#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:22:55 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179107 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/69/4306937.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_4306937
loop_
_publ_author_name
'Hanan E. Abdou'
'Ahmed A. Mohamed'
'John P. Fackler'
_publ_section_title
;
Syntheses of Mixed-Ligand Tetranuclear Gold(I)-Nitrogen Clusters by
Ligand Exchange Reactions with the Dinuclear Gold(I) Formamidinate Complex
Au2(2,6-Me2Ph-form)2
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              141
_journal_page_last               146
_journal_paper_doi               10.1021/ic0612449
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'C66 H60 Au4 N8 O'
_chemical_formula_weight         1769.10
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.94(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   23.058(5)
_cell_length_b                   14.314(3)
_cell_length_c                   18.528(4)
_cell_measurement_temperature    110(2)
_cell_volume                     6114(2)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      110(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  '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  0.0554
_diffrn_reflns_av_sigmaI/netI    0.0539
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            43077
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.77
_exptl_absorpt_coefficient_mu    9.616
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   SADAB
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.922
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needles
_exptl_crystal_F_000             3344
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         4.483
_refine_diff_density_min         -1.077
_refine_diff_density_rms         0.297
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.178
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     646
_refine_ls_number_reflns         10709
_refine_ls_number_restraints     473
_refine_ls_restrained_S_all      1.156
_refine_ls_R_factor_all          0.0988
_refine_ls_R_factor_gt           0.0589
_refine_ls_shift/su_max          0.152
_refine_ls_shift/su_mean         0.007
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0787P)²+71.0033P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1374
_refine_ls_wR_factor_ref         0.1796
_reflns_number_gt                7328
_reflns_number_total             10709
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic0612449si20060705_055847.cif
_cod_data_source_block           pzn
_cod_database_code               4306937
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.21829(3) 0.80908(4) 0.43726(3) 0.03996(17) Uani 1 1 d . . .
Au2 Au 0.35295(3) 0.85997(4) 0.42136(3) 0.04765(19) Uani 1 1 d . . .
Au3 Au 0.31266(2) 1.00616(4) 0.31145(3) 0.03986(17) Uani 1 1 d . . .
Au4 Au 0.17898(2) 0.97026(4) 0.34263(3) 0.03821(17) Uani 1 1 d . . .
O1 O 0.169(3) 0.165(3) 0.178(3) 0.40(5) Uani 1 1 d D . .
N1 N 0.2592(6) 0.8677(8) 0.5234(6) 0.045(3) Uani 1 1 d . . .
N2 N 0.3173(7) 0.8822(10) 0.5179(7) 0.060(4) Uani 1 1 d . A .
N3 N 0.3839(5) 0.8405(9) 0.3212(7) 0.046(3) Uani 1 1 d . B .
N4 N 0.3576(5) 0.8997(9) 0.2699(7) 0.046(3) Uani 1 1 d . B .
N5 N 0.2694(6) 1.1075(9) 0.3624(7) 0.053(3) Uani 1 1 d . C .
N6 N 0.2159(6) 1.0846(8) 0.3870(6) 0.045(3) Uani 1 1 d . C .
N7 N 0.1457(5) 0.8638(8) 0.2848(6) 0.040(3) Uani 1 1 d . . .
N8 N 0.1813(5) 0.7391(7) 0.3531(5) 0.035(3) Uani 1 1 d . . .
C1 C 0.2922(10) 0.9323(13) 0.6241(10) 0.077(6) Uani 1 1 d . A .
H1A H 0.2942 0.9575 0.6704 0.092 Uiso 1 1 calc R . .
C2 C 0.2418(8) 0.8989(10) 0.5891(7) 0.054(5) Uani 1 1 d D . .
C3 C 0.1826(6) 0.8920(8) 0.6164(6) 0.053(4) Uani 1 1 d D . .
C4 C 0.1423(6) 0.8239(9) 0.5925(6) 0.048(4) Uani 1 1 d D . .
H4A H 0.1538 0.7788 0.5595 0.058 Uiso 1 1 calc R . .
C5 C 0.0862(7) 0.8233(11) 0.6172(7) 0.062(5) Uani 1 1 d D . .
H5A H 0.0593 0.7804 0.5994 0.075 Uiso 1 1 calc R . .
C6 C 0.0705(7) 0.8894(12) 0.6702(8) 0.067(5) Uani 1 1 d D . .
H6A H 0.0339 0.8869 0.6905 0.080 Uiso 1 1 calc R . .
C7 C 0.1080(8) 0.9550(12) 0.6908(9) 0.078(6) Uani 1 1 d D . .
H7A H 0.0963 1.0013 0.7227 0.093 Uiso 1 1 calc R . .
C8 C 0.1646(8) 0.9556(11) 0.6656(8) 0.071(6) Uani 1 1 d D . .
H8A H 0.1905 1.0004 0.6828 0.085 Uiso 1 1 calc R . .
C9 C 0.3374(10) 0.9215(14) 0.5791(9) 0.080(7) Uani 1 1 d D . .
C10 C 0.4036(8) 0.9351(12) 0.5897(9) 0.15(3) Uiso 0.17(3) 1 d PD A -1
C11 C 0.4229(13) 0.970(6) 0.657(2) 0.15(3) Uiso 0.17(3) 1 d PD A -1
H11A H 0.3962 0.9808 0.6930 0.180 Uiso 0.17(3) 1 calc PR A -1
C12 C 0.4815(13) 0.989(6) 0.670(2) 0.15(3) Uiso 0.17(3) 1 d PD A -1
H12A H 0.4945 1.0117 0.7143 0.180 Uiso 0.17(3) 1 calc PR A -1
C13 C 0.5204(8) 0.9711(13) 0.6134(10) 0.15(3) Uiso 0.17(3) 1 d PD A -1
H13A H 0.5598 0.9828 0.6206 0.180 Uiso 0.17(3) 1 calc PR A -1
C14 C 0.5018(13) 0.938(5) 0.5506(19) 0.15(3) Uiso 0.17(3) 1 d PD A -1
H14A H 0.5283 0.9274 0.5142 0.180 Uiso 0.17(3) 1 calc PR A -1
C15 C 0.4431(12) 0.920(6) 0.538(2) 0.15(3) Uiso 0.17(3) 1 d PD A -1
H15A H 0.4310 0.8967 0.4930 0.180 Uiso 0.17(3) 1 calc PR A -1
C10A C 0.4036(8) 0.9351(12) 0.5897(9) 0.093 Uiso 0.83(3) 1 d PD A -2
C11A C 0.4202(9) 1.0139(14) 0.6293(11) 0.093 Uiso 0.83(3) 1 d PD A -2
H11B H 0.3922 1.0538 0.6476 0.111 Uiso 0.83(3) 1 calc PR A -2
C12A C 0.4792(9) 1.0327(14) 0.6416(11) 0.093 Uiso 0.83(3) 1 d PD A -2
H12B H 0.4908 1.0850 0.6679 0.111 Uiso 0.83(3) 1 calc PR A -2
C13A C 0.5204(8) 0.9711(13) 0.6134(10) 0.093 Uiso 0.83(3) 1 d PD A -2
H13B H 0.5596 0.9830 0.6213 0.111 Uiso 0.83(3) 1 calc PR A -2
C14A C 0.5046(9) 0.8961(14) 0.5756(11) 0.093 Uiso 0.83(3) 1 d PD A -2
H14B H 0.5325 0.8560 0.5573 0.111 Uiso 0.83(3) 1 calc PR A -2
C15A C 0.4453(9) 0.8779(14) 0.5636(11) 0.093 Uiso 0.83(3) 1 d PD A -2
H15B H 0.4344 0.8254 0.5372 0.111 Uiso 0.83(3) 1 calc PR A -2
C16 C 0.4074(7) 0.7903(11) 0.2126(9) 0.053(4) Uani 1 1 d . B .
H16A H 0.4227 0.7543 0.1758 0.064 Uiso 1 1 calc R . .
C17 C 0.4141(7) 0.7745(12) 0.2866(9) 0.056(4) Uani 1 1 d D . .
C18 C 0.4479(7) 0.7008(13) 0.3229(11) 0.083(9) Uiso 0.34(2) 1 d PD B -1
C19 C 0.4743(15) 0.7187(19) 0.3912(15) 0.083(9) Uiso 0.34(2) 1 d PD B -1
H19A H 0.4701 0.7769 0.4130 0.099 Uiso 0.34(2) 1 calc PR B -1
C20 C 0.5068(15) 0.6487(19) 0.4259(15) 0.083(9) Uiso 0.34(2) 1 d PD B -1
H20A H 0.5245 0.6592 0.4707 0.099 Uiso 0.34(2) 1 calc PR B -1
C21 C 0.5119(9) 0.5614(14) 0.3905(12) 0.083(9) Uiso 0.34(2) 1 d PD B -1
H21A H 0.5332 0.5138 0.4125 0.099 Uiso 0.34(2) 1 calc PR B -1
C22 C 0.4871(15) 0.5463(19) 0.3272(15) 0.083(9) Uiso 0.34(2) 1 d PD B -1
H22A H 0.4912 0.4883 0.3051 0.099 Uiso 0.34(2) 1 calc PR B -1
C23 C 0.4547(15) 0.6159(18) 0.2926(15) 0.083(9) Uiso 0.34(2) 1 d PD B -1
H23A H 0.4376 0.6036 0.2478 0.099 Uiso 0.34(2) 1 calc PR B -1
C18A C 0.4479(7) 0.7008(13) 0.3229(11) 0.121 Uiso 0.66(2) 1 d PD B -2
C19A C 0.4390(12) 0.6811(19) 0.3961(13) 0.121 Uiso 0.66(2) 1 d PD B -2
H19B H 0.4116 0.7149 0.4215 0.145 Uiso 0.66(2) 1 calc PR B -2
C20A C 0.4710(12) 0.611(2) 0.4311(13) 0.121 Uiso 0.66(2) 1 d PD B -2
H20B H 0.4654 0.5971 0.4796 0.145 Uiso 0.66(2) 1 calc PR B -2
C21A C 0.5119(9) 0.5614(14) 0.3905(12) 0.121 Uiso 0.66(2) 1 d PD B -2
H21B H 0.5338 0.5145 0.4125 0.145 Uiso 0.66(2) 1 calc PR B -2
C22A C 0.5198(12) 0.5806(19) 0.3217(13) 0.121 Uiso 0.66(2) 1 d PD B -2
H22B H 0.5471 0.5469 0.2960 0.145 Uiso 0.66(2) 1 calc PR B -2
C23A C 0.4879(11) 0.6507(19) 0.2866(13) 0.121 Uiso 0.66(2) 1 d PD B -2
H23B H 0.4942 0.6631 0.2381 0.145 Uiso 0.66(2) 1 calc PR B -2
C24 C 0.3738(6) 0.8690(11) 0.2045(8) 0.047(4) Uani 1 1 d D . .
C25 C 0.3532(5) 0.9129(9) 0.1369(7) 0.047(4) Uani 1 1 d D B .
C26 C 0.3443(6) 0.8560(11) 0.0763(8) 0.076(6) Uani 1 1 d D . .
H26A H 0.3523 0.7925 0.0800 0.091 Uiso 1 1 calc R B .
C27 C 0.3237(8) 0.8915(12) 0.0106(9) 0.101(8) Uani 1 1 d D B .
H27A H 0.3179 0.8531 -0.0294 0.121 Uiso 1 1 calc R . .
C28 C 0.3121(7) 0.9881(12) 0.0074(8) 0.092(7) Uani 1 1 d D . .
H28A H 0.2984 1.0142 -0.0355 0.110 Uiso 1 1 calc R B .
C29 C 0.3205(6) 1.0424(11) 0.0645(7) 0.065(5) Uani 1 1 d D B .
H29A H 0.3125 1.1059 0.0609 0.078 Uiso 1 1 calc R . .
C30 C 0.3411(5) 1.0059(9) 0.1300(7) 0.052(4) Uani 1 1 d D . .
H30A H 0.3466 1.0455 0.1694 0.063 Uiso 1 1 calc R B .
C31 C 0.2842(8) 1.1906(11) 0.3890(11) 0.071(5) Uani 1 1 d D . .
C32 C 0.3369(8) 1.2444(15) 0.3651(11) 0.15(2) Uiso 0.29(2) 1 d PD C -1
C33 C 0.3876(14) 1.1979(19) 0.344(3) 0.15(2) Uiso 0.29(2) 1 d PD C -1
H33A H 0.3888 1.1330 0.3455 0.179 Uiso 0.29(2) 1 calc PR C -1
C34 C 0.4359(15) 1.2469(19) 0.320(3) 0.15(2) Uiso 0.29(2) 1 d PD C -1
H34A H 0.4693 1.2158 0.3065 0.179 Uiso 0.29(2) 1 calc PR C -1
C35 C 0.4327(9) 1.3456(16) 0.3185(13) 0.15(2) Uiso 0.29(2) 1 d PD C -1
H35A H 0.4643 1.3803 0.3031 0.179 Uiso 0.29(2) 1 calc PR C -1
C36 C 0.3849(15) 1.3887(19) 0.339(3) 0.15(2) Uiso 0.29(2) 1 d PD C -1
H36A H 0.3835 1.4536 0.3371 0.179 Uiso 0.29(2) 1 calc PR C -1
C37 C 0.3365(15) 1.3394(18) 0.362(3) 0.15(2) Uiso 0.29(2) 1 d PD C -1
H37A H 0.3035 1.3719 0.3758 0.179 Uiso 0.29(2) 1 calc PR C -1
C32A C 0.3369(8) 1.2444(15) 0.3651(11) 0.115 Uiso 0.71(2) 1 d PD C -2
C33A C 0.3581(11) 1.2317(17) 0.2949(13) 0.115 Uiso 0.71(2) 1 d PD C -2
H33B H 0.3397 1.1890 0.2644 0.138 Uiso 0.71(2) 1 calc PR C -2
C34A C 0.4058(11) 1.2811(18) 0.2698(13) 0.115 Uiso 0.71(2) 1 d PD C -2
H34B H 0.4195 1.2723 0.2234 0.138 Uiso 0.71(2) 1 calc PR C -2
C35A C 0.4327(9) 1.3456(16) 0.3185(13) 0.115 Uiso 0.71(2) 1 d PD C -2
H35B H 0.4647 1.3798 0.3037 0.138 Uiso 0.71(2) 1 calc PR C -2
C36A C 0.4129(11) 1.3575(17) 0.3839(14) 0.115 Uiso 0.71(2) 1 d PD C -2
H36B H 0.4311 1.4001 0.4147 0.138 Uiso 0.71(2) 1 calc PR C -2
C37A C 0.3650(11) 1.3074(17) 0.4080(13) 0.115 Uiso 0.71(2) 1 d PD C -2
H37B H 0.3520 1.3173 0.4546 0.138 Uiso 0.71(2) 1 calc PR C -2
C38 C 0.2373(9) 1.2221(13) 0.4317(10) 0.073(5) Uani 1 1 d . C .
H38A H 0.2348 1.2790 0.4557 0.088 Uiso 1 1 calc R . .
C39 C 0.1976(8) 1.1537(11) 0.4307(9) 0.059(5) Uani 1 1 d D . .
C40 C 0.1396(6) 1.1522(8) 0.4636(6) 0.050(4) Uani 1 1 d D C .
C41 C 0.1067(7) 1.2350(10) 0.4679(7) 0.066(5) Uani 1 1 d D . .
H41A H 0.1221 1.2901 0.4499 0.080 Uiso 1 1 calc R C .
C42 C 0.0521(8) 1.2367(11) 0.4981(8) 0.093(7) Uani 1 1 d D C .
H42A H 0.0312 1.2921 0.5004 0.111 Uiso 1 1 calc R . .
C43 C 0.0291(7) 1.1529(11) 0.5252(8) 0.075(5) Uani 1 1 d D . .
H43A H -0.0074 1.1519 0.5458 0.090 Uiso 1 1 calc R C .
C44 C 0.0606(6) 1.0746(11) 0.5209(7) 0.068(5) Uani 1 1 d D C .
H44A H 0.0451 1.0194 0.5389 0.082 Uiso 1 1 calc R . .
C45 C 0.1156(6) 1.0721(9) 0.4906(6) 0.050(4) Uani 1 1 d D . .
H45A H 0.1360 1.0162 0.4887 0.060 Uiso 1 1 calc R C .
C46 C 0.1543(6) 0.7754(9) 0.2986(7) 0.037(3) Uani 1 1 d . . .
H46A H 0.1390 0.7336 0.2649 0.045 Uiso 1 1 calc R . .
C47 C 0.1115(7) 0.8897(9) 0.2216(8) 0.044(4) Uani 1 1 d . . .
C48 C 0.1403(7) 0.9053(10) 0.1573(8) 0.048(4) Uani 1 1 d . . .
C49 C 0.1070(8) 0.9321(11) 0.0975(8) 0.054(4) Uani 1 1 d . . .
H49A H 0.1246 0.9424 0.0534 0.065 Uiso 1 1 calc R . .
C50 C 0.0461(9) 0.9440(13) 0.1037(9) 0.070(6) Uani 1 1 d . . .
H50A H 0.0244 0.9649 0.0641 0.084 Uiso 1 1 calc R . .
C51 C 0.0190(9) 0.9251(14) 0.1665(10) 0.074(6) Uani 1 1 d . . .
H51A H -0.0211 0.9301 0.1686 0.089 Uiso 1 1 calc R . .
C52 C 0.0507(7) 0.8983(11) 0.2281(8) 0.049(4) Uani 1 1 d . . .
C53 C 0.2043(7) 0.8907(14) 0.1529(9) 0.067(5) Uani 1 1 d . . .
H53A H 0.2167 0.9042 0.1048 0.100 Uiso 1 1 calc R . .
H53B H 0.2134 0.8270 0.1646 0.100 Uiso 1 1 calc R . .
H53C H 0.2238 0.9315 0.1865 0.100 Uiso 1 1 calc R . .
C54 C 0.0206(7) 0.8797(14) 0.2998(9) 0.068(5) Uani 1 1 d . . .
H54A H -0.0204 0.8890 0.2937 0.101 Uiso 1 1 calc R . .
H54B H 0.0355 0.9219 0.3358 0.101 Uiso 1 1 calc R . .
H54C H 0.0280 0.8165 0.3147 0.101 Uiso 1 1 calc R . .
C55 C 0.1853(7) 0.6417(9) 0.3533(7) 0.042(4) Uani 1 1 d . . .
C56 C 0.1383(8) 0.5874(11) 0.3815(9) 0.058(5) Uani 1 1 d . . .
C57 C 0.1448(10) 0.4898(12) 0.3822(11) 0.074(6) Uani 1 1 d . . .
H57A H 0.1146 0.4541 0.4003 0.089 Uiso 1 1 calc R . .
C58 C 0.1919(9) 0.4448(14) 0.3583(9) 0.062(5) Uani 1 1 d . . .
H58A H 0.1933 0.3799 0.3593 0.074 Uiso 1 1 calc R . .
C59 C 0.2398(9) 0.4966(11) 0.3312(10) 0.071(6) Uani 1 1 d . . .
H59A H 0.2727 0.4664 0.3143 0.085 Uiso 1 1 calc R . .
C60 C 0.2359(8) 0.5953(11) 0.3310(8) 0.055(4) Uani 1 1 d . . .
C61 C 0.0845(7) 0.6360(12) 0.4075(9) 0.059(4) Uani 1 1 d . . .
H61A H 0.0576 0.5904 0.4249 0.088 Uiso 1 1 calc R . .
H61B H 0.0669 0.6702 0.3684 0.088 Uiso 1 1 calc R . .
H61C H 0.0947 0.6783 0.4459 0.088 Uiso 1 1 calc R . .
C62 C 0.2860(8) 0.6550(13) 0.3031(10) 0.068(5) Uani 1 1 d . . .
H62A H 0.2764 0.7200 0.3077 0.103 Uiso 1 1 calc R . .
H62B H 0.2925 0.6406 0.2533 0.103 Uiso 1 1 calc R . .
H62C H 0.3206 0.6418 0.3309 0.103 Uiso 1 1 calc R . .
C63 C 0.1592(15) 0.271(2) 0.209(2) 0.20(2) Uani 1 1 d D . .
H63A H 0.1961 0.2932 0.2279 0.236 Uiso 1 1 calc R . .
H63B H 0.1490 0.3105 0.1680 0.236 Uiso 1 1 calc R . .
C64 C 0.1145(14) 0.286(3) 0.2658(18) 0.169(15) Uani 1 1 d D . .
H64A H 0.1331 0.2959 0.3125 0.203 Uiso 1 1 calc R . .
H64B H 0.0906 0.3398 0.2542 0.203 Uiso 1 1 calc R . .
C65 C 0.078(3) 0.199(3) 0.267(4) 0.43(7) Uani 1 1 d D . .
H65A H 0.0825 0.1660 0.3123 0.510 Uiso 1 1 calc R . .
H65B H 0.0378 0.2124 0.2574 0.510 Uiso 1 1 calc R . .
C66 C 0.104(3) 0.143(5) 0.206(3) 0.37(6) Uani 1 1 d D . .
H66A H 0.0777 0.1497 0.1649 0.442 Uiso 1 1 calc R . .
H66B H 0.1029 0.0782 0.2204 0.442 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'
N N 0.0061 0.0033 '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'
O O 0.0106 0.0060 '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
N1 Au1 N8 174.6(5) . . ?
N1 Au1 Au4 105.8(3) . . ?
N8 Au1 Au4 79.2(3) . . ?
N1 Au1 Au2 62.6(4) . . ?
N8 Au1 Au2 115.9(3) . . ?
Au4 Au1 Au2 93.14(3) . . ?
N2 Au2 N3 176.3(5) . . ?
N2 Au2 Au3 111.2(4) . . ?
N3 Au2 Au3 65.8(3) . . ?
N2 Au2 Au1 62.8(4) . . ?
N3 Au2 Au1 114.2(3) . . ?
Au3 Au2 Au1 86.13(3) . . ?
N4 Au3 N5 174.5(5) . . ?
N4 Au3 Au2 65.3(3) . . ?
N5 Au3 Au2 109.3(4) . . ?
N4 Au3 Au4 117.0(3) . . ?
N5 Au3 Au4 62.7(4) . . ?
Au2 Au3 Au4 93.05(3) . . ?
N7 Au4 N6 171.8(5) . . ?
N7 Au4 Au1 80.7(3) . . ?
N6 Au4 Au1 105.2(3) . . ?
N7 Au4 Au3 112.8(3) . . ?
N6 Au4 Au3 62.6(4) . . ?
Au1 Au4 Au3 86.94(3) . . ?
C66 O1 C63 86(5) . . ?
C2 N1 N2 108.7(12) . . ?
C2 N1 Au1 134.5(11) . . ?
N2 N1 Au1 116.8(9) . . ?
C9 N2 N1 109.1(15) . . ?
C9 N2 Au2 132.8(13) . . ?
N1 N2 Au2 117.4(9) . . ?
C17 N3 N4 108.8(12) . . ?
C17 N3 Au2 136.9(10) . . ?
N4 N3 Au2 112.6(9) . . ?
C24 N4 N3 106.8(12) . . ?
C24 N4 Au3 138.3(11) . . ?
N3 N4 Au3 114.7(9) . . ?
C31 N5 N6 108.7(13) . . ?
C31 N5 Au3 134.0(13) . . ?
N6 N5 Au3 116.3(9) . . ?
C39 N6 N5 108.5(12) . . ?
C39 N6 Au4 134.9(12) . . ?
N5 N6 Au4 116.0(9) . . ?
C46 N7 C47 119.0(11) . . ?
C46 N7 Au4 125.2(9) . . ?
C47 N7 Au4 115.8(9) . . ?
C46 N8 C55 115.9(11) . . ?
C46 N8 Au1 126.5(9) . . ?
C55 N8 Au1 117.6(8) . . ?
C9 C1 C2 108.4(16) . . ?
N1 C2 C1 105.7(17) . . ?
N1 C2 C3 125.0(13) . . ?
C1 C2 C3 129.2(14) . . ?
C8 C3 C4 117.7(14) . . ?
C8 C3 C2 118.9(13) . . ?
C4 C3 C2 123.3(12) . . ?
C5 C4 C3 121.0(13) . . ?
C4 C5 C6 118.6(14) . . ?
C7 C6 C5 120.0(15) . . ?
C6 C7 C8 121.1(15) . . ?
C3 C8 C7 121.4(14) . . ?
N2 C9 C1 108.1(17) . . ?
N2 C9 C10 119.1(18) . . ?
C1 C9 C10 132.4(15) . . ?
C15 C10 C11 118.7(17) . . ?
C15 C10 C9 124.3(18) . . ?
C11 C10 C9 117.0(17) . . ?
C12 C11 C10 121(2) . . ?
C11 C12 C13 117(2) . . ?
C14 C13 C12 121.1(18) . . ?
C13 C14 C15 121(2) . . ?
C10 C15 C14 121(2) . . ?
C24 C16 C17 107.1(15) . . ?
N3 C17 C16 107.7(14) . . ?
N3 C17 C18 124.2(16) . . ?
C16 C17 C18 128.1(16) . . ?
C23 C18 C19 118.9(16) . . ?
C23 C18 C17 121.4(18) . . ?
C19 C18 C17 119.7(18) . . ?
C20 C19 C18 119.9(19) . . ?
C19 C20 C21 117.8(19) . . ?
C22 C21 C20 121.4(17) . . ?
C21 C22 C23 121(2) . . ?
C18 C23 C22 121(2) . . ?
N4 C24 C16 109.4(14) . . ?
N4 C24 C25 122.3(13) . . ?
C16 C24 C25 128.1(14) . . ?
C30 C25 C26 117.7(12) . . ?
C30 C25 C24 124.0(12) . . ?
C26 C25 C24 118.3(12) . . ?
C27 C26 C25 122.1(13) . . ?
C26 C27 C28 117.1(14) . . ?
C29 C28 C27 121.1(14) . . ?
C28 C29 C30 121.2(14) . . ?
C25 C30 C29 120.8(12) . . ?
N5 C31 C38 107.3(15) . . ?
N5 C31 C32 123.3(18) . . ?
C38 C31 C32 128.6(16) . . ?
C37 C32 C33 117.9(17) . . ?
C37 C32 C31 121.0(19) . . ?
C33 C32 C31 121.1(19) . . ?
C34 C33 C32 121(2) . . ?
C33 C34 C35 118(2) . . ?
C36 C35 C34 120.1(18) . . ?
C35 C36 C37 122(2) . . ?
C32 C37 C36 121(2) . . ?
C39 C38 C31 106.6(15) . . ?
C38 C39 N6 108.9(16) . . ?
C38 C39 C40 128.8(15) . . ?
N6 C39 C40 122.0(14) . . ?
C45 C40 C41 117.6(12) . . ?
C45 C40 C39 122.3(12) . . ?
C41 C40 C39 120.2(12) . . ?
C42 C41 C40 122.0(13) . . ?
C41 C42 C43 118.7(13) . . ?
C44 C43 C42 118.9(14) . . ?
C43 C44 C45 122.9(14) . . ?
C40 C45 C44 120.0(12) . . ?
N8 C46 N7 127.9(12) . . ?
C48 C47 C52 123.1(14) . . ?
C48 C47 N7 118.2(13) . . ?
C52 C47 N7 118.7(13) . . ?
C47 C48 C49 117.5(15) . . ?
C47 C48 C53 120.7(14) . . ?
C49 C48 C53 121.8(15) . . ?
C48 C49 C50 120.1(15) . . ?
C51 C50 C49 121.0(15) . . ?
C50 C51 C52 121.0(18) . . ?
C51 C52 C47 117.3(16) . . ?
C51 C52 C54 121.2(16) . . ?
C47 C52 C54 121.5(14) . . ?
N8 C55 C60 121.6(13) . . ?
N8 C55 C56 119.3(14) . . ?
C60 C55 C56 118.9(13) . . ?
C57 C56 C55 117.4(18) . . ?
C57 C56 C61 122.9(17) . . ?
C55 C56 C61 119.7(14) . . ?
C58 C57 C56 124.0(19) . . ?
C57 C58 C59 120.1(18) . . ?
C60 C59 C58 118.0(19) . . ?
C55 C60 C59 121.5(17) . . ?
C55 C60 C62 117.9(14) . . ?
C59 C60 C62 120.5(18) . . ?
C64 C63 O1 119(3) . . ?
C65 C64 C63 106(3) . . ?
C66 C65 C64 102(4) . . ?
C65 C66 O1 121(4) . . ?
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 N1 2.023(11) . ?
Au1 N8 2.029(10) . ?
Au1 Au4 3.0277(9) . ?
Au1 Au2 3.2075(10) . ?
Au2 N2 2.006(14) . ?
Au2 N3 2.018(13) . ?
Au2 Au3 3.0541(9) . ?
Au3 N4 2.004(13) . ?
Au3 N5 2.006(13) . ?
Au3 Au4 3.1870(10) . ?
Au4 N7 2.008(11) . ?
Au4 N6 2.014(11) . ?
O1 C66 1.64(7) . ?
O1 C63 1.64(6) . ?
N1 C2 1.363(19) . ?
N1 N2 1.362(18) . ?
N2 C9 1.34(2) . ?
N3 C17 1.34(2) . ?
N3 N4 1.404(16) . ?
N4 C24 1.347(19) . ?
N5 C31 1.329(19) . ?
N5 N6 1.361(17) . ?
N6 C39 1.350(19) . ?
N7 C46 1.305(17) . ?
N7 C47 1.449(18) . ?
N8 C46 1.288(16) . ?
N8 C55 1.397(16) . ?
C1 C9 1.35(3) . ?
C1 C2 1.41(2) . ?
C2 C3 1.47(2) . ?
C3 C8 1.359(15) . ?
C3 C4 1.413(14) . ?
C4 C5 1.381(15) . ?
C5 C6 1.414(16) . ?
C6 C7 1.329(16) . ?
C7 C8 1.393(16) . ?
C9 C10 1.55(3) . ?
C10 C15 1.354(18) . ?
C10 C11 1.406(18) . ?
C11 C12 1.396(19) . ?
C12 C13 1.413(19) . ?
C13 C14 1.320(18) . ?
C14 C15 1.398(19) . ?
C11A C12A 1.401(17) . ?
C14A C15A 1.405(17) . ?
C16 C24 1.37(2) . ?
C16 C17 1.40(2) . ?
C17 C18 1.47(2) . ?
C18 C23 1.349(17) . ?
C18 C19 1.420(17) . ?
C19 C20 1.401(19) . ?
C20 C21 1.418(18) . ?
C21 C22 1.315(18) . ?
C22 C23 1.395(18) . ?
C19A C20A 1.402(18) . ?
C22A C23A 1.397(18) . ?
C24 C25 1.473(19) . ?
C25 C30 1.366(14) . ?
C25 C26 1.400(14) . ?
C26 C27 1.396(16) . ?
C27 C28 1.410(16) . ?
C28 C29 1.324(16) . ?
C29 C30 1.397(15) . ?
C31 C38 1.42(3) . ?
C31 C32 1.51(3) . ?
C32 C37 1.361(18) . ?
C32 C33 1.406(18) . ?
C33 C34 1.394(19) . ?
C34 C35 1.415(19) . ?
C35 C36 1.322(18) . ?
C36 C37 1.396(19) . ?
C33A C34A 1.394(18) . ?
C36A C37A 1.396(18) . ?
C38 C39 1.34(2) . ?
C39 C40 1.48(2) . ?
C40 C45 1.371(14) . ?
C40 C41 1.409(14) . ?
C41 C42 1.386(16) . ?
C42 C43 1.408(16) . ?
C43 C44 1.339(15) . ?
C44 C45 1.397(15) . ?
C47 C48 1.39(2) . ?
C47 C52 1.42(2) . ?
C48 C49 1.39(2) . ?
C48 C53 1.49(2) . ?
C49 C50 1.42(2) . ?
C50 C51 1.36(3) . ?
C51 C52 1.40(2) . ?
C52 C54 1.53(2) . ?
C55 C60 1.41(2) . ?
C55 C56 1.44(2) . ?
C56 C57 1.41(2) . ?
C56 C61 1.51(2) . ?
C57 C58 1.34(3) . ?
C58 C59 1.43(3) . ?
C59 C60 1.42(2) . ?
C60 C62 1.53(2) . ?
C63 C64 1.50(3) . ?
C64 C65 1.50(3) . ?
C65 C66 1.50(3) . ?
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
N1 Au1 Au2 N2 3.4(6) . . . . ?
N8 Au1 Au2 N2 -170.9(6) . . . . ?
Au4 Au1 Au2 N2 109.6(5) . . . . ?
N1 Au1 Au2 N3 -174.1(5) . . . . ?
N8 Au1 Au2 N3 11.7(5) . . . . ?
Au4 Au1 Au2 N3 -67.9(4) . . . . ?
N1 Au1 Au2 Au3 -112.8(4) . . . . ?
N8 Au1 Au2 Au3 72.9(3) . . . . ?
Au4 Au1 Au2 Au3 -6.66(2) . . . . ?
N2 Au2 Au3 N4 -171.0(5) . . . . ?
N3 Au2 Au3 N4 6.6(5) . . . . ?
Au1 Au2 Au3 N4 -112.1(4) . . . . ?
N2 Au2 Au3 N5 9.6(6) . . . . ?
N3 Au2 Au3 N5 -172.8(5) . . . . ?
Au1 Au2 Au3 N5 68.4(4) . . . . ?
N2 Au2 Au3 Au4 -52.5(4) . . . . ?
N3 Au2 Au3 Au4 125.1(4) . . . . ?
Au1 Au2 Au3 Au4 6.33(2) . . . . ?
N1 Au1 Au4 N7 -177.6(5) . . . . ?
N8 Au1 Au4 N7 4.3(5) . . . . ?
Au2 Au1 Au4 N7 120.1(3) . . . . ?
N1 Au1 Au4 N6 8.2(6) . . . . ?
N8 Au1 Au4 N6 -169.9(5) . . . . ?
Au2 Au1 Au4 N6 -54.1(4) . . . . ?
N1 Au1 Au4 Au3 68.7(4) . . . . ?
N8 Au1 Au4 Au3 -109.4(3) . . . . ?
Au2 Au1 Au4 Au3 6.38(2) . . . . ?
N4 Au3 Au4 N7 -21.6(5) . . . . ?
N5 Au3 Au4 N7 164.6(6) . . . . ?
Au2 Au3 Au4 N7 -85.3(3) . . . . ?
N4 Au3 Au4 N6 165.9(5) . . . . ?
N5 Au3 Au4 N6 -8.0(6) . . . . ?
Au2 Au3 Au4 N6 102.2(4) . . . . ?
N4 Au3 Au4 Au1 57.0(4) . . . . ?
N5 Au3 Au4 Au1 -116.8(4) . . . . ?
Au2 Au3 Au4 Au1 -6.70(2) . . . . ?
N8 Au1 N1 C2 -112(5) . . . . ?
Au4 Au1 N1 C2 88.9(13) . . . . ?
Au2 Au1 N1 C2 174.1(15) . . . . ?
N8 Au1 N1 N2 69(5) . . . . ?
Au4 Au1 N1 N2 -90.3(10) . . . . ?
Au2 Au1 N1 N2 -5.0(9) . . . . ?
C2 N1 N2 C9 0.4(18) . . . . ?
Au1 N1 N2 C9 179.7(12) . . . . ?
C2 N1 N2 Au2 -171.3(10) . . . . ?
Au1 N1 N2 Au2 8.0(14) . . . . ?
N3 Au2 N2 C9 -136(7) . . . . ?
Au3 Au2 N2 C9 -100.7(18) . . . . ?
Au1 Au2 N2 C9 -174.4(19) . . . . ?
N3 Au2 N2 N1 33(8) . . . . ?
Au3 Au2 N2 N1 68.6(11) . . . . ?
Au1 Au2 N2 N1 -5.1(9) . . . . ?
N2 Au2 N3 C17 -136(7) . . . . ?
Au3 Au2 N3 C17 -172.3(16) . . . . ?
Au1 Au2 N3 C17 -98.8(15) . . . . ?
N2 Au2 N3 N4 27(8) . . . . ?
Au3 Au2 N3 N4 -9.3(7) . . . . ?
Au1 Au2 N3 N4 64.2(9) . . . . ?
C17 N3 N4 C24 -1.3(15) . . . . ?
Au2 N3 N4 C24 -169.1(9) . . . . ?
C17 N3 N4 Au3 -177.8(10) . . . . ?
Au2 N3 N4 Au3 14.4(11) . . . . ?
N5 Au3 N4 C24 -179(100) . . . . ?
Au2 Au3 N4 C24 175.4(15) . . . . ?
Au4 Au3 N4 C24 95.2(14) . . . . ?
N5 Au3 N4 N3 -4(6) . . . . ?
Au2 Au3 N4 N3 -9.6(7) . . . . ?
Au4 Au3 N4 N3 -89.9(9) . . . . ?
N4 Au3 N5 C31 90(6) . . . . ?
Au2 Au3 N5 C31 95.3(17) . . . . ?
Au4 Au3 N5 C31 178.6(19) . . . . ?
N4 Au3 N5 N6 -77(5) . . . . ?
Au2 Au3 N5 N6 -71.6(10) . . . . ?
Au4 Au3 N5 N6 11.7(8) . . . . ?
C31 N5 N6 C39 -1.1(18) . . . . ?
Au3 N5 N6 C39 169.0(10) . . . . ?
C31 N5 N6 Au4 171.4(11) . . . . ?
Au3 N5 N6 Au4 -18.5(13) . . . . ?
N7 Au4 N6 C39 124(3) . . . . ?
Au1 Au4 N6 C39 -100.1(14) . . . . ?
Au3 Au4 N6 C39 -178.4(15) . . . . ?
N7 Au4 N6 N5 -46(4) . . . . ?
Au1 Au4 N6 N5 89.9(9) . . . . ?
Au3 Au4 N6 N5 11.7(8) . . . . ?
N6 Au4 N7 C46 131(3) . . . . ?
Au1 Au4 N7 C46 -6.2(11) . . . . ?
Au3 Au4 N7 C46 76.5(12) . . . . ?
N6 Au4 N7 C47 -47(4) . . . . ?
Au1 Au4 N7 C47 176.3(10) . . . . ?
Au3 Au4 N7 C47 -101.0(10) . . . . ?
N1 Au1 N8 C46 -164(5) . . . . ?
Au4 Au1 N8 C46 -4.4(11) . . . . ?
Au2 Au1 N8 C46 -92.6(12) . . . . ?
N1 Au1 N8 C55 15(6) . . . . ?
Au4 Au1 N8 C55 175.4(11) . . . . ?
Au2 Au1 N8 C55 87.2(10) . . . . ?
N2 N1 C2 C1 -0.7(17) . . . . ?
Au1 N1 C2 C1 -179.9(12) . . . . ?
N2 N1 C2 C3 -177.4(12) . . . . ?
Au1 N1 C2 C3 3(2) . . . . ?
C9 C1 C2 N1 1(2) . . . . ?
C9 C1 C2 C3 177.3(16) . . . . ?
N1 C2 C3 C8 -153.2(14) . . . . ?
C1 C2 C3 C8 31(2) . . . . ?
N1 C2 C3 C4 24.9(19) . . . . ?
C1 C2 C3 C4 -151.0(16) . . . . ?
C8 C3 C4 C5 1.3(13) . . . . ?
C2 C3 C4 C5 -176.7(11) . . . . ?
C3 C4 C5 C6 -3.4(13) . . . . ?
C4 C5 C6 C7 5.4(19) . . . . ?
C5 C6 C7 C8 -5(2) . . . . ?
C4 C3 C8 C7 -1.1(18) . . . . ?
C2 C3 C8 C7 177.0(14) . . . . ?
C6 C7 C8 C3 3(2) . . . . ?
N1 N2 C9 C1 0(2) . . . . ?
Au2 N2 C9 C1 170.1(13) . . . . ?
N1 N2 C9 C10 173.4(13) . . . . ?
Au2 N2 C9 C10 -17(3) . . . . ?
C2 C1 C9 N2 -1(2) . . . . ?
C2 C1 C9 C10 -172.5(17) . . . . ?
N2 C9 C10 C15 8(5) . . . . ?
C1 C9 C10 C15 179(5) . . . . ?
N2 C9 C10 C11 -175(4) . . . . ?
C1 C9 C10 C11 -4(5) . . . . ?
C15 C10 C11 C12 0.02(15) . . . . ?
C9 C10 C11 C12 -176.9(12) . . . . ?
C10 C11 C12 C13 0.01(14) . . . . ?
C11 C12 C13 C14 0.0(3) . . . . ?
C12 C13 C14 C15 0.0(4) . . . . ?
C11 C10 C15 C14 0.0(3) . . . . ?
C9 C10 C15 C14 176.7(14) . . . . ?
C13 C14 C15 C10 0.0(4) . . . . ?
N4 N3 C17 C16 -0.3(17) . . . . ?
Au2 N3 C17 C16 163.1(12) . . . . ?
N4 N3 C17 C18 179.4(13) . . . . ?
Au2 N3 C17 C18 -17(2) . . . . ?
C24 C16 C17 N3 1.8(18) . . . . ?
C24 C16 C17 C18 -177.9(14) . . . . ?
N3 C17 C18 C23 149(2) . . . . ?
C16 C17 C18 C23 -32(3) . . . . ?
N3 C17 C18 C19 -31(2) . . . . ?
C16 C17 C18 C19 148(2) . . . . ?
C23 C18 C19 C20 -0.01(14) . . . . ?
C17 C18 C19 C20 -179.7(14) . . . . ?
C18 C19 C20 C21 -0.03(13) . . . . ?
C19 C20 C21 C22 0.1(3) . . . . ?
C20 C21 C22 C23 -0.1(4) . . . . ?
C19 C18 C23 C22 0.0(3) . . . . ?
C17 C18 C23 C22 179.7(14) . . . . ?
C21 C22 C23 C18 0.0(4) . . . . ?
N3 N4 C24 C16 2.5(16) . . . . ?
Au3 N4 C24 C16 177.7(11) . . . . ?
N3 N4 C24 C25 178.5(12) . . . . ?
Au3 N4 C24 C25 -6(2) . . . . ?
C17 C16 C24 N4 -2.7(18) . . . . ?
C17 C16 C24 C25 -178.4(13) . . . . ?
N4 C24 C25 C30 32.3(18) . . . . ?
C16 C24 C25 C30 -152.5(14) . . . . ?
N4 C24 C25 C26 -146.2(12) . . . . ?
C16 C24 C25 C26 29.0(19) . . . . ?
C30 C25 C26 C27 0.00(14) . . . . ?
C24 C25 C26 C27 178.6(11) . . . . ?
C25 C26 C27 C28 0.00(14) . . . . ?
C26 C27 C28 C29 0.0(3) . . . . ?
C27 C28 C29 C30 0.0(5) . . . . ?
C26 C25 C30 C29 0.0(3) . . . . ?
C24 C25 C30 C29 -178.5(11) . . . . ?
C28 C29 C30 C25 0.0(4) . . . . ?
N6 N5 C31 C38 -1(2) . . . . ?
Au3 N5 C31 C38 -168.4(13) . . . . ?
N6 N5 C31 C32 -171.2(15) . . . . ?
Au3 N5 C31 C32 21(3) . . . . ?
N5 C31 C32 C37 146(3) . . . . ?
C38 C31 C32 C37 -22(4) . . . . ?
N5 C31 C32 C33 -33(4) . . . . ?
C38 C31 C32 C33 159(3) . . . . ?
C37 C32 C33 C34 -0.02(15) . . . . ?
C31 C32 C33 C34 178.8(16) . . . . ?
C32 C33 C34 C35 -0.03(14) . . . . ?
C33 C34 C35 C36 0.1(3) . . . . ?
C34 C35 C36 C37 -0.1(5) . . . . ?
C33 C32 C37 C36 0.0(3) . . . . ?
C31 C32 C37 C36 -178.8(16) . . . . ?
C35 C36 C37 C32 0.0(5) . . . . ?
N5 C31 C38 C39 2(2) . . . . ?
C32 C31 C38 C39 172.1(18) . . . . ?
C31 C38 C39 N6 -3(2) . . . . ?
C31 C38 C39 C40 -176.9(16) . . . . ?
N5 N6 C39 C38 2.7(19) . . . . ?
Au4 N6 C39 C38 -167.8(13) . . . . ?
N5 N6 C39 C40 177.0(13) . . . . ?
Au4 N6 C39 C40 7(2) . . . . ?
C38 C39 C40 C45 -146.6(17) . . . . ?
N6 C39 C40 C45 40.3(19) . . . . ?
C38 C39 C40 C41 34(2) . . . . ?
N6 C39 C40 C41 -139.5(13) . . . . ?
C45 C40 C41 C42 -0.01(14) . . . . ?
C39 C40 C41 C42 179.8(11) . . . . ?
C40 C41 C42 C43 0.00(14) . . . . ?
C41 C42 C43 C44 0.0(3) . . . . ?
C42 C43 C44 C45 0.0(4) . . . . ?
C41 C40 C45 C44 0.0(3) . . . . ?
C39 C40 C45 C44 -179.8(12) . . . . ?
C43 C44 C45 C40 0.0(5) . . . . ?
C55 N8 C46 N7 -178.4(14) . . . . ?
Au1 N8 C46 N7 1(2) . . . . ?
C47 N7 C46 N8 -177.1(14) . . . . ?
Au4 N7 C46 N8 5(2) . . . . ?
C46 N7 C47 C48 -91.5(16) . . . . ?
Au4 N7 C47 C48 86.2(14) . . . . ?
C46 N7 C47 C52 88.6(17) . . . . ?
Au4 N7 C47 C52 -93.7(13) . . . . ?
C52 C47 C48 C49 1(2) . . . . ?
N7 C47 C48 C49 -178.6(12) . . . . ?
C52 C47 C48 C53 -177.0(15) . . . . ?
N7 C47 C48 C53 3(2) . . . . ?
C47 C48 C49 C50 1(2) . . . . ?
C53 C48 C49 C50 179.1(16) . . . . ?
C48 C49 C50 C51 -3(3) . . . . ?
C49 C50 C51 C52 3(3) . . . . ?
C50 C51 C52 C47 -1(3) . . . . ?
C50 C51 C52 C54 178.2(18) . . . . ?
C48 C47 C52 C51 -1(2) . . . . ?
N7 C47 C52 C51 178.8(14) . . . . ?
C48 C47 C52 C54 179.4(15) . . . . ?
N7 C47 C52 C54 -1(2) . . . . ?
C46 N8 C55 C60 99.2(16) . . . . ?
Au1 N8 C55 C60 -80.6(14) . . . . ?
C46 N8 C55 C56 -85.0(16) . . . . ?
Au1 N8 C55 C56 95.2(13) . . . . ?
N8 C55 C56 C57 -178.6(13) . . . . ?
C60 C55 C56 C57 -3(2) . . . . ?
N8 C55 C56 C61 2(2) . . . . ?
C60 C55 C56 C61 178.4(13) . . . . ?
C55 C56 C57 C58 0(2) . . . . ?
C61 C56 C57 C58 178.9(16) . . . . ?
C56 C57 C58 C59 1(3) . . . . ?
C57 C58 C59 C60 0(2) . . . . ?
N8 C55 C60 C59 -180.0(13) . . . . ?
C56 C55 C60 C59 4(2) . . . . ?
N8 C55 C60 C62 -3(2) . . . . ?
C56 C55 C60 C62 -178.4(13) . . . . ?
C58 C59 C60 C55 -3(2) . . . . ?
C58 C59 C60 C62 179.6(14) . . . . ?
C66 O1 C63 C64 22(5) . . . . ?
O1 C63 C64 C65 -15(6) . . . . ?
C63 C64 C65 C66 -3(7) . . . . ?
C64 C65 C66 O1 21(10) . . . . ?
C63 O1 C66 C65 -26(8) . . . . ?
