#------------------------------------------------------------------------------
#$Date: 2016-03-21 18:46:36 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178823 $
#$URL: svn://www.crystallography.net/cod/cif/4/10/77/4107751.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_4107751
loop_
_publ_author_name
'Manzhou Zhu'
'Christine M. Aikens'
'Frederick J. Hollander'
'George C. Schatz'
'Rongchao Jin'
_publ_section_title
;
 Correlating the Crystal Structure of A Thiol-Protected Au25 Cluster and
 Optical Properties
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5883
_journal_page_last               5885
_journal_paper_doi               10.1021/ja801173r
_journal_volume                  130
_journal_year                    2008
_chemical_formula_moiety         'C144 H162 Au25 S18 , C32 H68 N1'
_chemical_formula_sum            'C176 H230 Au25 N S18'
_chemical_formula_weight         7860.85
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                106.359(3)
_cell_angle_beta                 105.492(2)
_cell_angle_gamma                90.897(3)
_cell_formula_units_Z            1
_cell_length_a                   16.156(3)
_cell_length_b                   17.388(3)
_cell_length_c                   18.641(3)
_cell_measurement_reflns_used    8145
_cell_measurement_temperature    153(2)
_cell_measurement_theta_max      24.5
_cell_measurement_theta_min      2.3
_cell_volume                     4818.6(15)
_computing_cell_refinement       'SAINT v 7.07'
_computing_data_collection       'Bruker SMART v 5.631'
_computing_data_reduction        'SAINT v 7.07'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      153(2)
_diffrn_detector_area_resol_mean 8.366
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX'
_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  0.0499
_diffrn_reflns_av_sigmaI/netI    0.0587
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            54920
_diffrn_reflns_theta_full        25.71
_diffrn_reflns_theta_max         25.71
_diffrn_reflns_theta_min         2.07
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    19.181
_exptl_absorpt_correction_T_max  1.00
_exptl_absorpt_correction_T_min  0.51
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Blessing, 1995'
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    2.709
_exptl_crystal_description       blade
_exptl_crystal_F_000             3556
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.672
_refine_diff_density_min         -1.006
_refine_diff_density_rms         0.198
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.944
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1063
_refine_ls_number_reflns         18193
_refine_ls_number_restraints     424
_refine_ls_restrained_S_all      0.940
_refine_ls_R_factor_all          0.0530
_refine_ls_R_factor_gt           0.0314
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0250P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0569
_refine_ls_wR_factor_ref         0.0614
_reflns_number_gt                13635
_reflns_number_total             18193
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ja801173r-file005.cif
_cod_data_source_block           au25minus
_cod_original_cell_volume        4818.6(14)
_cod_database_code               4107751
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 0.501579(19) 0.665358(19) 0.520908(18) 0.02704(8) Uani 1 1 d . . .
Au2 Au 0.68505(2) 0.75238(2) 0.638505(19) 0.02975(8) Uani 1 1 d . . .
Au3 Au 0.798745(19) 0.58342(2) 0.658241(19) 0.03084(8) Uani 1 1 d . . .
Au4 Au 0.645311(18) 0.438138(19) 0.573307(18) 0.02729(8) Uani 1 1 d . . .
Au9 Au 0.405572(19) 0.583200(19) 0.596586(18) 0.02783(8) Uani 1 1 d . . .
Au10 Au 0.31736(2) 0.72355(2) 0.52470(2) 0.03628(9) Uani 1 1 d . . .
Au11 Au 0.41294(2) 0.70809(2) 0.369991(19) 0.03171(8) Uani 1 1 d . . .
Au12 Au 0.509974(19) 0.549590(19) 0.373481(18) 0.02687(8) Uani 1 1 d . . .
Au17 Au 0.596318(19) 0.596948(19) 0.645058(18) 0.02686(8) Uani 1 1 d . . .
Au18 Au 0.49327(2) 0.60039(2) 0.770664(19) 0.02976(8) Uani 1 1 d . . .
Au19 Au 0.306158(19) 0.46718(2) 0.65270(2) 0.03184(8) Uani 1 1 d . . .
Au20 Au 0.343965(18) 0.421442(19) 0.485869(18) 0.02705(8) Uani 1 1 d . . .
Au25 Au 0.5000 0.5000 0.5000 0.02191(10) Uani 1 2 d S . .
S1 S 0.55178(13) 0.79853(13) 0.60178(12) 0.0317(5) Uani 1 1 d . . .
S2 S 0.82422(13) 0.72015(13) 0.68004(13) 0.0349(5) Uani 1 1 d . . .
S3 S 0.79125(12) 0.44794(13) 0.65010(13) 0.0315(5) Uani 1 1 d . . .
S7 S 0.2840(11) 0.6639(10) 0.6059(11) 0.035(4) Uani 0.298(10) 1 d PD A 1
S8 S 0.33128(14) 0.79064(14) 0.43763(14) 0.0390(6) Uani 1 1 d . A .
S9 S 0.49645(12) 0.63776(13) 0.29517(12) 0.0298(5) Uani 1 1 d . A .
S10 S 0.3096(5) 0.6773(5) 0.6307(5) 0.0375(15) Uani 0.702(10) 1 d PD A 2
S13 S 0.63267(13) 0.64662(13) 0.78277(12) 0.0307(5) Uani 1 1 d . . .
S14 S 0.35941(13) 0.55820(14) 0.77567(13) 0.0353(5) Uani 1 1 d . . .
S15 S 0.23753(13) 0.37418(14) 0.53456(13) 0.0357(5) Uani 1 1 d . . .
C1 C 0.5641(6) 0.8666(5) 0.5460(5) 0.042(2) Uani 1 1 d . A .
H1A H 0.6021 0.8444 0.5130 0.050 Uiso 1 1 calc R . .
H1B H 0.5070 0.8701 0.5112 0.050 Uiso 1 1 calc R . .
C2 C 0.6022(6) 0.9507(4) 0.5980(5) 0.043(2) Uani 1 1 d D . .
H2A H 0.5655 0.9719 0.6325 0.051 Uiso 1 1 calc R A .
H2B H 0.6014 0.9866 0.5649 0.051 Uiso 1 1 calc R . .
C3 C 0.6947(3) 0.9529(2) 0.6480(3) 0.042(2) Uani 1 1 d GD A .
C4 C 0.7616(4) 0.9522(4) 0.6140(3) 0.056(3) Uani 1 1 d GD . .
H4A H 0.7493 0.9504 0.5608 0.067 Uiso 1 1 calc R A .
C5 C 0.8464(4) 0.9541(4) 0.6579(5) 0.073(4) Uani 1 1 d GD A .
H5A H 0.8921 0.9536 0.6347 0.087 Uiso 1 1 calc R . .
C6 C 0.8643(3) 0.9567(4) 0.7358(4) 0.066(3) Uani 1 1 d GD . .
H6A H 0.9222 0.9580 0.7658 0.079 Uiso 1 1 calc R A .
C7 C 0.7973(5) 0.9574(4) 0.7698(3) 0.056(3) Uani 1 1 d GD A .
H7A H 0.8096 0.9592 0.8230 0.068 Uiso 1 1 calc R . .
C8 C 0.7125(4) 0.9555(3) 0.7259(4) 0.045(2) Uani 1 1 d GD . .
H8A H 0.6668 0.9560 0.7491 0.054 Uiso 1 1 calc R A .
C9 C 0.8535(5) 0.7588(5) 0.7869(5) 0.039(2) Uani 1 1 d . A .
H9A H 0.8444 0.8166 0.8026 0.046 Uiso 1 1 calc R . .
H9B H 0.8156 0.7296 0.8066 0.046 Uiso 1 1 calc R . .
C10 C 0.9484(4) 0.7480(6) 0.8233(6) 0.050(3) Uani 1 1 d D . .
H10A H 0.9579 0.6903 0.8078 0.060 Uiso 1 1 calc R A .
H10B H 0.9867 0.7777 0.8045 0.060 Uiso 1 1 calc R . .
C11 C 0.9688(3) 0.7801(4) 0.9111(3) 0.046(3) Uani 1 1 d GD A .
C12 C 1.0091(4) 0.8576(4) 0.9497(4) 0.065(3) Uani 1 1 d GD . .
H12A H 1.0237 0.8903 0.9209 0.078 Uiso 1 1 calc R A .
C13 C 1.0279(4) 0.8872(4) 1.0303(4) 0.081(4) Uani 1 1 d GD A .
H13A H 1.0554 0.9402 1.0567 0.097 Uiso 1 1 calc R . .
C14 C 1.0065(4) 0.8394(6) 1.0724(3) 0.080(4) Uani 1 1 d GD . .
H14A H 1.0194 0.8596 1.1275 0.096 Uiso 1 1 calc R A .
C15 C 0.9663(5) 0.7619(5) 1.0338(4) 0.079(4) Uani 1 1 d GD A .
H15A H 0.9516 0.7292 1.0626 0.094 Uiso 1 1 calc R . .
C16 C 0.9474(4) 0.7323(3) 0.9532(4) 0.063(3) Uani 1 1 d GD . .
H16A H 0.9199 0.6793 0.9269 0.076 Uiso 1 1 calc R A .
C17 C 0.7861(5) 0.4533(5) 0.7484(5) 0.035(2) Uani 1 1 d . A .
H17A H 0.7430 0.4902 0.7623 0.043 Uiso 1 1 calc R . .
H17B H 0.7669 0.3992 0.7492 0.043 Uiso 1 1 calc R . .
C18 C 0.8730(4) 0.4828(5) 0.8086(5) 0.044(2) Uani 1 1 d D . .
H18A H 0.9162 0.4463 0.7941 0.053 Uiso 1 1 calc R A .
H18B H 0.8917 0.5371 0.8081 0.053 Uiso 1 1 calc R . .
C19 C 0.8704(3) 0.4864(4) 0.8895(3) 0.044(2) Uani 1 1 d GD A .
C20 C 0.9136(3) 0.4322(3) 0.9248(4) 0.051(3) Uani 1 1 d GD . .
H20A H 0.9442 0.3936 0.8978 0.061 Uiso 1 1 calc R A .
C21 C 0.9120(4) 0.4346(4) 0.9996(4) 0.065(3) Uani 1 1 d GD A .
H21A H 0.9415 0.3975 1.0237 0.078 Uiso 1 1 calc R . .
C22 C 0.8672(4) 0.4911(5) 1.0391(3) 0.067(3) Uani 1 1 d GD . .
H22A H 0.8661 0.4927 1.0902 0.081 Uiso 1 1 calc R A .
C23 C 0.8240(4) 0.5453(4) 1.0038(4) 0.070(3) Uani 1 1 d GD A .
H23A H 0.7934 0.5840 1.0308 0.084 Uiso 1 1 calc R . .
C24 C 0.8256(4) 0.5430(3) 0.9290(4) 0.052(3) Uani 1 1 d GD . .
H24A H 0.7961 0.5800 0.9049 0.062 Uiso 1 1 calc R A .
C49 C 0.3092(12) 0.7469(14) 0.6967(12) 0.028(7) Uiso 0.298(10) 1 d PD A 1
H49A H 0.2672 0.7872 0.6911 0.034 Uiso 0.298(10) 1 calc PR A 1
H49B H 0.3030 0.7260 0.7394 0.034 Uiso 0.298(10) 1 calc PR A 1
C50 C 0.4003(11) 0.7875(13) 0.7181(16) 0.022(8) Uiso 0.298(10) 1 d PD A 1
H50A H 0.4428 0.7521 0.7369 0.026 Uiso 0.298(10) 1 calc PR A 1
H50B H 0.4116 0.7970 0.6714 0.026 Uiso 0.298(10) 1 calc PR A 1
C51 C 0.4099(7) 0.8671(11) 0.7811(10) 0.037(8) Uiso 0.298(10) 1 d PGD A 1
C52 C 0.4217(15) 0.9402(15) 0.7669(12) 0.046(12) Uiso 0.298(10) 1 d PGD A 1
H52A H 0.4239 0.9410 0.7167 0.055 Uiso 0.298(10) 1 calc PR A 1
C53 C 0.4304(18) 1.0120(11) 0.8261(18) 0.088(16) Uiso 0.298(10) 1 d PGD A 1
H53A H 0.4385 1.0619 0.8163 0.105 Uiso 0.298(10) 1 calc PR A 1
C54 C 0.4272(16) 1.0107(13) 0.8995(15) 0.10(3) Uiso 0.298(10) 1 d PGD A 1
H54A H 0.4331 1.0597 0.9400 0.120 Uiso 0.298(10) 1 calc PR A 1
C55 C 0.4154(16) 0.9376(18) 0.9138(10) 0.066(11) Uiso 0.298(10) 1 d PGD A 1
H55A H 0.4132 0.9367 0.9640 0.079 Uiso 0.298(10) 1 calc PR A 1
C56 C 0.4068(13) 0.8658(13) 0.8546(13) 0.058(10) Uiso 0.298(10) 1 d PGD A 1
H56A H 0.3987 0.8158 0.8643 0.069 Uiso 0.298(10) 1 calc PR A 1
C57 C 0.2238(5) 0.7716(6) 0.3646(5) 0.048(3) Uani 1 1 d . . .
H57A H 0.2273 0.7923 0.3210 0.058 Uiso 1 1 calc R A .
H57B H 0.2073 0.7128 0.3431 0.058 Uiso 1 1 calc R . .
C58 C 0.1555(5) 0.8109(7) 0.3986(5) 0.062(3) Uani 1 1 d D A .
H58A H 0.1674 0.8702 0.4139 0.075 Uiso 1 1 calc R . .
H58B H 0.1558 0.7953 0.4458 0.075 Uiso 1 1 calc R . .
C59 C 0.0684(4) 0.7850(5) 0.3393(3) 0.061(3) Uani 1 1 d GD . .
C60 C 0.0269(6) 0.8386(4) 0.3022(6) 0.102(5) Uani 1 1 d GD A .
H60A H 0.0534 0.8916 0.3142 0.122 Uiso 1 1 calc R . .
C61 C -0.0534(6) 0.8147(7) 0.2475(6) 0.141(7) Uani 1 1 d GD A .
H61A H -0.0818 0.8514 0.2222 0.169 Uiso 1 1 calc R . .
C62 C -0.0922(4) 0.7372(8) 0.2300(4) 0.119(6) Uani 1 1 d GD A .
H62A H -0.1471 0.7209 0.1926 0.142 Uiso 1 1 calc R . .
C63 C -0.0507(6) 0.6836(5) 0.2671(6) 0.107(5) Uani 1 1 d GD A .
H63A H -0.0773 0.6306 0.2551 0.128 Uiso 1 1 calc R . .
C64 C 0.0296(5) 0.7075(4) 0.3217(5) 0.100(5) Uani 1 1 d GD A .
H64A H 0.0579 0.6708 0.3471 0.120 Uiso 1 1 calc R . .
C65 C 0.4216(5) 0.5852(5) 0.1987(4) 0.0295(19) Uani 1 1 d . . .
H65A H 0.4415 0.5321 0.1778 0.035 Uiso 1 1 calc R A .
H65B H 0.3635 0.5757 0.2044 0.035 Uiso 1 1 calc R . .
C66 C 0.4165(5) 0.6344(5) 0.1414(4) 0.037(2) Uani 1 1 d D A .
H66A H 0.4754 0.6543 0.1445 0.044 Uiso 1 1 calc R . .
H66B H 0.3894 0.5995 0.0876 0.044 Uiso 1 1 calc R . .
C67 C 0.3640(3) 0.7054(3) 0.1598(3) 0.035(2) Uani 1 1 d GD . .
C68 C 0.4038(3) 0.7821(4) 0.2030(3) 0.047(3) Uani 1 1 d GD A .
H68A H 0.4650 0.7909 0.2216 0.056 Uiso 1 1 calc R . .
C69 C 0.3541(4) 0.8458(3) 0.2190(4) 0.060(3) Uani 1 1 d GD A .
H69A H 0.3813 0.8983 0.2485 0.072 Uiso 1 1 calc R . .
C70 C 0.2646(4) 0.8329(3) 0.1918(4) 0.054(3) Uani 1 1 d GD A .
H70A H 0.2307 0.8765 0.2027 0.065 Uiso 1 1 calc R . .
C71 C 0.2248(3) 0.7562(4) 0.1486(4) 0.068(3) Uani 1 1 d GD A .
H71A H 0.1636 0.7474 0.1301 0.082 Uiso 1 1 calc R . .
C72 C 0.2745(3) 0.6924(3) 0.1327(3) 0.047(2) Uani 1 1 d GD A .
H72A H 0.2473 0.6400 0.1032 0.056 Uiso 1 1 calc R . .
C73 C 0.3714(8) 0.7621(7) 0.7119(8) 0.035(3) Uani 0.702(10) 1 d PD A 2
H73A H 0.3894 0.7449 0.7597 0.042 Uiso 0.702(10) 1 calc PR A 2
H73B H 0.4242 0.7784 0.7003 0.042 Uiso 0.702(10) 1 calc PR A 2
C74 C 0.3188(8) 0.8340(7) 0.7265(7) 0.046(4) Uani 0.702(10) 1 d PD A 2
H74A H 0.2911 0.8440 0.6762 0.055 Uiso 0.702(10) 1 calc PR A 2
H74B H 0.2724 0.8207 0.7479 0.055 Uiso 0.702(10) 1 calc PR A 2
C75 C 0.3727(5) 0.9100(5) 0.7823(5) 0.033(3) Uani 0.702(10) 1 d PGD A 2
C76 C 0.3706(6) 0.9360(6) 0.8595(5) 0.057(4) Uani 0.702(10) 1 d PG A 2
H76A H 0.3382 0.9042 0.8783 0.068 Uiso 0.702(10) 1 calc PR A 2
C77 C 0.4160(7) 1.0084(7) 0.9090(5) 0.084(10) Uani 0.702(10) 1 d PG A 2
H77A H 0.4145 1.0262 0.9617 0.101 Uiso 0.702(10) 1 calc PR A 2
C78 C 0.4634(7) 1.0550(5) 0.8814(8) 0.072(6) Uani 0.702(10) 1 d PG A 2
H78A H 0.4944 1.1045 0.9153 0.087 Uiso 0.702(10) 1 calc PR A 2
C79 C 0.4655(6) 1.0290(7) 0.8043(9) 0.079(6) Uani 0.702(10) 1 d PG A 2
H79A H 0.4980 1.0608 0.7855 0.095 Uiso 0.702(10) 1 calc PR A 2
C80 C 0.4202(7) 0.9565(7) 0.7548(5) 0.077(7) Uani 0.702(10) 1 d PG A 2
H80A H 0.4216 0.9388 0.7021 0.093 Uiso 0.702(10) 1 calc PR A 2
C97 C 0.6358(5) 0.7559(4) 0.8088(4) 0.0293(19) Uani 1 1 d . A .
H97A H 0.6840 0.7775 0.7945 0.035 Uiso 1 1 calc R . .
H97B H 0.5814 0.7710 0.7788 0.035 Uiso 1 1 calc R . .
C98 C 0.6475(6) 0.7941(6) 0.8973(4) 0.052(3) Uani 1 1 d D . .
H98A H 0.5905 0.7944 0.9076 0.063 Uiso 1 1 calc R A .
H98B H 0.6835 0.7615 0.9269 0.063 Uiso 1 1 calc R . .
C99 C 0.6899(4) 0.8791(3) 0.9241(3) 0.049(3) Uani 1 1 d GD A .
C100 C 0.7743(4) 0.8986(4) 0.9717(4) 0.061(3) Uani 1 1 d GD . .
H10C H 0.8062 0.8581 0.9879 0.073 Uiso 1 1 calc R A .
C101 C 0.8119(3) 0.9774(4) 0.9957(4) 0.065(3) Uani 1 1 d GD A .
H10D H 0.8696 0.9908 1.0283 0.078 Uiso 1 1 calc R . .
C102 C 0.7651(4) 1.0368(3) 0.9721(4) 0.063(3) Uani 1 1 d GD . .
H10E H 0.7909 1.0907 0.9885 0.075 Uiso 1 1 calc R A .
C103 C 0.6807(4) 1.0173(3) 0.9245(4) 0.053(3) Uani 1 1 d GD A .
H10F H 0.6488 1.0579 0.9084 0.064 Uiso 1 1 calc R . .
C104 C 0.6431(3) 0.9385(4) 0.9005(3) 0.047(3) Uani 1 1 d GD . .
H10G H 0.5854 0.9251 0.8680 0.057 Uiso 1 1 calc R A .
C105 C 0.3872(5) 0.4898(6) 0.8361(5) 0.042(2) Uani 1 1 d . A .
H10H H 0.4186 0.4468 0.8109 0.050 Uiso 1 1 calc R . .
H10I H 0.4267 0.5203 0.8874 0.050 Uiso 1 1 calc R . .
C106 C 0.3094(5) 0.4512(6) 0.8490(6) 0.049(3) Uani 1 1 d D . .
H10J H 0.2849 0.4917 0.8847 0.059 Uiso 1 1 calc R A .
H10K H 0.2642 0.4289 0.7989 0.059 Uiso 1 1 calc R . .
C107 C 0.3403(3) 0.3850(4) 0.8841(4) 0.047(2) Uani 1 1 d GD A .
C108 C 0.3278(4) 0.3061(4) 0.8358(3) 0.057(3) Uani 1 1 d GD . .
H10L H 0.3001 0.2946 0.7816 0.068 Uiso 1 1 calc R A .
C109 C 0.3557(5) 0.2440(3) 0.8669(4) 0.076(4) Uani 1 1 d GD A .
H10M H 0.3472 0.1900 0.8339 0.091 Uiso 1 1 calc R . .
C110 C 0.3962(5) 0.2608(4) 0.9462(4) 0.097(5) Uani 1 1 d GD . .
H11A H 0.4153 0.2184 0.9674 0.117 Uiso 1 1 calc R A .
C111 C 0.4088(5) 0.3397(5) 0.9944(3) 0.090(5) Uani 1 1 d GD A .
H11B H 0.4365 0.3512 1.0486 0.108 Uiso 1 1 calc R . .
C112 C 0.3808(5) 0.4018(3) 0.9634(4) 0.065(3) Uani 1 1 d GD . .
H11C H 0.3894 0.4558 0.9963 0.078 Uiso 1 1 calc R A .
C113 C 0.2706(6) 0.2763(5) 0.5433(5) 0.040(2) Uani 1 1 d . A .
H11D H 0.2404 0.2337 0.4949 0.048 Uiso 1 1 calc R . .
H11E H 0.3334 0.2759 0.5497 0.048 Uiso 1 1 calc R . .
C114 C 0.2500(7) 0.2576(6) 0.6139(4) 0.054(3) Uani 1 1 d D . .
H11F H 0.2883 0.2932 0.6635 0.064 Uiso 1 1 calc R A .
H11G H 0.1893 0.2662 0.6129 0.064 Uiso 1 1 calc R . .
C115 C 0.2652(6) 0.1693(3) 0.6065(3) 0.054(3) Uani 1 1 d GD A .
C116 C 0.1946(4) 0.1122(5) 0.5830(4) 0.072(3) Uani 1 1 d GD . .
H11H H 0.1377 0.1280 0.5716 0.086 Uiso 1 1 calc R A .
C117 C 0.2073(6) 0.0318(4) 0.5760(4) 0.102(5) Uani 1 1 d GD A .
H11I H 0.1591 -0.0073 0.5599 0.123 Uiso 1 1 calc R . .
C118 C 0.2905(8) 0.0086(4) 0.5925(4) 0.088(4) Uani 1 1 d GD . .
H11J H 0.2992 -0.0463 0.5877 0.105 Uiso 1 1 calc R A .
C119 C 0.3611(6) 0.0658(6) 0.6161(5) 0.095(4) Uani 1 1 d GD A .
H11K H 0.4180 0.0499 0.6274 0.114 Uiso 1 1 calc R . .
C120 C 0.3484(5) 0.1461(5) 0.6231(4) 0.072(3) Uani 1 1 d GD . .
H12B H 0.3967 0.1852 0.6392 0.086 Uiso 1 1 calc R A .
N1 N 0.0127(6) 0.5242(5) 0.5321(6) 0.062(3) Uani 0.50 1 d PDU B -1
C145 C -0.0335(7) 0.6000(7) 0.5364(11) 0.058(4) Uani 0.50 1 d PDU B -1
H14G H -0.0699 0.5965 0.4834 0.070 Uiso 0.50 1 calc PR B -1
H14H H -0.0724 0.6016 0.5697 0.070 Uiso 0.50 1 calc PR B -1
C146 C 0.0243(11) 0.6774(7) 0.5678(14) 0.074(6) Uani 0.50 1 d PDU B -1
H14I H 0.0520 0.6878 0.6243 0.089 Uiso 0.50 1 calc PR B -1
H14J H 0.0704 0.6733 0.5413 0.089 Uiso 0.50 1 calc PR B -1
C147 C -0.0276(11) 0.7454(8) 0.5545(11) 0.069(5) Uani 0.50 1 d PDU B -1
H14K H -0.0572 0.7332 0.4981 0.082 Uiso 0.50 1 calc PR B -1
H14L H -0.0725 0.7498 0.5823 0.082 Uiso 0.50 1 calc PR B -1
C148 C 0.0264(15) 0.8245(9) 0.5817(11) 0.080(6) Uani 0.50 1 d PDU B -1
H14M H -0.0081 0.8639 0.5607 0.096 Uiso 0.50 1 calc PR B -1
H14N H 0.0767 0.8177 0.5606 0.096 Uiso 0.50 1 calc PR B -1
C149 C 0.058(3) 0.8575(18) 0.6689(11) 0.081(9) Uani 0.50 1 d PDU B -1
H14O H 0.0079 0.8696 0.6901 0.097 Uiso 0.50 1 calc PR B -1
H14P H 0.0881 0.8166 0.6907 0.097 Uiso 0.50 1 calc PR B -1
C150 C 0.118(2) 0.9326(16) 0.6929(11) 0.080(7) Uani 0.50 1 d PDU B -1
H15B H 0.1716 0.9184 0.6785 0.096 Uiso 0.50 1 calc PR B -1
H15C H 0.0907 0.9695 0.6636 0.096 Uiso 0.50 1 calc PR B -1
C151 C 0.1405(18) 0.9759(14) 0.7785(11) 0.088(8) Uani 0.50 1 d PDU B -1
H15D H 0.1649 0.9383 0.8081 0.106 Uiso 0.50 1 calc PR B -1
H15E H 0.0874 0.9933 0.7925 0.106 Uiso 0.50 1 calc PR B -1
C152 C 0.2046(15) 1.0480(13) 0.8012(14) 0.104(8) Uani 0.50 1 d PDU B -1
H15T H 0.2211 1.0720 0.8579 0.156 Uiso 0.50 1 calc PR B -1
H15U H 0.1786 1.0876 0.7759 0.156 Uiso 0.50 1 calc PR B -1
H15V H 0.2559 1.0314 0.7846 0.156 Uiso 0.50 1 calc PR B -1
C153 C -0.0517(8) 0.4517(7) 0.5143(12) 0.067(5) Uani 0.50 1 d PDU B -1
H15F H -0.0841 0.4635 0.5537 0.080 Uiso 0.50 1 calc PR B -1
H15G H -0.0936 0.4452 0.4629 0.080 Uiso 0.50 1 calc PR B -1
C154 C -0.0147(12) 0.3743(7) 0.5131(14) 0.077(6) Uani 0.50 1 d PDU B -1
H15H H 0.0344 0.3728 0.4906 0.092 Uiso 0.50 1 calc PR B -1
H15I H 0.0091 0.3740 0.5678 0.092 Uiso 0.50 1 calc PR B -1
C155 C -0.0720(12) 0.2994(8) 0.4704(15) 0.090(7) Uani 0.50 1 d PDU B -1
H15J H -0.0975 0.2985 0.4156 0.108 Uiso 0.50 1 calc PR B -1
H15K H -0.1198 0.2976 0.4941 0.108 Uiso 0.50 1 calc PR B -1
C156 C -0.0241(16) 0.2280(9) 0.4724(14) 0.117(8) Uani 0.50 1 d PDU B -1
H15L H 0.0316 0.2370 0.4619 0.140 Uiso 0.50 1 calc PR B -1
H15M H -0.0113 0.2219 0.5254 0.140 Uiso 0.50 1 calc PR B -1
C157 C -0.0712(19) 0.1528(11) 0.4155(12) 0.108(8) Uani 0.50 1 d PDU B -1
H15R H -0.1303 0.1486 0.4209 0.130 Uiso 0.50 1 calc PR B -1
H15S H -0.0422 0.1069 0.4289 0.130 Uiso 0.50 1 calc PR B -1
C158 C -0.078(3) 0.145(2) 0.3333(13) 0.105(11) Uani 0.50 1 d PDU B -1
H15N H -0.1143 0.1855 0.3163 0.126 Uiso 0.50 1 calc PR B -1
H15O H -0.0196 0.1556 0.3278 0.126 Uiso 0.50 1 calc PR B -1
C159 C -0.115(4) 0.0634(18) 0.2841(13) 0.130(12) Uani 0.50 1 d PDU B -1
H15P H -0.0720 0.0250 0.2930 0.156 Uiso 0.50 1 calc PR B -1
H15Q H -0.1654 0.0483 0.3002 0.156 Uiso 0.50 1 calc PR B -1
C160 C -0.144(3) 0.056(2) 0.2002(14) 0.147(13) Uani 0.50 1 d PDU B -1
H16P H -0.1706 0.0010 0.1709 0.220 Uiso 0.50 1 calc PR B -1
H16Q H -0.0939 0.0669 0.1829 0.220 Uiso 0.50 1 calc PR B -1
H16R H -0.1859 0.0945 0.1909 0.220 Uiso 0.50 1 calc PR B -1
C161 C 0.0559(9) 0.5090(13) 0.4670(8) 0.081(5) Uani 0.50 1 d PDU B -1
H16B H 0.1032 0.5522 0.4813 0.097 Uiso 0.50 1 calc PR B -1
H16C H 0.0822 0.4574 0.4627 0.097 Uiso 0.50 1 calc PR B -1
C162 C -0.0038(16) 0.5055(14) 0.3882(7) 0.114(8) Uani 0.50 1 d PDU B -1
H16N H -0.0523 0.5379 0.3959 0.136 Uiso 0.50 1 calc PR B -1
H16O H 0.0280 0.5302 0.3603 0.136 Uiso 0.50 1 calc PR B -1
C163 C -0.0397(19) 0.4210(14) 0.3382(12) 0.116(9) Uani 0.50 1 d PDU B -1
H16L H -0.0795 0.3989 0.3613 0.139 Uiso 0.50 1 calc PR B -1
H16M H 0.0080 0.3861 0.3363 0.139 Uiso 0.50 1 calc PR B -1
C164 C -0.0875(18) 0.4209(16) 0.2563(11) 0.096(8) Uani 0.50 1 d PDU B -1
H16D H -0.1200 0.4688 0.2580 0.115 Uiso 0.50 1 calc PR B -1
H16E H -0.0462 0.4221 0.2258 0.115 Uiso 0.50 1 calc PR B -1
C165 C -0.149(3) 0.345(2) 0.2194(15) 0.103(11) Uani 0.50 1 d PDU B -1
H16F H -0.1967 0.3495 0.2435 0.123 Uiso 0.50 1 calc PR B -1
H16G H -0.1178 0.2986 0.2294 0.123 Uiso 0.50 1 calc PR B -1
C166 C -0.185(3) 0.330(3) 0.1324(14) 0.118(13) Uani 0.50 1 d PDU B -1
H16H H -0.1375 0.3262 0.1076 0.141 Uiso 0.50 1 calc PR B -1
H16I H -0.2190 0.3739 0.1216 0.141 Uiso 0.50 1 calc PR B -1
C167 C -0.242(2) 0.2508(19) 0.1007(19) 0.140(14) Uani 0.50 1 d PDU B -1
H16J H -0.2068 0.2059 0.0863 0.168 Uiso 0.50 1 calc PR B -1
H16K H -0.2661 0.2422 0.1417 0.168 Uiso 0.50 1 calc PR B -1
C168 C -0.315(2) 0.250(3) 0.030(3) 0.165(16) Uani 0.50 1 d PDU B -1
H16S H -0.3470 0.1969 0.0078 0.248 Uiso 0.50 1 calc PR B -1
H16T H -0.2909 0.2633 -0.0087 0.248 Uiso 0.50 1 calc PR B -1
H16U H -0.3533 0.2907 0.0457 0.248 Uiso 0.50 1 calc PR B -1
C169 C 0.0785(8) 0.5322(11) 0.6099(7) 0.066(5) Uani 0.50 1 d PDU B -1
H16V H 0.1131 0.4856 0.6030 0.079 Uiso 0.50 1 calc PR B -1
H16W H 0.1181 0.5812 0.6230 0.079 Uiso 0.50 1 calc PR B -1
C170 C 0.0454(14) 0.5367(16) 0.6767(7) 0.091(7) Uani 0.50 1 d PDU B -1
H17C H 0.0161 0.4831 0.6684 0.110 Uiso 0.50 1 calc PR B -1
H17D H 0.0009 0.5752 0.6766 0.110 Uiso 0.50 1 calc PR B -1
C171 C 0.1074(18) 0.5606(14) 0.7544(10) 0.085(8) Uani 0.50 1 d PDU B -1
H17E H 0.0779 0.5497 0.7913 0.102 Uiso 0.50 1 calc PR B -1
H17F H 0.1546 0.5251 0.7532 0.102 Uiso 0.50 1 calc PR B -1
C172 C 0.146(2) 0.6440(16) 0.7862(17) 0.084(9) Uani 0.50 1 d PDU B -1
H17G H 0.0990 0.6795 0.7830 0.101 Uiso 0.50 1 calc PR B -1
H17H H 0.1800 0.6533 0.7516 0.101 Uiso 0.50 1 calc PR B -1
C173 C 0.203(2) 0.6703(18) 0.8662(12) 0.064(7) Uani 0.50 1 d PDU B -1
H17I H 0.2374 0.6256 0.8752 0.076 Uiso 0.50 1 calc PR B -1
H17J H 0.1662 0.6799 0.9022 0.076 Uiso 0.50 1 calc PR B -1
C174 C 0.2625(14) 0.7428(13) 0.8875(12) 0.056(5) Uani 0.50 1 d PDU B -1
H17K H 0.2984 0.7336 0.8509 0.068 Uiso 0.50 1 calc PR B -1
H17L H 0.2279 0.7877 0.8795 0.068 Uiso 0.50 1 calc PR B -1
C175 C 0.3201(17) 0.7683(15) 0.9671(15) 0.087(8) Uani 0.50 1 d PDU B -1
H17N H 0.3413 0.8257 0.9805 0.104 Uiso 0.50 1 calc PR B -1
H17O H 0.2870 0.7634 1.0035 0.104 Uiso 0.50 1 calc PR B -1
C176 C 0.3943(12) 0.7211(15) 0.9777(12) 0.079(7) Uani 0.50 1 d PDU B -1
H17M H 0.4178 0.7258 1.0331 0.118 Uiso 0.50 1 calc PR B -1
H17P H 0.4388 0.7415 0.9589 0.118 Uiso 0.50 1 calc PR B -1
H17Q H 0.3760 0.6645 0.9481 0.118 Uiso 0.50 1 calc PR B -1
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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -2.0133 8.8022 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
S1 Au1 Au25 148.90(6) . .
S1 Au1 Au4 144.39(5) . 2_666
Au25 Au1 Au4 59.711(11) . 2_666
S1 Au1 Au9 109.77(6) . .
Au25 Au1 Au9 57.936(11) . .
Au4 Au1 Au9 62.099(16) 2_666 .
S1 Au1 Au20 106.52(5) . 2_666
Au25 Au1 Au20 57.442(11) . 2_666
Au4 Au1 Au20 109.041(18) 2_666 2_666
Au9 Au1 Au20 105.476(17) . 2_666
S1 Au1 Au12 141.65(5) . .
Au25 Au1 Au12 57.622(11) . .
Au4 Au1 Au12 61.090(13) 2_666 .
Au9 Au1 Au12 108.465(18) . .
Au20 Au1 Au12 59.631(11) 2_666 .
S1 Au1 Au17 91.52(6) . .
Au25 Au1 Au17 57.395(11) . .
Au4 Au1 Au17 109.612(17) 2_666 .
Au9 Au1 Au17 59.952(15) . .
Au20 Au1 Au17 56.359(12) 2_666 .
Au12 Au1 Au17 105.042(18) . .
S1 Au1 Au11 97.32(6) . .
Au25 Au1 Au11 113.431(13) . .
Au4 Au1 Au11 66.305(14) 2_666 .
Au9 Au1 Au11 122.352(17) . .
Au20 Au1 Au11 114.221(15) 2_666 .
Au12 Au1 Au11 63.851(16) . .
Au17 Au1 Au11 168.883(14) . .
S1 Au1 Au10 83.60(5) . .
Au25 Au1 Au10 110.766(13) . .
Au4 Au1 Au10 61.298(15) 2_666 .
Au9 Au1 Au10 64.595(14) . .
Au20 Au1 Au10 168.200(15) 2_666 .
Au12 Au1 Au10 115.942(13) . .
Au17 Au1 Au10 118.533(15) . .
Au11 Au1 Au10 69.415(12) . .
S1 Au1 Au2 45.61(5) . .
Au25 Au1 Au2 108.684(13) . .
Au4 Au1 Au2 168.300(15) 2_666 .
Au9 Au1 Au2 111.571(18) . .
Au20 Au1 Au2 61.961(15) 2_666 .
Au12 Au1 Au2 115.293(15) . .
Au17 Au1 Au2 59.603(13) . .
Au11 Au1 Au2 123.319(15) . .
Au10 Au1 Au2 126.486(16) . .
S2 Au2 S1 174.01(8) . .
S2 Au2 Au17 95.64(6) . .
S1 Au2 Au17 89.84(6) . .
S2 Au2 Au20 84.31(6) . 2_666
S1 Au2 Au20 100.99(5) . 2_666
Au17 Au2 Au20 52.897(14) . 2_666
S2 Au2 Au1 138.50(6) . .
S1 Au2 Au1 47.20(5) . .
Au17 Au2 Au1 56.109(12) . .
Au20 Au2 Au1 54.767(11) 2_666 .
S2 Au3 S3 171.90(8) . .
S2 Au3 Au20 88.36(6) . 2_666
S3 Au3 Au20 99.60(5) . 2_666
S2 Au3 Au17 91.90(5) . .
S3 Au3 Au17 94.10(5) . .
Au20 Au3 Au17 53.042(12) 2_666 .
S2 Au3 Au4 140.54(5) . .
S3 Au3 Au4 47.33(5) . .
Au20 Au3 Au4 56.544(13) 2_666 .
Au17 Au3 Au4 53.892(12) . .
S3 Au4 Au25 153.88(5) . .
S3 Au4 Au1 145.92(5) . 2_666
Au25 Au4 Au1 60.037(14) . 2_666
S3 Au4 Au12 127.66(5) . 2_666
Au25 Au4 Au12 58.051(13) . 2_666
Au1 Au4 Au12 62.098(15) 2_666 2_666
S3 Au4 Au17 100.70(5) . .
Au25 Au4 Au17 57.967(11) . .
Au1 Au4 Au17 110.270(16) 2_666 .
Au12 Au4 Au17 60.147(12) 2_666 .
S3 Au4 Au9 123.59(5) . 2_666
Au25 Au4 Au9 57.803(9) . 2_666
Au1 Au4 Au9 61.428(12) 2_666 2_666
Au12 Au4 Au9 108.717(15) 2_666 2_666
Au17 Au4 Au9 105.706(14) . 2_666
S3 Au4 Au20 99.33(6) . 2_666
Au25 Au4 Au20 57.298(11) . 2_666
Au1 Au4 Au20 109.287(16) 2_666 2_666
Au12 Au4 Au20 105.455(13) 2_666 2_666
Au17 Au4 Au20 56.567(15) . 2_666
Au9 Au4 Au20 59.653(13) 2_666 2_666
S3 Au4 Au10 85.51(5) . 2_666
Au25 Au4 Au10 114.388(15) . 2_666
Au1 Au4 Au10 65.412(15) 2_666 2_666
Au12 Au4 Au10 120.406(15) 2_666 2_666
Au17 Au4 Au10 171.477(15) . 2_666
Au9 Au4 Au10 65.831(13) 2_666 2_666
Au20 Au4 Au10 116.949(18) 2_666 2_666
S3 Au4 Au11 92.79(6) . 2_666
Au25 Au4 Au11 109.695(15) . 2_666
Au1 Au4 Au11 61.292(14) 2_666 2_666
Au12 Au4 Au11 62.414(12) 2_666 2_666
Au17 Au4 Au11 116.037(17) . 2_666
Au9 Au4 Au11 117.297(15) 2_666 2_666
Au20 Au4 Au11 166.766(13) 2_666 2_666
Au10 Au4 Au11 69.061(16) 2_666 2_666
S3 Au4 Au3 45.60(5) . .
Au25 Au4 Au3 108.285(17) . .
Au1 Au4 Au3 167.187(15) 2_666 .
Au12 Au4 Au3 117.791(16) 2_666 .
Au17 Au4 Au3 62.923(15) . .
Au9 Au4 Au3 108.714(14) 2_666 .
Au20 Au4 Au3 57.949(14) 2_666 .
Au10 Au4 Au3 119.694(16) 2_666 .
Au11 Au4 Au3 131.016(16) 2_666 .
S10 Au9 S7 12.3(3) . .
S10 Au9 Au25 154.1(2) . .
S7 Au9 Au25 146.1(5) . .
S10 Au9 Au12 146.0(2) . 2_666
S7 Au9 Au12 147.4(5) . 2_666
Au25 Au9 Au12 59.360(12) . 2_666
S10 Au9 Au1 101.9(2) . .
S7 Au9 Au1 102.9(5) . .
Au25 Au9 Au1 58.229(13) . .
Au12 Au9 Au1 109.764(16) 2_666 .
S10 Au9 Au20 121.77(17) . .
S7 Au9 Au20 110.2(3) . .
Au25 Au9 Au20 57.516(11) . .
Au12 Au9 Au20 61.137(15) 2_666 .
Au1 Au9 Au20 105.806(17) . .
S10 Au9 Au17 130.38(18) . .
S7 Au9 Au17 141.5(3) . .
Au25 Au9 Au17 57.668(11) . .
Au12 Au9 Au17 61.069(13) 2_666 .
Au1 Au9 Au17 60.471(13) . .
Au20 Au9 Au17 107.834(13) . .
S10 Au9 Au4 98.1(2) . 2_666
S7 Au9 Au4 88.4(5) . 2_666
Au25 Au9 Au4 57.791(12) . 2_666
Au12 Au9 Au4 109.459(14) 2_666 2_666
Au1 Au9 Au4 56.476(13) . 2_666
Au20 Au9 Au4 60.267(13) . 2_666
Au17 Au9 Au4 105.560(12) . 2_666
S10 Au9 Au18 90.9(2) . .
S7 Au9 Au18 101.3(5) . .
Au25 Au9 Au18 112.191(16) . .
Au12 Au9 Au18 64.415(12) 2_666 .
Au1 Au9 Au18 115.915(16) . .
Au20 Au9 Au18 119.417(16) . .
Au17 Au9 Au18 63.825(11) . .
Au4 Au9 Au18 169.190(14) 2_666 .
S10 Au9 Au19 86.6(2) . .
S7 Au9 Au19 84.1(5) . .
Au25 Au9 Au19 111.645(16) . .
Au12 Au9 Au19 63.693(15) 2_666 .
Au1 Au9 Au19 169.296(14) . .
Au20 Au9 Au19 63.822(16) . .
Au17 Au9 Au19 118.601(15) . .
Au4 Au9 Au19 116.324(15) 2_666 .
Au18 Au9 Au19 69.917(14) . .
S10 Au9 Au10 46.2(2) . .
S7 Au9 Au10 42.9(6) . .
Au25 Au9 Au10 108.118(15) . .
Au12 Au9 Au10 167.238(14) 2_666 .
Au1 Au9 Au10 61.048(14) . .
Au20 Au9 Au10 111.180(17) . .
Au17 Au9 Au10 115.830(14) . .
Au4 Au9 Au10 58.483(12) 2_666 .
Au18 Au9 Au10 126.678(14) . .
Au19 Au9 Au10 123.784(16) . .
S7 Au10 S8 171.5(5) . .
S7 Au10 S10 12.6(3) . .
S8 Au10 S10 169.88(19) . .
S7 Au10 Au4 90.2(4) . 2_666
S8 Au10 Au4 94.02(6) . 2_666
S10 Au10 Au4 95.15(18) . 2_666
S7 Au10 Au1 101.6(5) . .
S8 Au10 Au1 86.80(5) . .
S10 Au10 Au1 95.26(18) . .
Au4 Au10 Au1 53.291(10) 2_666 .
S7 Au10 Au9 48.4(5) . .
S8 Au10 Au9 139.59(5) . .
S10 Au10 Au9 45.74(18) . .
Au4 Au10 Au9 55.688(15) 2_666 .
Au1 Au10 Au9 54.357(10) . .
S8 Au11 S9 172.91(8) . .
S8 Au11 Au1 88.56(6) . .
S9 Au11 Au1 96.76(5) . .
S8 Au11 Au12 139.20(6) . .
S9 Au11 Au12 47.71(5) . .
Au1 Au11 Au12 55.909(11) . .
S8 Au11 Au4 89.55(6) . 2_666
S9 Au11 Au4 97.41(5) . 2_666
Au1 Au11 Au4 52.402(11) . 2_666
Au12 Au11 Au4 54.091(13) . 2_666
S9 Au12 Au25 156.46(5) . .
S9 Au12 Au9 142.79(5) . 2_666
Au25 Au12 Au9 59.708(10) . 2_666
S9 Au12 Au4 104.80(5) . 2_666
Au25 Au12 Au4 58.371(10) . 2_666
Au9 Au12 Au4 110.140(15) 2_666 2_666
S9 Au12 Au20 119.97(5) . 2_666
Au25 Au12 Au20 57.813(13) . 2_666
Au9 Au12 Au20 61.721(13) 2_666 2_666
Au4 Au12 Au20 106.011(18) 2_666 2_666
S9 Au12 Au17 131.16(5) . 2_666
Au25 Au12 Au17 58.030(10) . 2_666
Au9 Au12 Au17 61.847(16) 2_666 2_666
Au4 Au12 Au17 60.051(13) 2_666 2_666
Au20 Au12 Au17 108.861(15) 2_666 2_666
S9 Au12 Au1 99.35(5) . .
Au25 Au12 Au1 58.239(15) . .
Au9 Au12 Au1 110.117(17) 2_666 .
Au4 Au12 Au1 56.810(11) 2_666 .
Au20 Au12 Au1 60.140(14) 2_666 .
Au17 Au12 Au1 105.952(15) 2_666 .
S9 Au12 Au19 84.11(5) . 2_666
Au25 Au12 Au19 111.263(12) . 2_666
Au9 Au12 Au19 62.877(12) 2_666 2_666
Au4 Au12 Au19 169.209(15) 2_666 2_666
Au20 Au12 Au19 63.713(15) 2_666 2_666
Au17 Au12 Au19 118.565(15) 2_666 2_666
Au1 Au12 Au19 116.384(13) . 2_666
S9 Au12 Au18 91.23(5) . 2_666
Au25 Au12 Au18 110.661(17) . 2_666
Au9 Au12 Au18 62.179(15) 2_666 2_666
Au4 Au12 Au18 116.251(14) 2_666 2_666
Au20 Au12 Au18 117.952(16) 2_666 2_666
Au17 Au12 Au18 63.283(13) 2_666 2_666
Au1 Au12 Au18 168.543(15) . 2_666
Au19 Au12 Au18 68.854(11) 2_666 2_666
S9 Au12 Au11 46.19(5) . .
Au25 Au12 Au11 110.835(13) . .
Au9 Au12 Au11 170.106(15) 2_666 .
Au4 Au12 Au11 63.495(12) 2_666 .
Au20 Au12 Au11 111.610(14) 2_666 .
Au17 Au12 Au11 116.904(17) 2_666 .
Au1 Au12 Au11 60.240(13) . .
Au19 Au12 Au11 122.108(14) 2_666 .
Au18 Au12 Au11 126.935(15) 2_666 .
S13 Au17 Au25 154.17(5) . .
S13 Au17 Au20 145.21(5) . 2_666
Au25 Au17 Au20 59.473(14) . 2_666
S13 Au17 Au4 118.84(5) . .
Au25 Au17 Au4 58.276(11) . .
Au20 Au17 Au4 62.392(12) 2_666 .
S13 Au17 Au12 97.37(5) . 2_666
Au25 Au17 Au12 58.022(12) . 2_666
Au20 Au17 Au12 109.820(14) 2_666 2_666
Au4 Au17 Au12 59.800(15) . 2_666
S13 Au17 Au9 103.59(5) . .
Au25 Au17 Au9 57.985(9) . .
Au20 Au17 Au9 109.250(16) 2_666 .
Au4 Au17 Au9 106.102(14) . .
Au12 Au17 Au9 57.085(12) 2_666 .
S13 Au17 Au1 131.76(5) . .
Au25 Au17 Au1 57.999(14) . .
Au20 Au17 Au1 61.425(15) 2_666 .
Au4 Au17 Au1 109.382(17) . .
Au12 Au17 Au1 105.837(16) 2_666 .
Au9 Au17 Au1 59.577(11) . .
S13 Au17 Au2 90.55(5) . .
Au25 Au17 Au2 113.182(15) . .
Au20 Au17 Au2 65.379(12) 2_666 .
Au4 Au17 Au2 121.100(17) . .
Au12 Au17 Au2 170.078(15) 2_666 .
Au9 Au17 Au2 115.247(15) . .
Au1 Au17 Au2 64.288(13) . .
S13 Au17 Au18 46.04(5) . .
Au25 Au17 Au18 109.451(16) . .
Au20 Au17 Au18 168.756(14) 2_666 .
Au4 Au17 Au18 114.760(15) . .
Au12 Au17 Au18 61.824(12) 2_666 .
Au9 Au17 Au18 60.278(14) . .
Au1 Au17 Au18 112.120(17) . .
Au2 Au17 Au18 121.533(14) . .
S13 Au17 Au3 88.98(5) . .
Au25 Au17 Au3 108.730(13) . .
Au20 Au17 Au3 59.540(12) 2_666 .
Au4 Au17 Au3 63.184(11) . .
Au12 Au17 Au3 117.716(15) 2_666 .
Au9 Au17 Au3 166.715(14) . .
Au1 Au17 Au3 114.850(14) . .
Au2 Au17 Au3 68.186(13) . .
Au18 Au17 Au3 130.173(15) . .
S14 Au18 S13 172.69(8) . .
S14 Au18 Au9 86.37(6) . .
S13 Au18 Au9 100.81(5) . .
S14 Au18 Au12 92.76(6) . 2_666
S13 Au18 Au12 92.62(5) . 2_666
Au9 Au18 Au12 53.407(13) . 2_666
S14 Au18 Au17 139.68(6) . .
S13 Au18 Au17 47.55(5) . .
Au9 Au18 Au17 55.897(15) . .
Au12 Au18 Au17 54.894(12) 2_666 .
S15 Au19 S14 172.80(7) . .
S15 Au19 Au9 100.03(6) . .
S14 Au19 Au9 85.78(6) . .
S15 Au19 Au12 93.77(5) . 2_666
S14 Au19 Au12 93.11(5) . 2_666
Au9 Au19 Au12 53.430(12) . 2_666
S15 Au19 Au20 47.71(5) . .
S14 Au19 Au20 139.17(5) . .
Au9 Au19 Au20 55.537(12) . .
Au12 Au19 Au20 55.002(10) 2_666 .
S15 Au20 Au25 154.40(6) . .
S15 Au20 Au17 144.91(6) . 2_666
Au25 Au20 Au17 59.810(10) . 2_666
S15 Au20 Au12 97.71(6) . 2_666
Au25 Au20 Au12 58.118(12) . 2_666
Au17 Au20 Au12 110.211(19) 2_666 2_666
S15 Au20 Au1 119.71(6) . 2_666
Au25 Au20 Au1 58.364(14) . 2_666
Au17 Au20 Au1 62.220(12) 2_666 2_666
Au12 Au20 Au1 60.227(14) 2_666 2_666
S15 Au20 Au9 103.13(6) . .
Au25 Au20 Au9 58.146(10) . .
Au17 Au20 Au9 109.674(15) 2_666 .
Au12 Au20 Au9 57.143(12) 2_666 .
Au1 Au20 Au9 106.508(15) 2_666 .
S15 Au20 Au4 131.32(6) . 2_666
Au25 Au20 Au4 57.912(10) . 2_666
Au17 Au20 Au4 61.040(13) 2_666 2_666
Au12 Au20 Au4 106.113(15) 2_666 2_666
Au1 Au20 Au4 108.963(15) 2_666 2_666
Au9 Au20 Au4 60.080(16) . 2_666
S15 Au20 Au3 87.70(6) . 2_666
Au25 Au20 Au3 115.395(15) . 2_666
Au17 Au20 Au3 67.418(17) 2_666 2_666
Au12 Au20 Au3 171.541(15) 2_666 2_666
Au1 Au20 Au3 122.424(16) 2_666 2_666
Au9 Au20 Au3 115.360(16) . 2_666
Au4 Au20 Au3 65.508(13) 2_666 2_666
S15 Au20 Au2 87.11(6) . 2_666
Au25 Au20 Au2 110.495(13) . 2_666
Au17 Au20 Au2 61.724(13) 2_666 2_666
Au12 Au20 Au2 116.973(15) 2_666 2_666
Au1 Au20 Au2 63.272(12) 2_666 2_666
Au9 Au20 Au2 168.538(13) . 2_666
Au4 Au20 Au2 116.704(19) 2_666 2_666
Au3 Au20 Au2 69.612(14) 2_666 2_666
S15 Au20 Au19 45.83(5) . .
Au25 Au20 Au19 109.493(12) . .
Au17 Au20 Au19 169.244(14) 2_666 .
Au12 Au20 Au19 61.284(15) 2_666 .
Au1 Au20 Au19 114.351(14) 2_666 .
Au9 Au20 Au19 60.641(12) . .
Au4 Au20 Au19 113.417(15) 2_666 .
Au3 Au20 Au19 119.930(17) 2_666 .
Au2 Au20 Au19 127.090(15) 2_666 .
Au20 Au25 Au20 180.0 . 2_666
Au20 Au25 Au12 64.070(10) . 2_666
Au20 Au25 Au12 115.932(10) 2_666 2_666
Au20 Au25 Au12 115.930(10) . .
Au20 Au25 Au12 64.068(10) 2_666 .
Au12 Au25 Au12 180.0 2_666 .
Au20 Au25 Au17 119.282(12) . .
Au20 Au25 Au17 60.718(12) 2_666 .
Au12 Au25 Au17 63.947(15) 2_666 .
Au12 Au25 Au17 116.052(16) . .
Au20 Au25 Au17 60.717(12) . 2_666
Au20 Au25 Au17 119.283(12) 2_666 2_666
Au12 Au25 Au17 116.053(15) 2_666 2_666
Au12 Au25 Au17 63.947(15) . 2_666
Au17 Au25 Au17 180.0 . 2_666
Au20 Au25 Au4 115.210(15) . .
Au20 Au25 Au4 64.792(15) 2_666 .
Au12 Au25 Au4 63.579(12) 2_666 .
Au12 Au25 Au4 116.422(12) . .
Au17 Au25 Au4 63.757(13) . .
Au17 Au25 Au4 116.246(13) 2_666 .
Au20 Au25 Au4 64.791(15) . 2_666
Au20 Au25 Au4 115.207(15) 2_666 2_666
Au12 Au25 Au4 116.423(12) 2_666 2_666
Au12 Au25 Au4 63.577(12) . 2_666
Au17 Au25 Au4 116.244(12) . 2_666
Au17 Au25 Au4 63.754(13) 2_666 2_666
Au4 Au25 Au4 180.0 . 2_666
Au20 Au25 Au9 115.663(13) . 2_666
Au20 Au25 Au9 64.338(13) 2_666 2_666
Au12 Au25 Au9 119.070(13) 2_666 2_666
Au12 Au25 Au9 60.930(13) . 2_666
Au17 Au25 Au9 115.653(15) . 2_666
Au17 Au25 Au9 64.349(15) 2_666 2_666
Au4 Au25 Au9 64.407(15) . 2_666
Au4 Au25 Au9 115.592(15) 2_666 2_666
Au20 Au25 Au9 64.338(14) . .
Au20 Au25 Au9 115.661(13) 2_666 .
Au12 Au25 Au9 60.932(13) 2_666 .
Au12 Au25 Au9 119.068(13) . .
Au17 Au25 Au9 64.347(15) . .
Au17 Au25 Au9 115.651(15) 2_666 .
Au4 Au25 Au9 115.595(15) . .
Au4 Au25 Au9 64.406(14) 2_666 .
Au9 Au25 Au9 180.0 2_666 .
Au20 Au25 Au1 64.194(11) . 2_666
Au20 Au25 Au1 115.808(11) 2_666 2_666
Au12 Au25 Au1 64.138(11) 2_666 2_666
Au12 Au25 Au1 115.863(11) . 2_666
Au17 Au25 Au1 115.393(12) . 2_666
Au17 Au25 Au1 64.608(12) 2_666 2_666
Au4 Au25 Au1 60.253(11) . 2_666
Au4 Au25 Au1 119.747(11) 2_666 2_666
Au9 Au25 Au1 63.838(11) 2_666 2_666
Au9 Au25 Au1 116.164(11) . 2_666
Au20 Au25 Au1 115.805(11) . .
Au20 Au25 Au1 64.193(11) 2_666 .
Au12 Au25 Au1 115.861(11) 2_666 .
Au12 Au25 Au1 64.138(11) . .
Au17 Au25 Au1 64.606(11) . .
Au17 Au25 Au1 115.392(11) 2_666 .
Au4 Au25 Au1 119.747(11) . .
Au4 Au25 Au1 60.253(11) 2_666 .
Au9 Au25 Au1 116.164(11) 2_666 .
Au9 Au25 Au1 63.834(10) . .
Au1 Au25 Au1 179.998(2) 2_666 .
C1 S1 Au2 106.2(3) . .
C1 S1 Au1 112.3(3) . .
Au2 S1 Au1 87.19(7) . .
C9 S2 Au3 102.2(3) . .
C9 S2 Au2 104.8(3) . .
Au3 S2 Au2 100.35(8) . .
C17 S3 Au3 100.7(3) . .
C17 S3 Au4 105.8(3) . .
Au3 S3 Au4 87.07(7) . .
C49 S7 Au10 101.6(11) . .
C49 S7 Au9 112.1(10) . .
Au10 S7 Au9 88.8(7) . .
C57 S8 Au10 104.8(3) . .
C57 S8 Au11 102.2(3) . .
Au10 S8 Au11 101.47(9) . .
C65 S9 Au11 106.5(3) . .
C65 S9 Au12 107.8(3) . .
Au11 S9 Au12 86.10(7) . .
C73 S10 Au9 108.1(5) . .
C73 S10 Au10 99.9(6) . .
Au9 S10 Au10 88.1(3) . .
C97 S13 Au18 106.0(3) . .
C97 S13 Au17 107.5(3) . .
Au18 S13 Au17 86.41(7) . .
C105 S14 Au18 101.9(3) . .
C105 S14 Au19 101.2(3) . .
Au18 S14 Au19 100.90(8) . .
C113 S15 Au19 106.0(3) . .
C113 S15 Au20 103.4(3) . .
Au19 S15 Au20 86.46(7) . .
C2 C1 S1 112.4(6) . .
C2 C1 H1A 109.1 . .
S1 C1 H1A 109.1 . .
C2 C1 H1B 109.1 . .
S1 C1 H1B 109.1 . .
H1A C1 H1B 107.9 . .
C1 C2 C3 113.0(5) . .
C1 C2 H2A 109.0 . .
C3 C2 H2A 109.0 . .
C1 C2 H2B 109.0 . .
C3 C2 H2B 109.0 . .
H2A C2 H2B 107.8 . .
C4 C3 C8 120.0 . .
C4 C3 C2 118.6(6) . .
C8 C3 C2 121.4(6) . .
C3 C4 C5 120.0 . .
C3 C4 H4A 120.0 . .
C5 C4 H4A 120.0 . .
C4 C5 C6 120.0 . .
C4 C5 H5A 120.0 . .
C6 C5 H5A 120.0 . .
C7 C6 C5 120.0 . .
C7 C6 H6A 120.0 . .
C5 C6 H6A 120.0 . .
C6 C7 C8 120.0 . .
C6 C7 H7A 120.0 . .
C8 C7 H7A 120.0 . .
C7 C8 C3 120.0 . .
C7 C8 H8A 120.0 . .
C3 C8 H8A 120.0 . .
C10 C9 S2 110.9(6) . .
C10 C9 H9A 109.5 . .
S2 C9 H9A 109.5 . .
C10 C9 H9B 109.5 . .
S2 C9 H9B 109.5 . .
H9A C9 H9B 108.0 . .
C11 C10 C9 108.8(5) . .
C11 C10 H10A 109.9 . .
C9 C10 H10A 109.9 . .
C11 C10 H10B 109.9 . .
C9 C10 H10B 109.9 . .
H10A C10 H10B 108.3 . .
C12 C11 C16 120.0 . .
C12 C11 C10 119.9(6) . .
C16 C11 C10 120.1(6) . .
C13 C12 C11 120.0 . .
C13 C12 H12A 120.0 . .
C11 C12 H12A 120.0 . .
C12 C13 C14 120.0 . .
C12 C13 H13A 120.0 . .
C14 C13 H13A 120.0 . .
C15 C14 C13 120.0 . .
C15 C14 H14A 120.0 . .
C13 C14 H14A 120.0 . .
C14 C15 C16 120.0 . .
C14 C15 H15A 120.0 . .
C16 C15 H15A 120.0 . .
C15 C16 C11 120.0 . .
C15 C16 H16A 120.0 . .
C11 C16 H16A 120.0 . .
C18 C17 S3 111.7(6) . .
C18 C17 H17A 109.3 . .
S3 C17 H17A 109.3 . .
C18 C17 H17B 109.3 . .
S3 C17 H17B 109.3 . .
H17A C17 H17B 107.9 . .
C19 C18 C17 112.5(5) . .
C19 C18 H18A 109.1 . .
C17 C18 H18A 109.1 . .
C19 C18 H18B 109.1 . .
C17 C18 H18B 109.1 . .
H18A C18 H18B 107.8 . .
C20 C19 C24 120.0 . .
C20 C19 C18 119.1(6) . .
C24 C19 C18 120.9(6) . .
C21 C20 C19 120.0 . .
C21 C20 H20A 120.0 . .
C19 C20 H20A 120.0 . .
C20 C21 C22 120.0 . .
C20 C21 H21A 120.0 . .
C22 C21 H21A 120.0 . .
C21 C22 C23 120.0 . .
C21 C22 H22A 120.0 . .
C23 C22 H22A 120.0 . .
C22 C23 C24 120.0 . .
C22 C23 H23A 120.0 . .
C24 C23 H23A 120.0 . .
C23 C24 C19 120.0 . .
C23 C24 H24A 120.0 . .
C19 C24 H24A 120.0 . .
C50 C49 S7 112.0(10) . .
C50 C49 H49A 109.2 . .
S7 C49 H49A 109.2 . .
C50 C49 H49B 109.2 . .
S7 C49 H49B 109.2 . .
H49A C49 H49B 107.9 . .
C51 C50 C49 109.6(14) . .
C51 C50 H50A 109.8 . .
C49 C50 H50A 109.8 . .
C51 C50 H50B 109.8 . .
C49 C50 H50B 109.8 . .
H50A C50 H50B 108.2 . .
C52 C51 C56 120.0 . .
C52 C51 C50 122(2) . .
C56 C51 C50 118(2) . .
C51 C52 C53 120.0 . .
C51 C52 H52A 120.0 . .
C53 C52 H52A 120.0 . .
C54 C53 C52 120.0 . .
C54 C53 H53A 120.0 . .
C52 C53 H53A 120.0 . .
C53 C54 C55 120.0 . .
C53 C54 H54A 120.0 . .
C55 C54 H54A 120.0 . .
C54 C55 C56 120.0 . .
C54 C55 H55A 120.0 . .
C56 C55 H55A 120.0 . .
C55 C56 C51 120.0 . .
C55 C56 H56A 120.0 . .
C51 C56 H56A 120.0 . .
C58 C57 S8 112.3(6) . .
C58 C57 H57A 109.2 . .
S8 C57 H57A 109.2 . .
C58 C57 H57B 109.2 . .
S8 C57 H57B 109.2 . .
H57A C57 H57B 107.9 . .
C57 C58 C59 109.6(6) . .
C57 C58 H58A 109.8 . .
C59 C58 H58A 109.8 . .
C57 C58 H58B 109.8 . .
C59 C58 H58B 109.8 . .
H58A C58 H58B 108.2 . .
C60 C59 C64 120.0 . .
C60 C59 C58 120.0(7) . .
C64 C59 C58 120.0(7) . .
C61 C60 C59 120.0 . .
C61 C60 H60A 120.0 . .
C59 C60 H60A 120.0 . .
C60 C61 C62 120.0 . .
C60 C61 H61A 120.0 . .
C62 C61 H61A 120.0 . .
C63 C62 C61 120.0 . .
C63 C62 H62A 120.0 . .
C61 C62 H62A 120.0 . .
C64 C63 C62 120.0 . .
C64 C63 H63A 120.0 . .
C62 C63 H63A 120.0 . .
C63 C64 C59 120.0 . .
C63 C64 H64A 120.0 . .
C59 C64 H64A 120.0 . .
C66 C65 S9 111.3(6) . .
C66 C65 H65A 109.4 . .
S9 C65 H65A 109.4 . .
C66 C65 H65B 109.4 . .
S9 C65 H65B 109.4 . .
H65A C65 H65B 108.0 . .
C67 C66 C65 110.8(5) . .
C67 C66 H66A 109.5 . .
C65 C66 H66A 109.5 . .
C67 C66 H66B 109.5 . .
C65 C66 H66B 109.5 . .
H66A C66 H66B 108.1 . .
C68 C67 C72 120.0 . .
C68 C67 C66 121.3(5) . .
C72 C67 C66 118.7(5) . .
C67 C68 C69 120.0 . .
C67 C68 H68A 120.0 . .
C69 C68 H68A 120.0 . .
C70 C69 C68 120.0 . .
C70 C69 H69A 120.0 . .
C68 C69 H69A 120.0 . .
C69 C70 C71 120.0 . .
C69 C70 H70A 120.0 . .
C71 C70 H70A 120.0 . .
C70 C71 C72 120.0 . .
C70 C71 H71A 120.0 . .
C72 C71 H71A 120.0 . .
C71 C72 C67 120.0 . .
C71 C72 H72A 120.0 . .
C67 C72 H72A 120.0 . .
C74 C73 S10 111.7(9) . .
C74 C73 H73A 109.3 . .
S10 C73 H73A 109.3 . .
C74 C73 H73B 109.3 . .
S10 C73 H73B 109.3 . .
H73A C73 H73B 107.9 . .
C75 C74 C73 113.0(10) . .
C75 C74 H74A 109.0 . .
C73 C74 H74A 109.0 . .
C75 C74 H74B 109.0 . .
C73 C74 H74B 109.0 . .
H74A C74 H74B 107.8 . .
C76 C75 C80 120.0 . .
C76 C75 C74 120.4(9) . .
C80 C75 C74 119.5(9) . .
C77 C76 C75 120.0 . .
C77 C76 H76A 120.0 . .
C75 C76 H76A 120.0 . .
C76 C77 C78 120.0 . .
C76 C77 H77A 120.0 . .
C78 C77 H77A 120.0 . .
C77 C78 C79 120.0 . .
C77 C78 H78A 120.0 . .
C79 C78 H78A 120.0 . .
C80 C79 C78 120.0 . .
C80 C79 H79A 120.0 . .
C78 C79 H79A 120.0 . .
C79 C80 C75 120.0 . .
C79 C80 H80A 120.0 . .
C75 C80 H80A 120.0 . .
C98 C97 S13 111.7(6) . .
C98 C97 H97A 109.3 . .
S13 C97 H97A 109.3 . .
C98 C97 H97B 109.3 . .
S13 C97 H97B 109.3 . .
H97A C97 H97B 107.9 . .
C99 C98 C97 110.5(5) . .
C99 C98 H98A 109.6 . .
C97 C98 H98A 109.6 . .
C99 C98 H98B 109.6 . .
C97 C98 H98B 109.6 . .
H98A C98 H98B 108.1 . .
C100 C99 C104 120.0 . .
C100 C99 C98 121.1(6) . .
C104 C99 C98 118.9(6) . .
C99 C100 C101 120.0 . .
C99 C100 H10C 120.0 . .
C101 C100 H10C 120.0 . .
C100 C101 C102 120.0 . .
C100 C101 H10D 120.0 . .
C102 C101 H10D 120.0 . .
C103 C102 C101 120.0 . .
C103 C102 H10E 120.0 . .
C101 C102 H10E 120.0 . .
C104 C103 C102 120.0 . .
C104 C103 H10F 120.0 . .
C102 C103 H10F 120.0 . .
C103 C104 C99 120.0 . .
C103 C104 H10G 120.0 . .
C99 C104 H10G 120.0 . .
C106 C105 S14 113.8(6) . .
C106 C105 H10H 108.8 . .
S14 C105 H10H 108.8 . .
C106 C105 H10I 108.8 . .
S14 C105 H10I 108.8 . .
H10H C105 H10I 107.7 . .
C107 C106 C105 107.1(5) . .
C107 C106 H10J 110.3 . .
C105 C106 H10J 110.3 . .
C107 C106 H10K 110.3 . .
C105 C106 H10K 110.3 . .
H10J C106 H10K 108.5 . .
C108 C107 C112 120.0 . .
C108 C107 C106 119.0(6) . .
C112 C107 C106 121.0(6) . .
C109 C108 C107 120.0 . .
C109 C108 H10L 120.0 . .
C107 C108 H10L 120.0 . .
C108 C109 C110 120.0 . .
C108 C109 H10M 120.0 . .
C110 C109 H10M 120.0 . .
C111 C110 C109 120.0 . .
C111 C110 H11A 120.0 . .
C109 C110 H11A 120.0 . .
C110 C111 C112 120.0 . .
C110 C111 H11B 120.0 . .
C112 C111 H11B 120.0 . .
C111 C112 C107 120.0 . .
C111 C112 H11C 120.0 . .
C107 C112 H11C 120.0 . .
C114 C113 S15 111.8(6) . .
C114 C113 H11D 109.3 . .
S15 C113 H11D 109.3 . .
C114 C113 H11E 109.3 . .
S15 C113 H11E 109.3 . .
H11D C113 H11E 107.9 . .
C115 C114 C113 106.8(5) . .
C115 C114 H11F 110.4 . .
C113 C114 H11F 110.4 . .
C115 C114 H11G 110.4 . .
C113 C114 H11G 110.4 . .
H11F C114 H11G 108.6 . .
C116 C115 C120 120.0 . .
C116 C115 C114 119.3(7) . .
C120 C115 C114 120.7(7) . .
C115 C116 C117 120.0 . .
C115 C116 H11H 120.0 . .
C117 C116 H11H 120.0 . .
C118 C117 C116 120.0 . .
C118 C117 H11I 120.0 . .
C116 C117 H11I 120.0 . .
C119 C118 C117 120.0 . .
C119 C118 H11J 120.0 . .
C117 C118 H11J 120.0 . .
C118 C119 C120 120.0 . .
C118 C119 H11K 120.0 . .
C120 C119 H11K 120.0 . .
C119 C120 C115 120.0 . .
C119 C120 H12B 120.0 . .
C115 C120 H12B 120.0 . .
C145 N1 C161 109.9(9) . .
C145 N1 C169 110.0(8) . .
C161 N1 C169 110.8(8) . .
C145 N1 C153 110.2(8) . .
C161 N1 C153 107.9(8) . .
C169 N1 C153 108.0(9) . .
C146 C145 N1 115.2(8) . .
C146 C145 H14G 108.5 . .
N1 C145 H14G 108.5 . .
C146 C145 H14H 108.5 . .
N1 C145 H14H 108.5 . .
H14G C145 H14H 107.5 . .
C147 C146 C145 109.7(13) . .
C147 C146 H14I 109.7 . .
C145 C146 H14I 109.7 . .
C147 C146 H14J 109.7 . .
C145 C146 H14J 109.7 . .
H14I C146 H14J 108.2 . .
C148 C147 C146 112.8(14) . .
C148 C147 H14K 109.0 . .
C146 C147 H14K 109.0 . .
C148 C147 H14L 109.0 . .
C146 C147 H14L 109.0 . .
H14K C147 H14L 107.8 . .
C147 C148 C149 113.1(14) . .
C147 C148 H14M 109.0 . .
C149 C148 H14M 109.0 . .
C147 C148 H14N 109.0 . .
C149 C148 H14N 109.0 . .
H14M C148 H14N 107.8 . .
C150 C149 C148 110.8(16) . .
C150 C149 H14O 109.5 . .
C148 C149 H14O 109.5 . .
C150 C149 H14P 109.5 . .
C148 C149 H14P 109.5 . .
H14O C149 H14P 108.1 . .
C151 C150 C149 113.5(16) . .
C151 C150 H15B 108.9 . .
C149 C150 H15B 108.9 . .
C151 C150 H15C 108.9 . .
C149 C150 H15C 108.9 . .
H15B C150 H15C 107.7 . .
C150 C151 C152 112.0(15) . .
C150 C151 H15D 109.2 . .
C152 C151 H15D 109.2 . .
C150 C151 H15E 109.2 . .
C152 C151 H15E 109.2 . .
H15D C151 H15E 107.9 . .
C151 C152 H15T 109.5 . .
C151 C152 H15U 109.5 . .
H15T C152 H15U 109.5 . .
C151 C152 H15V 109.5 . .
H15T C152 H15V 109.5 . .
H15U C152 H15V 109.5 . .
C154 C153 N1 116.0(8) . .
C154 C153 H15F 108.3 . .
N1 C153 H15F 108.3 . .
C154 C153 H15G 108.3 . .
N1 C153 H15G 108.3 . .
H15F C153 H15G 107.4 . .
C155 C154 C153 118.0(15) . .
C155 C154 H15H 107.8 . .
C153 C154 H15H 107.8 . .
C155 C154 H15I 107.8 . .
C153 C154 H15I 107.8 . .
H15H C154 H15I 107.1 . .
C154 C155 C156 110.9(16) . .
C154 C155 H15J 109.5 . .
C156 C155 H15J 109.5 . .
C154 C155 H15K 109.5 . .
C156 C155 H15K 109.5 . .
H15J C155 H15K 108.0 . .
C157 C156 C155 113.4(16) . .
C157 C156 H15L 108.9 . .
C155 C156 H15L 108.9 . .
C157 C156 H15M 108.9 . .
C155 C156 H15M 108.9 . .
H15L C156 H15M 107.7 . .
C156 C157 C158 115.3(17) . .
C156 C157 H15R 108.4 . .
C158 C157 H15R 108.4 . .
C156 C157 H15S 108.4 . .
C158 C157 H15S 108.4 . .
H15R C157 H15S 107.5 . .
C159 C158 C157 109.6(18) . .
C159 C158 H15N 109.7 . .
C157 C158 H15N 109.7 . .
C159 C158 H15O 109.7 . .
C157 C158 H15O 109.7 . .
H15N C158 H15O 108.2 . .
C160 C159 C158 113.4(18) . .
C160 C159 H15P 108.9 . .
C158 C159 H15P 108.9 . .
C160 C159 H15Q 108.9 . .
C158 C159 H15Q 108.9 . .
H15P C159 H15Q 107.7 . .
C159 C160 H16P 109.5 . .
C159 C160 H16Q 109.5 . .
H16P C160 H16Q 109.5 . .
C159 C160 H16R 109.5 . .
H16P C160 H16R 109.5 . .
H16Q C160 H16R 109.5 . .
C162 C161 N1 114.5(10) . .
C162 C161 H16B 108.6 . .
N1 C161 H16B 108.6 . .
C162 C161 H16C 108.6 . .
N1 C161 H16C 108.6 . .
H16B C161 H16C 107.6 . .
C163 C162 C161 113.3(19) . .
C163 C162 H16N 108.9 . .
C161 C162 H16N 108.9 . .
C163 C162 H16O 108.9 . .
C161 C162 H16O 108.9 . .
H16N C162 H16O 107.7 . .
C162 C163 C164 110.3(19) . .
C162 C163 H16L 109.6 . .
C164 C163 H16L 109.6 . .
C162 C163 H16M 109.6 . .
C164 C163 H16M 109.6 . .
H16L C163 H16M 108.1 . .
C165 C164 C163 107.5(18) . .
C165 C164 H16D 110.2 . .
C163 C164 H16D 110.2 . .
C165 C164 H16E 110.2 . .
C163 C164 H16E 110.2 . .
H16D C164 H16E 108.5 . .
C164 C165 C166 111.7(19) . .
C164 C165 H16F 109.3 . .
C166 C165 H16F 109.3 . .
C164 C165 H16G 109.3 . .
C166 C165 H16G 109.3 . .
H16F C165 H16G 107.9 . .
C165 C166 C167 107.5(19) . .
C165 C166 H16H 110.2 . .
C167 C166 H16H 110.2 . .
C165 C166 H16I 110.2 . .
C167 C166 H16I 110.2 . .
H16H C166 H16I 108.5 . .
C168 C167 C166 111(2) . .
C168 C167 H16J 109.4 . .
C166 C167 H16J 109.4 . .
C168 C167 H16K 109.4 . .
C166 C167 H16K 109.4 . .
H16J C167 H16K 108.0 . .
C167 C168 H16S 109.5 . .
C167 C168 H16T 109.5 . .
H16S C168 H16T 109.5 . .
C167 C168 H16U 109.5 . .
H16S C168 H16U 109.5 . .
H16T C168 H16U 109.5 . .
C170 C169 N1 117.3(9) . .
C170 C169 H16V 108.0 . .
N1 C169 H16V 108.0 . .
C170 C169 H16W 108.0 . .
N1 C169 H16W 108.0 . .
H16V C169 H16W 107.2 . .
C169 C170 C171 117.8(16) . .
C169 C170 H17C 107.9 . .
C171 C170 H17C 107.9 . .
C169 C170 H17D 107.9 . .
C171 C170 H17D 107.9 . .
H17C C170 H17D 107.2 . .
C172 C171 C170 117.8(16) . .
C172 C171 H17E 107.8 . .
C170 C171 H17E 107.8 . .
C172 C171 H17F 107.9 . .
C170 C171 H17F 107.8 . .
H17E C171 H17F 107.2 . .
C171 C172 C173 118.3(19) . .
C171 C172 H17G 107.7 . .
C173 C172 H17G 107.7 . .
C171 C172 H17H 107.7 . .
C173 C172 H17H 107.7 . .
H17G C172 H17H 107.1 . .
C172 C173 C174 116.6(17) . .
C172 C173 H17I 108.2 . .
C174 C173 H17I 108.1 . .
C172 C173 H17J 108.1 . .
C174 C173 H17J 108.1 . .
H17I C173 H17J 107.3 . .
C175 C174 C173 116.6(16) . .
C175 C174 H17K 108.1 . .
C173 C174 H17K 108.1 . .
C175 C174 H17L 108.1 . .
C173 C174 H17L 108.1 . .
H17K C174 H17L 107.3 . .
C176 C175 C174 113.2(17) . .
C176 C175 H17N 108.9 . .
C174 C175 H17N 108.9 . .
C176 C175 H17O 108.9 . .
C174 C175 H17O 108.9 . .
H17N C175 H17O 107.8 . .
C175 C176 H17M 109.5 . .
C175 C176 H17P 109.5 . .
H17M C176 H17P 109.5 . .
C175 C176 H17Q 109.5 . .
H17M C176 H17Q 109.5 . .
H17P C176 H17Q 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 S1 2.369(2) .
Au1 Au25 2.7893(6) .
Au1 Au4 2.7954(5) 2_666
Au1 Au9 2.9447(5) .
Au1 Au20 2.9494(6) 2_666
Au1 Au12 2.9520(6) .
Au1 Au17 2.9714(6) .
Au1 Au11 3.0945(6) .
Au1 Au10 3.1707(7) .
Au1 Au2 3.2251(6) .
Au2 S2 2.307(2) .
Au2 S1 2.307(2) .
Au2 Au17 3.0875(6) .
Au2 Au20 3.1871(6) 2_666
Au3 S2 2.307(2) .
Au3 S3 2.317(2) .
Au3 Au20 3.0162(6) 2_666
Au3 Au17 3.2309(7) .
Au3 Au4 3.2383(6) .
Au4 S3 2.384(2) .
Au4 Au25 2.7801(4) .
Au4 Au1 2.7954(5) 2_666
Au4 Au12 2.9241(6) 2_666
Au4 Au17 2.9315(6) .
Au4 Au9 2.9634(7) 2_666
Au4 Au20 2.9690(6) 2_666
Au4 Au10 3.0584(6) 2_666
Au4 Au11 3.2308(6) 2_666
Au9 S10 2.346(8) .
Au9 S7 2.447(18) .
Au9 Au25 2.7805(4) .
Au9 Au12 2.8145(6) 2_666
Au9 Au20 2.9506(6) .
Au9 Au17 2.9560(7) .
Au9 Au4 2.9634(7) 2_666
Au9 Au18 3.1002(7) .
Au9 Au19 3.1191(6) .
Au9 Au10 3.2731(6) .
Au10 S7 2.23(2) .
Au10 S8 2.302(3) .
Au10 S10 2.364(10) .
Au10 Au4 3.0585(6) 2_666
Au11 S8 2.306(2) .
Au11 S9 2.314(2) .
Au11 Au12 3.1998(6) .
Au11 Au4 3.2307(6) 2_666
Au12 S9 2.373(2) .
Au12 Au25 2.7706(5) .
Au12 Au9 2.8145(6) 2_666
Au12 Au4 2.9240(6) 2_666
Au12 Au20 2.9343(6) 2_666
Au12 Au17 2.9343(6) 2_666
Au12 Au19 3.1414(7) 2_666
Au12 Au18 3.1618(6) 2_666
Au17 S13 2.369(2) .
Au17 Au25 2.7708(5) .
Au17 Au20 2.7961(6) 2_666
Au17 Au12 2.9343(6) 2_666
Au17 Au18 3.2038(6) .
Au18 S14 2.307(2) .
Au18 S13 2.311(2) .
Au18 Au12 3.1617(6) 2_666
Au19 S15 2.308(2) .
Au19 S14 2.315(2) .
Au19 Au12 3.1415(7) 2_666
Au19 Au20 3.2116(7) .
Au20 S15 2.380(2) .
Au20 Au25 2.7613(5) .
Au20 Au17 2.7960(6) 2_666
Au20 Au12 2.9343(6) 2_666
Au20 Au1 2.9494(6) 2_666
Au20 Au4 2.9689(6) 2_666
Au20 Au3 3.0161(6) 2_666
Au20 Au2 3.1871(6) 2_666
Au25 Au20 2.7613(5) 2_666
Au25 Au12 2.7705(5) 2_666
Au25 Au17 2.7708(5) 2_666
Au25 Au4 2.7801(4) 2_666
Au25 Au9 2.7805(4) 2_666
Au25 Au1 2.7893(6) 2_666
S1 C1 1.822(9) .
S2 C9 1.837(8) .
S3 C17 1.834(8) .
S7 C49 1.831(14) .
S8 C57 1.857(9) .
S9 C65 1.846(8) .
S10 C73 1.831(14) .
S13 C97 1.820(8) .
S14 C105 1.840(9) .
S15 C113 1.830(9) .
C1 C2 1.520(10) .
C1 H1A 0.9900 .
C1 H1B 0.9900 .
C2 C3 1.529(9) .
C2 H2A 0.9900 .
C2 H2B 0.9900 .
C3 C4 1.3900 .
C3 C8 1.3900 .
C4 C5 1.3900 .
C4 H4A 0.9500 .
C5 C6 1.3900 .
C5 H5A 0.9500 .
C6 C7 1.3900 .
C6 H6A 0.9500 .
C7 C8 1.3900 .
C7 H7A 0.9500 .
C8 H8A 0.9500 .
C9 C10 1.540(10) .
C9 H9A 0.9900 .
C9 H9B 0.9900 .
C10 C11 1.514(10) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 C12 1.3900 .
C11 C16 1.3900 .
C12 C13 1.3900 .
C12 H12A 0.9500 .
C13 C14 1.3900 .
C13 H13A 0.9500 .
C14 C15 1.3900 .
C14 H14A 0.9500 .
C15 C16 1.3900 .
C15 H15A 0.9500 .
C16 H16A 0.9500 .
C17 C18 1.517(10) .
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C18 C19 1.505(10) .
C18 H18A 0.9900 .
C18 H18B 0.9900 .
C19 C20 1.3900 .
C19 C24 1.3900 .
C20 C21 1.3900 .
C20 H20A 0.9500 .
C21 C22 1.3900 .
C21 H21A 0.9500 .
C22 C23 1.3900 .
C22 H22A 0.9500 .
C23 C24 1.3900 .
C23 H23A 0.9500 .
C24 H24A 0.9500 .
C49 C50 1.523(14) .
C49 H49A 0.9900 .
C49 H49B 0.9900 .
C50 C51 1.516(13) .
C50 H50A 0.9900 .
C50 H50B 0.9900 .
C51 C52 1.3900 .
C51 C56 1.3900 .
C52 C53 1.3900 .
C52 H52A 0.9500 .
C53 C54 1.3900 .
C53 H53A 0.9500 .
C54 C55 1.3900 .
C54 H54A 0.9500 .
C55 C56 1.3900 .
C55 H55A 0.9500 .
C56 H56A 0.9500 .
C57 C58 1.496(11) .
C57 H57A 0.9900 .
C57 H57B 0.9900 .
C58 C59 1.509(10) .
C58 H58A 0.9900 .
C58 H58B 0.9900 .
C59 C60 1.3900 .
C59 C64 1.3900 .
C60 C61 1.3900 .
C60 H60A 0.9500 .
C61 C62 1.3900 .
C61 H61A 0.9500 .
C62 C63 1.3900 .
C62 H62A 0.9500 .
C63 C64 1.3900 .
C63 H63A 0.9500 .
C64 H64A 0.9500 .
C65 C66 1.534(10) .
C65 H65A 0.9900 .
C65 H65B 0.9900 .
C66 C67 1.520(9) .
C66 H66A 0.9900 .
C66 H66B 0.9900 .
C67 C68 1.3900 .
C67 C72 1.3900 .
C68 C69 1.3900 .
C68 H68A 0.9500 .
C69 C70 1.3900 .
C69 H69A 0.9500 .
C70 C71 1.3900 .
C70 H70A 0.9500 .
C71 C72 1.3900 .
C71 H71A 0.9500 .
C72 H72A 0.9500 .
C73 C74 1.523(14) .
C73 H73A 0.9900 .
C73 H73B 0.9900 .
C74 C75 1.515(13) .
C74 H74A 0.9900 .
C74 H74B 0.9900 .
C75 C76 1.3900 .
C75 C80 1.3900 .
C76 C77 1.3900 .
C76 H76A 0.9500 .
C77 C78 1.3900 .
C77 H77A 0.9500 .
C78 C79 1.3900 .
C78 H78A 0.9500 .
C79 C80 1.3900 .
C79 H79A 0.9500 .
C80 H80A 0.9500 .
C97 C98 1.552(10) .
C97 H97A 0.9900 .
C97 H97B 0.9900 .
C98 C99 1.507(10) .
C98 H98A 0.9900 .
C98 H98B 0.9900 .
C99 C100 1.3900 .
C99 C104 1.3900 .
C100 C101 1.3900 .
C100 H10C 0.9500 .
C101 C102 1.3900 .
C101 H10D 0.9500 .
C102 C103 1.3900 .
C102 H10E 0.9500 .
C103 C104 1.3900 .
C103 H10F 0.9500 .
C104 H10G 0.9500 .
C105 C106 1.521(11) .
C105 H10H 0.9900 .
C105 H10I 0.9900 .
C106 C107 1.507(10) .
C106 H10J 0.9900 .
C106 H10K 0.9900 .
C107 C108 1.3900 .
C107 C112 1.3900 .
C108 C109 1.3900 .
C108 H10L 0.9500 .
C109 C110 1.3900 .
C109 H10M 0.9500 .
C110 C111 1.3900 .
C110 H11A 0.9500 .
C111 C112 1.3900 .
C111 H11B 0.9500 .
C112 H11C 0.9500 .
C113 C114 1.555(11) .
C113 H11D 0.9900 .
C113 H11E 0.9900 .
C114 C115 1.532(11) .
C114 H11F 0.9900 .
C114 H11G 0.9900 .
C115 C116 1.3900 .
C115 C120 1.3900 .
C116 C117 1.3900 .
C116 H11H 0.9500 .
C117 C118 1.3900 .
C117 H11I 0.9500 .
C118 C119 1.3900 .
C118 H11J 0.9500 .
C119 C120 1.3900 .
C119 H11K 0.9500 .
C120 H12B 0.9500 .
N1 C145 1.518(5) .
N1 C161 1.519(5) .
N1 C169 1.520(5) .
N1 C153 1.523(5) .
C145 C146 1.501(10) .
C145 H14G 0.9900 .
C145 H14H 0.9900 .
C146 C147 1.500(10) .
C146 H14I 0.9900 .
C146 H14J 0.9900 .
C147 C148 1.496(10) .
C147 H14K 0.9900 .
C147 H14L 0.9900 .
C148 C149 1.500(10) .
C148 H14M 0.9900 .
C148 H14N 0.9900 .
C149 C150 1.499(11) .
C149 H14O 0.9900 .
C149 H14P 0.9900 .
C150 C151 1.499(10) .
C150 H15B 0.9900 .
C150 H15C 0.9900 .
C151 C152 1.500(11) .
C151 H15D 0.9900 .
C151 H15E 0.9900 .
C152 H15T 0.9800 .
C152 H15U 0.9800 .
C152 H15V 0.9800 .
C153 C154 1.478(11) .
C153 H15F 0.9900 .
C153 H15G 0.9900 .
C154 C155 1.474(11) .
C154 H15H 0.9900 .
C154 H15I 0.9900 .
C155 C156 1.476(11) .
C155 H15J 0.9900 .
C155 H15K 0.9900 .
C156 C157 1.473(11) .
C156 H15L 0.9900 .
C156 H15M 0.9900 .
C157 C158 1.476(11) .
C157 H15R 0.9900 .
C157 H15S 0.9900 .
C158 C159 1.475(11) .
C158 H15N 0.9900 .
C158 H15O 0.9900 .
C159 C160 1.474(11) .
C159 H15P 0.9900 .
C159 H15Q 0.9900 .
C160 H16P 0.9800 .
C160 H16Q 0.9800 .
C160 H16R 0.9800 .
C161 C162 1.512(15) .
C161 H16B 0.9900 .
C161 H16C 0.9900 .
C162 C163 1.510(15) .
C162 H16N 0.9900 .
C162 H16O 0.9900 .
C163 C164 1.514(15) .
C163 H16L 0.9900 .
C163 H16M 0.9900 .
C164 C165 1.510(15) .
C164 H16D 0.9900 .
C164 H16E 0.9900 .
C165 C166 1.511(15) .
C165 H16F 0.9900 .
C165 H16G 0.9900 .
C166 C167 1.512(15) .
C166 H16H 0.9900 .
C166 H16I 0.9900 .
C167 C168 1.510(15) .
C167 H16J 0.9900 .
C167 H16K 0.9900 .
C168 H16S 0.9800 .
C168 H16T 0.9800 .
C168 H16U 0.9800 .
C169 C170 1.464(11) .
C169 H16V 0.9900 .
C169 H16W 0.9900 .
C170 C171 1.465(11) .
C170 H17C 0.9900 .
C170 H17D 0.9900 .
C171 C172 1.463(11) .
C171 H17E 0.9900 .
C171 H17F 0.9900 .
C172 C173 1.465(11) .
C172 H17G 0.9900 .
C172 H17H 0.9900 .
C173 C174 1.465(11) .
C173 H17I 0.9900 .
C173 H17J 0.9900 .
C174 C175 1.464(11) .
C174 H17K 0.9900 .
C174 H17L 0.9900 .
C175 C176 1.464(11) .
C175 H17N 0.9900 .
C175 H17O 0.9900 .
C176 H17M 0.9800 .
C176 H17P 0.9800 .
C176 H17Q 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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
S1 Au1 Au2 S2 -177.39(12) . .
Au25 Au1 Au2 S2 23.57(9) . .
Au4 Au1 Au2 S2 30.52(12) 2_666 .
Au9 Au1 Au2 S2 85.61(9) . .
Au20 Au1 Au2 S2 -10.97(9) 2_666 .
Au12 Au1 Au2 S2 -38.69(9) . .
Au17 Au1 Au2 S2 54.49(9) . .
Au11 Au1 Au2 S2 -112.87(9) . .
Au10 Au1 Au2 S2 159.26(9) . .
Au25 Au1 Au2 S1 -159.04(8) . .
Au4 Au1 Au2 S1 -152.08(11) 2_666 .
Au9 Au1 Au2 S1 -97.00(8) . .
Au20 Au1 Au2 S1 166.42(8) 2_666 .
Au12 Au1 Au2 S1 138.70(8) . .
Au17 Au1 Au2 S1 -128.11(8) . .
Au11 Au1 Au2 S1 64.52(8) . .
Au10 Au1 Au2 S1 -23.34(8) . .
S1 Au1 Au2 Au17 128.11(8) . .
Au25 Au1 Au2 Au17 -30.924(11) . .
Au4 Au1 Au2 Au17 -23.97(7) 2_666 .
Au9 Au1 Au2 Au17 31.112(12) . .
Au20 Au1 Au2 Au17 -65.464(15) 2_666 .
Au12 Au1 Au2 Au17 -93.186(19) . .
Au11 Au1 Au2 Au17 -167.362(17) . .
Au10 Au1 Au2 Au17 104.77(2) . .
S1 Au1 Au2 Au20 -166.42(8) . 2_666
Au25 Au1 Au2 Au20 34.540(12) . 2_666
Au4 Au1 Au2 Au20 41.49(7) 2_666 2_666
Au9 Au1 Au2 Au20 96.577(18) . 2_666
Au12 Au1 Au2 Au20 -27.722(13) . 2_666
Au17 Au1 Au2 Au20 65.464(16) . 2_666
Au11 Au1 Au2 Au20 -101.897(19) . 2_666
Au10 Au1 Au2 Au20 170.233(19) . 2_666
S2 Au3 Au4 S3 -177.18(11) . .
Au20 Au3 Au4 S3 151.77(7) 2_666 .
Au17 Au3 Au4 S3 -142.43(7) . .
S2 Au3 Au4 Au25 2.47(9) . .
S3 Au3 Au4 Au25 179.66(7) . .
Au20 Au3 Au4 Au25 -28.573(11) 2_666 .
Au17 Au3 Au4 Au25 37.223(12) . .
S2 Au3 Au4 Au1 25.70(11) . 2_666
S3 Au3 Au4 Au1 -157.12(10) . 2_666
Au20 Au3 Au4 Au1 -5.35(6) 2_666 2_666
Au17 Au3 Au4 Au1 60.45(6) . 2_666
S2 Au3 Au4 Au12 -60.41(9) . 2_666
S3 Au3 Au4 Au12 116.77(7) . 2_666
Au20 Au3 Au4 Au12 -91.456(19) 2_666 2_666
Au17 Au3 Au4 Au12 -25.660(14) . 2_666
S2 Au3 Au4 Au17 -34.75(9) . .
S3 Au3 Au4 Au17 142.43(7) . .
Au20 Au3 Au4 Au17 -65.796(14) 2_666 .
S2 Au3 Au4 Au9 63.75(9) . 2_666
S3 Au3 Au4 Au9 -119.07(7) . 2_666
Au20 Au3 Au4 Au9 32.705(13) 2_666 2_666
Au17 Au3 Au4 Au9 98.501(15) . 2_666
S2 Au3 Au4 Au20 31.05(9) . 2_666
S3 Au3 Au4 Au20 -151.77(7) . 2_666
Au17 Au3 Au4 Au20 65.796(14) . 2_666
S2 Au3 Au4 Au10 136.03(9) . 2_666
S3 Au3 Au4 Au10 -46.79(7) . 2_666
Au20 Au3 Au4 Au10 104.980(19) 2_666 2_666
Au17 Au3 Au4 Au10 170.776(18) . 2_666
S2 Au3 Au4 Au11 -136.80(9) . 2_666
S3 Au3 Au4 Au11 40.39(7) . 2_666
Au20 Au3 Au4 Au11 -167.844(18) 2_666 2_666
Au17 Au3 Au4 Au11 -102.048(19) . 2_666
S1 Au1 Au9 S10 50.02(18) . .
Au25 Au1 Au9 S10 -161.93(17) . .
Au4 Au1 Au9 S10 -91.91(17) 2_666 .
Au20 Au1 Au9 S10 164.41(17) 2_666 .
Au12 Au1 Au9 S10 -133.01(17) . .
Au17 Au1 Au9 S10 129.93(17) . .
Au11 Au1 Au9 S10 -62.80(17) . .
Au10 Au1 Au9 S10 -22.40(17) . .
Au2 Au1 Au9 S10 98.94(17) . .
S1 Au1 Au9 S7 62.6(3) . .
Au25 Au1 Au9 S7 -149.4(3) . .
Au4 Au1 Au9 S7 -79.4(3) 2_666 .
Au20 Au1 Au9 S7 177.0(3) 2_666 .
Au12 Au1 Au9 S7 -120.5(3) . .
Au17 Au1 Au9 S7 142.5(3) . .
Au11 Au1 Au9 S7 -50.3(3) . .
Au10 Au1 Au9 S7 -9.9(3) . .
Au2 Au1 Au9 S7 111.5(3) . .
S1 Au1 Au9 Au25 -148.05(6) . .
Au4 Au1 Au9 Au25 70.016(12) 2_666 .
Au20 Au1 Au9 Au25 -33.661(11) 2_666 .
Au12 Au1 Au9 Au25 28.913(11) . .
Au17 Au1 Au9 Au25 -68.149(12) . .
Au11 Au1 Au9 Au25 99.128(17) . .
Au10 Au1 Au9 Au25 139.522(12) . .
Au2 Au1 Au9 Au25 -99.139(15) . .
S1 Au1 Au9 Au12 -117.31(6) . 2_666
Au25 Au1 Au9 Au12 30.737(12) . 2_666
Au4 Au1 Au9 Au12 100.753(17) 2_666 2_666
Au20 Au1 Au9 Au12 -2.923(17) 2_666 2_666
Au12 Au1 Au9 Au12 59.65(2) . 2_666
Au17 Au1 Au9 Au12 -37.412(14) . 2_666
Au11 Au1 Au9 Au12 129.865(16) . 2_666
Au10 Au1 Au9 Au12 170.259(15) . 2_666
Au2 Au1 Au9 Au12 -68.402(19) . 2_666
S1 Au1 Au9 Au20 178.24(5) . .
Au25 Au1 Au9 Au20 -33.708(11) . .
Au4 Au1 Au9 Au20 36.308(13) 2_666 .
Au20 Au1 Au9 Au20 -67.369(18) 2_666 .
Au12 Au1 Au9 Au20 -4.795(16) . .
Au17 Au1 Au9 Au20 -101.857(16) . .
Au11 Au1 Au9 Au20 65.420(19) . .
Au10 Au1 Au9 Au20 105.814(16) . .
Au2 Au1 Au9 Au20 -132.847(14) . .
S1 Au1 Au9 Au17 -79.90(6) . .
Au25 Au1 Au9 Au17 68.149(12) . .
Au4 Au1 Au9 Au17 138.165(15) 2_666 .
Au20 Au1 Au9 Au17 34.488(13) 2_666 .
Au12 Au1 Au9 Au17 97.062(16) . .
Au11 Au1 Au9 Au17 167.277(17) . .
Au10 Au1 Au9 Au17 -152.329(14) . .
Au2 Au1 Au9 Au17 -30.990(13) . .
S1 Au1 Au9 Au4 141.93(6) . 2_666
Au25 Au1 Au9 Au4 -70.016(12) . 2_666
Au20 Au1 Au9 Au4 -103.677(16) 2_666 2_666
Au12 Au1 Au9 Au4 -41.103(13) . 2_666
Au17 Au1 Au9 Au4 -138.165(15) . 2_666
Au11 Au1 Au9 Au4 29.112(15) . 2_666
Au10 Au1 Au9 Au4 69.506(14) . 2_666
Au2 Au1 Au9 Au4 -169.155(15) . 2_666
S1 Au1 Au9 Au18 -46.92(6) . .
Au25 Au1 Au9 Au18 101.128(16) . .
Au4 Au1 Au9 Au18 171.144(16) 2_666 .
Au20 Au1 Au9 Au18 67.467(18) 2_666 .
Au12 Au1 Au9 Au18 130.041(15) . .
Au17 Au1 Au9 Au18 32.979(14) . .
Au11 Au1 Au9 Au18 -159.744(14) . .
Au10 Au1 Au9 Au18 -119.350(17) . .
Au2 Au1 Au9 Au18 1.989(18) . .
S1 Au1 Au9 Au19 -167.92(9) . .
Au25 Au1 Au9 Au19 -19.87(8) . .
Au4 Au1 Au9 Au19 50.15(8) 2_666 .
Au20 Au1 Au9 Au19 -53.53(8) 2_666 .
Au12 Au1 Au9 Au19 9.04(8) . .
Au17 Au1 Au9 Au19 -88.02(8) . .
Au11 Au1 Au9 Au19 79.26(8) . .
Au10 Au1 Au9 Au19 119.65(8) . .
Au2 Au1 Au9 Au19 -119.01(8) . .
S1 Au1 Au9 Au10 72.43(6) . .
Au25 Au1 Au9 Au10 -139.522(13) . .
Au4 Au1 Au9 Au10 -69.506(14) 2_666 .
Au20 Au1 Au9 Au10 -173.183(15) 2_666 .
Au12 Au1 Au9 Au10 -110.609(16) . .
Au17 Au1 Au9 Au10 152.329(14) . .
Au11 Au1 Au9 Au10 -40.394(15) . .
Au2 Au1 Au9 Au10 121.339(16) . .
S1 Au1 Au10 S7 -104.7(3) . .
Au25 Au1 Au10 S7 46.8(3) . .
Au4 Au1 Au10 S7 81.5(3) 2_666 .
Au9 Au1 Au10 S7 10.8(3) . .
Au20 Au1 Au10 S7 44.8(3) 2_666 .
Au12 Au1 Au10 S7 109.9(3) . .
Au17 Au1 Au10 S7 -16.4(3) . .
Au11 Au1 Au10 S7 155.0(3) . .
Au2 Au1 Au10 S7 -88.1(3) . .
S1 Au1 Au10 S8 76.40(8) . .
Au25 Au1 Au10 S8 -132.08(6) . .
Au4 Au1 Au10 S8 -97.43(6) 2_666 .
Au9 Au1 Au10 S8 -168.12(6) . .
Au20 Au1 Au10 S8 -134.11(9) 2_666 .
Au12 Au1 Au10 S8 -68.98(6) . .
Au17 Au1 Au10 S8 164.65(6) . .
Au11 Au1 Au10 S8 -23.91(6) . .
Au2 Au1 Au10 S8 92.96(6) . .
S1 Au1 Au10 S10 -93.66(19) . .
Au25 Au1 Au10 S10 57.85(18) . .
Au4 Au1 Au10 S10 92.51(18) 2_666 .
Au9 Au1 Au10 S10 21.81(18) . .
Au20 Au1 Au10 S10 55.83(19) 2_666 .
Au12 Au1 Au10 S10 120.96(18) . .
Au17 Au1 Au10 S10 -5.42(18) . .
Au11 Au1 Au10 S10 166.03(18) . .
Au2 Au1 Au10 S10 -77.10(18) . .
S1 Au1 Au10 Au4 173.83(6) . 2_666
Au25 Au1 Au10 Au4 -34.656(13) . 2_666
Au9 Au1 Au10 Au4 -70.697(18) . 2_666
Au20 Au1 Au10 Au4 -36.68(7) 2_666 2_666
Au12 Au1 Au10 Au4 28.445(14) . 2_666
Au17 Au1 Au10 Au4 -97.93(2) . 2_666
Au11 Au1 Au10 Au4 73.515(16) . 2_666
Au2 Au1 Au10 Au4 -169.611(19) . 2_666
S1 Au1 Au10 Au9 -115.47(6) . .
Au25 Au1 Au10 Au9 36.040(12) . .
Au4 Au1 Au10 Au9 70.697(18) 2_666 .
Au20 Au1 Au10 Au9 34.02(7) 2_666 .
Au12 Au1 Au10 Au9 99.14(2) . .
Au17 Au1 Au10 Au9 -27.229(14) . .
Au11 Au1 Au10 Au9 144.212(14) . .
Au2 Au1 Au10 Au9 -98.91(2) . .
S10 Au9 Au10 S7 -16.9(4) . .
Au25 Au9 Au10 S7 158.7(4) . .
Au12 Au9 Au10 S7 148.1(4) 2_666 .
Au1 Au9 Au10 S7 -165.8(4) . .
Au20 Au9 Au10 S7 97.3(4) . .
Au17 Au9 Au10 S7 -139.1(4) . .
Au4 Au9 Au10 S7 127.9(4) 2_666 .
Au18 Au9 Au10 S7 -63.6(4) . .
Au19 Au9 Au10 S7 25.4(4) . .
S10 Au9 Au10 S8 167.4(3) . .
S7 Au9 Au10 S8 -175.7(4) . .
Au25 Au9 Au10 S8 -17.02(9) . .
Au12 Au9 Au10 S8 -27.64(12) 2_666 .
Au1 Au9 Au10 S8 18.48(9) . .
Au20 Au9 Au10 S8 -78.38(9) . .
Au17 Au9 Au10 S8 45.15(9) . .
Au4 Au9 Au10 S8 -47.87(9) 2_666 .
Au18 Au9 Au10 S8 120.64(9) . .
Au19 Au9 Au10 S8 -150.32(9) . .
S7 Au9 Au10 S10 16.9(4) . .
Au25 Au9 Au10 S10 175.6(2) . .
Au12 Au9 Au10 S10 165.0(3) 2_666 .
Au1 Au9 Au10 S10 -148.9(2) . .
Au20 Au9 Au10 S10 114.2(2) . .
Au17 Au9 Au10 S10 -122.2(2) . .
Au4 Au9 Au10 S10 144.8(2) 2_666 .
Au18 Au9 Au10 S10 -46.7(2) . .
Au19 Au9 Au10 S10 42.3(2) . .
S10 Au9 Au10 Au4 -144.8(2) . 2_666
S7 Au9 Au10 Au4 -127.9(4) . 2_666
Au25 Au9 Au10 Au4 30.852(12) . 2_666
Au12 Au9 Au10 Au4 20.23(6) 2_666 2_666
Au1 Au9 Au10 Au4 66.350(12) . 2_666
Au20 Au9 Au10 Au4 -30.512(13) . 2_666
Au17 Au9 Au10 Au4 93.025(15) . 2_666
Au18 Au9 Au10 Au4 168.515(18) . 2_666
Au19 Au9 Au10 Au4 -102.451(17) . 2_666
S10 Au9 Au10 Au1 148.9(2) . .
S7 Au9 Au10 Au1 165.8(4) . .
Au25 Au9 Au10 Au1 -35.498(11) . .
Au12 Au9 Au10 Au1 -46.12(6) 2_666 .
Au20 Au9 Au10 Au1 -96.862(17) . .
Au17 Au9 Au10 Au1 26.675(14) . .
Au4 Au9 Au10 Au1 -66.350(13) 2_666 .
Au18 Au9 Au10 Au1 102.165(19) . .
Au19 Au9 Au10 Au1 -168.802(18) . .
S1 Au1 Au11 S8 -56.48(8) . .
Au25 Au1 Au11 S8 128.31(6) . .
Au4 Au1 Au11 S8 90.54(6) 2_666 .
Au9 Au1 Au11 S8 62.54(6) . .
Au20 Au1 Au11 S8 -168.32(6) 2_666 .
Au12 Au1 Au11 S8 158.66(6) . .
Au17 Au1 Au11 S8 161.13(9) . .
Au10 Au1 Au11 S8 23.83(6) . .
Au2 Au1 Au11 S8 -97.05(6) . .
S1 Au1 Au11 S9 118.81(7) . .
Au25 Au1 Au11 S9 -56.40(5) . .
Au4 Au1 Au11 S9 -94.17(5) 2_666 .
Au9 Au1 Au11 S9 -122.17(5) . .
Au20 Au1 Au11 S9 6.97(5) 2_666 .
Au12 Au1 Au11 S9 -26.05(5) . .
Au17 Au1 Au11 S9 -23.58(9) . .
Au10 Au1 Au11 S9 -160.88(5) . .
Au2 Au1 Au11 S9 78.24(6) . .
S1 Au1 Au11 Au12 144.87(5) . .
Au25 Au1 Au11 Au12 -30.351(12) . .
Au4 Au1 Au11 Au12 -68.119(16) 2_666 .
Au9 Au1 Au11 Au12 -96.124(19) . .
Au20 Au1 Au11 Au12 33.023(13) 2_666 .
Au17 Au1 Au11 Au12 2.47(7) . .
Au10 Au1 Au11 Au12 -134.828(13) . .
Au2 Au1 Au11 Au12 104.292(19) . .
S1 Au1 Au11 Au4 -147.02(5) . 2_666
Au25 Au1 Au11 Au4 37.768(12) . 2_666
Au9 Au1 Au11 Au4 -28.004(14) . 2_666
Au20 Au1 Au11 Au4 101.142(19) 2_666 2_666
Au12 Au1 Au11 Au4 68.119(16) . 2_666
Au17 Au1 Au11 Au4 70.59(7) . 2_666
Au10 Au1 Au11 Au4 -66.709(15) . 2_666
Au2 Au1 Au11 Au4 172.411(17) . 2_666
S1 Au1 Au12 S9 -41.39(10) . .
Au25 Au1 Au12 S9 172.24(5) . .
Au4 Au1 Au12 S9 101.64(5) 2_666 .
Au9 Au1 Au12 S9 143.22(5) . .
Au20 Au1 Au12 S9 -119.29(5) 2_666 .
Au17 Au1 Au12 S9 -153.97(5) . .
Au11 Au1 Au12 S9 25.54(5) . .
Au10 Au1 Au12 S9 73.13(5) . .
Au2 Au1 Au12 S9 -90.87(5) . .
S1 Au1 Au12 Au25 146.37(9) . .
Au4 Au1 Au12 Au25 -70.606(11) 2_666 .
Au9 Au1 Au12 Au25 -29.023(11) . .
Au20 Au1 Au12 Au25 68.469(11) 2_666 .
Au17 Au1 Au12 Au25 33.790(11) . .
Au11 Au1 Au12 Au25 -146.703(13) . .
Au10 Au1 Au12 Au25 -99.113(14) . .
Au2 Au1 Au12 Au25 96.886(14) . .
S1 Au1 Au12 Au9 115.52(9) . 2_666
Au25 Au1 Au12 Au9 -30.847(12) . 2_666
Au4 Au1 Au12 Au9 -101.453(17) 2_666 2_666
Au9 Au1 Au12 Au9 -59.87(2) . 2_666
Au20 Au1 Au12 Au9 37.622(13) 2_666 2_666
Au17 Au1 Au12 Au9 2.943(17) . 2_666
Au11 Au1 Au12 Au9 -177.550(15) . 2_666
Au10 Au1 Au12 Au9 -129.960(15) . 2_666
Au2 Au1 Au12 Au9 66.039(19) . 2_666
S1 Au1 Au12 Au4 -143.03(9) . 2_666
Au25 Au1 Au12 Au4 70.606(11) . 2_666
Au9 Au1 Au12 Au4 41.583(13) . 2_666
Au20 Au1 Au12 Au4 139.075(17) 2_666 2_666
Au17 Au1 Au12 Au4 104.396(17) . 2_666
Au11 Au1 Au12 Au4 -76.097(15) . 2_666
Au10 Au1 Au12 Au4 -28.507(15) . 2_666
Au2 Au1 Au12 Au4 167.492(17) . 2_666
S1 Au1 Au12 Au20 77.90(9) . 2_666
Au25 Au1 Au12 Au20 -68.469(11) . 2_666
Au4 Au1 Au12 Au20 -139.075(16) 2_666 2_666
Au9 Au1 Au12 Au20 -97.492(18) . 2_666
Au17 Au1 Au12 Au20 -34.679(12) . 2_666
Au11 Au1 Au12 Au20 144.827(14) . 2_666
Au10 Au1 Au12 Au20 -167.582(17) . 2_666
Au2 Au1 Au12 Au20 28.417(14) . 2_666
S1 Au1 Au12 Au17 -179.18(8) . 2_666
Au25 Au1 Au12 Au17 34.450(11) . 2_666
Au4 Au1 Au12 Au17 -36.156(13) 2_666 2_666
Au9 Au1 Au12 Au17 5.428(16) . 2_666
Au20 Au1 Au12 Au17 102.920(18) 2_666 2_666
Au17 Au1 Au12 Au17 68.241(19) . 2_666
Au11 Au1 Au12 Au17 -112.253(18) . 2_666
Au10 Au1 Au12 Au17 -64.663(19) . 2_666
Au2 Au1 Au12 Au17 131.337(15) . 2_666
S1 Au1 Au12 Au19 46.64(9) . 2_666
Au25 Au1 Au12 Au19 -99.730(14) . 2_666
Au4 Au1 Au12 Au19 -170.336(17) 2_666 2_666
Au9 Au1 Au12 Au19 -128.753(15) . 2_666
Au20 Au1 Au12 Au19 -31.261(15) 2_666 2_666
Au17 Au1 Au12 Au19 -65.940(18) . 2_666
Au11 Au1 Au12 Au19 113.567(17) . 2_666
Au10 Au1 Au12 Au19 161.157(14) . 2_666
Au2 Au1 Au12 Au19 -2.84(2) . 2_666
S1 Au1 Au12 Au18 161.49(10) . 2_666
Au25 Au1 Au12 Au18 15.13(7) . 2_666
Au4 Au1 Au12 Au18 -55.48(7) 2_666 2_666
Au9 Au1 Au12 Au18 -13.90(7) . 2_666
Au20 Au1 Au12 Au18 83.60(7) 2_666 2_666
Au17 Au1 Au12 Au18 48.92(7) . 2_666
Au11 Au1 Au12 Au18 -131.58(7) . 2_666
Au10 Au1 Au12 Au18 -83.99(7) . 2_666
Au2 Au1 Au12 Au18 112.01(7) . 2_666
S1 Au1 Au12 Au11 -66.93(9) . .
Au25 Au1 Au12 Au11 146.703(13) . .
Au4 Au1 Au12 Au11 76.097(15) 2_666 .
Au9 Au1 Au12 Au11 117.681(18) . .
Au20 Au1 Au12 Au11 -144.827(13) 2_666 .
Au17 Au1 Au12 Au11 -179.506(14) . .
Au10 Au1 Au12 Au11 47.590(14) . .
Au2 Au1 Au12 Au11 -116.411(17) . .
S8 Au11 Au12 S9 -177.71(11) . .
Au1 Au11 Au12 S9 -143.88(7) . .
Au4 Au11 Au12 S9 150.93(7) 2_666 .
S8 Au11 Au12 Au25 -3.87(9) . .
S9 Au11 Au12 Au25 173.84(7) . .
Au1 Au11 Au12 Au25 29.962(12) . .
Au4 Au11 Au12 Au25 -35.235(10) 2_666 .
S8 Au11 Au12 Au9 -20.33(13) . 2_666
S9 Au11 Au12 Au9 157.38(11) . 2_666
Au1 Au11 Au12 Au9 13.51(8) . 2_666
Au4 Au11 Au12 Au9 -51.69(8) 2_666 2_666
S8 Au11 Au12 Au4 31.36(9) . 2_666
S9 Au11 Au12 Au4 -150.93(7) . 2_666
Au1 Au11 Au12 Au4 65.197(13) . 2_666
S8 Au11 Au12 Au20 -66.33(9) . 2_666
S9 Au11 Au12 Au20 111.37(7) . 2_666
Au1 Au11 Au12 Au20 -32.503(13) . 2_666
Au4 Au11 Au12 Au20 -97.700(19) 2_666 2_666
S8 Au11 Au12 Au17 59.89(9) . 2_666
S9 Au11 Au12 Au17 -122.40(7) . 2_666
Au1 Au11 Au12 Au17 93.719(15) . 2_666
Au4 Au11 Au12 Au17 28.522(14) 2_666 2_666
S8 Au11 Au12 Au1 -33.83(9) . .
S9 Au11 Au12 Au1 143.88(7) . .
Au4 Au11 Au12 Au1 -65.197(13) 2_666 .
S8 Au11 Au12 Au19 -138.05(9) . 2_666
S9 Au11 Au12 Au19 39.66(7) . 2_666
Au1 Au11 Au12 Au19 -104.215(17) . 2_666
Au4 Au11 Au12 Au19 -169.412(17) 2_666 2_666
S8 Au11 Au12 Au18 135.45(9) . 2_666
S9 Au11 Au12 Au18 -46.84(7) . 2_666
Au1 Au11 Au12 Au18 169.286(18) . 2_666
Au4 Au11 Au12 Au18 104.089(19) 2_666 2_666
S3 Au4 Au17 S13 -46.16(8) . .
Au25 Au4 Au17 S13 150.17(6) . .
Au1 Au4 Au17 S13 119.39(6) 2_666 .
Au12 Au4 Au17 S13 81.31(6) 2_666 .
Au9 Au4 Au17 S13 -175.81(6) 2_666 .
Au20 Au4 Au17 S13 -140.35(6) 2_666 .
Au10 Au4 Au17 S13 177.49(11) 2_666 .
Au11 Au4 Au17 S13 52.31(6) 2_666 .
Au3 Au4 Au17 S13 -72.48(6) . .
S3 Au4 Au17 Au25 163.66(6) . .
Au1 Au4 Au17 Au25 -30.783(12) 2_666 .
Au12 Au4 Au17 Au25 -68.863(14) 2_666 .
Au9 Au4 Au17 Au25 34.019(11) 2_666 .
Au20 Au4 Au17 Au25 69.476(15) 2_666 .
Au10 Au4 Au17 Au25 27.32(10) 2_666 .
Au11 Au4 Au17 Au25 -97.862(18) 2_666 .
Au3 Au4 Au17 Au25 137.349(13) . .
S3 Au4 Au17 Au20 94.19(6) . 2_666
Au25 Au4 Au17 Au20 -69.476(15) . 2_666
Au1 Au4 Au17 Au20 -100.259(17) 2_666 2_666
Au12 Au4 Au17 Au20 -138.339(13) 2_666 2_666
Au9 Au4 Au17 Au20 -35.457(14) 2_666 2_666
Au10 Au4 Au17 Au20 -42.16(10) 2_666 2_666
Au11 Au4 Au17 Au20 -167.338(15) 2_666 2_666
Au3 Au4 Au17 Au20 67.873(13) . 2_666
S3 Au4 Au17 Au12 -127.47(6) . 2_666
Au25 Au4 Au17 Au12 68.863(15) . 2_666
Au1 Au4 Au17 Au12 38.080(16) 2_666 2_666
Au9 Au4 Au17 Au12 102.882(15) 2_666 2_666
Au20 Au4 Au17 Au12 138.339(14) 2_666 2_666
Au10 Au4 Au17 Au12 96.18(10) 2_666 2_666
Au11 Au4 Au17 Au12 -28.999(13) 2_666 2_666
Au3 Au4 Au17 Au12 -153.788(15) . 2_666
S3 Au4 Au17 Au9 -162.15(6) . .
Au25 Au4 Au17 Au9 34.190(11) . .
Au1 Au4 Au17 Au9 3.407(18) 2_666 .
Au12 Au4 Au17 Au9 -34.673(14) 2_666 .
Au9 Au4 Au17 Au9 68.209(17) 2_666 .
Au20 Au4 Au17 Au9 103.666(16) 2_666 .
Au10 Au4 Au17 Au9 61.51(10) 2_666 .
Au11 Au4 Au17 Au9 -63.672(19) 2_666 .
Au3 Au4 Au17 Au9 171.539(15) . .
S3 Au4 Au17 Au1 135.06(6) . .
Au25 Au4 Au17 Au1 -28.605(10) . .
Au1 Au4 Au17 Au1 -59.388(19) 2_666 .
Au12 Au4 Au17 Au1 -97.468(16) 2_666 .
Au9 Au4 Au17 Au1 5.413(16) 2_666 .
Au20 Au4 Au17 Au1 40.871(15) 2_666 .
Au10 Au4 Au17 Au1 -1.29(10) 2_666 .
Au11 Au4 Au17 Au1 -126.467(17) 2_666 .
Au3 Au4 Au17 Au1 108.744(14) . .
S3 Au4 Au17 Au2 64.02(6) . .
Au25 Au4 Au17 Au2 -99.646(19) . .
Au1 Au4 Au17 Au2 -130.429(18) 2_666 .
Au12 Au4 Au17 Au2 -168.509(17) 2_666 .
Au9 Au4 Au17 Au2 -65.627(19) 2_666 .
Au20 Au4 Au17 Au2 -30.170(14) 2_666 .
Au10 Au4 Au17 Au2 -72.33(10) 2_666 .
Au11 Au4 Au17 Au2 162.492(13) 2_666 .
Au3 Au4 Au17 Au2 37.703(16) . .
S3 Au4 Au17 Au18 -97.94(6) . .
Au25 Au4 Au17 Au18 98.396(18) . .
Au1 Au4 Au17 Au18 67.61(2) 2_666 .
Au12 Au4 Au17 Au18 29.533(13) 2_666 .
Au9 Au4 Au17 Au18 132.415(16) 2_666 .
Au20 Au4 Au17 Au18 167.872(15) 2_666 .
Au10 Au4 Au17 Au18 125.71(10) 2_666 .
Au11 Au4 Au17 Au18 0.534(18) 2_666 .
Au3 Au4 Au17 Au18 -124.255(16) . .
S3 Au4 Au17 Au3 26.31(5) . .
Au25 Au4 Au17 Au3 -137.349(13) . .
Au1 Au4 Au17 Au3 -168.132(16) 2_666 .
Au12 Au4 Au17 Au3 153.788(15) 2_666 .
Au9 Au4 Au17 Au3 -103.330(14) 2_666 .
Au20 Au4 Au17 Au3 -67.873(13) 2_666 .
Au10 Au4 Au17 Au3 -110.03(10) 2_666 .
Au11 Au4 Au17 Au3 124.789(16) 2_666 .
S10 Au9 Au17 S13 50.6(3) . .
S7 Au9 Au17 S13 58.3(9) . .
Au25 Au9 Au17 S13 -160.21(6) . .
Au12 Au9 Au17 S13 -90.05(6) 2_666 .
Au1 Au9 Au17 S13 130.74(6) . .
Au20 Au9 Au17 S13 -130.83(6) . .
Au4 Au9 Au17 S13 165.99(6) 2_666 .
Au18 Au9 Au17 S13 -16.20(6) . .
Au19 Au9 Au17 S13 -61.46(6) . .
Au10 Au9 Au17 S13 103.90(6) . .
S10 Au9 Au17 Au25 -149.2(3) . .
S7 Au9 Au17 Au25 -141.5(9) . .
Au12 Au9 Au17 Au25 70.165(14) 2_666 .
Au1 Au9 Au17 Au25 -69.046(16) . .
Au20 Au9 Au17 Au25 29.385(11) . .
Au4 Au9 Au17 Au25 -33.793(12) 2_666 .
Au18 Au9 Au17 Au25 144.016(14) . .
Au19 Au9 Au17 Au25 98.75(2) . .
Au10 Au9 Au17 Au25 -95.883(18) . .
S10 Au9 Au17 Au20 -117.7(3) . 2_666
S7 Au9 Au17 Au20 -110.0(9) . 2_666
Au25 Au9 Au17 Au20 31.476(13) . 2_666
Au12 Au9 Au17 Au20 101.641(15) 2_666 2_666
Au1 Au9 Au17 Au20 -37.570(15) . 2_666
Au20 Au9 Au17 Au20 60.86(2) . 2_666
Au4 Au9 Au17 Au20 -2.317(18) 2_666 2_666
Au18 Au9 Au17 Au20 175.492(16) . 2_666
Au19 Au9 Au17 Au20 130.224(17) . 2_666
Au10 Au9 Au17 Au20 -64.407(18) . 2_666
S10 Au9 Au17 Au4 176.5(3) . .
S7 Au9 Au17 Au4 -175.8(9) . .
Au25 Au9 Au17 Au4 -34.313(10) . .
Au12 Au9 Au17 Au4 35.852(15) 2_666 .
Au1 Au9 Au17 Au4 -103.359(19) . .
Au20 Au9 Au17 Au4 -4.929(17) . .
Au4 Au9 Au17 Au4 -68.106(18) 2_666 .
Au18 Au9 Au17 Au4 109.703(16) . .
Au19 Au9 Au17 Au4 64.44(2) . .
Au10 Au9 Au17 Au4 -130.196(18) . .
S10 Au9 Au17 Au12 140.7(3) . 2_666
S7 Au9 Au17 Au12 148.3(9) . 2_666
Au25 Au9 Au17 Au12 -70.165(13) . 2_666
Au1 Au9 Au17 Au12 -139.211(14) . 2_666
Au20 Au9 Au17 Au12 -40.780(15) . 2_666
Au4 Au9 Au17 Au12 -103.958(14) 2_666 2_666
Au18 Au9 Au17 Au12 73.851(12) . 2_666
Au19 Au9 Au17 Au12 28.583(14) . 2_666
Au10 Au9 Au17 Au12 -166.048(16) . 2_666
S10 Au9 Au17 Au1 -80.1(3) . .
S7 Au9 Au17 Au1 -72.5(9) . .
Au25 Au9 Au17 Au1 69.046(17) . .
Au12 Au9 Au17 Au1 139.211(14) 2_666 .
Au20 Au9 Au17 Au1 98.430(19) . .
Au4 Au9 Au17 Au1 35.253(14) 2_666 .
Au18 Au9 Au17 Au1 -146.938(15) . .
Au19 Au9 Au17 Au1 167.794(16) . .
Au10 Au9 Au17 Au1 -26.837(13) . .
S10 Au9 Au17 Au2 -46.6(3) . .
S7 Au9 Au17 Au2 -38.9(9) . .
Au25 Au9 Au17 Au2 102.618(18) . .
Au12 Au9 Au17 Au2 172.783(16) 2_666 .
Au1 Au9 Au17 Au2 33.572(13) . .
Au20 Au9 Au17 Au2 132.003(17) . .
Au4 Au9 Au17 Au2 68.826(17) 2_666 .
Au18 Au9 Au17 Au2 -113.366(15) . .
Au19 Au9 Au17 Au2 -158.633(14) . .
Au10 Au9 Au17 Au2 6.735(19) . .
S10 Au9 Au17 Au18 66.8(3) . .
S7 Au9 Au17 Au18 74.5(9) . .
Au25 Au9 Au17 Au18 -144.016(14) . .
Au12 Au9 Au17 Au18 -73.851(12) 2_666 .
Au1 Au9 Au17 Au18 146.938(15) . .
Au20 Au9 Au17 Au18 -114.631(17) . .
Au4 Au9 Au17 Au18 -177.809(15) 2_666 .
Au19 Au9 Au17 Au18 -45.268(15) . .
Au10 Au9 Au17 Au18 120.101(16) . .
S10 Au9 Au17 Au3 -148.6(3) . .
S7 Au9 Au17 Au3 -141.0(9) . .
Au25 Au9 Au17 Au3 0.54(6) . .
Au12 Au9 Au17 Au3 70.70(7) 2_666 .
Au1 Au9 Au17 Au3 -68.51(7) . .
Au20 Au9 Au17 Au3 29.92(7) . .
Au4 Au9 Au17 Au3 -33.26(7) 2_666 .
Au18 Au9 Au17 Au3 144.55(7) . .
Au19 Au9 Au17 Au3 99.28(7) . .
Au10 Au9 Au17 Au3 -95.35(7) . .
S1 Au1 Au17 S13 31.21(9) . .
Au25 Au1 Au17 S13 -149.87(7) . .
Au4 Au1 Au17 S13 -119.58(7) 2_666 .
Au9 Au1 Au17 S13 -80.85(7) . .
Au20 Au1 Au17 S13 140.11(7) 2_666 .
Au12 Au1 Au17 S13 176.24(7) . .
Au11 Au1 Au17 S13 173.95(9) . .
Au10 Au1 Au17 S13 -52.32(7) . .
Au2 Au1 Au17 S13 65.43(7) . .
S1 Au1 Au17 Au25 -178.92(5) . .
Au4 Au1 Au17 Au25 30.285(11) 2_666 .
Au9 Au1 Au17 Au25 69.023(11) . .
Au20 Au1 Au17 Au25 -70.020(12) 2_666 .
Au12 Au1 Au17 Au25 -33.888(11) . .
Au11 Au1 Au17 Au25 -36.19(7) . .
Au10 Au1 Au17 Au25 97.544(16) . .
Au2 Au1 Au17 Au25 -144.697(12) . .
S1 Au1 Au17 Au20 -108.90(5) . 2_666
Au25 Au1 Au17 Au20 70.020(13) . 2_666
Au4 Au1 Au17 Au20 100.306(18) 2_666 2_666
Au9 Au1 Au17 Au20 139.043(15) . 2_666
Au12 Au1 Au17 Au20 36.133(13) . 2_666
Au11 Au1 Au17 Au20 33.83(7) . 2_666
Au10 Au1 Au17 Au20 167.564(16) . 2_666
Au2 Au1 Au17 Au20 -74.677(15) . 2_666
S1 Au1 Au17 Au4 -150.22(5) . .
Au25 Au1 Au17 Au4 28.699(11) . .
Au4 Au1 Au17 Au4 58.98(2) 2_666 .
Au9 Au1 Au17 Au4 97.722(16) . .
Au20 Au1 Au17 Au4 -41.321(13) 2_666 .
Au12 Au1 Au17 Au4 -5.188(16) . .
Au11 Au1 Au17 Au4 -7.49(8) . .
Au10 Au1 Au17 Au4 126.243(15) . .
Au2 Au1 Au17 Au4 -115.998(17) . .
S1 Au1 Au17 Au12 146.81(5) . 2_666
Au25 Au1 Au17 Au12 -34.269(11) . 2_666
Au4 Au1 Au17 Au12 -3.984(17) 2_666 2_666
Au9 Au1 Au17 Au12 34.754(12) . 2_666
Au20 Au1 Au17 Au12 -104.290(17) 2_666 2_666
Au12 Au1 Au17 Au12 -68.157(18) . 2_666
Au11 Au1 Au17 Au12 -70.46(8) . 2_666
Au10 Au1 Au17 Au12 63.274(19) . 2_666
Au2 Au1 Au17 Au12 -178.966(14) . 2_666
S1 Au1 Au17 Au9 112.06(5) . .
Au25 Au1 Au17 Au9 -69.023(11) . .
Au4 Au1 Au17 Au9 -38.738(13) 2_666 .
Au20 Au1 Au17 Au9 -139.043(15) 2_666 .
Au12 Au1 Au17 Au9 -102.910(16) . .
Au11 Au1 Au17 Au9 -105.21(7) . .
Au10 Au1 Au17 Au9 28.521(15) . .
Au2 Au1 Au17 Au9 146.280(14) . .
S1 Au1 Au17 Au2 -34.22(5) . .
Au25 Au1 Au17 Au2 144.697(12) . .
Au4 Au1 Au17 Au2 174.982(15) 2_666 .
Au9 Au1 Au17 Au2 -146.280(14) . .
Au20 Au1 Au17 Au2 74.677(15) 2_666 .
Au12 Au1 Au17 Au2 110.810(16) . .
Au11 Au1 Au17 Au2 108.51(7) . .
Au10 Au1 Au17 Au2 -117.759(18) . .
S1 Au1 Au17 Au18 81.30(5) . .
Au25 Au1 Au17 Au18 -99.781(15) . .
Au4 Au1 Au17 Au18 -69.496(19) 2_666 .
Au9 Au1 Au17 Au18 -30.758(14) . .
Au20 Au1 Au17 Au18 -169.801(16) 2_666 .
Au12 Au1 Au17 Au18 -133.668(14) . .
Au11 Au1 Au17 Au18 -135.97(7) . .
Au10 Au1 Au17 Au18 -2.237(19) . .
Au2 Au1 Au17 Au18 115.522(17) . .
S1 Au1 Au17 Au3 -81.57(5) . .
Au25 Au1 Au17 Au3 97.348(14) . .
Au4 Au1 Au17 Au3 127.633(15) 2_666 .
Au9 Au1 Au17 Au3 166.371(16) . .
Au20 Au1 Au17 Au3 27.327(13) 2_666 .
Au12 Au1 Au17 Au3 63.460(17) . .
Au11 Au1 Au17 Au3 61.16(8) . .
Au10 Au1 Au17 Au3 -165.109(13) . .
Au2 Au1 Au17 Au3 -47.349(14) . .
S2 Au2 Au17 S13 75.54(7) . .
S1 Au2 Au17 S13 -102.01(7) . .
Au20 Au2 Au17 S13 154.03(5) 2_666 .
Au1 Au2 Au17 S13 -137.28(5) . .
S2 Au2 Au17 Au25 -114.96(6) . .
S1 Au2 Au17 Au25 67.48(5) . .
Au20 Au2 Au17 Au25 -36.480(13) 2_666 .
Au1 Au2 Au17 Au25 32.217(11) . .
S2 Au2 Au17 Au20 -78.48(6) . 2_666
S1 Au2 Au17 Au20 103.96(5) . 2_666
Au1 Au2 Au17 Au20 68.697(15) . 2_666
S2 Au2 Au17 Au4 -49.15(6) . .
S1 Au2 Au17 Au4 133.29(5) . .
Au20 Au2 Au17 Au4 29.333(14) 2_666 .
Au1 Au2 Au17 Au4 98.03(2) . .
S2 Au2 Au17 Au12 -141.40(9) . 2_666
S1 Au2 Au17 Au12 41.04(10) . 2_666
Au20 Au2 Au17 Au12 -62.92(8) 2_666 2_666
Au1 Au2 Au17 Au12 5.78(8) . 2_666
S2 Au2 Au17 Au9 -179.14(6) . .
S1 Au2 Au17 Au9 3.31(5) . .
Au20 Au2 Au17 Au9 -100.652(17) 2_666 .
Au1 Au2 Au17 Au9 -31.955(13) . .
S2 Au2 Au17 Au1 -147.18(6) . .
S1 Au2 Au17 Au1 35.26(5) . .
Au20 Au2 Au17 Au1 -68.697(16) 2_666 .
S2 Au2 Au17 Au18 111.58(6) . .
S1 Au2 Au17 Au18 -65.97(6) . .
Au20 Au2 Au17 Au18 -169.934(17) 2_666 .
Au1 Au2 Au17 Au18 -101.24(2) . .
S2 Au2 Au17 Au3 -13.14(6) . .
S1 Au2 Au17 Au3 169.30(5) . .
Au20 Au2 Au17 Au3 65.341(12) 2_666 .
Au1 Au2 Au17 Au3 134.038(14) . .
S2 Au3 Au17 S13 -77.91(8) . .
S3 Au3 Au17 S13 96.63(8) . .
Au20 Au3 Au17 S13 -164.42(6) 2_666 .
Au4 Au3 Au17 S13 123.34(6) . .
S2 Au3 Au17 Au25 121.27(6) . .
S3 Au3 Au17 Au25 -64.19(6) . .
Au20 Au3 Au17 Au25 34.751(13) 2_666 .
Au4 Au3 Au17 Au25 -37.483(11) . .
S2 Au3 Au17 Au20 86.51(6) . 2_666
S3 Au3 Au17 Au20 -98.94(6) . 2_666
Au4 Au3 Au17 Au20 -72.234(14) . 2_666
S2 Au3 Au17 Au4 158.75(6) . .
S3 Au3 Au17 Au4 -26.71(6) . .
Au20 Au3 Au17 Au4 72.234(14) 2_666 .
S2 Au3 Au17 Au12 -175.71(6) . 2_666
S3 Au3 Au17 Au12 -1.16(6) . 2_666
Au20 Au3 Au17 Au12 97.779(16) 2_666 2_666
Au4 Au3 Au17 Au12 25.545(15) . 2_666
S2 Au3 Au17 Au9 120.79(8) . .
S3 Au3 Au17 Au9 -64.67(9) . .
Au20 Au3 Au17 Au9 34.27(6) 2_666 .
Au4 Au3 Au17 Au9 -37.96(6) . .
S2 Au3 Au17 Au1 58.63(6) . .
S3 Au3 Au17 Au1 -126.83(6) . .
Au20 Au3 Au17 Au1 -27.885(14) 2_666 .
Au4 Au3 Au17 Au1 -100.120(19) . .
S2 Au3 Au17 Au2 13.09(6) . .
S3 Au3 Au17 Au2 -172.37(6) . .
Au20 Au3 Au17 Au2 -73.429(12) 2_666 .
Au4 Au3 Au17 Au2 -145.663(16) . .
S2 Au3 Au17 Au18 -100.45(6) . .
S3 Au3 Au17 Au18 74.09(6) . .
Au20 Au3 Au17 Au18 173.04(2) 2_666 .
Au4 Au3 Au17 Au18 100.80(2) . .
S10 Au9 Au18 S14 59.5(2) . .
S7 Au9 Au18 S14 52.8(4) . .
Au25 Au9 Au18 S14 -132.49(6) . .
Au12 Au9 Au18 S14 -96.15(6) 2_666 .
Au1 Au9 Au18 S14 163.24(6) . .
Au20 Au9 Au18 S14 -68.33(6) . .
Au17 Au9 Au18 S14 -164.91(6) . .
Au4 Au9 Au18 S14 -153.58(10) 2_666 .
Au19 Au9 Au18 S14 -26.52(6) . .
Au10 Au9 Au18 S14 91.25(6) . .
S10 Au9 Au18 S13 -119.1(2) . .
S7 Au9 Au18 S13 -125.8(4) . .
Au25 Au9 Au18 S13 48.86(6) . .
Au12 Au9 Au18 S13 85.20(6) 2_666 .
Au1 Au9 Au18 S13 -15.42(6) . .
Au20 Au9 Au18 S13 113.02(6) . .
Au17 Au9 Au18 S13 16.44(5) . .
Au4 Au9 Au18 S13 27.76(10) 2_666 .
Au19 Au9 Au18 S13 154.82(5) . .
Au10 Au9 Au18 S13 -87.41(6) . .
S10 Au9 Au18 Au12 155.7(2) . 2_666
S7 Au9 Au18 Au12 149.0(4) . 2_666
Au25 Au9 Au18 Au12 -36.336(11) . 2_666
Au1 Au9 Au18 Au12 -100.613(18) . 2_666
Au20 Au9 Au18 Au12 27.823(14) . 2_666
Au17 Au9 Au18 Au12 -68.759(13) . 2_666
Au4 Au9 Au18 Au12 -57.43(8) 2_666 2_666
Au19 Au9 Au18 Au12 69.627(16) . 2_666
Au10 Au9 Au18 Au12 -172.603(18) . 2_666
S10 Au9 Au18 Au17 -135.6(2) . .
S7 Au9 Au18 Au17 -142.3(4) . .
Au25 Au9 Au18 Au17 32.424(13) . .
Au12 Au9 Au18 Au17 68.759(13) 2_666 .
Au1 Au9 Au18 Au17 -31.854(14) . .
Au20 Au9 Au18 Au17 96.582(15) . .
Au4 Au9 Au18 Au17 11.33(8) 2_666 .
Au19 Au9 Au18 Au17 138.387(14) . .
Au10 Au9 Au18 Au17 -103.843(18) . .
S13 Au17 Au18 S14 -178.45(12) . .
Au25 Au17 Au18 S14 -8.22(9) . .
Au20 Au17 Au18 S14 1.31(13) 2_666 .
Au4 Au17 Au18 S14 -71.40(9) . .
Au12 Au17 Au18 S14 -42.50(9) 2_666 .
Au9 Au17 Au18 S14 23.67(9) . .
Au1 Au17 Au18 S14 54.19(9) . .
Au2 Au17 Au18 S14 126.73(9) . .
Au3 Au17 Au18 S14 -146.28(9) . .
Au25 Au17 Au18 S13 170.23(7) . .
Au20 Au17 Au18 S13 179.76(11) 2_666 .
Au4 Au17 Au18 S13 107.06(7) . .
Au12 Au17 Au18 S13 135.96(7) 2_666 .
Au9 Au17 Au18 S13 -157.87(7) . .
Au1 Au17 Au18 S13 -127.36(7) . .
Au2 Au17 Au18 S13 -54.82(7) . .
Au3 Au17 Au18 S13 32.17(7) . .
S13 Au17 Au18 Au9 157.87(7) . .
Au25 Au17 Au18 Au9 -31.894(12) . .
Au20 Au17 Au18 Au9 -22.37(8) 2_666 .
Au4 Au17 Au18 Au9 -95.071(15) . .
Au12 Au17 Au18 Au9 -66.170(13) 2_666 .
Au1 Au17 Au18 Au9 30.518(14) . .
Au2 Au17 Au18 Au9 103.057(17) . .
Au3 Au17 Au18 Au9 -169.955(19) . .
S13 Au17 Au18 Au12 -135.96(7) . 2_666
Au25 Au17 Au18 Au12 34.276(11) . 2_666
Au20 Au17 Au18 Au12 43.80(8) 2_666 2_666
Au4 Au17 Au18 Au12 -28.901(14) . 2_666
Au9 Au17 Au18 Au12 66.170(13) . 2_666
Au1 Au17 Au18 Au12 96.688(18) . 2_666
Au2 Au17 Au18 Au12 169.227(17) . 2_666
Au3 Au17 Au18 Au12 -103.785(19) . 2_666
S10 Au9 Au19 S15 109.90(18) . .
S7 Au9 Au19 S15 97.8(4) . .
Au25 Au9 Au19 S15 -51.14(6) . .
Au12 Au9 Au19 S15 -87.25(6) 2_666 .
Au1 Au9 Au19 S15 -33.03(10) . .
Au20 Au9 Au19 S15 -18.17(6) . .
Au17 Au9 Au19 S15 -115.10(6) . .
Au4 Au9 Au19 S15 12.54(6) 2_666 .
Au18 Au9 Au19 S15 -157.85(6) . .
Au10 Au9 Au19 S15 80.78(6) . .
S10 Au9 Au19 S14 -65.81(18) . .
S7 Au9 Au19 S14 -77.9(4) . .
Au25 Au9 Au19 S14 133.15(5) . .
Au12 Au9 Au19 S14 97.04(6) 2_666 .
Au1 Au9 Au19 S14 151.26(9) . .
Au20 Au9 Au19 S14 166.12(5) . .
Au17 Au9 Au19 S14 69.19(6) . .
Au4 Au9 Au19 S14 -163.18(5) 2_666 .
Au18 Au9 Au19 S14 26.44(5) . .
Au10 Au9 Au19 S14 -94.94(6) . .
S10 Au9 Au19 Au12 -162.84(17) . 2_666
S7 Au9 Au19 Au12 -174.9(4) . 2_666
Au25 Au9 Au19 Au12 36.113(12) . 2_666
Au1 Au9 Au19 Au12 54.23(8) . 2_666
Au20 Au9 Au19 Au12 69.084(13) . 2_666
Au17 Au9 Au19 Au12 -27.847(14) . 2_666
Au4 Au9 Au19 Au12 99.789(17) 2_666 2_666
Au18 Au9 Au19 Au12 -70.599(13) . 2_666
Au10 Au9 Au19 Au12 168.029(18) . 2_666
S10 Au9 Au19 Au20 128.07(17) . .
S7 Au9 Au19 Au20 116.0(4) . .
Au25 Au9 Au19 Au20 -32.971(11) . .
Au12 Au9 Au19 Au20 -69.084(13) 2_666 .
Au1 Au9 Au19 Au20 -14.86(8) . .
Au17 Au9 Au19 Au20 -96.931(17) . .
Au4 Au9 Au19 Au20 30.705(13) 2_666 .
Au18 Au9 Au19 Au20 -139.683(14) . .
Au10 Au9 Au19 Au20 98.945(17) . .
S10 Au9 Au20 S15 -49.8(3) . .
S7 Au9 Au20 S15 -54.5(6) . .
Au25 Au9 Au20 S15 160.96(6) . .
Au12 Au9 Au20 S15 90.77(6) 2_666 .
Au1 Au9 Au20 S15 -165.04(6) . .
Au17 Au9 Au20 S15 131.52(6) . .
Au4 Au9 Au20 S15 -130.39(6) 2_666 .
Au18 Au9 Au20 S15 62.04(6) . .
Au19 Au9 Au20 S15 17.80(6) . .
Au10 Au9 Au20 S15 -100.49(6) . .
S10 Au9 Au20 Au25 149.3(3) . .
S7 Au9 Au20 Au25 144.5(6) . .
Au12 Au9 Au20 Au25 -70.188(14) 2_666 .
Au1 Au9 Au20 Au25 34.009(10) . .
Au17 Au9 Au20 Au25 -29.439(12) . .
Au4 Au9 Au20 Au25 68.653(10) 2_666 .
Au18 Au9 Au20 Au25 -98.918(16) . .
Au19 Au9 Au20 Au25 -143.154(12) . .
Au10 Au9 Au20 Au25 98.550(16) . .
S10 Au9 Au20 Au17 117.6(3) . 2_666
S7 Au9 Au20 Au17 112.8(6) . 2_666
Au25 Au9 Au20 Au17 -31.692(11) . 2_666
Au12 Au9 Au20 Au17 -101.879(19) 2_666 2_666
Au1 Au9 Au20 Au17 2.317(17) . 2_666
Au17 Au9 Au20 Au17 -61.13(2) . 2_666
Au4 Au9 Au20 Au17 36.961(14) 2_666 2_666
Au18 Au9 Au20 Au17 -130.609(17) . 2_666
Au19 Au9 Au20 Au17 -174.846(15) . 2_666
Au10 Au9 Au20 Au17 66.86(2) . 2_666
S10 Au9 Au20 Au12 -140.5(3) . 2_666
S7 Au9 Au20 Au12 -145.3(6) . 2_666
Au25 Au9 Au20 Au12 70.188(14) . 2_666
Au1 Au9 Au20 Au12 104.196(18) . 2_666
Au17 Au9 Au20 Au12 40.748(13) . 2_666
Au4 Au9 Au20 Au12 138.840(14) 2_666 2_666
Au18 Au9 Au20 Au12 -28.730(13) . 2_666
Au19 Au9 Au20 Au12 -72.966(16) . 2_666
Au10 Au9 Au20 Au12 168.737(15) . 2_666
S10 Au9 Au20 Au1 -176.6(3) . 2_666
S7 Au9 Au20 Au1 178.6(6) . 2_666
Au25 Au9 Au20 Au1 34.085(12) . 2_666
Au12 Au9 Au20 Au1 -36.103(13) 2_666 2_666
Au1 Au9 Au20 Au1 68.093(19) . 2_666
Au17 Au9 Au20 Au1 4.645(17) . 2_666
Au4 Au9 Au20 Au1 102.737(14) 2_666 2_666
Au18 Au9 Au20 Au1 -64.833(17) . 2_666
Au19 Au9 Au20 Au1 -109.069(16) . 2_666
Au10 Au9 Au20 Au1 132.635(14) . 2_666
S10 Au9 Au20 Au4 80.6(3) . 2_666
S7 Au9 Au20 Au4 75.9(6) . 2_666
Au25 Au9 Au20 Au4 -68.653(10) . 2_666
Au12 Au9 Au20 Au4 -138.840(14) 2_666 2_666
Au1 Au9 Au20 Au4 -34.644(13) . 2_666
Au17 Au9 Au20 Au4 -98.092(14) . 2_666
Au18 Au9 Au20 Au4 -167.570(16) . 2_666
Au19 Au9 Au20 Au4 148.193(14) . 2_666
Au10 Au9 Au20 Au4 29.897(13) . 2_666
S10 Au9 Au20 Au3 44.0(3) . 2_666
S7 Au9 Au20 Au3 39.2(6) . 2_666
Au25 Au9 Au20 Au3 -105.322(17) . 2_666
Au12 Au9 Au20 Au3 -175.509(16) 2_666 2_666
Au1 Au9 Au20 Au3 -71.31(2) . 2_666
Au17 Au9 Au20 Au3 -134.761(15) . 2_666
Au4 Au9 Au20 Au3 -36.669(14) 2_666 2_666
Au18 Au9 Au20 Au3 155.761(14) . 2_666
Au19 Au9 Au20 Au3 111.524(18) . 2_666
Au10 Au9 Au20 Au3 -6.772(18) . 2_666
S10 Au9 Au20 Au2 157.4(3) . 2_666
S7 Au9 Au20 Au2 152.6(6) . 2_666
Au25 Au9 Au20 Au2 8.10(7) . 2_666
Au12 Au9 Au20 Au2 -62.08(7) 2_666 2_666
Au1 Au9 Au20 Au2 42.11(8) . 2_666
Au17 Au9 Au20 Au2 -21.34(8) . 2_666
Au4 Au9 Au20 Au2 76.76(7) 2_666 2_666
Au18 Au9 Au20 Au2 -90.81(8) . 2_666
Au19 Au9 Au20 Au2 -135.05(8) . 2_666
Au10 Au9 Au20 Au2 106.65(7) . 2_666
S10 Au9 Au20 Au19 -67.6(3) . .
S7 Au9 Au20 Au19 -72.3(6) . .
Au25 Au9 Au20 Au19 143.154(12) . .
Au12 Au9 Au20 Au19 72.966(16) 2_666 .
Au1 Au9 Au20 Au19 177.163(14) . .
Au17 Au9 Au20 Au19 113.715(16) . .
Au4 Au9 Au20 Au19 -148.193(14) 2_666 .
Au18 Au9 Au20 Au19 44.236(16) . .
Au10 Au9 Au20 Au19 -118.296(17) . .
S14 Au19 Au20 S15 -176.94(12) . .
Au9 Au19 Au20 S15 -155.48(8) . .
Au12 Au19 Au20 S15 138.20(8) 2_666 .
S15 Au19 Au20 Au25 -171.82(8) . .
S14 Au19 Au20 Au25 11.24(9) . .
Au9 Au19 Au20 Au25 32.706(11) . .
Au12 Au19 Au20 Au25 -33.615(13) 2_666 .
S15 Au19 Au20 Au17 -177.57(11) . 2_666
S14 Au19 Au20 Au17 5.49(13) . 2_666
Au9 Au19 Au20 Au17 26.95(8) . 2_666
Au12 Au19 Au20 Au17 -39.37(8) 2_666 2_666
S15 Au19 Au20 Au12 -138.20(8) . 2_666
S14 Au19 Au20 Au12 44.86(9) . 2_666
Au9 Au19 Au20 Au12 66.321(13) . 2_666
S15 Au19 Au20 Au1 -108.60(8) . 2_666
S14 Au19 Au20 Au1 74.46(9) . 2_666
Au9 Au19 Au20 Au1 95.927(18) . 2_666
Au12 Au19 Au20 Au1 29.607(14) 2_666 2_666
S15 Au19 Au20 Au9 155.48(8) . .
S14 Au19 Au20 Au9 -21.46(9) . .
Au12 Au19 Au20 Au9 -66.321(13) 2_666 .
S15 Au19 Au20 Au4 125.62(8) . 2_666
S14 Au19 Au20 Au4 -51.32(9) . 2_666
Au9 Au19 Au20 Au4 -29.856(13) . 2_666
Au12 Au19 Au20 Au4 -96.176(14) 2_666 2_666
S15 Au19 Au20 Au3 51.40(8) . 2_666
S14 Au19 Au20 Au3 -125.54(9) . 2_666
Au9 Au19 Au20 Au3 -104.074(18) . 2_666
Au12 Au19 Au20 Au3 -170.395(18) 2_666 2_666
S15 Au19 Au20 Au2 -34.66(8) . 2_666
S14 Au19 Au20 Au2 148.40(9) . 2_666
Au9 Au19 Au20 Au2 169.863(17) . 2_666
Au12 Au19 Au20 Au2 103.543(17) 2_666 2_666
S15 Au20 Au25 Au20 -114(10) . 2_666
Au17 Au20 Au25 Au20 79(10) 2_666 2_666
Au12 Au20 Au25 Au20 -135(10) 2_666 2_666
Au1 Au20 Au25 Au20 153(10) 2_666 2_666
Au9 Au20 Au25 Au20 -66(10) . 2_666
Au4 Au20 Au25 Au20 6(10) 2_666 2_666
Au3 Au20 Au25 Au20 39(10) 2_666 2_666
Au2 Au20 Au25 Au20 115(10) 2_666 2_666
Au19 Au20 Au25 Au20 -100(10) . 2_666
S15 Au20 Au25 Au12 21.21(13) . 2_666
Au17 Au20 Au25 Au12 -146.366(14) 2_666 2_666
Au1 Au20 Au25 Au12 -72.323(12) 2_666 2_666
Au9 Au20 Au25 Au12 68.546(15) . 2_666
Au4 Au20 Au25 Au12 140.876(12) 2_666 2_666
Au3 Au20 Au25 Au12 173.807(16) 2_666 2_666
Au2 Au20 Au25 Au12 -109.740(18) 2_666 2_666
Au19 Au20 Au25 Au12 34.875(14) . 2_666
S15 Au20 Au25 Au12 -158.79(13) . .
Au17 Au20 Au25 Au12 33.635(14) 2_666 .
Au12 Au20 Au25 Au12 180.0 2_666 .
Au1 Au20 Au25 Au12 107.678(12) 2_666 .
Au9 Au20 Au25 Au12 -111.453(15) . .
Au4 Au20 Au25 Au12 -39.123(12) 2_666 .
Au3 Au20 Au25 Au12 -6.192(16) 2_666 .
Au2 Au20 Au25 Au12 70.260(18) 2_666 .
Au19 Au20 Au25 Au12 -145.125(13) . .
S15 Au20 Au25 Au17 -12.43(13) . .
Au17 Au20 Au25 Au17 180.0 2_666 .
Au12 Au20 Au25 Au17 -33.637(14) 2_666 .
Au1 Au20 Au25 Au17 -105.960(12) 2_666 .
Au9 Au20 Au25 Au17 34.909(13) . .
Au4 Au20 Au25 Au17 107.239(15) 2_666 .
Au3 Au20 Au25 Au17 140.170(15) 2_666 .
Au2 Au20 Au25 Au17 -143.377(12) 2_666 .
Au19 Au20 Au25 Au17 1.238(16) . .
S15 Au20 Au25 Au17 167.57(13) . 2_666
Au12 Au20 Au25 Au17 146.365(14) 2_666 2_666
Au1 Au20 Au25 Au17 74.043(12) 2_666 2_666
Au9 Au20 Au25 Au17 -145.088(13) . 2_666
Au4 Au20 Au25 Au17 -72.758(15) 2_666 2_666
Au3 Au20 Au25 Au17 -39.828(15) 2_666 2_666
Au2 Au20 Au25 Au17 36.625(12) 2_666 2_666
Au19 Au20 Au25 Au17 -178.760(15) . 2_666
S15 Au20 Au25 Au4 60.33(13) . .
Au17 Au20 Au25 Au4 -107.240(15) 2_666 .
Au12 Au20 Au25 Au4 39.125(12) 2_666 .
Au1 Au20 Au25 Au4 -33.198(14) 2_666 .
Au9 Au20 Au25 Au4 107.671(17) . .
Au4 Au20 Au25 Au4 180.001(1) 2_666 .
Au3 Au20 Au25 Au4 -147.068(12) 2_666 .
Au2 Au20 Au25 Au4 -70.615(19) 2_666 .
Au19 Au20 Au25 Au4 74.000(17) . .
S15 Au20 Au25 Au4 -119.67(13) . 2_666
Au17 Au20 Au25 Au4 72.758(15) 2_666 2_666
Au12 Au20 Au25 Au4 -140.876(12) 2_666 2_666
Au1 Au20 Au25 Au4 146.801(13) 2_666 2_666
Au9 Au20 Au25 Au4 -72.330(17) . 2_666
Au3 Au20 Au25 Au4 32.931(12) 2_666 2_666
Au2 Au20 Au25 Au4 109.384(19) 2_666 2_666
Au19 Au20 Au25 Au4 -106.001(17) . 2_666
S15 Au20 Au25 Au9 132.66(13) . 2_666
Au17 Au20 Au25 Au9 -34.909(13) 2_666 2_666
Au12 Au20 Au25 Au9 111.456(15) 2_666 2_666
Au1 Au20 Au25 Au9 39.133(14) 2_666 2_666
Au9 Au20 Au25 Au9 180.0 . 2_666
Au4 Au20 Au25 Au9 -107.668(17) 2_666 2_666
Au3 Au20 Au25 Au9 -74.737(19) 2_666 2_666
Au2 Au20 Au25 Au9 1.716(15) 2_666 2_666
Au19 Au20 Au25 Au9 146.331(12) . 2_666
S15 Au20 Au25 Au9 -47.34(13) . .
Au17 Au20 Au25 Au9 145.088(13) 2_666 .
Au12 Au20 Au25 Au9 -68.546(15) 2_666 .
Au1 Au20 Au25 Au9 -140.869(13) 2_666 .
Au4 Au20 Au25 Au9 72.330(16) 2_666 .
Au3 Au20 Au25 Au9 105.261(19) 2_666 .
Au2 Au20 Au25 Au9 -178.286(15) 2_666 .
Au19 Au20 Au25 Au9 -33.671(12) . .
S15 Au20 Au25 Au1 93.53(13) . 2_666
Au17 Au20 Au25 Au1 -74.043(12) 2_666 2_666
Au12 Au20 Au25 Au1 72.323(12) 2_666 2_666
Au9 Au20 Au25 Au1 140.869(14) . 2_666
Au4 Au20 Au25 Au1 -146.801(13) 2_666 2_666
Au3 Au20 Au25 Au1 -113.870(16) 2_666 2_666
Au2 Au20 Au25 Au1 -37.417(13) 2_666 2_666
Au19 Au20 Au25 Au1 107.197(14) . 2_666
S15 Au20 Au25 Au1 -86.47(13) . .
Au17 Au20 Au25 Au1 105.958(12) 2_666 .
Au12 Au20 Au25 Au1 -107.676(12) 2_666 .
Au1 Au20 Au25 Au1 180.0 2_666 .
Au9 Au20 Au25 Au1 -39.130(14) . .
Au4 Au20 Au25 Au1 33.200(13) 2_666 .
Au3 Au20 Au25 Au1 66.131(16) 2_666 .
Au2 Au20 Au25 Au1 142.584(13) 2_666 .
Au19 Au20 Au25 Au1 -72.801(14) . .
S9 Au12 Au25 Au20 88.11(12) . .
Au9 Au12 Au25 Au20 -106.299(16) 2_666 .
Au4 Au12 Au25 Au20 39.605(14) 2_666 .
Au20 Au12 Au25 Au20 180.0 2_666 .
Au17 Au12 Au25 Au20 -32.531(12) 2_666 .
Au1 Au12 Au25 Au20 107.590(13) . .
Au19 Au12 Au25 Au20 -143.751(14) 2_666 .
Au18 Au12 Au25 Au20 -69.234(15) 2_666 .
Au11 Au12 Au25 Au20 76.932(17) . .
S9 Au12 Au25 Au20 -91.89(12) . 2_666
Au9 Au12 Au25 Au20 73.702(16) 2_666 2_666
Au4 Au12 Au25 Au20 -140.393(14) 2_666 2_666
Au17 Au12 Au25 Au20 147.470(12) 2_666 2_666
Au1 Au12 Au25 Au20 -72.408(12) . 2_666
Au19 Au12 Au25 Au20 36.251(14) 2_666 2_666
Au18 Au12 Au25 Au20 110.768(15) 2_666 2_666
Au11 Au12 Au25 Au20 -103.066(18) . 2_666
S9 Au12 Au25 Au12 -15(27) . 2_666
Au9 Au12 Au25 Au12 151(27) 2_666 2_666
Au4 Au12 Au25 Au12 -64(27) 2_666 2_666
Au20 Au12 Au25 Au12 77(27) 2_666 2_666
Au17 Au12 Au25 Au12 -136(27) 2_666 2_666
Au1 Au12 Au25 Au12 4(27) . 2_666
Au19 Au12 Au25 Au12 113(27) 2_666 2_666
Au18 Au12 Au25 Au12 -172(27) 2_666 2_666
Au11 Au12 Au25 Au12 -26(27) . 2_666
S9 Au12 Au25 Au17 -59.35(12) . .
Au9 Au12 Au25 Au17 106.235(17) 2_666 .
Au4 Au12 Au25 Au17 -107.861(14) 2_666 .
Au20 Au12 Au25 Au17 32.533(12) 2_666 .
Au17 Au12 Au25 Au17 180.0 2_666 .
Au1 Au12 Au25 Au17 -39.875(13) . .
Au19 Au12 Au25 Au17 68.783(17) 2_666 .
Au18 Au12 Au25 Au17 143.300(13) 2_666 .
Au11 Au12 Au25 Au17 -70.534(18) . .
S9 Au12 Au25 Au17 120.64(12) . 2_666
Au9 Au12 Au25 Au17 -73.768(17) 2_666 2_666
Au4 Au12 Au25 Au17 72.137(14) 2_666 2_666
Au20 Au12 Au25 Au17 -147.470(12) 2_666 2_666
Au1 Au12 Au25 Au17 140.122(13) . 2_666
Au19 Au12 Au25 Au17 -111.219(17) 2_666 2_666
Au18 Au12 Au25 Au17 -36.703(13) 2_666 2_666
Au11 Au12 Au25 Au17 109.464(18) . 2_666
S9 Au12 Au25 Au4 -131.49(12) . .
Au9 Au12 Au25 Au4 34.095(13) 2_666 .
Au4 Au12 Au25 Au4 180.0 2_666 .
Au20 Au12 Au25 Au4 -39.607(15) 2_666 .
Au17 Au12 Au25 Au4 107.863(15) 2_666 .
Au1 Au12 Au25 Au4 -112.015(11) . .
Au19 Au12 Au25 Au4 -3.356(15) 2_666 .
Au18 Au12 Au25 Au4 71.160(14) 2_666 .
Au11 Au12 Au25 Au4 -142.673(12) . .
S9 Au12 Au25 Au4 48.51(12) . 2_666
Au9 Au12 Au25 Au4 -145.905(13) 2_666 2_666
Au20 Au12 Au25 Au4 140.393(15) 2_666 2_666
Au17 Au12 Au25 Au4 -72.137(15) 2_666 2_666
Au1 Au12 Au25 Au4 67.985(11) . 2_666
Au19 Au12 Au25 Au4 176.644(15) 2_666 2_666
Au18 Au12 Au25 Au4 -108.839(14) 2_666 2_666
Au11 Au12 Au25 Au4 37.327(12) . 2_666
S9 Au12 Au25 Au9 -165.59(13) . 2_666
Au4 Au12 Au25 Au9 145.904(13) 2_666 2_666
Au20 Au12 Au25 Au9 -73.702(15) 2_666 2_666
Au17 Au12 Au25 Au9 73.768(16) 2_666 2_666
Au1 Au12 Au25 Au9 -146.110(13) . 2_666
Au19 Au12 Au25 Au9 -37.451(12) 2_666 2_666
Au18 Au12 Au25 Au9 37.065(13) 2_666 2_666
Au11 Au12 Au25 Au9 -176.768(15) . 2_666
S9 Au12 Au25 Au9 14.41(13) . .
Au9 Au12 Au25 Au9 180.0 2_666 .
Au4 Au12 Au25 Au9 -34.096(13) 2_666 .
Au20 Au12 Au25 Au9 106.297(15) 2_666 .
Au17 Au12 Au25 Au9 -106.232(16) 2_666 .
Au1 Au12 Au25 Au9 33.890(13) . .
Au19 Au12 Au25 Au9 142.548(13) 2_666 .
Au18 Au12 Au25 Au9 -142.935(13) 2_666 .
Au11 Au12 Au25 Au9 3.231(15) . .
S9 Au12 Au25 Au1 160.52(12) . 2_666
Au9 Au12 Au25 Au1 -33.891(13) 2_666 2_666
Au4 Au12 Au25 Au1 112.014(11) 2_666 2_666
Au20 Au12 Au25 Au1 -107.593(12) 2_666 2_666
Au17 Au12 Au25 Au1 39.877(13) 2_666 2_666
Au1 Au12 Au25 Au1 180.0 . 2_666
Au19 Au12 Au25 Au1 -71.342(14) 2_666 2_666
Au18 Au12 Au25 Au1 3.175(14) 2_666 2_666
Au11 Au12 Au25 Au1 149.341(12) . 2_666
S9 Au12 Au25 Au1 -19.48(12) . .
Au9 Au12 Au25 Au1 146.110(13) 2_666 .
Au4 Au12 Au25 Au1 -67.985(11) 2_666 .
Au20 Au12 Au25 Au1 72.408(13) 2_666 .
Au17 Au12 Au25 Au1 -140.122(13) 2_666 .
Au19 Au12 Au25 Au1 108.659(14) 2_666 .
Au18 Au12 Au25 Au1 -176.824(14) 2_666 .
Au11 Au12 Au25 Au1 -30.658(12) . .
S13 Au17 Au25 Au20 14.13(12) . .
Au20 Au17 Au25 Au20 180.0 2_666 .
Au4 Au17 Au25 Au20 105.545(16) . .
Au12 Au17 Au25 Au20 33.677(12) 2_666 .
Au9 Au17 Au25 Au20 -34.906(14) . .
Au1 Au17 Au25 Au20 -106.634(13) . .
Au2 Au17 Au25 Au20 -141.134(12) . .
Au18 Au17 Au25 Au20 -2.145(15) . .
Au3 Au17 Au25 Au20 145.224(13) . .
S13 Au17 Au25 Au20 -165.87(12) . 2_666
Au4 Au17 Au25 Au20 -74.457(15) . 2_666
Au12 Au17 Au25 Au20 -146.326(12) 2_666 2_666
Au9 Au17 Au25 Au20 145.092(14) . 2_666
Au1 Au17 Au25 Au20 73.364(13) . 2_666
Au2 Au17 Au25 Au20 38.863(12) . 2_666
Au18 Au17 Au25 Au20 177.853(15) . 2_666
Au3 Au17 Au25 Au20 -34.778(13) . 2_666
S13 Au17 Au25 Au12 -19.55(12) . 2_666
Au20 Au17 Au25 Au12 146.326(12) 2_666 2_666
Au4 Au17 Au25 Au12 71.868(15) . 2_666
Au9 Au17 Au25 Au12 -68.583(13) . 2_666
Au1 Au17 Au25 Au12 -140.311(13) . 2_666
Au2 Au17 Au25 Au12 -174.811(15) . 2_666
Au18 Au17 Au25 Au12 -35.821(12) . 2_666
Au3 Au17 Au25 Au12 111.547(16) . 2_666
S13 Au17 Au25 Au12 160.45(12) . .
Au20 Au17 Au25 Au12 -33.675(12) 2_666 .
Au4 Au17 Au25 Au12 -108.132(15) . .
Au12 Au17 Au25 Au12 180.0 2_666 .
Au9 Au17 Au25 Au12 111.417(14) . .
Au1 Au17 Au25 Au12 39.689(13) . .
Au2 Au17 Au25 Au12 5.189(15) . .
Au18 Au17 Au25 Au12 144.178(12) . .
Au3 Au17 Au25 Au12 -68.453(16) . .
S13 Au17 Au25 Au17 78(8) . 2_666
Au20 Au17 Au25 Au17 -116(8) 2_666 2_666
Au4 Au17 Au25 Au17 169(8) . 2_666
Au12 Au17 Au25 Au17 98(8) 2_666 2_666
Au9 Au17 Au25 Au17 29(8) . 2_666
Au1 Au17 Au25 Au17 -43(8) . 2_666
Au2 Au17 Au25 Au17 -77(8) . 2_666
Au18 Au17 Au25 Au17 62(8) . 2_666
Au3 Au17 Au25 Au17 -151(8) . 2_666
S13 Au17 Au25 Au4 -91.42(12) . .
Au20 Au17 Au25 Au4 74.457(15) 2_666 .
Au12 Au17 Au25 Au4 -71.868(15) 2_666 .
Au9 Au17 Au25 Au4 -140.451(13) . .
Au1 Au17 Au25 Au4 147.821(13) . .
Au2 Au17 Au25 Au4 113.321(17) . .
Au18 Au17 Au25 Au4 -107.690(17) . .
Au3 Au17 Au25 Au4 39.679(13) . .
S13 Au17 Au25 Au4 88.58(12) . 2_666
Au20 Au17 Au25 Au4 -105.541(15) 2_666 2_666
Au4 Au17 Au25 Au4 180.0 . 2_666
Au12 Au17 Au25 Au4 108.133(15) 2_666 2_666
Au9 Au17 Au25 Au4 39.550(13) . 2_666
Au1 Au17 Au25 Au4 -32.178(12) . 2_666
Au2 Au17 Au25 Au4 -66.678(17) . 2_666
Au18 Au17 Au25 Au4 72.312(17) . 2_666
Au3 Au17 Au25 Au4 -140.320(12) . 2_666
S13 Au17 Au25 Au9 -130.97(12) . 2_666
Au20 Au17 Au25 Au9 34.906(14) 2_666 2_666
Au4 Au17 Au25 Au9 -39.551(13) . 2_666
Au12 Au17 Au25 Au9 -111.419(13) 2_666 2_666
Au9 Au17 Au25 Au9 180.0 . 2_666
Au1 Au17 Au25 Au9 108.270(12) . 2_666
Au2 Au17 Au25 Au9 73.770(16) . 2_666
Au18 Au17 Au25 Au9 -147.241(13) . 2_666
Au3 Au17 Au25 Au9 0.128(15) . 2_666
S13 Au17 Au25 Au9 49.03(12) . .
Au20 Au17 Au25 Au9 -145.092(14) 2_666 .
Au4 Au17 Au25 Au9 140.451(13) . .
Au12 Au17 Au25 Au9 68.583(13) 2_666 .
Au1 Au17 Au25 Au9 -71.728(12) . .
Au2 Au17 Au25 Au9 -106.228(16) . .
Au18 Au17 Au25 Au9 32.761(13) . .
Au3 Au17 Au25 Au9 -179.870(15) . .
S13 Au17 Au25 Au1 -59.24(12) . 2_666
Au20 Au17 Au25 Au1 106.638(13) 2_666 2_666
Au4 Au17 Au25 Au1 32.181(12) . 2_666
Au12 Au17 Au25 Au1 -39.687(13) 2_666 2_666
Au9 Au17 Au25 Au1 -108.270(12) . 2_666
Au1 Au17 Au25 Au1 180.0 . 2_666
Au2 Au17 Au25 Au1 145.502(13) . 2_666
Au18 Au17 Au25 Au1 -75.509(15) . 2_666
Au3 Au17 Au25 Au1 71.860(14) . 2_666
S13 Au17 Au25 Au1 120.76(12) . .
Au20 Au17 Au25 Au1 -73.364(13) 2_666 .
Au4 Au17 Au25 Au1 -147.821(12) . .
Au12 Au17 Au25 Au1 140.311(13) 2_666 .
Au9 Au17 Au25 Au1 71.728(11) . .
Au2 Au17 Au25 Au1 -34.500(13) . .
Au18 Au17 Au25 Au1 104.490(15) . .
Au3 Au17 Au25 Au1 -108.142(14) . .
S3 Au4 Au25 Au20 -150.64(12) . .
Au1 Au4 Au25 Au20 34.593(14) 2_666 .
Au12 Au4 Au25 Au20 -39.322(12) 2_666 .
Au17 Au4 Au25 Au20 -111.755(15) . .
Au9 Au4 Au25 Au20 107.773(13) 2_666 .
Au20 Au4 Au25 Au20 180.0 2_666 .
Au10 Au4 Au25 Au20 72.528(18) 2_666 .
Au11 Au4 Au25 Au20 -2.728(14) 2_666 .
Au3 Au4 Au25 Au20 -151.201(12) . .
S3 Au4 Au25 Au20 29.36(12) . 2_666
Au1 Au4 Au25 Au20 -145.408(14) 2_666 2_666
Au12 Au4 Au25 Au20 140.678(12) 2_666 2_666
Au17 Au4 Au25 Au20 68.245(15) . 2_666
Au9 Au4 Au25 Au20 -72.227(13) 2_666 2_666
Au10 Au4 Au25 Au20 -107.472(18) 2_666 2_666
Au11 Au4 Au25 Au20 177.271(15) 2_666 2_666
Au3 Au4 Au25 Au20 28.799(12) . 2_666
S3 Au4 Au25 Au12 -111.32(12) . 2_666
Au1 Au4 Au25 Au12 73.915(14) 2_666 2_666
Au17 Au4 Au25 Au12 -72.432(16) . 2_666
Au9 Au4 Au25 Au12 147.095(14) 2_666 2_666
Au20 Au4 Au25 Au12 -140.678(12) 2_666 2_666
Au10 Au4 Au25 Au12 111.850(18) 2_666 2_666
Au11 Au4 Au25 Au12 36.594(12) 2_666 2_666
Au3 Au4 Au25 Au12 -111.879(15) . 2_666
S3 Au4 Au25 Au12 68.68(12) . .
Au1 Au4 Au25 Au12 -106.086(14) 2_666 .
Au12 Au4 Au25 Au12 180.0 2_666 .
Au17 Au4 Au25 Au12 107.567(15) . .
Au9 Au4 Au25 Au12 -32.905(14) 2_666 .
Au20 Au4 Au25 Au12 39.322(12) 2_666 .
Au10 Au4 Au25 Au12 -68.150(19) 2_666 .
Au11 Au4 Au25 Au12 -143.407(12) 2_666 .
Au3 Au4 Au25 Au12 68.121(15) . .
S3 Au4 Au25 Au17 -38.89(12) . .
Au1 Au4 Au25 Au17 146.347(13) 2_666 .
Au12 Au4 Au25 Au17 72.432(15) 2_666 .
Au9 Au4 Au25 Au17 -140.472(13) 2_666 .
Au20 Au4 Au25 Au17 -68.245(15) 2_666 .
Au10 Au4 Au25 Au17 -175.717(16) 2_666 .
Au11 Au4 Au25 Au17 109.026(18) 2_666 .
Au3 Au4 Au25 Au17 -39.446(13) . .
S3 Au4 Au25 Au17 141.11(12) . 2_666
Au1 Au4 Au25 Au17 -33.652(13) 2_666 2_666
Au12 Au4 Au25 Au17 -107.567(15) 2_666 2_666
Au17 Au4 Au25 Au17 180.0 . 2_666
Au9 Au4 Au25 Au17 39.528(13) 2_666 2_666
Au20 Au4 Au25 Au17 111.755(15) 2_666 2_666
Au10 Au4 Au25 Au17 4.283(16) 2_666 2_666
Au11 Au4 Au25 Au17 -70.973(17) 2_666 2_666
Au3 Au4 Au25 Au17 140.554(12) . 2_666
S3 Au4 Au25 Au4 85(9) . 2_666
Au1 Au4 Au25 Au4 -89(9) 2_666 2_666
Au12 Au4 Au25 Au4 -163(9) 2_666 2_666
Au17 Au4 Au25 Au4 124(9) . 2_666
Au9 Au4 Au25 Au4 -16(9) 2_666 2_666
Au20 Au4 Au25 Au4 56(9) 2_666 2_666
Au10 Au4 Au25 Au4 -51(9) 2_666 2_666
Au11 Au4 Au25 Au4 -127(9) 2_666 2_666
Au3 Au4 Au25 Au4 85(9) . 2_666
S3 Au4 Au25 Au9 101.58(12) . 2_666
Au1 Au4 Au25 Au9 -73.180(13) 2_666 2_666
Au12 Au4 Au25 Au9 -147.095(14) 2_666 2_666
Au17 Au4 Au25 Au9 140.472(13) . 2_666
Au20 Au4 Au25 Au9 72.227(13) 2_666 2_666
Au10 Au4 Au25 Au9 -35.245(14) 2_666 2_666
Au11 Au4 Au25 Au9 -110.501(16) 2_666 2_666
Au3 Au4 Au25 Au9 101.026(14) . 2_666
S3 Au4 Au25 Au9 -78.41(12) . .
Au1 Au4 Au25 Au9 106.821(13) 2_666 .
Au12 Au4 Au25 Au9 32.906(14) 2_666 .
Au17 Au4 Au25 Au9 -39.526(13) . .
Au9 Au4 Au25 Au9 180.0 2_666 .
Au20 Au4 Au25 Au9 -107.771(13) 2_666 .
Au10 Au4 Au25 Au9 144.757(14) 2_666 .
Au11 Au4 Au25 Au9 69.500(16) 2_666 .
Au3 Au4 Au25 Au9 -78.972(14) . .
S3 Au4 Au25 Au1 174.76(12) . 2_666
Au12 Au4 Au25 Au1 -73.915(14) 2_666 2_666
Au17 Au4 Au25 Au1 -146.347(13) . 2_666
Au9 Au4 Au25 Au1 73.180(13) 2_666 2_666
Au20 Au4 Au25 Au1 145.408(14) 2_666 2_666
Au10 Au4 Au25 Au1 37.936(13) 2_666 2_666
Au11 Au4 Au25 Au1 -37.321(13) 2_666 2_666
Au3 Au4 Au25 Au1 174.207(15) . 2_666
S3 Au4 Au25 Au1 -5.24(12) . .
Au1 Au4 Au25 Au1 180.0 2_666 .
Au12 Au4 Au25 Au1 106.084(14) 2_666 .
Au17 Au4 Au25 Au1 33.651(13) . .
Au9 Au4 Au25 Au1 -106.821(13) 2_666 .
Au20 Au4 Au25 Au1 -34.594(14) 2_666 .
Au10 Au4 Au25 Au1 -142.066(13) 2_666 .
Au11 Au4 Au25 Au1 142.677(13) 2_666 .
Au3 Au4 Au25 Au1 -5.795(15) . .
S10 Au9 Au25 Au20 -96.8(4) . .
S7 Au9 Au25 Au20 -77.7(7) . .
Au12 Au9 Au25 Au20 73.263(15) 2_666 .
Au1 Au9 Au25 Au20 -140.726(13) . .
Au17 Au9 Au25 Au20 146.377(13) . .
Au4 Au9 Au25 Au20 -72.914(14) 2_666 .
Au18 Au9 Au25 Au20 111.662(17) . .
Au19 Au9 Au25 Au20 35.379(13) . .
Au10 Au9 Au25 Au20 -104.024(17) . .
S10 Au9 Au25 Au20 83.2(4) . 2_666
S7 Au9 Au25 Au20 102.3(7) . 2_666
Au12 Au9 Au25 Au20 -106.739(15) 2_666 2_666
Au1 Au9 Au25 Au20 39.271(13) . 2_666
Au20 Au9 Au25 Au20 179.998(2) . 2_666
Au17 Au9 Au25 Au20 -33.625(13) . 2_666
Au4 Au9 Au25 Au20 107.084(14) 2_666 2_666
Au18 Au9 Au25 Au20 -68.340(17) . 2_666
Au19 Au9 Au25 Au20 -144.623(13) . 2_666
Au10 Au9 Au25 Au20 75.974(16) . 2_666
S10 Au9 Au25 Au12 -170.0(4) . 2_666
S7 Au9 Au25 Au12 -151.0(7) . 2_666
Au1 Au9 Au25 Au12 146.010(13) . 2_666
Au20 Au9 Au25 Au12 -73.263(15) . 2_666
Au17 Au9 Au25 Au12 73.113(15) . 2_666
Au4 Au9 Au25 Au12 -146.177(13) 2_666 2_666
Au18 Au9 Au25 Au12 38.399(13) . 2_666
Au19 Au9 Au25 Au12 -37.884(13) . 2_666
Au10 Au9 Au25 Au12 -177.287(15) . 2_666
S10 Au9 Au25 Au12 10.0(4) . .
S7 Au9 Au25 Au12 29.0(7) . .
Au12 Au9 Au25 Au12 180.0 2_666 .
Au1 Au9 Au25 Au12 -33.989(13) . .
Au20 Au9 Au25 Au12 106.737(15) . .
Au17 Au9 Au25 Au12 -106.886(15) . .
Au4 Au9 Au25 Au12 33.823(13) 2_666 .
Au18 Au9 Au25 Au12 -141.600(13) . .
Au19 Au9 Au25 Au12 142.116(13) . .
Au10 Au9 Au25 Au12 2.713(15) . .
S10 Au9 Au25 Au17 116.9(4) . .
S7 Au9 Au25 Au17 135.9(7) . .
Au12 Au9 Au25 Au17 -73.113(15) 2_666 .
Au1 Au9 Au25 Au17 72.897(14) . .
Au20 Au9 Au25 Au17 -146.377(13) . .
Au4 Au9 Au25 Au17 140.710(14) 2_666 .
Au18 Au9 Au25 Au17 -34.714(13) . .
Au19 Au9 Au25 Au17 -110.998(16) . .
Au10 Au9 Au25 Au17 109.599(17) . .
S10 Au9 Au25 Au17 -63.1(4) . 2_666
S7 Au9 Au25 Au17 -44.1(7) . 2_666
Au12 Au9 Au25 Au17 106.888(14) 2_666 2_666
Au1 Au9 Au25 Au17 -107.102(13) . 2_666
Au20 Au9 Au25 Au17 33.625(13) . 2_666
Au17 Au9 Au25 Au17 180.0 . 2_666
Au4 Au9 Au25 Au17 -39.289(14) 2_666 2_666
Au18 Au9 Au25 Au17 145.287(13) . 2_666
Au19 Au9 Au25 Au17 69.004(16) . 2_666
Au10 Au9 Au25 Au17 -70.399(17) . 2_666
S10 Au9 Au25 Au4 156.1(4) . .
S7 Au9 Au25 Au4 175.2(7) . .
Au12 Au9 Au25 Au4 -33.823(13) 2_666 .
Au1 Au9 Au25 Au4 112.187(13) . .
Au20 Au9 Au25 Au4 -107.087(14) . .
Au17 Au9 Au25 Au4 39.290(14) . .
Au4 Au9 Au25 Au4 180.0 2_666 .
Au18 Au9 Au25 Au4 4.576(16) . .
Au19 Au9 Au25 Au4 -71.708(16) . .
Au10 Au9 Au25 Au4 148.889(12) . .
S10 Au9 Au25 Au4 -23.9(4) . 2_666
S7 Au9 Au25 Au4 -4.8(7) . 2_666
Au12 Au9 Au25 Au4 146.177(13) 2_666 2_666
Au1 Au9 Au25 Au4 -67.813(13) . 2_666
Au20 Au9 Au25 Au4 72.914(14) . 2_666
Au17 Au9 Au25 Au4 -140.710(14) . 2_666
Au18 Au9 Au25 Au4 -175.424(16) . 2_666
Au19 Au9 Au25 Au4 108.293(16) . 2_666
Au10 Au9 Au25 Au4 -31.110(12) . 2_666
S10 Au9 Au25 Au9 17(6) . 2_666
S7 Au9 Au25 Au9 36(6) . 2_666
Au12 Au9 Au25 Au9 -173(6) 2_666 2_666
Au1 Au9 Au25 Au9 -27(6) . 2_666
Au20 Au9 Au25 Au9 114(6) . 2_666
Au17 Au9 Au25 Au9 -100(6) . 2_666
Au4 Au9 Au25 Au9 41(6) 2_666 2_666
Au18 Au9 Au25 Au9 -135(6) . 2_666
Au19 Au9 Au25 Au9 149(6) . 2_666
Au10 Au9 Au25 Au9 10(6) . 2_666
S10 Au9 Au25 Au1 -136.0(4) . 2_666
S7 Au9 Au25 Au1 -117.0(7) . 2_666
Au12 Au9 Au25 Au1 33.990(13) 2_666 2_666
Au1 Au9 Au25 Au1 180.0 . 2_666
Au20 Au9 Au25 Au1 -39.274(13) . 2_666
Au17 Au9 Au25 Au1 107.103(14) . 2_666
Au4 Au9 Au25 Au1 -112.187(13) 2_666 2_666
Au18 Au9 Au25 Au1 72.389(16) . 2_666
Au19 Au9 Au25 Au1 -3.895(15) . 2_666
Au10 Au9 Au25 Au1 -143.298(12) . 2_666
S10 Au9 Au25 Au1 44.0(4) . .
S7 Au9 Au25 Au1 63.0(7) . .
Au12 Au9 Au25 Au1 -146.010(13) 2_666 .
Au20 Au9 Au25 Au1 140.726(13) . .
Au17 Au9 Au25 Au1 -72.897(13) . .
Au4 Au9 Au25 Au1 67.813(13) 2_666 .
Au18 Au9 Au25 Au1 -107.611(16) . .
Au19 Au9 Au25 Au1 176.105(15) . .
Au10 Au9 Au25 Au1 36.702(12) . .
S1 Au1 Au25 Au20 113.92(10) . .
Au4 Au1 Au25 Au20 -34.792(15) 2_666 .
Au9 Au1 Au25 Au20 39.330(13) . .
Au20 Au1 Au25 Au20 180.0 2_666 .
Au12 Au1 Au25 Au20 -107.781(11) . .
Au17 Au1 Au25 Au20 111.830(13) . .
Au11 Au1 Au25 Au20 -75.297(15) . .
Au10 Au1 Au25 Au20 0.492(15) . .
Au2 Au1 Au25 Au20 143.579(14) . .
S1 Au1 Au25 Au20 -66.08(10) . 2_666
Au4 Au1 Au25 Au20 145.207(14) 2_666 2_666
Au9 Au1 Au25 Au20 -140.671(13) . 2_666
Au12 Au1 Au25 Au20 72.218(11) . 2_666
Au17 Au1 Au25 Au20 -68.171(13) . 2_666
Au11 Au1 Au25 Au20 104.702(15) . 2_666
Au10 Au1 Au25 Au20 -179.509(15) . 2_666
Au2 Au1 Au25 Au20 -36.422(14) . 2_666
S1 Au1 Au25 Au12 41.70(10) . 2_666
Au4 Au1 Au25 Au12 -107.011(14) 2_666 2_666
Au9 Au1 Au25 Au12 -32.889(12) . 2_666
Au20 Au1 Au25 Au12 107.782(11) 2_666 2_666
Au12 Au1 Au25 Au12 180.0 . 2_666
Au17 Au1 Au25 Au12 39.612(14) . 2_666
Au11 Au1 Au25 Au12 -147.515(14) . 2_666
Au10 Au1 Au25 Au12 -71.726(14) . 2_666
Au2 Au1 Au25 Au12 71.360(16) . 2_666
S1 Au1 Au25 Au12 -138.30(10) . .
Au4 Au1 Au25 Au12 72.989(14) 2_666 .
Au9 Au1 Au25 Au12 147.111(12) . .
Au20 Au1 Au25 Au12 -72.218(11) 2_666 .
Au17 Au1 Au25 Au12 -140.388(14) . .
Au11 Au1 Au25 Au12 32.485(14) . .
Au10 Au1 Au25 Au12 108.273(14) . .
Au2 Au1 Au25 Au12 -108.640(16) . .
S1 Au1 Au25 Au17 2.09(10) . .
Au4 Au1 Au25 Au17 -146.623(12) 2_666 .
Au9 Au1 Au25 Au17 -72.500(17) . .
Au20 Au1 Au25 Au17 68.171(13) 2_666 .
Au12 Au1 Au25 Au17 140.388(14) . .
Au11 Au1 Au25 Au17 172.873(15) . .
Au10 Au1 Au25 Au17 -111.338(16) . .
Au2 Au1 Au25 Au17 31.748(11) . .
S1 Au1 Au25 Au17 -177.92(10) . 2_666
Au4 Au1 Au25 Au17 33.376(12) 2_666 2_666
Au9 Au1 Au25 Au17 107.498(17) . 2_666
Au20 Au1 Au25 Au17 -111.831(13) 2_666 2_666
Au12 Au1 Au25 Au17 -39.613(14) . 2_666
Au17 Au1 Au25 Au17 179.998(2) . 2_666
Au11 Au1 Au25 Au17 -7.129(15) . 2_666
Au10 Au1 Au25 Au17 68.660(16) . 2_666
Au2 Au1 Au25 Au17 -148.254(11) . 2_666
S1 Au1 Au25 Au4 -31.29(10) . .
Au4 Au1 Au25 Au4 179.998(2) 2_666 .
Au9 Au1 Au25 Au4 -105.879(18) . .
Au20 Au1 Au25 Au4 34.792(15) 2_666 .
Au12 Au1 Au25 Au4 107.009(14) . .
Au17 Au1 Au25 Au4 -33.379(12) . .
Au11 Au1 Au25 Au4 139.494(12) . .
Au10 Au1 Au25 Au4 -144.717(14) . .
Au2 Au1 Au25 Au4 -1.631(15) . .
S1 Au1 Au25 Au4 148.71(10) . 2_666
Au9 Au1 Au25 Au4 74.122(17) . 2_666
Au20 Au1 Au25 Au4 -145.207(14) 2_666 2_666
Au12 Au1 Au25 Au4 -72.989(14) . 2_666
Au17 Au1 Au25 Au4 146.623(12) . 2_666
Au11 Au1 Au25 Au4 -40.504(12) . 2_666
Au10 Au1 Au25 Au4 35.285(14) . 2_666
Au2 Au1 Au25 Au4 178.371(15) . 2_666
S1 Au1 Au25 Au9 -105.41(10) . 2_666
Au4 Au1 Au25 Au9 105.877(18) 2_666 2_666
Au9 Au1 Au25 Au9 180.0 . 2_666
Au20 Au1 Au25 Au9 -39.330(13) 2_666 2_666
Au12 Au1 Au25 Au9 32.888(12) . 2_666
Au17 Au1 Au25 Au9 -107.501(17) . 2_666
Au11 Au1 Au25 Au9 65.372(19) . 2_666
Au10 Au1 Au25 Au9 141.161(13) . 2_666
Au2 Au1 Au25 Au9 -75.753(19) . 2_666
S1 Au1 Au25 Au9 74.59(10) . .
Au4 Au1 Au25 Au9 -74.122(17) 2_666 .
Au20 Au1 Au25 Au9 140.671(13) 2_666 .
Au12 Au1 Au25 Au9 -147.111(12) . .
Au17 Au1 Au25 Au9 72.500(17) . .
Au11 Au1 Au25 Au9 -114.627(18) . .
Au10 Au1 Au25 Au9 -38.838(13) . .
Au2 Au1 Au25 Au9 104.249(19) . .
S1 Au1 Au25 Au1 75(14) . 2_666
Au4 Au1 Au25 Au1 -74(14) 2_666 2_666
Au9 Au1 Au25 Au1 0(14) . 2_666
Au20 Au1 Au25 Au1 141(14) 2_666 2_666
Au12 Au1 Au25 Au1 -147(14) . 2_666
Au17 Au1 Au25 Au1 73(14) . 2_666
Au11 Au1 Au25 Au1 -114(14) . 2_666
Au10 Au1 Au25 Au1 -39(14) . 2_666
Au2 Au1 Au25 Au1 104(14) . 2_666
S2 Au2 S1 C1 50.8(8) . .
Au17 Au2 S1 C1 -153.1(3) . .
Au20 Au2 S1 C1 -101.1(3) 2_666 .
Au1 Au2 S1 C1 -112.4(3) . .
S2 Au2 S1 Au1 163.2(7) . .
Au17 Au2 S1 Au1 -40.78(5) . .
Au20 Au2 S1 Au1 11.26(6) 2_666 .
Au25 Au1 S1 C1 147.3(3) . .
Au4 Au1 S1 C1 -83.0(3) 2_666 .
Au9 Au1 S1 C1 -152.4(3) . .
Au20 Au1 S1 C1 93.9(3) 2_666 .
Au12 Au1 S1 C1 32.2(3) . .
Au17 Au1 S1 C1 149.1(3) . .
Au11 Au1 S1 C1 -24.1(3) . .
Au10 Au1 S1 C1 -92.4(3) . .
Au2 Au1 S1 C1 106.3(3) . .
Au25 Au1 S1 Au2 41.00(13) . .
Au4 Au1 S1 Au2 170.62(4) 2_666 .
Au9 Au1 S1 Au2 101.24(5) . .
Au20 Au1 S1 Au2 -12.48(7) 2_666 .
Au12 Au1 S1 Au2 -74.11(10) . .
Au17 Au1 S1 Au2 42.76(5) . .
Au11 Au1 S1 Au2 -130.48(5) . .
Au10 Au1 S1 Au2 161.30(6) . .
S3 Au3 S2 C9 -46.6(6) . .
Au20 Au3 S2 C9 144.1(3) 2_666 .
Au17 Au3 S2 C9 91.2(3) . .
Au4 Au3 S2 C9 118.6(3) . .
S3 Au3 S2 Au2 -154.3(5) . .
Au20 Au3 S2 Au2 36.32(7) 2_666 .
Au17 Au3 S2 Au2 -16.61(7) . .
Au4 Au3 S2 Au2 10.82(13) . .
S1 Au2 S2 C9 67.7(8) . .
Au17 Au2 S2 C9 -88.2(3) . .
Au20 Au2 S2 C9 -140.0(3) 2_666 .
Au1 Au2 S2 C9 -131.0(3) . .
S1 Au2 S2 Au3 173.4(7) . .
Au17 Au2 S2 Au3 17.49(7) . .
Au20 Au2 S2 Au3 -34.27(6) 2_666 .
Au1 Au2 S2 Au3 -25.28(13) . .
S2 Au3 S3 C17 61.6(6) . .
Au20 Au3 S3 C17 -129.2(2) 2_666 .
Au17 Au3 S3 C17 -76.0(3) . .
Au4 Au3 S3 C17 -105.6(3) . .
S2 Au3 S3 Au4 167.2(5) . .
Au20 Au3 S3 Au4 -23.59(6) 2_666 .
Au17 Au3 S3 Au4 29.59(5) . .
Au25 Au4 S3 C17 99.5(3) . .
Au1 Au4 S3 C17 -88.6(3) 2_666 .
Au12 Au4 S3 C17 6.3(3) 2_666 .
Au17 Au4 S3 C17 66.7(3) . .
Au9 Au4 S3 C17 -176.1(3) 2_666 .
Au20 Au4 S3 C17 124.2(3) 2_666 .
Au10 Au4 S3 C17 -119.2(3) 2_666 .
Au11 Au4 S3 C17 -50.4(3) 2_666 .
Au3 Au4 S3 C17 100.3(3) . .
Au25 Au4 S3 Au3 -0.74(16) . .
Au1 Au4 S3 Au3 171.15(4) 2_666 .
Au12 Au4 S3 Au3 -93.93(7) 2_666 .
Au17 Au4 S3 Au3 -33.54(6) . .
Au9 Au4 S3 Au3 83.61(6) 2_666 .
Au20 Au4 S3 Au3 23.97(6) 2_666 .
Au10 Au4 S3 Au3 140.57(6) 2_666 .
Au11 Au4 S3 Au3 -150.69(5) 2_666 .
S8 Au10 S7 C49 -87(2) . .
S10 Au10 S7 C49 40(2) . .
Au4 Au10 S7 C49 153.0(10) 2_666 .
Au1 Au10 S7 C49 100.6(10) . .
Au9 Au10 S7 C49 112.3(10) . .
S8 Au10 S7 Au9 161(2) . .
S10 Au10 S7 Au9 -72(3) . .
Au4 Au10 S7 Au9 40.7(3) 2_666 .
Au1 Au10 S7 Au9 -11.8(3) . .
S10 Au9 S7 C49 -3(3) . .
Au25 Au9 S7 C49 -140.3(10) . .
Au12 Au9 S7 C49 90.4(11) 2_666 .
Au1 Au9 S7 C49 -89.3(13) . .
Au20 Au9 S7 C49 158.2(11) . .
Au17 Au9 S7 C49 -31.0(18) . .
Au4 Au9 S7 C49 -144.4(12) 2_666 .
Au18 Au9 S7 C49 30.8(13) . .
Au19 Au9 S7 C49 98.9(13) . .
Au10 Au9 S7 C49 -102.1(12) . .
S10 Au9 S7 Au10 100(4) . .
Au25 Au9 S7 Au10 -38.3(8) . .
Au12 Au9 S7 Au10 -167.5(2) 2_666 .
Au1 Au9 S7 Au10 12.7(4) . .
Au20 Au9 S7 Au10 -99.7(3) . .
Au17 Au9 S7 Au10 71.1(8) . .
Au4 Au9 S7 Au10 -42.3(3) 2_666 .
Au18 Au9 S7 Au10 132.9(3) . .
Au19 Au9 S7 Au10 -159.0(3) . .
S7 Au10 S8 C57 -35(2) . .
S10 Au10 S8 C57 -120.6(11) . .
Au4 Au10 S8 C57 84.5(3) 2_666 .
Au1 Au10 S8 C57 137.4(3) . .
Au9 Au10 S8 C57 122.4(3) . .
S7 Au10 S8 Au11 -142(2) . .
S10 Au10 S8 Au11 133.3(10) . .
Au4 Au10 S8 Au11 -21.54(7) 2_666 .
Au1 Au10 S8 Au11 31.30(7) . .
Au9 Au10 S8 Au11 16.35(14) . .
S9 Au11 S8 C57 81.1(7) . .
Au1 Au11 S8 C57 -140.2(3) . .
Au12 Au11 S8 C57 -112.8(3) . .
Au4 Au11 S8 C57 -87.8(3) 2_666 .
S9 Au11 S8 Au10 -170.8(6) . .
Au1 Au11 S8 Au10 -32.12(7) . .
Au12 Au11 S8 Au10 -4.65(14) . .
Au4 Au11 S8 Au10 20.28(7) 2_666 .
S8 Au11 S9 C65 -84.8(7) . .
Au1 Au11 S9 C65 136.8(3) . .
Au12 Au11 S9 C65 107.4(3) . .
Au4 Au11 S9 C65 84.0(3) 2_666 .
S8 Au11 S9 Au12 167.8(6) . .
Au1 Au11 S9 Au12 29.45(5) . .
Au4 Au11 S9 Au12 -23.39(5) 2_666 .
Au25 Au12 S9 C65 -120.6(3) . .
Au9 Au12 S9 C65 80.2(3) 2_666 .
Au4 Au12 S9 C65 -79.3(3) 2_666 .
Au20 Au12 S9 C65 161.9(3) 2_666 .
Au17 Au12 S9 C65 -16.4(3) 2_666 .
Au1 Au12 S9 C65 -137.3(3) . .
Au19 Au12 S9 C65 106.9(3) 2_666 .
Au18 Au12 S9 C65 38.3(3) 2_666 .
Au11 Au12 S9 C65 -106.0(3) . .
Au25 Au12 S9 Au11 -14.54(16) . .
Au9 Au12 S9 Au11 -173.73(3) 2_666 .
Au4 Au12 S9 Au11 26.73(6) 2_666 .
Au20 Au12 S9 Au11 -92.06(6) 2_666 .
Au17 Au12 S9 Au11 89.68(7) 2_666 .
Au1 Au12 S9 Au11 -31.24(5) . .
Au19 Au12 S9 Au11 -147.08(5) 2_666 .
Au18 Au12 S9 Au11 144.33(5) 2_666 .
S7 Au9 S10 C73 -168(4) . .
Au25 Au9 S10 C73 -109.3(6) . .
Au12 Au9 S10 C73 86.1(7) 2_666 .
Au1 Au9 S10 C73 -72.2(6) . .
Au20 Au9 S10 C73 170.5(5) . .
Au17 Au9 S10 C73 -11.1(8) . .
Au4 Au9 S10 C73 -129.6(6) 2_666 .
Au18 Au9 S10 C73 44.5(6) . .
Au19 Au9 S10 C73 114.3(6) . .
Au10 Au9 S10 C73 -99.8(7) . .
S7 Au9 S10 Au10 -68(4) . .
Au25 Au9 S10 Au10 -9.6(5) . .
Au12 Au9 S10 Au10 -174.13(9) 2_666 .
Au1 Au9 S10 Au10 27.52(19) . .
Au20 Au9 S10 Au10 -89.7(2) . .
Au17 Au9 S10 Au10 88.7(2) . .
Au4 Au9 S10 Au10 -29.79(19) 2_666 .
Au18 Au9 S10 Au10 144.27(16) . .
Au19 Au9 S10 Au10 -145.91(17) . .
S7 Au10 S10 C73 -156(3) . .
S8 Au10 S10 C73 -18.2(13) . .
Au4 Au10 S10 C73 136.6(4) 2_666 .
Au1 Au10 S10 C73 83.1(4) . .
Au9 Au10 S10 C73 108.0(5) . .
S7 Au10 S10 Au9 96(3) . .
S8 Au10 S10 Au9 -126.2(10) . .
Au4 Au10 S10 Au9 28.59(18) 2_666 .
Au1 Au10 S10 Au9 -24.94(18) . .
S14 Au18 S13 C97 -80.7(7) . .
Au9 Au18 S13 C97 88.7(3) . .
Au12 Au18 S13 C97 141.9(3) 2_666 .
Au17 Au18 S13 C97 107.2(3) . .
S14 Au18 S13 Au17 172.1(6) . .
Au9 Au18 S13 Au17 -18.51(6) . .
Au12 Au18 S13 Au17 34.70(5) 2_666 .
Au25 Au17 S13 C97 -127.1(3) . .
Au20 Au17 S13 C97 74.5(3) 2_666 .
Au4 Au17 S13 C97 156.7(3) . .
Au12 Au17 S13 C97 -143.8(3) 2_666 .
Au9 Au17 S13 C97 -85.9(3) . .
Au1 Au17 S13 C97 -24.8(3) . .
Au2 Au17 S13 C97 30.2(3) . .
Au18 Au17 S13 C97 -105.6(3) . .
Au3 Au17 S13 C97 98.4(3) . .
Au25 Au17 S13 Au18 -21.53(15) . .
Au20 Au17 S13 Au18 -179.92(4) 2_666 .
Au4 Au17 S13 Au18 -97.65(5) . .
Au12 Au17 S13 Au18 -38.17(6) 2_666 .
Au9 Au17 S13 Au18 19.67(6) . .
Au1 Au17 S13 Au18 80.81(8) . .
Au2 Au17 S13 Au18 135.84(5) . .
Au3 Au17 S13 Au18 -155.99(5) . .
S13 Au18 S14 C105 -51.3(7) . .
Au9 Au18 S14 C105 139.1(3) . .
Au12 Au18 S14 C105 86.1(3) 2_666 .
Au17 Au18 S14 C105 119.7(3) . .
S13 Au18 S14 Au19 -155.3(6) . .
Au9 Au18 S14 Au19 35.13(7) . .
Au12 Au18 S14 Au19 -17.92(7) 2_666 .
Au17 Au18 S14 Au19 15.67(14) . .
S15 Au19 S14 C105 76.5(7) . .
Au9 Au19 S14 C105 -139.5(3) . .
Au12 Au19 S14 C105 -86.5(3) 2_666 .
Au20 Au19 S14 C105 -121.9(3) . .
S15 Au19 S14 Au18 -179(30) . .
Au9 Au19 S14 Au18 -34.91(7) . .
Au12 Au19 S14 Au18 18.05(7) 2_666 .
Au20 Au19 S14 Au18 -17.30(13) . .
S14 Au19 S15 C113 -93.3(7) . .
Au9 Au19 S15 C113 123.2(3) . .
Au12 Au19 S15 C113 69.7(3) 2_666 .
Au20 Au19 S15 C113 102.9(3) . .
S14 Au19 S15 Au20 163.8(6) . .
Au9 Au19 S15 Au20 20.34(6) . .
Au12 Au19 S15 Au20 -33.17(6) 2_666 .
Au25 Au20 S15 C113 -87.5(3) . .
Au17 Au20 S15 C113 73.6(3) 2_666 .
Au12 Au20 S15 C113 -69.5(3) 2_666 .
Au1 Au20 S15 C113 -9.4(3) 2_666 .
Au9 Au20 S15 C113 -127.4(3) . .
Au4 Au20 S15 C113 171.1(3) 2_666 .
Au3 Au20 S15 C113 117.1(3) 2_666 .
Au2 Au20 S15 C113 47.4(3) 2_666 .
Au19 Au20 S15 C113 -105.6(3) . .
Au25 Au20 S15 Au19 18.09(17) . .
Au17 Au20 S15 Au19 179.21(4) 2_666 .
Au12 Au20 S15 Au19 36.15(6) 2_666 .
Au1 Au20 S15 Au19 96.17(6) 2_666 .
Au9 Au20 S15 Au19 -21.81(7) . .
Au4 Au20 S15 Au19 -83.32(8) 2_666 .
Au3 Au20 S15 Au19 -137.32(6) 2_666 .
Au2 Au20 S15 Au19 152.98(6) 2_666 .
Au2 S1 C1 C2 -82.4(6) . .
Au1 S1 C1 C2 -176.0(5) . .
S1 C1 C2 C3 64.9(9) . .
C1 C2 C3 C4 80.0(7) . .
C1 C2 C3 C8 -100.0(7) . .
C8 C3 C4 C5 0.0 . .
C2 C3 C4 C5 180.0 . .
C3 C4 C5 C6 0.0 . .
C4 C5 C6 C7 0.0 . .
C5 C6 C7 C8 0.0 . .
C6 C7 C8 C3 0.0 . .
C4 C3 C8 C7 0.0 . .
C2 C3 C8 C7 180.0 . .
Au3 S2 C9 C10 80.5(6) . .
Au2 S2 C9 C10 -175.2(6) . .
S2 C9 C10 C11 -179.6(6) . .
C9 C10 C11 C12 -97.5(7) . .
C9 C10 C11 C16 82.5(7) . .
C16 C11 C12 C13 0.0 . .
C10 C11 C12 C13 180.0 . .
C11 C12 C13 C14 0.0 . .
C12 C13 C14 C15 0.0 . .
C13 C14 C15 C16 0.0 . .
C14 C15 C16 C11 0.0 . .
C12 C11 C16 C15 0.0 . .
C10 C11 C16 C15 180.0 . .
Au3 S3 C17 C18 -74.1(6) . .
Au4 S3 C17 C18 -164.1(6) . .
S3 C17 C18 C19 -179.2(6) . .
C17 C18 C19 C20 110.7(7) . .
C17 C18 C19 C24 -69.3(7) . .
C24 C19 C20 C21 0.0 . .
C18 C19 C20 C21 180.0 . .
C19 C20 C21 C22 0.0 . .
C20 C21 C22 C23 0.0 . .
C21 C22 C23 C24 0.0 . .
C22 C23 C24 C19 0.0 . .
C20 C19 C24 C23 0.0 . .
C18 C19 C24 C23 180.0 . .
Au10 S7 C49 C50 -53(2) . .
Au9 S7 C49 C50 41(3) . .
S7 C49 C50 C51 166(2) . .
C49 C50 C51 C52 -113(2) . .
C49 C50 C51 C56 67(2) . .
C56 C51 C52 C53 0.0 . .
C50 C51 C52 C53 180.0 . .
C51 C52 C53 C54 0.0 . .
C52 C53 C54 C55 0.0 . .
C53 C54 C55 C56 0.0 . .
C54 C55 C56 C51 0.0 . .
C52 C51 C56 C55 0.0 . .
C50 C51 C56 C55 180.0 . .
Au10 S8 C57 C58 66.9(8) . .
Au11 S8 C57 C58 172.4(7) . .
S8 C57 C58 C59 -173.2(7) . .
C57 C58 C59 C60 -106.7(8) . .
C57 C58 C59 C64 73.3(8) . .
C64 C59 C60 C61 0.0 . .
C58 C59 C60 C61 180.0 . .
C59 C60 C61 C62 0.0 . .
C60 C61 C62 C63 0.0 . .
C61 C62 C63 C64 0.0 . .
C62 C63 C64 C59 0.0 . .
C60 C59 C64 C63 0.0 . .
C58 C59 C64 C63 180.0 . .
Au11 S9 C65 C66 94.9(5) . .
Au12 S9 C65 C66 -174.0(5) . .
S9 C65 C66 C67 -74.5(7) . .
C65 C66 C67 C68 98.0(6) . .
C65 C66 C67 C72 -82.0(6) . .
C72 C67 C68 C69 0.0 . .
C66 C67 C68 C69 -180.0 . .
C67 C68 C69 C70 0.0 . .
C68 C69 C70 C71 0.0 . .
C69 C70 C71 C72 0.0 . .
C70 C71 C72 C67 0.0 . .
C68 C67 C72 C71 0.0 . .
C66 C67 C72 C71 180.0 . .
Au9 S10 C73 C74 167.6(8) . .
Au10 S10 C73 C74 76.4(10) . .
S10 C73 C74 C75 -168.9(9) . .
C73 C74 C75 C76 -102.3(11) . .
C73 C74 C75 C80 81.7(12) . .
C80 C75 C76 C77 0.0 . .
C74 C75 C76 C77 -175.9(9) . .
C75 C76 C77 C78 0.0 . .
C76 C77 C78 C79 0.0 . .
C77 C78 C79 C80 0.0 . .
C78 C79 C80 C75 0.0 . .
C76 C75 C80 C79 0.0 . .
C74 C75 C80 C79 176.0(9) . .
Au18 S13 C97 C98 81.4(6) . .
Au17 S13 C97 C98 172.7(5) . .
S13 C97 C98 C99 153.8(6) . .
C97 C98 C99 C100 -109.3(7) . .
C97 C98 C99 C104 70.7(7) . .
C104 C99 C100 C101 0.0 . .
C98 C99 C100 C101 180.0 . .
C99 C100 C101 C102 0.0 . .
C100 C101 C102 C103 0.0 . .
C101 C102 C103 C104 0.0 . .
C102 C103 C104 C99 0.0 . .
C100 C99 C104 C103 0.0 . .
C98 C99 C104 C103 180.0 . .
Au18 S14 C105 C106 -179.4(6) . .
Au19 S14 C105 C106 -75.6(7) . .
S14 C105 C106 C107 168.2(6) . .
C105 C106 C107 C108 -98.6(7) . .
C105 C106 C107 C112 81.4(7) . .
C112 C107 C108 C109 0.0 . .
C106 C107 C108 C109 180.0 . .
C107 C108 C109 C110 0.0 . .
C108 C109 C110 C111 0.0 . .
C109 C110 C111 C112 0.0 . .
C110 C111 C112 C107 0.0 . .
C108 C107 C112 C111 0.0 . .
C106 C107 C112 C111 -180.0 . .
Au19 S15 C113 C114 56.0(7) . .
Au20 S15 C113 C114 146.1(6) . .
S15 C113 C114 C115 170.0(6) . .
C113 C114 C115 C116 -106.0(7) . .
C113 C114 C115 C120 73.9(7) . .
C120 C115 C116 C117 0.0 . .
C114 C115 C116 C117 180.0 . .
C115 C116 C117 C118 0.0 . .
C116 C117 C118 C119 0.0 . .
C117 C118 C119 C120 0.0 . .
C118 C119 C120 C115 0.0 . .
C116 C115 C120 C119 0.0 . .
C114 C115 C120 C119 -180.0 . .
C161 N1 C145 C146 -71.8(18) . .
C169 N1 C145 C146 50.5(18) . .
C153 N1 C145 C146 169.4(17) . .
N1 C145 C146 C147 169.0(15) . .
C145 C146 C147 C148 -177.9(17) . .
C146 C147 C148 C149 -72(3) . .
C147 C148 C149 C150 175(3) . .
C148 C149 C150 C151 171(3) . .
C149 C150 C151 C152 177(3) . .
C145 N1 C153 C154 -176.4(17) . .
C161 N1 C153 C154 64(2) . .
C169 N1 C153 C154 -56.3(19) . .
N1 C153 C154 C155 -159(2) . .
C153 C154 C155 C156 178(2) . .
C154 C155 C156 C157 -166(2) . .
C155 C156 C157 C158 72(4) . .
C156 C157 C158 C159 172(4) . .
C157 C158 C159 C160 166(4) . .
C145 N1 C161 C162 -54.5(17) . .
C169 N1 C161 C162 -176.2(15) . .
C153 N1 C161 C162 65.7(18) . .
N1 C161 C162 C163 -95(2) . .
C161 C162 C163 C164 -171(2) . .
C162 C163 C164 C165 -159(3) . .
C163 C164 C165 C166 -167(4) . .
C164 C165 C166 C167 178(4) . .
C165 C166 C167 C168 150(5) . .
C145 N1 C169 C170 66(2) . .
C161 N1 C169 C170 -172.4(18) . .
C153 N1 C169 C170 -54(2) . .
N1 C169 C170 C171 -167.9(17) . .
C169 C170 C171 C172 69(4) . .
C170 C171 C172 C173 175(3) . .
C171 C172 C173 C174 160(3) . .
C172 C173 C174 C175 -179(3) . .
C173 C174 C175 C176 79(4) . .
