F65 F 0.5742(3) 0.6471(2) 0.4209(2) 0.0392(10) Uani 1 1 d . . .
F66 F 0.6792(3) 0.5399(2) 0.4401(2) 0.0297(9) Uani 1 1 d . . .
N11 N 0.7987(4) -0.0264(3) 0.7991(2) 0.0161(11) Uani 1 1 d . . .
N12 N 0.9019(4) -0.1081(3) 0.7801(3) 0.0176(11) Uani 1 1 d . . .
N13 N 1.0769(4) 0.0093(3) 0.7214(3) 0.0222(12) Uani 1 1 d . . .
N14 N 1.0234(4) 0.0449(3) 0.6259(3) 0.0208(12) Uani 1 1 d . . .
N15 N 0.9319(4) -0.1388(3) 0.5803(3) 0.0223(12) Uani 1 1 d . . .
N16 N 0.7609(4) -0.1850(3) 0.5939(3) 0.0206(12) Uani 1 1 d . . .
N31 N 0.8154(4) 0.4772(2) -0.0041(2) 0.0146(11) Uani 1 1 d . . .
N32 N 0.9074(4) 0.5899(3) 0.0410(3) 0.0173(11) Uani 1 1 d . . .
N33 N 0.7954(5) 0.6646(3) 0.1938(3) 0.0348(15) Uani 1 1 d . . .
N34 N 0.6292(4) 0.6242(3) 0.1266(3) 0.0233(12) Uani 1 1 d . . .
N35 N 0.9944(4) 0.5425(3) 0.1855(3) 0.0223(12) Uani 1 1 d . . .
N36 N 0.8767(4) 0.5275(3) 0.2591(3) 0.0214(12) Uani 1 1 d . . .
N51 N 0.6636(4) 0.2824(3) 0.4291(2) 0.0154(11) Uani 1 1 d . . .
N52 N 0.7477(4) 0.1905(3) 0.4047(3) 0.0177(11) Uani 1 1 d . . .
N53 N 0.7702(4) 0.1633(3) 0.2005(3) 0.0229(12) Uani 1 1 d . . .
N54 N 0.5999(4) 0.1213(3) 0.2194(3) 0.0215(12) Uani 1 1 d . . .
N55 N 0.9241(4) 0.3015(3) 0.3608(3) 0.0241(12) Uani 1 1 d . . .
N56 N 0.9008(4) 0.3375(3) 0.2625(3) 0.0199(12) Uani 1 1 d . . .
C11 C 0.5670(5) 0.0452(3) 0.5995(3) 0.0197(14) Uani 1 1 d . . .
C12 C 0.4632(5) -0.0009(3) 0.5814(3) 0.0202(14) Uani 1 1 d . . .
C13 C 0.3664(5) 0.0196(3) 0.5555(3) 0.0183(13) Uani 1 1 d . . .
C14 C 0.3727(5) 0.0885(4) 0.5470(3) 0.0228(15) Uani 1 1 d . . .
C15 C 0.4731(6) 0.1370(4) 0.5646(3) 0.0253(15) Uani 1 1 d . . .
C16 C 0.5672(5) 0.1145(3) 0.5895(3) 0.0214(14) Uani 1 1 d . . .
C21 C 0.6520(5) 0.1455(3) 0.7832(3) 0.0205(14) Uani 1 1 d . . .
C22 C 0.5422(5) 0.1389(3) 0.7538(3) 0.0212(14) Uani 1 1 d . . .
C23 C 0.4987(5) 0.1960(4) 0.7375(3) 0.0254(15) Uani 1 1 d . . .
C24 C 0.5676(6) 0.2654(4) 0.7528(4) 0.0310(17) Uani 1 1 d . . .
C25 C 0.6757(6) 0.2750(3) 0.7847(3) 0.0261(15) Uani 1 1 d . . .
C26 C 0.7158(5) 0.2161(3) 0.7989(3) 0.0205(14) Uani 1 1 d . . .
C31 C 0.5018(5) 0.3346(3) 0.0801(3) 0.0184(13) Uani 1 1 d . . .
C32 C 0.5098(5) 0.2662(3) 0.0893(3) 0.0171(13) Uani 1 1 d . . .
C33 C 0.4201(5) 0.2088(3) 0.0782(3) 0.0223(14) Uani 1 1 d . . .
C34 C 0.3139(5) 0.2203(3) 0.0571(3) 0.0216(14) Uani 1 1 d . . .
C35 C 0.3002(5) 0.2872(4) 0.0460(3) 0.0220(14) Uani 1 1 d . . .
C36 C 0.3938(5) 0.3419(3) 0.0576(3) 0.0222(14) Uani 1 1 d . . .
C41 C 0.7338(5) 0.2597(3) -0.0155(3) 0.0188(13) Uani 1 1 d . . .
C42 C 0.8153(6) 0.2261(3) 0.0096(3) 0.0248(15) Uani 1 1 d . . .
C43 C 0.8003(6) 0.1524(4) 0.0062(4) 0.0325(17) Uani 1 1 d . . .
C44 C 0.6976(7) 0.1093(3) -0.0231(4) 0.0320(17) Uani 1 1 d . . .
C45 C 0.6131(6) 0.1396(4) -0.0493(3) 0.0285(16) Uani 1 1 d . . .
C46 C 0.6333(6) 0.2133(3) -0.0455(3) 0.0237(15) Uani 1 1 d . . .
C51 C 0.4255(5) 0.3569(3) 0.2383(3) 0.0194(14) Uani 1 1 d . . .
C52 C 0.3227(5) 0.3090(3) 0.2193(3) 0.0192(14) Uani 1 1 d . . .
C53 C 0.2251(5) 0.3265(3) 0.1951(3) 0.0197(14) Uani 1 1 d . . .
C54 C 0.2250(5) 0.3974(3) 0.1890(3) 0.0176(13) Uani 1 1 d . . .
C55 C 0.3248(5) 0.4479(3) 0.2076(3) 0.0228(14) Uani 1 1 d . . .
C56 C 0.4212(5) 0.4269(3) 0.2307(3) 0.0180(13) Uani 1 1 d . . .
C61 C 0.5098(5) 0.4519(3) 0.4149(3) 0.0160(13) Uani 1 1 d . . .
C62 C 0.3938(5) 0.4411(3) 0.3979(3) 0.0206(14) Uani 1 1 d . . .
C63 C 0.3391(5) 0.4957(4) 0.3880(3) 0.0227(15) Uani 1 1 d . . .
C64 C 0.3992(6) 0.5653(4) 0.3949(3) 0.0264(16) Uani 1 1 d . . .
C65 C 0.5144(5) 0.5787(3) 0.4125(3) 0.0235(15) Uani 1 1 d . . .
C66 C 0.5659(5) 0.5226(3) 0.4227(3) 0.0210(14) Uani 1 1 d . . .
C111 C 0.8533(5) -0.0601(3) 0.7534(3) 0.0192(14) Uani 1 1 d . . .
C112 C 0.8156(5) -0.0545(3) 0.8557(3) 0.0185(13) Uani 1 1 d . . .
H112 H 0.7872 -0.0408 0.8966 0.022 Uiso 1 1 calc R . .
C113 C 0.8797(5) -0.1056(3) 0.8446(3) 0.0224(14) Uani 1 1 d . . .
H113 H 0.9040 -0.1336 0.8754 0.027 Uiso 1 1 calc R . .
C114 C 0.9691(6) -0.1568(4) 0.7473(4) 0.0309(17) Uani 1 1 d . . .
H11A H 0.9193 -0.1974 0.7131 0.046 Uiso 1 1 calc R . .
H11B H 1.0107 -0.1760 0.7821 0.046 Uiso 1 1 calc R . .
H11C H 1.0220 -0.1295 0.7248 0.046 Uiso 1 1 calc R . .
C121 C 0.9910(5) 0.0074(3) 0.6728(3) 0.0182(13) Uani 1 1 d . . .
C122 C 1.1667(5) 0.0504(4) 0.7041(4) 0.0283(16) Uani 1 1 d . . .
H122 H 1.2410 0.0617 0.7293 0.034 Uiso 1 1 calc R . .
C123 C 1.1354(5) 0.0727(3) 0.6466(3) 0.0217(14) Uani 1 1 d . . .
H123 H 1.1823 0.1020 0.6246 0.026 Uiso 1 1 calc R . .
C124 C 0.9528(6) 0.0572(4) 0.5673(3) 0.0304(16) Uani 1 1 d . . .
H12A H 0.9083 0.0104 0.5397 0.046 Uiso 1 1 calc R . .
H12B H 0.9998 0.0809 0.5394 0.046 Uiso 1 1 calc R . .
H12C H 0.9025 0.0886 0.5834 0.046 Uiso 1 1 calc R . .
C131 C 0.8490(5) -0.1265(3) 0.6119(3) 0.0191(14) Uani 1 1 d . . .
C132 C 0.8978(6) -0.2076(3) 0.5414(3) 0.0265(15) Uani 1 1 d . . .
H132 H 0.9409 -0.2319 0.5128 0.032 Uiso 1 1 calc R . .
C133 C 0.7916(6) -0.2370(3) 0.5494(3) 0.0268(16) Uani 1 1 d . . .
H133 H 0.7486 -0.2844 0.5280 0.032 Uiso 1 1 calc R . .
C134 C 0.6529(5) -0.1915(4) 0.6171(3) 0.0241(15) Uani 1 1 d . . .
H13A H 0.6126 -0.1563 0.6014 0.036 Uiso 1 1 calc R . .
H13B H 0.6656 -0.1818 0.6672 0.036 Uiso 1 1 calc R . .
H13C H 0.6084 -0.2410 0.5981 0.036 Uiso 1 1 calc R . .
C311 C 0.8393(5) 0.5315(3) 0.0533(3) 0.0162(13) Uani 1 1 d . . .
C312 C 0.8710(5) 0.5017(3) -0.0509(3) 0.0217(14) Uani 1 1 d . . .
H312 H 0.8707 0.4745 -0.0955 0.026 Uiso 1 1 calc R . .
C313 C 0.9277(5) 0.5717(3) -0.0237(3) 0.0219(14) Uani 1 1 d . . .
H313 H 0.9728 0.6020 -0.0459 0.026 Uiso 1 1 calc R . .
C314 C 0.9593(6) 0.6602(3) 0.0884(3) 0.0289(16) Uani 1 1 d . . .
H31A H 1.0176 0.6866 0.0687 0.043 Uiso 1 1 calc R . .
H31B H 0.9929 0.6517 0.1322 0.043 Uiso 1 1 calc R . .
H31C H 0.9021 0.6892 0.0958 0.043 Uiso 1 1 calc R . .
C321 C 0.7280(5) 0.6074(3) 0.1512(3) 0.0196(14) Uani 1 1 d . . .
C322 C 0.7391(6) 0.7201(4) 0.1962(5) 0.049(2) Uani 1 1 d . . .
H322 H 0.7675 0.7686 0.2221 0.059 Uiso 1 1 calc R . .
C323 C 0.6359(6) 0.6954(4) 0.1555(4) 0.0363(18) Uani 1 1 d . . .
H323 H 0.5796 0.7228 0.1488 0.044 Uiso 1 1 calc R . .
C324 C 0.5267(5) 0.5760(4) 0.0855(3) 0.0280(16) Uani 1 1 d . . .
H32A H 0.4815 0.5547 0.1156 0.042 Uiso 1 1 calc R . .
H32B H 0.5461 0.5370 0.0531 0.042 Uiso 1 1 calc R . .
H32C H 0.4837 0.6040 0.0602 0.042 Uiso 1 1 calc R . .
C331 C 0.8880(5) 0.5314(3) 0.1936(3) 0.0172(13) Uani 1 1 d . . .
C332 C 1.0541(5) 0.5457(3) 0.2494(3) 0.0209(14) Uani 1 1 d . . .
H332 H 1.1334 0.5535 0.2604 0.025 Uiso 1 1 calc R . .
C333 C 0.9846(5) 0.5363(4) 0.2934(3) 0.0264(16) Uani 1 1 d . . .
H333 H 1.0058 0.5358 0.3403 0.032 Uiso 1 1 calc R . .
C334 C 0.7748(6) 0.5185(4) 0.2877(4) 0.0393(19) Uani 1 1 d . . .
H33A H 0.7479 0.5642 0.2939 0.059 Uiso 1 1 calc R . .
H33B H 0.7903 0.5055 0.3321 0.059 Uiso 1 1 calc R . .
H33C H 0.7174 0.4796 0.2564 0.059 Uiso 1 1 calc R . .
C511 C 0.7027(5) 0.2416(3) 0.3794(3) 0.0179(13) Uani 1 1 d . . .
C512 C 0.6865(5) 0.2563(3) 0.4860(3) 0.0235(15) Uani 1 1 d . . .
H512 H 0.6686 0.2748 0.5293 0.028 Uiso 1 1 calc R . .
C513 C 0.7384(5) 0.2001(3) 0.4720(3) 0.0233(14) Uani 1 1 d . . .
H513 H 0.7636 0.1725 0.5030 0.028 Uiso 1 1 calc R . .
C514 C 0.7999(5) 0.1351(3) 0.3680(3) 0.0220(14) Uani 1 1 d . . .
H51A H 0.7415 0.0956 0.3384 0.033 Uiso 1 1 calc R . .
H51B H 0.8446 0.1155 0.4011 0.033 Uiso 1 1 calc R . .
H51C H 0.8485 0.1573 0.3400 0.033 Uiso 1 1 calc R . .
C521 C 0.6913(5) 0.1771(3) 0.2361(3) 0.0201(14) Uani 1 1 d . . .
C522 C 0.7264(6) 0.0955(3) 0.1589(4) 0.0303(16) Uani 1 1 d . . .
H522 H 0.7631 0.0710 0.1261 0.036 Uiso 1 1 calc R . .
C523 C 0.6235(6) 0.0684(4) 0.1709(4) 0.0298(16) Uani 1 1 d . . .
H523 H 0.5773 0.0219 0.1499 0.036 Uiso 1 1 calc R . .
C524 C 0.4978(5) 0.1174(3) 0.2483(4) 0.0263(16) Uani 1 1 d . . .
H52A H 0.5168 0.1246 0.2982 0.040 Uiso 1 1 calc R . .
H52B H 0.4484 0.0696 0.2290 0.040 Uiso 1 1 calc R . .
H52C H 0.4595 0.1556 0.2372 0.040 Uiso 1 1 calc R . .
C531 C 0.8515(5) 0.3017(3) 0.3063(3) 0.0190(14) Uani 1 1 d . . .
C532 C 1.0244(5) 0.3385(3) 0.3513(4) 0.0247(15) Uani 1 1 d . . .
H532 H 1.0934 0.3468 0.3821 0.030 Uiso 1 1 calc R . .
C533 C 1.0116(5) 0.3614(3) 0.2921(3) 0.0237(15) Uani 1 1 d . . .
H533 H 1.0682 0.3887 0.2745 0.028 Uiso 1 1 calc R . .
C534 C 0.8506(5) 0.3430(4) 0.1952(3) 0.0268(15) Uani 1 1 d . . .
H53A H 0.8400 0.2958 0.1630 0.040 Uiso 1 1 calc R . .
H53B H 0.8999 0.3802 0.1799 0.040 Uiso 1 1 calc R . .
H53C H 0.7779 0.3566 0.1972 0.040 Uiso 1 1 calc R . .
C1 C 0.8868(6) 0.9220(4) 0.1188(4) 0.0356(18) Uani 1 1 d . . .
D1 D 0.9089 0.9563 0.1648 0.043 Uiso 1 1 calc R . .
C2 C 0.9955(7) 0.7282(4) 0.3143(4) 0.052(2) Uani 1 1 d . . .
D2 D 0.9696 0.6839 0.2761 0.063 Uiso 1 1 calc R . .
C3 C 0.9738(12) 0.5351(8) 0.5188(7) 0.036(4) Uani 0.50 1 d P . .
D3 D 0.9498 0.5482 0.5640 0.044 Uiso 0.50 1 calc PR . .
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'
D D 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'
N N 0.0061 0.0033 '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'
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
C11 Au1 P1 172.24(18) . . ?
C11 Au1 Au2 103.23(17) . . ?
P1 Au1 Au2 83.28(4) . . ?
C21 Au2 N11 178.5(2) . . ?
C21 Au2 Au1 93.27(17) . . ?
N11 Au2 Au1 86.04(14) . . ?
C31 Au3 P3 174.54(18) . . ?
C31 Au3 Au4 100.20(17) . . ?
P3 Au3 Au4 84.43(4) . . ?
C41 Au4 N31 173.0(2) . . ?
C41 Au4 Au3 102.46(17) . . ?
N31 Au4 Au3 83.28(13) . . ?
C51 Au5 P5 170.07(17) . . ?
C51 Au5 Au6 100.16(17) . . ?
P5 Au5 Au6 84.71(4) . . ?
C61 Au6 N51 179.0(2) . . ?
C61 Au6 Au5 93.18(16) . . ?
N51 Au6 Au5 86.73(13) . . ?
C3 Cl32 C3 60.6(9) 2_766 . ?
C121 P1 C131 101.1(3) . . ?
C121 P1 C111 103.7(3) . . ?
C131 P1 C111 106.1(3) . . ?
C121 P1 Au1 119.0(2) . . ?
C131 P1 Au1 113.5(2) . . ?
C111 P1 Au1 112.0(2) . . ?
C311 P3 C321 106.4(3) . . ?
C311 P3 C331 103.4(3) . . ?
C321 P3 C331 101.6(3) . . ?
C311 P3 Au3 110.75(19) . . ?
C321 P3 Au3 115.5(2) . . ?
C331 P3 Au3 117.8(2) . . ?
C531 P5 C521 102.5(3) . . ?
C531 P5 C511 99.8(3) . . ?
C521 P5 C511 107.0(3) . . ?
C531 P5 Au5 123.7(2) . . ?
C521 P5 Au5 112.4(2) . . ?
C511 P5 Au5 109.9(2) . . ?
C111 N11 C112 106.5(5) . . ?
C111 N11 Au2 127.3(4) . . ?
C112 N11 Au2 125.7(4) . . ?
C111 N12 C113 108.8(5) . . ?
C111 N12 C114 127.3(5) . . ?
C113 N12 C114 123.9(5) . . ?
C121 N13 C122 104.4(5) . . ?
C121 N14 C123 106.4(5) . . ?
C121 N14 C124 127.4(5) . . ?
C123 N14 C124 126.1(5) . . ?
C131 N15 C132 105.6(5) . . ?
C133 N16 C131 106.7(5) . . ?
C133 N16 C134 125.5(5) . . ?
C131 N16 C134 127.8(5) . . ?
C312 N31 C311 107.4(5) . . ?
C312 N31 Au4 121.9(4) . . ?
C311 N31 Au4 126.1(4) . . ?
C313 N32 C311 108.4(5) . . ?
C313 N32 C314 123.1(5) . . ?
C311 N32 C314 128.4(5) . . ?
C321 N33 C322 105.9(6) . . ?
C323 N34 C321 106.7(5) . . ?
C323 N34 C324 123.4(5) . . ?
C321 N34 C324 129.3(5) . . ?
C331 N35 C332 104.3(5) . . ?
C331 N36 C333 104.8(5) . . ?
C331 N36 C334 128.4(5) . . ?
C333 N36 C334 126.9(6) . . ?
C511 N51 C512 106.3(5) . . ?
C511 N51 Au6 127.5(4) . . ?
C512 N51 Au6 126.2(4) . . ?
C511 N52 C513 107.8(5) . . ?
C511 N52 C514 127.1(5) . . ?
C513 N52 C514 125.0(5) . . ?
C521 N53 C522 104.6(5) . . ?
C521 N54 C523 106.4(5) . . ?
C521 N54 C524 127.2(5) . . ?
C523 N54 C524 126.4(5) . . ?
C531 N55 C532 104.8(5) . . ?
C531 N56 C533 106.1(5) . . ?
C531 N56 C534 127.6(5) . . ?
C533 N56 C534 126.0(5) . . ?
C12 C11 C16 114.2(6) . . ?
C12 C11 Au1 120.9(5) . . ?
C16 C11 Au1 124.9(5) . . ?
F12 C12 C11 120.0(5) . . ?
F12 C12 C13 116.4(5) . . ?
C11 C12 C13 123.6(6) . . ?
F13 C13 C14 120.0(5) . . ?
F13 C13 C12 121.0(5) . . ?
C14 C13 C12 119.1(6) . . ?
C13 C14 F14 120.2(6) . . ?
C13 C14 C15 120.1(6) . . ?
F14 C14 C15 119.7(6) . . ?
F15 C15 C14 120.2(6) . . ?
F15 C15 C16 120.7(6) . . ?
C14 C15 C16 119.1(6) . . ?
F16 C16 C15 117.2(6) . . ?
F16 C16 C11 118.9(5) . . ?
C15 C16 C11 123.9(6) . . ?
C22 C21 C26 114.7(6) . . ?
C22 C21 Au2 123.6(5) . . ?
C26 C21 Au2 121.3(5) . . ?
F22 C22 C23 116.2(6) . . ?
F22 C22 C21 120.3(6) . . ?
C23 C22 C21 123.5(6) . . ?
F23 C23 C22 121.2(6) . . ?
F23 C23 C24 119.6(6) . . ?
C22 C23 C24 119.3(6) . . ?
F24 C24 C25 121.4(6) . . ?
F24 C24 C23 119.5(6) . . ?
C25 C24 C23 119.1(6) . . ?
F25 C25 C24 119.3(6) . . ?
F25 C25 C26 121.2(6) . . ?
C24 C25 C26 119.5(6) . . ?
F26 C26 C25 116.3(5) . . ?
F26 C26 C21 119.8(6) . . ?
C25 C26 C21 123.9(6) . . ?
C32 C31 C36 114.4(5) . . ?
C32 C31 Au3 123.9(4) . . ?
C36 C31 Au3 121.7(5) . . ?
F32 C32 C33 115.7(5) . . ?
F32 C32 C31 120.0(5) . . ?
C33 C32 C31 124.4(6) . . ?
F33 C33 C32 122.4(6) . . ?
F33 C33 C34 119.4(6) . . ?
C32 C33 C34 118.2(6) . . ?
F34 C34 C35 119.7(6) . . ?
F34 C34 C33 119.9(6) . . ?
C35 C34 C33 120.4(6) . . ?
F35 C35 C36 122.3(6) . . ?
F35 C35 C34 119.6(5) . . ?
C36 C35 C34 118.1(6) . . ?
F36 C36 C35 115.3(6) . . ?
F36 C36 C31 120.1(5) . . ?
C35 C36 C31 124.5(6) . . ?
C46 C41 C42 114.5(6) . . ?
C46 C41 Au4 124.3(5) . . ?
C42 C41 Au4 121.2(5) . . ?
F42 C42 C41 120.4(6) . . ?
F42 C42 C43 115.3(6) . . ?
C41 C42 C43 124.3(6) . . ?
F43 C43 C44 119.9(6) . . ?
F43 C43 C42 121.7(7) . . ?
C44 C43 C42 118.4(7) . . ?
F44 C44 C43 120.7(7) . . ?
F44 C44 C45 119.3(7) . . ?
C43 C44 C45 120.0(6) . . ?
F45 C45 C44 120.1(6) . . ?
F45 C45 C46 120.7(6) . . ?
C44 C45 C46 119.1(6) . . ?
F46 C46 C41 120.0(5) . . ?
F46 C46 C45 116.3(6) . . ?
C41 C46 C45 123.7(6) . . ?
C52 C51 C56 113.6(5) . . ?
C52 C51 Au5 120.3(5) . . ?
C56 C51 Au5 126.0(4) . . ?
C53 C52 F52 115.8(5) . . ?
C53 C52 C51 124.9(6) . . ?
F52 C52 C51 119.3(5) . . ?
F53 C53 C52 122.7(5) . . ?
F53 C53 C54 118.0(5) . . ?
C52 C53 C54 119.2(6) . . ?
F54 C54 C55 120.9(5) . . ?
F54 C54 C53 120.4(5) . . ?
C55 C54 C53 118.6(5) . . ?
F55 C55 C56 121.2(6) . . ?
F55 C55 C54 119.2(6) . . ?
C56 C55 C54 119.6(6) . . ?
F56 C56 C55 116.5(5) . . ?
F56 C56 C51 119.5(5) . . ?
C55 C56 C51 123.9(6) . . ?
C66 C61 C62 114.6(5) . . ?
C66 C61 Au6 123.5(5) . . ?
C62 C61 Au6 121.8(4) . . ?
F62 C62 C63 116.8(6) . . ?
F62 C62 C61 120.0(5) . . ?
C63 C62 C61 123.2(6) . . ?
F63 C63 C62 120.9(6) . . ?
F63 C63 C64 119.1(6) . . ?
C62 C63 C64 120.0(6) . . ?
F64 C64 C63 120.5(6) . . ?
F64 C64 C65 120.7(6) . . ?
C63 C64 C65 118.8(6) . . ?
F65 C65 C66 121.2(6) . . ?
F65 C65 C64 119.3(6) . . ?
C66 C65 C64 119.4(6) . . ?
F66 C66 C65 116.1(6) . . ?
F66 C66 C61 120.0(6) . . ?
C65 C66 C61 123.9(6) . . ?
N12 C111 N11 109.4(5) . . ?
N12 C111 P1 128.8(5) . . ?
N11 C111 P1 121.8(4) . . ?
N11 C112 C113 109.3(5) . . ?
N11 C112 H112 125.3 . . ?
C113 C112 H112 125.3 . . ?
N12 C113 C112 106.0(6) . . ?
N12 C113 H113 127.0 . . ?
C112 C113 H113 127.0 . . ?
N12 C114 H11A 109.5 . . ?
N12 C114 H11B 109.5 . . ?
H11A C114 H11B 109.5 . . ?
N12 C114 H11C 109.5 . . ?
H11A C114 H11C 109.5 . . ?
H11B C114 H11C 109.5 . . ?
N13 C121 N14 111.6(5) . . ?
N13 C121 P1 123.6(5) . . ?
N14 C121 P1 124.7(5) . . ?
C123 C122 N13 110.8(6) . . ?
C123 C122 H122 124.6 . . ?
N13 C122 H122 124.6 . . ?
C122 C123 N14 106.7(6) . . ?
C122 C123 H123 126.6 . . ?
N14 C123 H123 126.6 . . ?
N14 C124 H12A 109.5 . . ?
N14 C124 H12B 109.5 . . ?
H12A C124 H12B 109.5 . . ?
N14 C124 H12C 109.5 . . ?
H12A C124 H12C 109.5 . . ?
H12B C124 H12C 109.5 . . ?
N15 C131 N16 111.6(5) . . ?
N15 C131 P1 123.4(5) . . ?
N16 C131 P1 124.9(5) . . ?
N15 C132 C133 110.1(6) . . ?
N15 C132 H132 124.9 . . ?
C133 C132 H132 124.9 . . ?
N16 C133 C132 106.0(5) . . ?
N16 C133 H133 127.0 . . ?
C132 C133 H133 127.0 . . ?
N16 C134 H13A 109.5 . . ?
N16 C134 H13B 109.5 . . ?
H13A C134 H13B 109.5 . . ?
N16 C134 H13C 109.5 . . ?
H13A C134 H13C 109.5 . . ?
H13B C134 H13C 109.5 . . ?
N31 C311 N32 108.2(5) . . ?
N31 C311 P3 121.4(4) . . ?
N32 C311 P3 130.0(4) . . ?
N31 C312 C313 109.1(5) . . ?
N31 C312 H312 125.4 . . ?
C313 C312 H312 125.4 . . ?
N32 C313 C312 106.9(5) . . ?
N32 C313 H313 126.6 . . ?
C312 C313 H313 126.6 . . ?
N32 C314 H31A 109.5 . . ?
N32 C314 H31B 109.5 . . ?
H31A C314 H31B 109.5 . . ?
N32 C314 H31C 109.5 . . ?
H31A C314 H31C 109.5 . . ?
H31B C314 H31C 109.5 . . ?
N33 C321 N34 111.0(5) . . ?
N33 C321 P3 121.7(5) . . ?
N34 C321 P3 127.1(4) . . ?
N33 C322 C323 109.6(6) . . ?
N33 C322 H322 125.2 . . ?
C323 C322 H322 125.2 . . ?
N34 C323 C322 106.8(6) . . ?
N34 C323 H323 126.6 . . ?
C322 C323 H323 126.6 . . ?
N34 C324 H32A 109.5 . . ?
N34 C324 H32B 109.5 . . ?
H32A C324 H32B 109.5 . . ?
N34 C324 H32C 109.5 . . ?
H32A C324 H32C 109.5 . . ?
H32B C324 H32C 109.5 . . ?
N35 C331 N36 112.6(5) . . ?
N35 C331 P3 123.2(5) . . ?
N36 C331 P3 124.2(4) . . ?
C333 C332 N35 110.4(5) . . ?
C333 C332 H332 124.8 . . ?
N35 C332 H332 124.8 . . ?
C332 C333 N36 108.0(6) . . ?
C332 C333 H333 126.0 . . ?
N36 C333 H333 126.0 . . ?
N36 C334 H33A 109.5 . . ?
N36 C334 H33B 109.5 . . ?
H33A C334 H33B 109.5 . . ?
N36 C334 H33C 109.5 . . ?
H33A C334 H33C 109.5 . . ?
H33B C334 H33C 109.5 . . ?
N51 C511 N52 109.2(5) . . ?
N51 C511 P5 122.7(5) . . ?
N52 C511 P5 127.7(5) . . ?
C513 C512 N51 109.9(6) . . ?
C513 C512 H512 125.1 . . ?
N51 C512 H512 125.1 . . ?
C512 C513 N52 106.8(6) . . ?
C512 C513 H513 126.6 . . ?
N52 C513 H513 126.6 . . ?
N52 C514 H51A 109.5 . . ?
N52 C514 H51B 109.5 . . ?
H51A C514 H51B 109.5 . . ?
N52 C514 H51C 109.5 . . ?
H51A C514 H51C 109.5 . . ?
H51B C514 H51C 109.5 . . ?
N53 C521 N54 112.0(5) . . ?
N53 C521 P5 122.1(5) . . ?
N54 C521 P5 125.8(4) . . ?
C523 C522 N53 110.7(6) . . ?
C523 C522 H522 124.6 . . ?
N53 C522 H522 124.6 . . ?
C522 C523 N54 106.2(6) . . ?
C522 C523 H523 126.9 . . ?
N54 C523 H523 126.9 . . ?
N54 C524 H52A 109.5 . . ?
N54 C524 H52B 109.5 . . ?
H52A C524 H52B 109.5 . . ?
N54 C524 H52C 109.5 . . ?
H52A C524 H52C 109.5 . . ?
H52B C524 H52C 109.5 . . ?
N55 C531 N56 112.0(5) . . ?
N55 C531 P5 121.8(5) . . ?
N56 C531 P5 126.2(5) . . ?
C533 C532 N55 110.6(6) . . ?
C533 C532 H532 124.7 . . ?
N55 C532 H532 124.7 . . ?
C532 C533 N56 106.5(6) . . ?
C532 C533 H533 126.8 . . ?
N56 C533 H533 126.8 . . ?
N56 C534 H53A 109.5 . . ?
N56 C534 H53B 109.5 . . ?
H53A C534 H53B 109.5 . . ?
N56 C534 H53C 109.5 . . ?
H53A C534 H53C 109.5 . . ?
H53B C534 H53C 109.5 . . ?
Cl13 C1 Cl11 110.3(4) . . ?
Cl13 C1 Cl12 111.8(4) . . ?
Cl11 C1 Cl12 110.1(4) . . ?
Cl13 C1 D1 108.2 . . ?
Cl11 C1 D1 108.2 . . ?
Cl12 C1 D1 108.2 . . ?
Cl21 C2 Cl22 110.1(5) . . ?
Cl21 C2 Cl23 110.9(5) . . ?
Cl22 C2 Cl23 110.4(5) . . ?
Cl21 C2 D2 108.4 . . ?
Cl22 C2 D2 108.4 . . ?
Cl23 C2 D2 108.4 . . ?
Cl32 C3 Cl32 119.4(9) 2_766 . ?
Cl32 C3 Cl31 102.3(8) 2_766 . ?
Cl32 C3 Cl31 103.4(7) . . ?
Cl32 C3 D3 110.3 2_766 . ?
Cl32 C3 D3 110.3 . . ?
Cl31 C3 D3 110.3 . . ?
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 C11 2.047(6) . ?
Au1 P1 2.2648(16) . ?
Au1 Au2 3.0240(4) . ?
Au2 C21 2.004(6) . ?
Au2 N11 2.060(5) . ?
Au3 C31 2.046(6) . ?
Au3 P3 2.2752(16) . ?
Au3 Au4 3.0170(4) . ?
Au4 C41 2.003(6) . ?
Au4 N31 2.062(5) . ?
Au5 C51 2.045(6) . ?
Au5 P5 2.2660(16) . ?
Au5 Au6 2.9903(4) . ?
Au6 C61 2.008(6) . ?
Au6 N51 2.060(5) . ?
Cl11 C1 1.754(7) . ?
Cl12 C1 1.759(7) . ?
Cl13 C1 1.743(8) . ?
Cl21 C2 1.737(8) . ?
Cl22 C2 1.746(8) . ?
Cl23 C2 1.753(10) . ?
Cl31 C3 1.753(15) . ?
Cl32 C3 1.665(14) 2_766 ?
Cl32 C3 1.676(14) . ?
P1 C121 1.797(6) . ?
P1 C131 1.805(6) . ?
P1 C111 1.808(6) . ?
P3 C311 1.793(6) . ?
P3 C321 1.794(6) . ?
P3 C331 1.799(6) . ?
P5 C531 1.791(6) . ?
P5 C521 1.797(6) . ?
P5 C511 1.804(6) . ?
F12 C12 1.364(7) . ?
F13 C13 1.351(7) . ?
F14 C14 1.360(7) . ?
F15 C15 1.353(7) . ?
F16 C16 1.369(7) . ?
F22 C22 1.357(7) . ?
F23 C23 1.359(7) . ?
F24 C24 1.349(7) . ?
F25 C25 1.350(7) . ?
F26 C26 1.356(7) . ?
F32 C32 1.353(7) . ?
F33 C33 1.349(7) . ?
F34 C34 1.352(7) . ?
F35 C35 1.342(7) . ?
F36 C36 1.367(7) . ?
F42 C42 1.366(7) . ?
F43 C43 1.344(8) . ?
F44 C44 1.360(7) . ?
F45 C45 1.357(7) . ?
F46 C46 1.357(7) . ?
F52 C52 1.372(7) . ?
F53 C53 1.351(7) . ?
F54 C54 1.335(7) . ?
F55 C55 1.353(7) . ?
F56 C56 1.361(7) . ?
F62 C62 1.354(7) . ?
F63 C63 1.355(7) . ?
F64 C64 1.349(7) . ?
F65 C65 1.350(7) . ?
F66 C66 1.355(7) . ?
N11 C111 1.349(8) . ?
N11 C112 1.363(8) . ?
N12 C111 1.337(7) . ?
N12 C113 1.365(8) . ?
N12 C114 1.476(8) . ?
N13 C121 1.331(7) . ?
N13 C122 1.369(8) . ?
N14 C121 1.360(8) . ?
N14 C123 1.362(8) . ?
N14 C124 1.452(8) . ?
N15 C131 1.310(8) . ?
N15 C132 1.355(8) . ?
N16 C133 1.350(8) . ?
N16 C131 1.366(7) . ?
N16 C134 1.465(8) . ?
N31 C312 1.352(8) . ?
N31 C311 1.357(7) . ?
N32 C313 1.359(8) . ?
N32 C311 1.361(7) . ?
N32 C314 1.470(8) . ?
N33 C321 1.321(8) . ?
N33 C322 1.364(9) . ?
N34 C323 1.357(8) . ?
N34 C321 1.364(8) . ?
N34 C324 1.462(8) . ?
N35 C331 1.331(8) . ?
N35 C332 1.379(8) . ?
N36 C331 1.366(8) . ?
N36 C333 1.377(8) . ?
N36 C334 1.452(8) . ?
N51 C511 1.348(7) . ?
N51 C512 1.356(8) . ?
N52 C511 1.353(7) . ?
N52 C513 1.362(8) . ?
N52 C514 1.469(7) . ?
N53 C521 1.323(8) . ?
N53 C522 1.371(8) . ?
N54 C521 1.361(7) . ?
N54 C523 1.368(8) . ?
N54 C524 1.456(8) . ?
N55 C531 1.320(7) . ?
N55 C532 1.370(8) . ?
N56 C531 1.365(8) . ?
N56 C533 1.369(8) . ?
N56 C534 1.446(8) . ?
C11 C12 1.377(9) . ?
C11 C16 1.377(8) . ?
C12 C13 1.386(8) . ?
C13 C14 1.351(9) . ?
C14 C15 1.366(9) . ?
C15 C16 1.373(9) . ?
C21 C22 1.374(9) . ?
C21 C26 1.390(8) . ?
C22 C23 1.374(9) . ?
C23 C24 1.397(9) . ?
C24 C25 1.362(10) . ?
C25 C26 1.370(9) . ?
C31 C32 1.376(8) . ?
C31 C36 1.384(9) . ?
C32 C33 1.374(8) . ?
C33 C34 1.387(9) . ?
C34 C35 1.376(9) . ?
C35 C36 1.373(8) . ?
C41 C46 1.372(9) . ?
C41 C42 1.374(9) . ?
C42 C43 1.377(9) . ?
C43 C44 1.366(10) . ?
C44 C45 1.370(10) . ?
C45 C46 1.373(9) . ?
C51 C52 1.383(8) . ?
C51 C56 1.386(8) . ?
C52 C53 1.356(8) . ?
C53 C54 1.386(8) . ?
C54 C55 1.377(8) . ?
C55 C56 1.371(9) . ?
C61 C66 1.374(8) . ?
C61 C62 1.392(9) . ?
C62 C63 1.370(9) . ?
C63 C64 1.375(9) . ?
C64 C65 1.379(9) . ?
C65 C66 1.373(9) . ?
C112 C113 1.365(9) . ?
C112 H112 0.9500 . ?
C113 H113 0.9500 . ?
C114 H11A 0.9800 . ?
C114 H11B 0.9800 . ?
C114 H11C 0.9800 . ?
C122 C123 1.347(9) . ?
C122 H122 0.9500 . ?
C123 H123 0.9500 . ?
C124 H12A 0.9800 . ?
C124 H12B 0.9800 . ?
C124 H12C 0.9800 . ?
C132 C133 1.376(9) . ?
C132 H132 0.9500 . ?
C133 H133 0.9500 . ?
C134 H13A 0.9800 . ?
C134 H13B 0.9800 . ?
C134 H13C 0.9800 . ?
C312 C313 1.364(9) . ?
C312 H312 0.9500 . ?
C313 H313 0.9500 . ?
C314 H31A 0.9800 . ?
C314 H31B 0.9800 . ?
C314 H31C 0.9800 . ?
C322 C323 1.364(10) . ?
C322 H322 0.9500 . ?
C323 H323 0.9500 . ?
C324 H32A 0.9800 . ?
C324 H32B 0.9800 . ?
C324 H32C 0.9800 . ?
C332 C333 1.336(9) . ?
C332 H332 0.9500 . ?
C333 H333 0.9500 . ?
C334 H33A 0.9800 . ?
C334 H33B 0.9800 . ?
C334 H33C 0.9800 . ?
C512 C513 1.348(9) . ?
C512 H512 0.9500 . ?
C513 H513 0.9500 . ?
C514 H51A 0.9800 . ?
C514 H51B 0.9800 . ?
C514 H51C 0.9800 . ?
C522 C523 1.357(10) . ?
C522 H522 0.9500 . ?
C523 H523 0.9500 . ?
C524 H52A 0.9800 . ?
C524 H52B 0.9800 . ?
C524 H52C 0.9800 . ?
C532 C533 1.354(9) . ?
C532 H532 0.9500 . ?
C533 H533 0.9500 . ?
C534 H53A 0.9800 . ?
C534 H53B 0.9800 . ?
C534 H53C 0.9800 . ?
C1 D1 1.0000 . ?
C2 D2 1.0000 . ?
C3 D3 1.0000 . ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C1 D1 N13 1.00 2.24 3.181(9) 156.0 2_766
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
C11 Au1 Au2 C21 -29.1(3) . . . . ?
P1 Au1 Au2 C21 155.17(19) . . . . ?
C11 Au1 Au2 N11 152.2(2) . . . . ?
P1 Au1 Au2 N11 -23.53(14) . . . . ?
C31 Au3 Au4 C41 -34.1(3) . . . . ?
P3 Au3 Au4 C41 148.88(19) . . . . ?
C31 Au3 Au4 N31 150.0(2) . . . . ?
P3 Au3 Au4 N31 -27.05(14) . . . . ?
C51 Au5 Au6 C61 -27.8(3) . . . . ?
P5 Au5 Au6 C61 160.95(18) . . . . ?
C51 Au5 Au6 N51 151.2(2) . . . . ?
P5 Au5 Au6 N51 -20.09(14) . . . . ?
Au2 Au1 P1 C121 -95.8(2) . . . . ?
Au2 Au1 P1 C131 145.5(2) . . . . ?
Au2 Au1 P1 C111 25.4(2) . . . . ?
Au4 Au3 P3 C311 22.7(2) . . . . ?
Au4 Au3 P3 C321 143.8(2) . . . . ?
Au4 Au3 P3 C331 -95.9(2) . . . . ?
Au6 Au5 P5 C531 -91.4(3) . . . . ?
Au6 Au5 P5 C521 144.9(2) . . . . ?
Au6 Au5 P5 C511 25.9(2) . . . . ?
Au1 Au2 N11 C111 24.1(5) . . . . ?
Au1 Au2 N11 C112 -165.0(5) . . . . ?
Au3 Au4 N31 C312 -169.3(4) . . . . ?
Au3 Au4 N31 C311 37.8(4) . . . . ?
Au5 Au6 N51 C511 13.0(5) . . . . ?
Au5 Au6 N51 C512 -168.4(5) . . . . ?
Au2 Au1 C11 C12 -95.7(5) . . . . ?
Au2 Au1 C11 C16 83.6(5) . . . . ?
C16 C11 C12 F12 -179.5(5) . . . . ?
Au1 C11 C12 F12 -0.1(8) . . . . ?
C16 C11 C12 C13 -0.2(9) . . . . ?
Au1 C11 C12 C13 179.3(5) . . . . ?
F12 C12 C13 F13 -1.5(8) . . . . ?
C11 C12 C13 F13 179.2(6) . . . . ?
F12 C12 C13 C14 179.5(5) . . . . ?
C11 C12 C13 C14 0.2(10) . . . . ?
F13 C13 C14 F14 2.2(9) . . . . ?
C12 C13 C14 F14 -178.8(5) . . . . ?
F13 C13 C14 C15 -179.7(6) . . . . ?
C12 C13 C14 C15 -0.7(9) . . . . ?
C13 C14 C15 F15 -178.6(6) . . . . ?
F14 C14 C15 F15 -0.5(9) . . . . ?
C13 C14 C15 C16 1.3(10) . . . . ?
F14 C14 C15 C16 179.4(6) . . . . ?
F15 C15 C16 F16 0.1(9) . . . . ?
C14 C15 C16 F16 -179.8(5) . . . . ?
F15 C15 C16 C11 178.6(6) . . . . ?
C14 C15 C16 C11 -1.4(10) . . . . ?
C12 C11 C16 F16 179.2(5) . . . . ?
Au1 C11 C16 F16 -0.2(8) . . . . ?
C12 C11 C16 C15 0.8(9) . . . . ?
Au1 C11 C16 C15 -178.6(5) . . . . ?
Au1 Au2 C21 C22 66.8(5) . . . . ?
Au1 Au2 C21 C26 -104.7(5) . . . . ?
C26 C21 C22 F22 -178.8(5) . . . . ?
Au2 C21 C22 F22 9.3(8) . . . . ?
C26 C21 C22 C23 3.4(9) . . . . ?
Au2 C21 C22 C23 -168.5(5) . . . . ?
F22 C22 C23 F23 -0.2(9) . . . . ?
C21 C22 C23 F23 177.8(6) . . . . ?
F22 C22 C23 C24 -179.8(6) . . . . ?
C21 C22 C23 C24 -1.9(10) . . . . ?
F23 C23 C24 F24 0.5(10) . . . . ?
C22 C23 C24 F24 -179.8(6) . . . . ?
F23 C23 C24 C25 179.3(6) . . . . ?
C22 C23 C24 C25 -1.1(10) . . . . ?
F24 C24 C25 F25 0.8(10) . . . . ?
C23 C24 C25 F25 -177.9(6) . . . . ?
F24 C24 C25 C26 -179.1(6) . . . . ?
C23 C24 C25 C26 2.2(10) . . . . ?
F25 C25 C26 F26 -0.1(9) . . . . ?
C24 C25 C26 F26 179.8(6) . . . . ?
F25 C25 C26 C21 179.6(6) . . . . ?
C24 C25 C26 C21 -0.6(10) . . . . ?
C22 C21 C26 F26 177.5(5) . . . . ?
Au2 C21 C26 F26 -10.4(8) . . . . ?
C22 C21 C26 C25 -2.2(9) . . . . ?
Au2 C21 C26 C25 170.0(5) . . . . ?
Au4 Au3 C31 C32 66.7(5) . . . . ?
Au4 Au3 C31 C36 -115.0(5) . . . . ?
C36 C31 C32 F32 179.5(5) . . . . ?
Au3 C31 C32 F32 -2.1(8) . . . . ?
C36 C31 C32 C33 -0.7(9) . . . . ?
Au3 C31 C32 C33 177.7(5) . . . . ?
F32 C32 C33 F33 0.8(8) . . . . ?
C31 C32 C33 F33 -179.0(5) . . . . ?
F32 C32 C33 C34 179.1(5) . . . . ?
C31 C32 C33 C34 -0.7(9) . . . . ?
F33 C33 C34 F34 0.2(9) . . . . ?
C32 C33 C34 F34 -178.2(5) . . . . ?
F33 C33 C34 C35 -180.0(5) . . . . ?
C32 C33 C34 C35 1.6(9) . . . . ?
F34 C34 C35 F35 0.3(9) . . . . ?
C33 C34 C35 F35 -179.5(5) . . . . ?
F34 C34 C35 C36 178.6(5) . . . . ?
C33 C34 C35 C36 -1.2(9) . . . . ?
F35 C35 C36 F36 0.1(9) . . . . ?
C34 C35 C36 F36 -178.2(5) . . . . ?
F35 C35 C36 C31 178.0(6) . . . . ?
C34 C35 C36 C31 -0.3(10) . . . . ?
C32 C31 C36 F36 179.0(5) . . . . ?
Au3 C31 C36 F36 0.6(8) . . . . ?
C32 C31 C36 C35 1.2(9) . . . . ?
Au3 C31 C36 C35 -177.2(5) . . . . ?
Au3 Au4 C41 C46 73.4(5) . . . . ?
Au3 Au4 C41 C42 -107.7(5) . . . . ?
C46 C41 C42 F42 179.8(5) . . . . ?
Au4 C41 C42 F42 0.8(8) . . . . ?
C46 C41 C42 C43 -0.5(10) . . . . ?
Au4 C41 C42 C43 -179.5(5) . . . . ?
F42 C42 C43 F43 0.1(10) . . . . ?
C41 C42 C43 F43 -179.7(6) . . . . ?
F42 C42 C43 C44 179.0(6) . . . . ?
C41 C42 C43 C44 -0.8(11) . . . . ?
F43 C43 C44 F44 -1.4(10) . . . . ?
C42 C43 C44 F44 179.7(6) . . . . ?
F43 C43 C44 C45 179.9(6) . . . . ?
C42 C43 C44 C45 1.0(11) . . . . ?
F44 C44 C45 F45 0.1(10) . . . . ?
C43 C44 C45 F45 178.8(6) . . . . ?
F44 C44 C45 C46 -178.7(6) . . . . ?
C43 C44 C45 C46 -0.1(11) . . . . ?
C42 C41 C46 F46 -179.5(5) . . . . ?
Au4 C41 C46 F46 -0.5(9) . . . . ?
C42 C41 C46 C45 1.5(10) . . . . ?
Au4 C41 C46 C45 -179.5(5) . . . . ?
F45 C45 C46 F46 0.9(9) . . . . ?
C44 C45 C46 F46 179.7(6) . . . . ?
F45 C45 C46 C41 179.9(6) . . . . ?
C44 C45 C46 C41 -1.3(10) . . . . ?
Au6 Au5 C51 C52 -99.0(5) . . . . ?
Au6 Au5 C51 C56 83.7(5) . . . . ?
C56 C51 C52 C53 0.1(9) . . . . ?
Au5 C51 C52 C53 -177.5(5) . . . . ?
C56 C51 C52 F52 179.8(5) . . . . ?
Au5 C51 C52 F52 2.1(8) . . . . ?
F52 C52 C53 F53 -1.2(9) . . . . ?
C51 C52 C53 F53 178.4(6) . . . . ?
F52 C52 C53 C54 179.6(5) . . . . ?
C51 C52 C53 C54 -0.7(10) . . . . ?
F53 C53 C54 F54 2.3(9) . . . . ?
C52 C53 C54 F54 -178.4(5) . . . . ?
F53 C53 C54 C55 -178.9(5) . . . . ?
C52 C53 C54 C55 0.3(9) . . . . ?
F54 C54 C55 F55 -0.8(9) . . . . ?
C53 C54 C55 F55 -179.6(5) . . . . ?
F54 C54 C55 C56 179.4(5) . . . . ?
C53 C54 C55 C56 0.7(9) . . . . ?
F55 C55 C56 F56 -0.2(9) . . . . ?
C54 C55 C56 F56 179.5(5) . . . . ?
F55 C55 C56 C51 178.9(6) . . . . ?
C54 C55 C56 C51 -1.4(10) . . . . ?
C52 C51 C56 F56 -180.0(5) . . . . ?
Au5 C51 C56 F56 -2.5(8) . . . . ?
C52 C51 C56 C55 0.9(9) . . . . ?
Au5 C51 C56 C55 178.4(5) . . . . ?
Au5 Au6 C61 C66 -97.6(5) . . . . ?
Au5 Au6 C61 C62 79.0(5) . . . . ?
C66 C61 C62 F62 -179.2(5) . . . . ?
Au6 C61 C62 F62 3.9(8) . . . . ?
C66 C61 C62 C63 1.5(9) . . . . ?
Au6 C61 C62 C63 -175.3(5) . . . . ?
F62 C62 C63 F63 -1.4(9) . . . . ?
C61 C62 C63 F63 177.8(6) . . . . ?
F62 C62 C63 C64 -179.4(5) . . . . ?
C61 C62 C63 C64 -0.2(10) . . . . ?
F63 C63 C64 F64 0.0(9) . . . . ?
C62 C63 C64 F64 178.0(6) . . . . ?
F63 C63 C64 C65 -178.7(6) . . . . ?
C62 C63 C64 C65 -0.7(10) . . . . ?
F64 C64 C65 F65 2.7(10) . . . . ?
C63 C64 C65 F65 -178.6(6) . . . . ?
F64 C64 C65 C66 -178.6(6) . . . . ?
C63 C64 C65 C66 0.1(10) . . . . ?
F65 C65 C66 F66 -1.1(9) . . . . ?
C64 C65 C66 F66 -179.8(6) . . . . ?
F65 C65 C66 C61 -179.9(6) . . . . ?
C64 C65 C66 C61 1.4(10) . . . . ?
C62 C61 C66 F66 179.1(5) . . . . ?
Au6 C61 C66 F66 -4.1(8) . . . . ?
C62 C61 C66 C65 -2.1(9) . . . . ?
Au6 C61 C66 C65 174.6(5) . . . . ?
C113 N12 C111 N11 -0.5(7) . . . . ?
C114 N12 C111 N11 179.5(5) . . . . ?
C113 N12 C111 P1 -178.3(5) . . . . ?
C114 N12 C111 P1 1.7(9) . . . . ?
C112 N11 C111 N12 0.5(6) . . . . ?
Au2 N11 C111 N12 172.9(4) . . . . ?
C112 N11 C111 P1 178.5(4) . . . . ?
Au2 N11 C111 P1 -9.2(7) . . . . ?
C121 P1 C111 N12 -72.7(6) . . . . ?
C131 P1 C111 N12 33.3(6) . . . . ?
Au1 P1 C111 N12 157.7(5) . . . . ?
C121 P1 C111 N11 109.7(5) . . . . ?
C131 P1 C111 N11 -144.2(5) . . . . ?
Au1 P1 C111 N11 -19.9(5) . . . . ?
C111 N11 C112 C113 -0.4(7) . . . . ?
Au2 N11 C112 C113 -172.9(4) . . . . ?
C111 N12 C113 C112 0.2(7) . . . . ?
C114 N12 C113 C112 -179.7(5) . . . . ?
N11 C112 C113 N12 0.1(7) . . . . ?
C122 N13 C121 N14 0.6(7) . . . . ?
C122 N13 C121 P1 178.9(5) . . . . ?
C123 N14 C121 N13 -0.9(7) . . . . ?
C124 N14 C121 N13 -177.5(6) . . . . ?
C123 N14 C121 P1 -179.2(4) . . . . ?
C124 N14 C121 P1 4.2(9) . . . . ?
C131 P1 C121 N13 -94.9(5) . . . . ?
C111 P1 C121 N13 14.9(6) . . . . ?
Au1 P1 C121 N13 140.2(4) . . . . ?
C131 P1 C121 N14 83.3(5) . . . . ?
C111 P1 C121 N14 -166.9(5) . . . . ?
Au1 P1 C121 N14 -41.7(6) . . . . ?
C121 N13 C122 C123 0.0(7) . . . . ?
N13 C122 C123 N14 -0.5(7) . . . . ?
C121 N14 C123 C122 0.8(7) . . . . ?
C124 N14 C123 C122 177.5(6) . . . . ?
C132 N15 C131 N16 -0.9(7) . . . . ?
C132 N15 C131 P1 -178.6(5) . . . . ?
C133 N16 C131 N15 1.1(7) . . . . ?
C134 N16 C131 N15 -178.7(6) . . . . ?
C133 N16 C131 P1 178.7(5) . . . . ?
C134 N16 C131 P1 -1.0(9) . . . . ?
C121 P1 C131 N15 -5.4(6) . . . . ?
C111 P1 C131 N15 -113.3(5) . . . . ?
Au1 P1 C131 N15 123.3(5) . . . . ?
C121 P1 C131 N16 177.3(5) . . . . ?
C111 P1 C131 N16 69.3(6) . . . . ?
Au1 P1 C131 N16 -54.1(6) . . . . ?
C131 N15 C132 C133 0.5(7) . . . . ?
C131 N16 C133 C132 -0.7(7) . . . . ?
C134 N16 C133 C132 179.1(6) . . . . ?
N15 C132 C133 N16 0.1(8) . . . . ?
C312 N31 C311 N32 1.5(6) . . . . ?
Au4 N31 C311 N32 157.6(4) . . . . ?
C312 N31 C311 P3 174.9(4) . . . . ?
Au4 N31 C311 P3 -29.1(7) . . . . ?
C313 N32 C311 N31 -1.1(6) . . . . ?
C314 N32 C311 N31 -177.2(6) . . . . ?
C313 N32 C311 P3 -173.7(5) . . . . ?
C314 N32 C311 P3 10.2(9) . . . . ?
C321 P3 C311 N31 -133.3(5) . . . . ?
C331 P3 C311 N31 120.1(5) . . . . ?
Au3 P3 C311 N31 -6.9(5) . . . . ?
C321 P3 C311 N32 38.5(6) . . . . ?
C331 P3 C311 N32 -68.1(6) . . . . ?
Au3 P3 C311 N32 164.8(5) . . . . ?
C311 N31 C312 C313 -1.4(7) . . . . ?
Au4 N31 C312 C313 -158.7(4) . . . . ?
C311 N32 C313 C312 0.2(7) . . . . ?
C314 N32 C313 C312 176.5(6) . . . . ?
N31 C312 C313 N32 0.8(7) . . . . ?
C322 N33 C321 N34 -0.8(8) . . . . ?
C322 N33 C321 P3 173.7(6) . . . . ?
C323 N34 C321 N33 0.0(8) . . . . ?
C324 N34 C321 N33 -171.6(6) . . . . ?
C323 N34 C321 P3 -174.1(5) . . . . ?
C324 N34 C321 P3 14.3(10) . . . . ?
C311 P3 C321 N33 -86.5(6) . . . . ?
C331 P3 C321 N33 21.4(6) . . . . ?
Au3 P3 C321 N33 150.2(5) . . . . ?
C311 P3 C321 N34 87.1(6) . . . . ?
C331 P3 C321 N34 -165.0(6) . . . . ?
Au3 P3 C321 N34 -36.2(6) . . . . ?
C321 N33 C322 C323 1.3(9) . . . . ?
C321 N34 C323 C322 0.8(8) . . . . ?
C324 N34 C323 C322 173.0(7) . . . . ?
N33 C322 C323 N34 -1.3(10) . . . . ?
C332 N35 C331 N36 0.1(7) . . . . ?
C332 N35 C331 P3 179.6(4) . . . . ?
C333 N36 C331 N35 -0.5(7) . . . . ?
C334 N36 C331 N35 177.7(6) . . . . ?
C333 N36 C331 P3 180.0(4) . . . . ?
C334 N36 C331 P3 -1.8(9) . . . . ?
C311 P3 C331 N35 1.4(6) . . . . ?
C321 P3 C331 N35 -108.8(5) . . . . ?
Au3 P3 C331 N35 123.9(5) . . . . ?
C311 P3 C331 N36 -179.2(5) . . . . ?
C321 P3 C331 N36 70.6(5) . . . . ?
Au3 P3 C331 N36 -56.7(5) . . . . ?
C331 N35 C332 C333 0.4(7) . . . . ?
N35 C332 C333 N36 -0.7(8) . . . . ?
C331 N36 C333 C332 0.7(7) . . . . ?
C334 N36 C333 C332 -177.6(6) . . . . ?
C512 N51 C511 N52 0.8(6) . . . . ?
Au6 N51 C511 N52 179.6(4) . . . . ?
C512 N51 C511 P5 -172.9(4) . . . . ?
Au6 N51 C511 P5 5.9(7) . . . . ?
C513 N52 C511 N51 -1.0(7) . . . . ?
C514 N52 C511 N51 -179.8(5) . . . . ?
C513 N52 C511 P5 172.3(5) . . . . ?
C514 N52 C511 P5 -6.5(9) . . . . ?
C531 P5 C511 N51 103.2(5) . . . . ?
C521 P5 C511 N51 -150.4(5) . . . . ?
Au5 P5 C511 N51 -28.2(5) . . . . ?
C531 P5 C511 N52 -69.3(6) . . . . ?
C521 P5 C511 N52 37.1(6) . . . . ?
Au5 P5 C511 N52 159.4(5) . . . . ?
C511 N51 C512 C513 -0.3(7) . . . . ?
Au6 N51 C512 C513 -179.1(4) . . . . ?
N51 C512 C513 N52 -0.3(7) . . . . ?
C511 N52 C513 C512 0.8(7) . . . . ?
C514 N52 C513 C512 179.6(5) . . . . ?
C522 N53 C521 N54 0.4(7) . . . . ?
C522 N53 C521 P5 -177.3(5) . . . . ?
C523 N54 C521 N53 1.0(7) . . . . ?
C524 N54 C521 N53 179.6(6) . . . . ?
C523 N54 C521 P5 178.6(5) . . . . ?
C524 N54 C521 P5 -2.7(9) . . . . ?
C531 P5 C521 N53 -13.5(6) . . . . ?
C511 P5 C521 N53 -117.9(5) . . . . ?
Au5 P5 C521 N53 121.4(5) . . . . ?
C531 P5 C521 N54 169.1(5) . . . . ?
C511 P5 C521 N54 64.7(6) . . . . ?
Au5 P5 C521 N54 -56.0(6) . . . . ?
C521 N53 C522 C523 -1.7(8) . . . . ?
N53 C522 C523 N54 2.3(8) . . . . ?
C521 N54 C523 C522 -2.0(7) . . . . ?
C524 N54 C523 C522 179.4(6) . . . . ?
C532 N55 C531 N56 -0.3(7) . . . . ?
C532 N55 C531 P5 -177.6(5) . . . . ?
C533 N56 C531 N55 -0.2(7) . . . . ?
C534 N56 C531 N55 173.7(6) . . . . ?
C533 N56 C531 P5 176.9(5) . . . . ?
C534 N56 C531 P5 -9.1(9) . . . . ?
C521 P5 C531 N55 -102.9(6) . . . . ?
C511 P5 C531 N55 7.1(6) . . . . ?
Au5 P5 C531 N55 129.1(5) . . . . ?
C521 P5 C531 N56 80.2(6) . . . . ?
C511 P5 C531 N56 -169.8(5) . . . . ?
Au5 P5 C531 N56 -47.8(6) . . . . ?
C531 N55 C532 C533 0.8(7) . . . . ?
N55 C532 C533 N56 -0.9(7) . . . . ?
C531 N56 C533 C532 0.7(7) . . . . ?
C534 N56 C533 C532 -173.4(6) . . . . ?
C3 Cl32 C3 Cl32 0.000(1) 2_766 . . 2_766 ?
C3 Cl32 C3 Cl31 112.7(13) 2_766 . . . ?
