#------------------------------------------------------------------------------
#$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $
#$Revision: 176729 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/81/1518166.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_1518166
loop_
_publ_author_name
'Lane, Andrew'
'Barnes, Charles'
'Vollmer, Matthew'
'Walensky, Justin'
_publ_section_title
;
 Reactivity of Mononuclear and Dinuclear Gold(I) Amidinate Complexes with
 CS2 and CsBr3
;
_journal_issue                   4
_journal_name_full               Inorganics
_journal_page_first              540
_journal_paper_doi               10.3390/inorganics2040540
_journal_volume                  2
_journal_year                    2014
_chemical_formula_moiety         'C72 H76 Au4 N8 S8'
_chemical_formula_sum            'C72 H76 Au4 N8 S8'
_chemical_formula_weight         2097.75
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_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
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                99.1330(10)
_cell_angle_beta                 96.0620(10)
_cell_angle_gamma                102.1610(10)
_cell_formula_units_Z            2
_cell_length_a                   8.3937(2)
_cell_length_b                   15.4728(4)
_cell_length_c                   29.2585(8)
_cell_measurement_reflns_used    3.0
_cell_measurement_temperature    100(2)
_cell_measurement_theta_min      72.0
_cell_volume                     3629.30(16)
_computing_cell_refinement       'APEX2 (Bruker AXS, 2008)'
_computing_data_collection       'APEX2 (Bruker AXS, 2008)'
_computing_data_reduction        'APEX2 (Bruker AXS, 2008)'
_computing_molecular_graphics    'X-SEED, Barbour, 2001'
_computing_publication_material  'CIFTAB (Sheldrick, 2013)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.975
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_device_type  'Bruker APEXII CCD area detector'
_diffrn_measurement_method       'omega and phi scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0245
_diffrn_reflns_av_unetI/netI     0.0182
_diffrn_reflns_Laue_measured_fraction_full 0.975
_diffrn_reflns_Laue_measured_fraction_max 0.955
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_number            67268
_diffrn_reflns_point_group_measured_fraction_full 0.975
_diffrn_reflns_point_group_measured_fraction_max 0.955
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         72.227
_diffrn_reflns_theta_min         2.973
_diffrn_source                   'Incoatec Cu Microfocus tube'
_diffrn_standards_decay_%        0.0
_exptl_absorpt_coefficient_mu    17.373
_exptl_absorpt_correction_T_max  0.85
_exptl_absorpt_correction_T_min  0.39
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
 Data were corrected for decay and absorption using the program SADABS
 (Sheldrick, G. M. (2003). SADABS. Version 2.10. University of
 Göttingen, Germany).
;
_exptl_crystal_colour            Orange
_exptl_crystal_density_diffrn    1.920
_exptl_crystal_description       Needle
_exptl_crystal_F_000             2016
_exptl_crystal_size_max          0.350
_exptl_crystal_size_mid          0.020
_exptl_crystal_size_min          0.010
_refine_diff_density_max         0.908
_refine_diff_density_min         -0.770
_refine_diff_density_rms         0.091
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.075
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     845
_refine_ls_number_reflns         13696
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.075
_refine_ls_R_factor_all          0.0201
_refine_ls_R_factor_gt           0.0183
_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)+(0.0187P)²+5.0208P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0427
_refine_ls_wR_factor_ref         0.0435
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12936
_reflns_number_total             13696
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            s1.cif
_cod_data_source_block           AuCS2
_cod_database_code               1518166
#BEGIN Tags that were not found in dictionaries:
_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   0.064
_shelx_estimated_absorpt_t_max   0.845
_shelxl_version_number           2013-4
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Au1 Au -0.06448(2) 0.54637(2) 0.72066(2) 0.01630(3) Uani 1 1 d . .
Au2 Au 0.08316(2) 0.43001(2) 0.76289(2) 0.01729(3) Uani 1 1 d . .
Au3 Au 0.43807(2) 0.52609(2) 0.79397(2) 0.01633(3) Uani 1 1 d . .
Au4 Au 0.57706(2) 0.47081(2) 0.71644(2) 0.01549(3) Uani 1 1 d . .
S1 S -0.11621(9) 0.44226(5) 0.65166(2) 0.01863(14) Uani 1 1 d . .
S2 S 0.14545(9) 0.35497(5) 0.69608(2) 0.02017(15) Uani 1 1 d . .
S3 S -0.00586(9) 0.65772(5) 0.78671(2) 0.01937(15) Uani 1 1 d . .
S4 S 0.01725(11) 0.49462(5) 0.83215(2) 0.02520(17) Uani 1 1 d . .
S5 S 0.42346(10) 0.39279(5) 0.82080(3) 0.02015(15) Uani 1 1 d . .
S6 S 0.63031(9) 0.34702(5) 0.74296(2) 0.01873(14) Uani 1 1 d . .
S7 S 0.45971(10) 0.66739(5) 0.77723(3) 0.02269(16) Uani 1 1 d . .
S8 S 0.52842(10) 0.58639(5) 0.68046(2) 0.02182(15) Uani 1 1 d . .
N1 N 0.0446(3) 0.33421(16) 0.60685(8) 0.0169(5) Uani 1 1 d . .
N2 N -0.0066(3) 0.31544(17) 0.52632(8) 0.0187(5) Uani 1 1 d . .
N3 N 0.0549(3) 0.66138(16) 0.87668(8) 0.0171(5) Uani 1 1 d . .
N4 N 0.1174(3) 0.67877(16) 0.95724(8) 0.0186(5) Uani 1 1 d . .
N5 N 0.5593(3) 0.25298(15) 0.80719(8) 0.0155(5) Uani 1 1 d . .
N6 N 0.5345(3) 0.16432(16) 0.86429(8) 0.0166(5) Uani 1 1 d . .
N7 N 0.4980(3) 0.75282(15) 0.70815(8) 0.0164(5) Uani 1 1 d . .
N8 N 0.5245(3) 0.84533(16) 0.65319(8) 0.0183(5) Uani 1 1 d . .
C1 C 0.1276(4) 0.2601(2) 0.60342(10) 0.0210(6) Uani 1 1 d . .
C2 C 0.0358(4) 0.1749(2) 0.60480(11) 0.0267(7) Uani 1 1 d . .
C3 C 0.1214(5) 0.1060(2) 0.60419(12) 0.0364(9) Uani 1 1 d . .
H3 H 0.0632 0.0465 0.6048 0.044 Uiso 1 1 calc R U
C4 C 0.2871(5) 0.1232(3) 0.60274(12) 0.0401(10) Uani 1 1 d . .
H4 H 0.3431 0.0759 0.6031 0.048 Uiso 1 1 calc R U
C5 C 0.3745(5) 0.2087(3) 0.60081(11) 0.0334(8) Uani 1 1 d . .
H5 H 0.4895 0.2195 0.5996 0.040 Uiso 1 1 calc R U
C6 C 0.2949(4) 0.2792(2) 0.60068(10) 0.0229(7) Uani 1 1 d . .
C7 C -0.1454(5) 0.1577(2) 0.60726(13) 0.0354(8) Uani 1 1 d . .
H7A H -0.1636 0.1886 0.6375 0.053 Uiso 1 1 calc R U
H7B H -0.1908 0.0929 0.6038 0.053 Uiso 1 1 calc R U
H7C H -0.2001 0.1806 0.5820 0.053 Uiso 1 1 calc R U
C8 C 0.3873(4) 0.3725(2) 0.59810(11) 0.0268(7) Uani 1 1 d . .
H8A H 0.5058 0.3776 0.6059 0.040 Uiso 1 1 calc R U
H8B H 0.3526 0.4167 0.6204 0.040 Uiso 1 1 calc R U
H8C H 0.3637 0.3839 0.5664 0.040 Uiso 1 1 calc R U
C9 C -0.0609(4) 0.3477(2) 0.48585(10) 0.0188(6) Uani 1 1 d . .
C10 C -0.2219(4) 0.3595(2) 0.47679(10) 0.0221(6) Uani 1 1 d . .
C11 C -0.2694(4) 0.3850(2) 0.43486(11) 0.0249(7) Uani 1 1 d . .
H11 H -0.3773 0.3942 0.4286 0.030 Uiso 1 1 calc R U
C12 C -0.1635(4) 0.3972(2) 0.40215(11) 0.0244(7) Uani 1 1 d . .
H12 H -0.1988 0.4139 0.3736 0.029 Uiso 1 1 calc R U
C13 C -0.0049(4) 0.3849(2) 0.41147(10) 0.0216(6) Uani 1 1 d . .
H13 H 0.0681 0.3931 0.3890 0.026 Uiso 1 1 calc R U
C14 C 0.0485(4) 0.36075(19) 0.45309(10) 0.0195(6) Uani 1 1 d . .
C15 C -0.3443(4) 0.3436(3) 0.51065(11) 0.0324(8) Uani 1 1 d . .
H15A H -0.3234 0.3965 0.5357 0.049 Uiso 1 1 calc R U
H15B H -0.3325 0.2908 0.5241 0.049 Uiso 1 1 calc R U
H15C H -0.4563 0.3333 0.4941 0.049 Uiso 1 1 calc R U
C16 C 0.2229(4) 0.3520(2) 0.46406(11) 0.0249(7) Uani 1 1 d . .
H16A H 0.2739 0.3487 0.4354 0.037 Uiso 1 1 calc R U
H16B H 0.2231 0.2972 0.4768 0.037 Uiso 1 1 calc R U
H16C H 0.2855 0.4045 0.4871 0.037 Uiso 1 1 calc R U
C17 C -0.0065(4) 0.3625(2) 0.56558(10) 0.0180(6) Uani 1 1 d . .
H17 H -0.0410 0.4175 0.5673 0.022 Uiso 1 1 calc R U
C18 C 0.0275(4) 0.37722(19) 0.65037(10) 0.0176(6) Uani 1 1 d . .
C19 C 0.0338(4) 0.75294(19) 0.88284(9) 0.0175(6) Uani 1 1 d . .
C20 C -0.1226(4) 0.7663(2) 0.88859(10) 0.0211(6) Uani 1 1 d . .
C21 C -0.1403(4) 0.8548(2) 0.89660(11) 0.0282(7) Uani 1 1 d . .
H21 H -0.2456 0.8663 0.9000 0.034 Uiso 1 1 calc R U
C22 C -0.0061(5) 0.9263(2) 0.89963(12) 0.0303(8) Uani 1 1 d . .
H22 H -0.0201 0.9862 0.9052 0.036 Uiso 1 1 calc R U
C23 C 0.1477(4) 0.9106(2) 0.89464(11) 0.0250(7) Uani 1 1 d . .
H23 H 0.2391 0.9601 0.8972 0.030 Uiso 1 1 calc R U
C24 C 0.1710(4) 0.8231(2) 0.88585(10) 0.0192(6) Uani 1 1 d . .
C25 C -0.2645(4) 0.6878(2) 0.88753(12) 0.0290(7) Uani 1 1 d . .
H25A H -0.2421 0.6577 0.9138 0.044 Uiso 1 1 calc R U
H25B H -0.2782 0.6451 0.8580 0.044 Uiso 1 1 calc R U
H25C H -0.3655 0.7093 0.8901 0.044 Uiso 1 1 calc R U
C26 C 0.3375(4) 0.8060(2) 0.88031(11) 0.0239(7) Uani 1 1 d . .
H26A H 0.4191 0.8635 0.8857 0.036 Uiso 1 1 calc R U
H26B H 0.3353 0.7735 0.8485 0.036 Uiso 1 1 calc R U
H26C H 0.3673 0.7698 0.9030 0.036 Uiso 1 1 calc R U
C27 C 0.1015(4) 0.63011(19) 0.91766(10) 0.0183(6) Uani 1 1 d . .
H27 H 0.1210 0.5714 0.9153 0.022 Uiso 1 1 calc R U
C28 C 0.1660(4) 0.64019(19) 0.99639(10) 0.0206(6) Uani 1 1 d . .
C29 C 0.0539(4) 0.6276(2) 1.02855(10) 0.0239(7) Uani 1 1 d . .
C30 C 0.0980(5) 0.5927(2) 1.06723(11) 0.0314(8) Uani 1 1 d . .
H30 H 0.0235 0.5842 1.0893 0.038 Uiso 1 1 calc R U
C31 C 0.2470(5) 0.5698(2) 1.07471(12) 0.0365(9) Uani 1 1 d . .
H31 H 0.2739 0.5446 1.1013 0.044 Uiso 1 1 calc R U
C32 C 0.3571(5) 0.5837(2) 1.04332(12) 0.0319(8) Uani 1 1 d . .
H32 H 0.4609 0.5691 1.0490 0.038 Uiso 1 1 calc R U
C33 C 0.3196(4) 0.6188(2) 1.00333(11) 0.0237(7) Uani 1 1 d . .
C34 C -0.1119(4) 0.6487(2) 1.01952(12) 0.0311(8) Uani 1 1 d . .
H34A H -0.1825 0.6017 0.9949 0.047 Uiso 1 1 calc R U
H34B H -0.0990 0.7070 1.0095 0.047 Uiso 1 1 calc R U
H34C H -0.1625 0.6510 1.0482 0.047 Uiso 1 1 calc R U
C35 C 0.4444(4) 0.6360(2) 0.97013(12) 0.0316(8) Uani 1 1 d . .
H35A H 0.5527 0.6330 0.9851 0.047 Uiso 1 1 calc R U
H35B H 0.4502 0.6957 0.9623 0.047 Uiso 1 1 calc R U
H35C H 0.4110 0.5902 0.9415 0.047 Uiso 1 1 calc R U
C36 C 0.0262(4) 0.60706(19) 0.83341(10) 0.0168(6) Uani 1 1 d . .
C37 C 0.6125(4) 0.18485(18) 0.77632(10) 0.0169(6) Uani 1 1 d . .
C38 C 0.4947(4) 0.12673(19) 0.74134(10) 0.0199(6) Uani 1 1 d . .
C39 C 0.5493(4) 0.0650(2) 0.71044(11) 0.0261(7) Uani 1 1 d . .
H39 H 0.4727 0.0243 0.6863 0.031 Uiso 1 1 calc R U
C40 C 0.7126(5) 0.0622(2) 0.71447(12) 0.0309(8) Uani 1 1 d . .
H40 H 0.7475 0.0198 0.6930 0.037 Uiso 1 1 calc R U
C41 C 0.8269(4) 0.1204(2) 0.74939(12) 0.0271(7) Uani 1 1 d . .
H41 H 0.9394 0.1178 0.7515 0.033 Uiso 1 1 calc R U
C42 C 0.7781(4) 0.1828(2) 0.78142(10) 0.0199(6) Uani 1 1 d . .
C43 C 0.3168(4) 0.1319(2) 0.73669(11) 0.0267(7) Uani 1 1 d . .
H43A H 0.3051 0.1861 0.7245 0.040 Uiso 1 1 calc R U
H43B H 0.2796 0.1345 0.7674 0.040 Uiso 1 1 calc R U
H43C H 0.2498 0.0785 0.7151 0.040 Uiso 1 1 calc R U
C44 C 0.9002(4) 0.2468(2) 0.81979(11) 0.0255(7) Uani 1 1 d . .
H44A H 0.8785 0.3070 0.8224 0.038 Uiso 1 1 calc R U
H44B H 1.0121 0.2489 0.8125 0.038 Uiso 1 1 calc R U
H44C H 0.8895 0.2260 0.8495 0.038 Uiso 1 1 calc R U
C45 C 0.5277(4) 0.23827(19) 0.85169(10) 0.0173(6) Uani 1 1 d . .
H45 H 0.5007 0.2845 0.8728 0.021 Uiso 1 1 calc R U
C46 C 0.4913(4) 0.15272(18) 0.90925(10) 0.0169(6) Uani 1 1 d . .
C47 C 0.3321(4) 0.15387(19) 0.91956(10) 0.0190(6) Uani 1 1 d . .
C48 C 0.2926(4) 0.1351(2) 0.96253(11) 0.0230(6) Uani 1 1 d . .
H48 H 0.1856 0.1363 0.9701 0.028 Uiso 1 1 calc R U
C49 C 0.4075(4) 0.1146(2) 0.99470(11) 0.0247(7) Uani 1 1 d . .
H49 H 0.3789 0.1017 1.0238 0.030 Uiso 1 1 calc R U
C50 C 0.5633(4) 0.1133(2) 0.98382(11) 0.0238(7) Uani 1 1 d . .
H50 H 0.6415 0.0999 1.0059 0.029 Uiso 1 1 calc R U
C51 C 0.6083(4) 0.13131(19) 0.94129(10) 0.0196(6) Uani 1 1 d . .
C52 C 0.2015(4) 0.1710(2) 0.88468(11) 0.0256(7) Uani 1 1 d . .
H52A H 0.2263 0.2348 0.8824 0.038 Uiso 1 1 calc R U
H52B H 0.0936 0.1548 0.8950 0.038 Uiso 1 1 calc R U
H52C H 0.1998 0.1344 0.8540 0.038 Uiso 1 1 calc R U
C53 C 0.7772(4) 0.1303(2) 0.92988(11) 0.0232(7) Uani 1 1 d . .
H53A H 0.7692 0.0944 0.8986 0.035 Uiso 1 1 calc R U
H53B H 0.8349 0.1039 0.9530 0.035 Uiso 1 1 calc R U
H53C H 0.8383 0.1920 0.9306 0.035 Uiso 1 1 calc R U
C54 C 0.5398(4) 0.33017(19) 0.79132(10) 0.0171(6) Uani 1 1 d . .
C55 C 0.4617(4) 0.82535(18) 0.74052(10) 0.0168(6) Uani 1 1 d . .
C56 C 0.2986(4) 0.83316(19) 0.73848(10) 0.0186(6) Uani 1 1 d . .
C57 C 0.2650(4) 0.9014(2) 0.77029(11) 0.0234(7) Uani 1 1 d . .
H57 H 0.1547 0.9074 0.7705 0.028 Uiso 1 1 calc R U
C58 C 0.3910(4) 0.9607(2) 0.80176(11) 0.0260(7) Uani 1 1 d . .
H58 H 0.3667 1.0077 0.8230 0.031 Uiso 1 1 calc R U
C59 C 0.5513(4) 0.9521(2) 0.80232(10) 0.0246(7) Uani 1 1 d . .
H59 H 0.6362 0.9934 0.8240 0.029 Uiso 1 1 calc R U
C60 C 0.5913(4) 0.88369(19) 0.77168(10) 0.0200(6) Uani 1 1 d . .
C61 C 0.1652(4) 0.7698(2) 0.70327(10) 0.0230(7) Uani 1 1 d . .
H61A H 0.0581 0.7813 0.7092 0.034 Uiso 1 1 calc R U
H61B H 0.1667 0.7076 0.7059 0.034 Uiso 1 1 calc R U
H61C H 0.1837 0.7791 0.6717 0.034 Uiso 1 1 calc R U
C62 C 0.7655(4) 0.8733(2) 0.77213(11) 0.0264(7) Uani 1 1 d . .
H62A H 0.7743 0.8165 0.7819 0.040 Uiso 1 1 calc R U
H62B H 0.8397 0.9236 0.7941 0.040 Uiso 1 1 calc R U
H62C H 0.7959 0.8730 0.7407 0.040 Uiso 1 1 calc R U
C63 C 0.5318(4) 0.77009(19) 0.66395(10) 0.0179(6) Uani 1 1 d . .
H63 H 0.5600 0.7253 0.6422 0.022 Uiso 1 1 calc R U
C64 C 0.5663(4) 0.86193(19) 0.60903(10) 0.0190(6) Uani 1 1 d . .
C65 C 0.4433(4) 0.8795(2) 0.57743(11) 0.0220(6) Uani 1 1 d . .
C66 C 0.4841(4) 0.9017(2) 0.53536(11) 0.0278(7) Uani 1 1 d . .
H66 H 0.4024 0.9137 0.5138 0.033 Uiso 1 1 calc R U
C67 C 0.6414(5) 0.9066(2) 0.52417(11) 0.0312(8) Uani 1 1 d . .
H67 H 0.6672 0.9217 0.4951 0.037 Uiso 1 1 calc R U
C68 C 0.7608(4) 0.8895(2) 0.55546(11) 0.0274(7) Uani 1 1 d . .
H68 H 0.8687 0.8930 0.5477 0.033 Uiso 1 1 calc R U
C69 C 0.7261(4) 0.8673(2) 0.59834(11) 0.0219(6) Uani 1 1 d . .
C70 C 0.2713(4) 0.8722(2) 0.58938(11) 0.0271(7) Uani 1 1 d . .
H70A H 0.2057 0.8940 0.5659 0.041 Uiso 1 1 calc R U
H70B H 0.2758 0.9087 0.6203 0.041 Uiso 1 1 calc R U
H70C H 0.2206 0.8092 0.5897 0.041 Uiso 1 1 calc R U
C71 C 0.8626(4) 0.8521(2) 0.63213(12) 0.0282(7) Uani 1 1 d . .
H71A H 0.8459 0.7877 0.6327 0.042 Uiso 1 1 calc R U
H71B H 0.8610 0.8850 0.6635 0.042 Uiso 1 1 calc R U
H71C H 0.9691 0.8738 0.6220 0.042 Uiso 1 1 calc R U
C72 C 0.4964(4) 0.67106(19) 0.72132(10) 0.0170(6) 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 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -4.4197 7.2980 '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_3
S3 Au1 S1 176.10(3) .
S3 Au1 Au2 94.234(18) .
S1 Au1 Au2 88.355(18) .
S3 Au1 Au4 102.69(2) 1_455
S1 Au1 Au4 79.451(19) 1_455
Au2 Au1 Au4 104.178(5) 1_455
S2 Au2 S4 175.37(3) .
S2 Au2 Au1 96.215(18) .
S4 Au2 Au1 87.62(2) .
S2 Au2 Au3 91.57(2) .
S4 Au2 Au3 89.83(2) .
Au1 Au2 Au3 106.373(5) .
S7 Au3 S5 172.62(3) .
S7 Au3 Au4 92.061(19) .
S5 Au3 Au4 93.944(19) .
S7 Au3 Au2 105.61(2) .
S5 Au3 Au2 77.44(2) .
Au4 Au3 Au2 100.932(5) .
S6 Au4 S8 172.62(3) .
S6 Au4 Au3 93.435(19) .
S8 Au4 Au3 93.634(19) .
S6 Au4 Au1 90.45(2) 1_655
S8 Au4 Au1 88.33(2) 1_655
Au3 Au4 Au1 116.286(5) 1_655
C18 S1 Au1 110.75(10) .
C18 S2 Au2 107.18(11) .
C36 S3 Au1 106.94(10) .
C36 S4 Au2 110.53(10) .
C54 S5 Au3 109.89(10) .
C54 S6 Au4 111.57(10) .
C72 S7 Au3 111.93(10) .
C72 S8 Au4 109.40(10) .
C18 N1 C17 122.3(2) .
C18 N1 C1 119.1(2) .
C17 N1 C1 118.5(2) .
C17 N2 C9 117.4(3) .
C36 N3 C27 121.7(2) .
C36 N3 C19 121.7(2) .
C27 N3 C19 116.5(2) .
C27 N4 C28 116.1(3) .
C54 N5 C45 122.1(2) .
C54 N5 C37 118.6(2) .
C45 N5 C37 119.3(2) .
C45 N6 C46 117.7(3) .
C72 N7 C63 122.9(2) .
C72 N7 C55 119.7(2) .
C63 N7 C55 117.4(2) .
C63 N8 C64 118.4(3) .
C6 C1 C2 123.7(3) .
C6 C1 N1 118.2(3) .
C2 C1 N1 118.1(3) .
C1 C2 C3 116.7(3) .
C1 C2 C7 121.5(3) .
C3 C2 C7 121.8(3) .
C4 C3 C2 121.0(3) .
C4 C3 H3 119.5 .
C2 C3 H3 119.5 .
C3 C4 C5 120.8(3) .
C3 C4 H4 119.6 .
C5 C4 H4 119.6 .
C4 C5 C6 120.5(4) .
C4 C5 H5 119.8 .
C6 C5 H5 119.8 .
C1 C6 C5 117.3(3) .
C1 C6 C8 121.4(3) .
C5 C6 C8 121.3(3) .
C2 C7 H7A 109.5 .
C2 C7 H7B 109.5 .
H7A C7 H7B 109.5 .
C2 C7 H7C 109.5 .
H7A C7 H7C 109.5 .
H7B C7 H7C 109.5 .
C6 C8 H8A 109.5 .
C6 C8 H8B 109.5 .
H8A C8 H8B 109.5 .
C6 C8 H8C 109.5 .
H8A C8 H8C 109.5 .
H8B C8 H8C 109.5 .
C10 C9 C14 120.6(3) .
C10 C9 N2 121.8(3) .
C14 C9 N2 117.4(3) .
C11 C10 C9 118.4(3) .
C11 C10 C15 119.6(3) .
C9 C10 C15 122.0(3) .
C12 C11 C10 121.6(3) .
C12 C11 H11 119.2 .
C10 C11 H11 119.2 .
C11 C12 C13 119.3(3) .
C11 C12 H12 120.3 .
C13 C12 H12 120.3 .
C14 C13 C12 121.0(3) .
C14 C13 H13 119.5 .
C12 C13 H13 119.5 .
C13 C14 C9 119.1(3) .
C13 C14 C16 120.8(3) .
C9 C14 C16 120.1(3) .
C10 C15 H15A 109.5 .
C10 C15 H15B 109.5 .
H15A C15 H15B 109.5 .
C10 C15 H15C 109.5 .
H15A C15 H15C 109.5 .
H15B C15 H15C 109.5 .
C14 C16 H16A 109.5 .
C14 C16 H16B 109.5 .
H16A C16 H16B 109.5 .
C14 C16 H16C 109.5 .
H16A C16 H16C 109.5 .
H16B C16 H16C 109.5 .
N2 C17 N1 120.2(3) .
N2 C17 H17 119.9 .
N1 C17 H17 119.9 .
N1 C18 S2 115.2(2) .
N1 C18 S1 116.1(2) .
S2 C18 S1 128.62(18) .
C24 C19 C20 123.2(3) .
C24 C19 N3 119.0(3) .
C20 C19 N3 117.7(3) .
C21 C20 C19 117.4(3) .
C21 C20 C25 121.9(3) .
C19 C20 C25 120.7(3) .
C22 C21 C20 120.9(3) .
C22 C21 H21 119.6 .
C20 C21 H21 119.6 .
C23 C22 C21 120.2(3) .
C23 C22 H22 119.9 .
C21 C22 H22 119.9 .
C22 C23 C24 121.0(3) .
C22 C23 H23 119.5 .
C24 C23 H23 119.5 .
C19 C24 C23 117.3(3) .
C19 C24 C26 121.6(3) .
C23 C24 C26 121.1(3) .
C20 C25 H25A 109.5 .
C20 C25 H25B 109.5 .
H25A C25 H25B 109.5 .
C20 C25 H25C 109.5 .
H25A C25 H25C 109.5 .
H25B C25 H25C 109.5 .
C24 C26 H26A 109.5 .
C24 C26 H26B 109.5 .
H26A C26 H26B 109.5 .
C24 C26 H26C 109.5 .
H26A C26 H26C 109.5 .
H26B C26 H26C 109.5 .
N4 C27 N3 120.9(3) .
N4 C27 H27 119.5 .
N3 C27 H27 119.5 .
C33 C28 C29 121.3(3) .
C33 C28 N4 121.9(3) .
C29 C28 N4 116.7(3) .
C30 C29 C28 118.4(3) .
C30 C29 C34 121.4(3) .
C28 C29 C34 120.1(3) .
C31 C30 C29 121.7(3) .
C31 C30 H30 119.1 .
C29 C30 H30 119.1 .
C30 C31 C32 119.4(3) .
C30 C31 H31 120.3 .
C32 C31 H31 120.3 .
C31 C32 C33 121.6(4) .
C31 C32 H32 119.2 .
C33 C32 H32 119.2 .
C28 C33 C32 117.5(3) .
C28 C33 C35 121.8(3) .
C32 C33 C35 120.6(3) .
C29 C34 H34A 109.5 .
C29 C34 H34B 109.5 .
H34A C34 H34B 109.5 .
C29 C34 H34C 109.5 .
H34A C34 H34C 109.5 .
H34B C34 H34C 109.5 .
C33 C35 H35A 109.5 .
C33 C35 H35B 109.5 .
H35A C35 H35B 109.5 .
C33 C35 H35C 109.5 .
H35A C35 H35C 109.5 .
H35B C35 H35C 109.5 .
N3 C36 S3 116.2(2) .
N3 C36 S4 116.7(2) .
S3 C36 S4 127.00(17) .
C42 C37 C38 123.1(3) .
C42 C37 N5 119.0(3) .
C38 C37 N5 117.9(3) .
C39 C38 C37 117.2(3) .
C39 C38 C43 121.4(3) .
C37 C38 C43 121.4(3) .
C40 C39 C38 120.8(3) .
C40 C39 H39 119.6 .
C38 C39 H39 119.6 .
C39 C40 C41 120.9(3) .
C39 C40 H40 119.5 .
C41 C40 H40 119.5 .
C40 C41 C42 120.5(3) .
C40 C41 H41 119.8 .
C42 C41 H41 119.8 .
C37 C42 C41 117.5(3) .
C37 C42 C44 121.1(3) .
C41 C42 C44 121.4(3) .
C38 C43 H43A 109.5 .
C38 C43 H43B 109.5 .
H43A C43 H43B 109.5 .
C38 C43 H43C 109.5 .
H43A C43 H43C 109.5 .
H43B C43 H43C 109.5 .
C42 C44 H44A 109.5 .
C42 C44 H44B 109.5 .
H44A C44 H44B 109.5 .
C42 C44 H44C 109.5 .
H44A C44 H44C 109.5 .
H44B C44 H44C 109.5 .
N6 C45 N5 121.1(3) .
N6 C45 H45 119.4 .
N5 C45 H45 119.4 .
C47 C46 C51 120.9(3) .
C47 C46 N6 120.9(3) .
C51 C46 N6 117.9(3) .
C48 C47 C46 118.6(3) .
C48 C47 C52 119.4(3) .
C46 C47 C52 121.9(3) .
C47 C48 C49 121.1(3) .
C47 C48 H48 119.5 .
C49 C48 H48 119.5 .
C50 C49 C48 119.5(3) .
C50 C49 H49 120.3 .
C48 C49 H49 120.3 .
C49 C50 C51 121.5(3) .
C49 C50 H50 119.2 .
C51 C50 H50 119.2 .
C50 C51 C46 118.4(3) .
C50 C51 C53 121.2(3) .
C46 C51 C53 120.4(3) .
C47 C52 H52A 109.5 .
C47 C52 H52B 109.5 .
H52A C52 H52B 109.5 .
C47 C52 H52C 109.5 .
H52A C52 H52C 109.5 .
H52B C52 H52C 109.5 .
C51 C53 H53A 109.5 .
C51 C53 H53B 109.5 .
H53A C53 H53B 109.5 .
C51 C53 H53C 109.5 .
H53A C53 H53C 109.5 .
H53B C53 H53C 109.5 .
N5 C54 S6 114.1(2) .
N5 C54 S5 116.8(2) .
S6 C54 S5 129.06(17) .
C60 C55 C56 123.4(3) .
C60 C55 N7 118.5(3) .
C56 C55 N7 118.1(3) .
C57 C56 C55 117.5(3) .
C57 C56 C61 121.5(3) .
C55 C56 C61 121.0(3) .
C58 C57 C56 120.6(3) .
C58 C57 H57 119.7 .
C56 C57 H57 119.7 .
C59 C58 C57 120.4(3) .
C59 C58 H58 119.8 .
C57 C58 H58 119.8 .
C58 C59 C60 121.3(3) .
C58 C59 H59 119.4 .
C60 C59 H59 119.4 .
C55 C60 C59 116.8(3) .
C55 C60 C62 121.5(3) .
C59 C60 C62 121.7(3) .
C56 C61 H61A 109.5 .
C56 C61 H61B 109.5 .
H61A C61 H61B 109.5 .
C56 C61 H61C 109.5 .
H61A C61 H61C 109.5 .
H61B C61 H61C 109.5 .
C60 C62 H62A 109.5 .
C60 C62 H62B 109.5 .
H62A C62 H62B 109.5 .
C60 C62 H62C 109.5 .
H62A C62 H62C 109.5 .
H62B C62 H62C 109.5 .
N8 C63 N7 119.9(3) .
N8 C63 H63 120.0 .
N7 C63 H63 120.0 .
C69 C64 C65 120.8(3) .
C69 C64 N8 121.6(3) .
C65 C64 N8 117.5(3) .
C66 C65 C64 118.6(3) .
C66 C65 C70 121.5(3) .
C64 C65 C70 119.9(3) .
C67 C66 C65 121.3(3) .
C67 C66 H66 119.4 .
C65 C66 H66 119.4 .
C68 C67 C66 119.6(3) .
C68 C67 H67 120.2 .
C66 C67 H67 120.2 .
C67 C68 C69 121.3(3) .
C67 C68 H68 119.3 .
C69 C68 H68 119.3 .
C68 C69 C64 118.5(3) .
C68 C69 C71 119.3(3) .
C64 C69 C71 122.2(3) .
C65 C70 H70A 109.5 .
C65 C70 H70B 109.5 .
H70A C70 H70B 109.5 .
C65 C70 H70C 109.5 .
H70A C70 H70C 109.5 .
H70B C70 H70C 109.5 .
C69 C71 H71A 109.5 .
C69 C71 H71B 109.5 .
H71A C71 H71B 109.5 .
C69 C71 H71C 109.5 .
H71A C71 H71C 109.5 .
H71B C71 H71C 109.5 .
N7 C72 S7 114.4(2) .
N7 C72 S8 117.4(2) .
S7 C72 S8 128.11(17) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 S3 2.3087(7) .
Au1 S1 2.3124(7) .
Au1 Au2 2.76154(17) .
Au1 Au4 2.97132(18) 1_455
Au2 S2 2.2789(7) .
Au2 S4 2.2888(7) .
Au2 Au3 3.00745(19) .
Au3 S7 2.2900(7) .
Au3 S5 2.3051(7) .
Au3 Au4 2.75717(19) .
Au4 S6 2.2869(7) .
Au4 S8 2.2996(7) .
Au4 Au1 2.97129(18) 1_655
S1 C18 1.725(3) .
S2 C18 1.702(3) .
S3 C36 1.704(3) .
S4 C36 1.720(3) .
S5 C54 1.717(3) .
S6 C54 1.705(3) .
S7 C72 1.703(3) .
S8 C72 1.714(3) .
N1 C18 1.377(4) .
N1 C17 1.405(4) .
N1 C1 1.457(4) .
N2 C17 1.259(4) .
N2 C9 1.425(4) .
N3 C36 1.371(4) .
N3 C27 1.410(4) .
N3 C19 1.450(4) .
N4 C27 1.255(4) .
N4 C28 1.434(4) .
N5 C54 1.382(4) .
N5 C45 1.399(4) .
N5 C37 1.452(4) .
N6 C45 1.267(4) .
N6 C46 1.429(4) .
N7 C72 1.378(4) .
N7 C63 1.407(4) .
N7 C55 1.455(4) .
N8 C63 1.265(4) .
N8 C64 1.422(4) .
C1 C6 1.387(5) .
C1 C2 1.390(4) .
C2 C3 1.404(5) .
C2 C7 1.499(5) .
C3 C4 1.367(6) .
C3 H3 0.9500 .
C4 C5 1.384(6) .
C4 H4 0.9500 .
C5 C6 1.394(5) .
C5 H5 0.9500 .
C6 C8 1.505(5) .
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 1.404(4) .
C9 C14 1.404(4) .
C10 C11 1.392(4) .
C10 C15 1.511(4) .
C11 C12 1.381(5) .
C11 H11 0.9500 .
C12 C13 1.390(5) .
C12 H12 0.9500 .
C13 C14 1.387(4) .
C13 H13 0.9500 .
C14 C16 1.504(4) .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 0.9800 .
C16 H16A 0.9800 .
C16 H16B 0.9800 .
C16 H16C 0.9800 .
C17 H17 0.9500 .
C19 C24 1.391(4) .
C19 C20 1.395(4) .
C20 C21 1.394(5) .
C20 C25 1.506(4) .
C21 C22 1.386(5) .
C21 H21 0.9500 .
C22 C23 1.381(5) .
C22 H22 0.9500 .
C23 C24 1.396(4) .
C23 H23 0.9500 .
C24 C26 1.497(4) .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
C27 H27 0.9500 .
C28 C33 1.399(5) .
C28 C29 1.406(4) .
C29 C30 1.378(4) .
C29 C34 1.501(5) .
C30 C31 1.376(6) .
C30 H30 0.9500 .
C31 C32 1.379(6) .
C31 H31 0.9500 .
C32 C33 1.400(4) .
C32 H32 0.9500 .
C33 C35 1.513(5) .
C34 H34A 0.9800 .
C34 H34B 0.9800 .
C34 H34C 0.9800 .
C35 H35A 0.9800 .
C35 H35B 0.9800 .
C35 H35C 0.9800 .
C37 C42 1.390(4) .
C37 C38 1.398(4) .
C38 C39 1.392(4) .
C38 C43 1.505(5) .
C39 C40 1.373(5) .
C39 H39 0.9500 .
C40 C41 1.383(5) .
C40 H40 0.9500 .
C41 C42 1.392(4) .
C41 H41 0.9500 .
C42 C44 1.505(4) .
C43 H43A 0.9800 .
C43 H43B 0.9800 .
C43 H43C 0.9800 .
C44 H44A 0.9800 .
C44 H44B 0.9800 .
C44 H44C 0.9800 .
C45 H45 0.9500 .
C46 C47 1.403(4) .
C46 C51 1.413(4) .
C47 C48 1.392(4) .
C47 C52 1.512(4) .
C48 C49 1.396(4) .
C48 H48 0.9500 .
C49 C50 1.381(5) .
C49 H49 0.9500 .
C50 C51 1.391(4) .
C50 H50 0.9500 .
C51 C53 1.493(4) .
C52 H52A 0.9800 .
C52 H52B 0.9800 .
C52 H52C 0.9800 .
C53 H53A 0.9800 .
C53 H53B 0.9800 .
C53 H53C 0.9800 .
C55 C60 1.394(4) .
C55 C56 1.395(4) .
C56 C57 1.389(4) .
C56 C61 1.500(4) .
C57 C58 1.388(5) .
C57 H57 0.9500 .
C58 C59 1.379(5) .
C58 H58 0.9500 .
C59 C60 1.395(4) .
C59 H59 0.9500 .
C60 C62 1.503(5) .
C61 H61A 0.9800 .
C61 H61B 0.9800 .
C61 H61C 0.9800 .
C62 H62A 0.9800 .
C62 H62B 0.9800 .
C62 H62C 0.9800 .
C63 H63 0.9500 .
C64 C69 1.398(5) .
C64 C65 1.410(4) .
C65 C66 1.387(4) .
C65 C70 1.507(5) .
C66 C67 1.383(5) .
C66 H66 0.9500 .
C67 C68 1.381(5) .
C67 H67 0.9500 .
C68 C69 1.396(4) .
C68 H68 0.9500 .
C69 C71 1.514(4) .
C70 H70A 0.9800 .
C70 H70B 0.9800 .
C70 H70C 0.9800 .
C71 H71A 0.9800 .
C71 H71B 0.9800 .
C71 H71C 0.9800 .
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
C18 N1 C1 C6 -93.8(3)
C17 N1 C1 C6 82.5(3)
C18 N1 C1 C2 83.9(3)
C17 N1 C1 C2 -99.8(3)
C6 C1 C2 C3 1.2(5)
N1 C1 C2 C3 -176.4(3)
C6 C1 C2 C7 -179.4(3)
N1 C1 C2 C7 3.1(4)
C1 C2 C3 C4 0.6(5)
C7 C2 C3 C4 -178.9(3)
C2 C3 C4 C5 -1.4(5)
C3 C4 C5 C6 0.5(5)
C2 C1 C6 C5 -2.1(4)
N1 C1 C6 C5 175.5(3)
C2 C1 C6 C8 178.5(3)
N1 C1 C6 C8 -4.0(4)
C4 C5 C6 C1 1.2(5)
C4 C5 C6 C8 -179.4(3)
C17 N2 C9 C10 -62.1(4)
C17 N2 C9 C14 122.9(3)
C14 C9 C10 C11 -0.6(4)
N2 C9 C10 C11 -175.4(3)
C14 C9 C10 C15 178.3(3)
N2 C9 C10 C15 3.5(5)
C9 C10 C11 C12 1.1(5)
C15 C10 C11 C12 -177.8(3)
C10 C11 C12 C13 -0.8(5)
C11 C12 C13 C14 -0.2(5)
C12 C13 C14 C9 0.7(4)
C12 C13 C14 C16 -176.9(3)
C10 C9 C14 C13 -0.4(4)
N2 C9 C14 C13 174.7(3)
C10 C9 C14 C16 177.3(3)
N2 C9 C14 C16 -7.7(4)
C9 N2 C17 N1 179.6(3)
C18 N1 C17 N2 -171.6(3)
C1 N1 C17 N2 12.2(4)
C17 N1 C18 S2 -162.2(2)
C1 N1 C18 S2 13.9(3)
C17 N1 C18 S1 20.4(4)
C1 N1 C18 S1 -163.4(2)
Au2 S2 C18 N1 -177.65(19)
Au2 S2 C18 S1 -0.7(2)
Au1 S1 C18 N1 -159.60(19)
Au1 S1 C18 S2 23.5(2)
C36 N3 C19 C24 -96.9(3)
C27 N3 C19 C24 85.0(3)
C36 N3 C19 C20 87.3(3)
C27 N3 C19 C20 -90.8(3)
C24 C19 C20 C21 1.6(4)
N3 C19 C20 C21 177.2(3)
C24 C19 C20 C25 -176.6(3)
N3 C19 C20 C25 -1.1(4)
C19 C20 C21 C22 -1.3(5)
C25 C20 C21 C22 176.9(3)
C20 C21 C22 C23 0.1(5)
C21 C22 C23 C24 0.9(5)
C20 C19 C24 C23 -0.6(4)
N3 C19 C24 C23 -176.2(3)
C20 C19 C24 C26 178.9(3)
N3 C19 C24 C26 3.3(4)
C22 C23 C24 C19 -0.7(4)
C22 C23 C24 C26 179.8(3)
C28 N4 C27 N3 -179.7(3)
C36 N3 C27 N4 -175.5(3)
C19 N3 C27 N4 2.5(4)
C27 N4 C28 C33 64.8(4)
C27 N4 C28 C29 -117.3(3)
C33 C28 C29 C30 -0.5(4)
N4 C28 C29 C30 -178.5(3)
C33 C28 C29 C34 -178.3(3)
N4 C28 C29 C34 3.8(4)
C28 C29 C30 C31 -0.4(5)
C34 C29 C30 C31 177.3(3)
C29 C30 C31 C32 1.4(5)
C30 C31 C32 C33 -1.4(5)
C29 C28 C33 C32 0.5(4)
N4 C28 C33 C32 178.3(3)
C29 C28 C33 C35 -177.2(3)
N4 C28 C33 C35 0.6(4)
C31 C32 C33 C28 0.5(5)
C31 C32 C33 C35 178.2(3)
C27 N3 C36 S3 -172.7(2)
C19 N3 C36 S3 9.3(4)
C27 N3 C36 S4 10.1(4)
C19 N3 C36 S4 -167.9(2)
Au1 S3 C36 N3 -176.8(2)
Au1 S3 C36 S4 0.1(2)
Au2 S4 C36 N3 -154.8(2)
Au2 S4 C36 S3 28.3(2)
C54 N5 C37 C42 97.7(3)
C45 N5 C37 C42 -82.9(3)
C54 N5 C37 C38 -79.4(3)
C45 N5 C37 C38 99.9(3)
C42 C37 C38 C39 -0.4(4)
N5 C37 C38 C39 176.6(2)
C42 C37 C38 C43 -179.2(3)
N5 C37 C38 C43 -2.2(4)
C37 C38 C39 C40 -0.2(4)
C43 C38 C39 C40 178.6(3)
C38 C39 C40 C41 0.2(5)
C39 C40 C41 C42 0.4(5)
C38 C37 C42 C41 1.0(4)
N5 C37 C42 C41 -176.0(2)
C38 C37 C42 C44 -179.8(3)
N5 C37 C42 C44 3.2(4)
C40 C41 C42 C37 -0.9(4)
C40 C41 C42 C44 179.9(3)
C46 N6 C45 N5 -176.5(3)
C54 N5 C45 N6 174.7(3)
C37 N5 C45 N6 -4.6(4)
C45 N6 C46 C47 62.3(4)
C45 N6 C46 C51 -123.8(3)
C51 C46 C47 C48 1.2(4)
N6 C46 C47 C48 175.0(3)
C51 C46 C47 C52 -176.2(3)
N6 C46 C47 C52 -2.5(4)
C46 C47 C48 C49 -0.7(4)
C52 C47 C48 C49 176.8(3)
C47 C48 C49 C50 0.3(5)
C48 C49 C50 C51 -0.5(5)
C49 C50 C51 C46 1.1(5)
C49 C50 C51 C53 179.7(3)
C47 C46 C51 C50 -1.4(4)
N6 C46 C51 C50 -175.3(3)
C47 C46 C51 C53 180.0(3)
N6 C46 C51 C53 6.1(4)
C45 N5 C54 S6 165.1(2)
C37 N5 C54 S6 -15.6(3)
C45 N5 C54 S5 -17.4(4)
C37 N5 C54 S5 162.0(2)
Au4 S6 C54 N5 176.17(17)
Au4 S6 C54 S5 -1.0(2)
Au3 S5 C54 N5 172.64(18)
Au3 S5 C54 S6 -10.2(2)
C72 N7 C55 C60 89.0(3)
C63 N7 C55 C60 -91.7(3)
C72 N7 C55 C56 -91.4(3)
C63 N7 C55 C56 87.8(3)
C60 C55 C56 C57 -1.9(4)
N7 C55 C56 C57 178.5(2)
C60 C55 C56 C61 178.3(3)
N7 C55 C56 C61 -1.3(4)
C55 C56 C57 C58 1.9(4)
C61 C56 C57 C58 -178.3(3)
C56 C57 C58 C59 -0.9(5)
C57 C58 C59 C60 -0.3(5)
C56 C55 C60 C59 0.8(4)
N7 C55 C60 C59 -179.7(2)
C56 C55 C60 C62 -179.2(3)
N7 C55 C60 C62 0.4(4)
C58 C59 C60 C55 0.3(4)
C58 C59 C60 C62 -179.7(3)
C64 N8 C63 N7 177.3(3)
C72 N7 C63 N8 177.0(3)
C55 N7 C63 N8 -2.3(4)
C63 N8 C64 C69 -65.4(4)
C63 N8 C64 C65 119.2(3)
C69 C64 C65 C66 0.4(4)
N8 C64 C65 C66 175.8(3)
C69 C64 C65 C70 179.3(3)
N8 C64 C65 C70 -5.3(4)
C64 C65 C66 C67 0.1(5)
C70 C65 C66 C67 -178.8(3)
C65 C66 C67 C68 -0.3(5)
C66 C67 C68 C69 0.0(5)
C67 C68 C69 C64 0.5(5)
C67 C68 C69 C71 -178.1(3)
C65 C64 C69 C68 -0.6(4)
N8 C64 C69 C68 -175.9(3)
C65 C64 C69 C71 177.8(3)
N8 C64 C69 C71 2.6(4)
C63 N7 C72 S7 177.8(2)
C55 N7 C72 S7 -3.0(3)
C63 N7 C72 S8 -2.9(4)
C55 N7 C72 S8 176.3(2)
Au3 S7 C72 N7 175.29(18)
Au3 S7 C72 S8 -4.0(2)
Au4 S8 C72 N7 167.30(19)
Au4 S8 C72 S7 -13.4(2)
