# Electronic Supplementary Material (ESI) for Nanoscale.
# This journal is © The Royal Society of Chemistry 2017

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
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# Crystallographic Data Centre (CCDC).
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# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
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data_160512_zsl6_0ma
_database_code_depnum_ccdc_archive 'CCDC 1523232'
_audit_update_record             
;
2016-12-17 deposited with the CCDC.
2017-01-20 downloaded from the CCDC.
;
_audit_creation_date             2016-07-21
_audit_creation_method           
;
Olex2 1.2
(compiled 2016.02.16 svn.r3265 for OlexSys, GUI svn.r5155)
;
_chemical_name_common            ?
_chemical_name_systematic        Au34(SC6H11)22
_chemical_formula_moiety         'C132 H242 Au34 S22'
_chemical_formula_sum            'C132 H242 Au34 S22'
_chemical_formula_weight         9231.42
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -4.4197 7.2980 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           60
_space_group_name_H-M_alt        'P b c n'
_space_group_name_Hall           '-P 2n 2ab'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y+1/2, z+1/2'
'-x, y, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y-1/2, -z-1/2'
'x, -y, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   26.0266(7)
_cell_length_b                   27.9405(8)
_cell_length_c                   28.5247(8)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     20743.1(10)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9710
_cell_measurement_temperature    173
_cell_measurement_theta_max      68.33
_cell_measurement_theta_min      3.52
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    46.203
_exptl_absorpt_correction_T_max  0.1665
_exptl_absorpt_correction_T_min  0.0382
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014) was used for absorption correction.
wR2(int) was 0.1411 before and 0.1031 after correction.
The Ratio of minimum to maximum transmission is 0.2294.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    2.956
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             16288
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0870
_diffrn_reflns_av_unetI/netI     0.0371
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_k_max       33
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_limit_l_min       -34
_diffrn_reflns_number            188505
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         68.384
_diffrn_reflns_theta_min         2.320
_diffrn_ambient_temperature      172.99
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                17030
_reflns_number_total             19001
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         4.583
_refine_diff_density_min         -4.317
_refine_diff_density_rms         0.391
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     849
_refine_ls_number_reflns         19001
_refine_ls_number_restraints     396
_refine_ls_R_factor_all          0.0537
_refine_ls_R_factor_gt           0.0494
_refine_ls_restrained_S_all      1.044
_refine_ls_shift/su_max          0.010
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0858P)²+362.2514P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1314
_refine_ls_wR_factor_ref         0.1353
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(C7) \\sim Ueq, Uanis(C60) \\sim Ueq, Uanis(C65) \\sim Ueq, Uanis(C55)
\\sim Ueq, Uanis(C50) \\sim Ueq, Uanis(C54) \\sim Ueq, Uanis(C66) \\sim Ueq,
Uanis(C42) \\sim Ueq, Uanis(C37) \\sim Ueq, Uanis(C1) \\sim Ueq, Uanis(C13)
\\sim Ueq, Uanis(C20) \\sim Ueq, Uanis(C19) \\sim Ueq, Uanis(C62) \\sim Ueq,
Uanis(C31) \\sim Ueq, Uanis(C49) \\sim Ueq, Uanis(C32) \\sim Ueq, Uanis(C41)
\\sim Ueq, Uanis(C14) \\sim Ueq, Uanis(C18) \\sim Ueq, Uanis(C24) \\sim Ueq,
Uanis(C56) \\sim Ueq, Uanis(C40) \\sim Ueq, Uanis(C6) \\sim Ueq, Uanis(C36)
\\sim Ueq, Uanis(C2) \\sim Ueq, Uanis(C25) \\sim Ueq, Uanis(C43) \\sim Ueq,
Uanis(C59) \\sim Ueq, Uanis(C57) \\sim Ueq, Uanis(C38) \\sim Ueq, Uanis(C17)
\\sim Ueq, Uanis(C34) \\sim Ueq, Uanis(C53) \\sim Ueq, Uanis(C58) \\sim Ueq,
Uanis(C44) \\sim Ueq, Uanis(C23) \\sim Ueq, Uanis(C21) \\sim Ueq, Uanis(C5)
\\sim Ueq, Uanis(C35) \\sim Ueq, Uanis(C10) \\sim Ueq, Uanis(C3) \\sim Ueq,
Uanis(C16) \\sim Ueq, Uanis(C4) \\sim Ueq, Uanis(C52) \\sim Ueq, Uanis(C22)
\\sim Ueq, Uanis(C51) \\sim Ueq, Uanis(C48) \\sim Ueq, Uanis(C39) \\sim Ueq,
Uanis(C15) \\sim Ueq, Uanis(C8) \\sim Ueq, Uanis(C30) \\sim Ueq, Uanis(C26)
\\sim Ueq, Uanis(C11) \\sim Ueq, Uanis(C12) \\sim Ueq, Uanis(C9) \\sim Ueq,
Uanis(C45) \\sim Ueq, Uanis(C27) \\sim Ueq, Uanis(C61) \\sim Ueq, Uanis(C33)
\\sim Ueq, Uanis(C64) \\sim Ueq, Uanis(C63) \\sim Ueq, Uanis(C47) \\sim Ueq,
Uanis(C46) \\sim Ueq, Uanis(C28) \\sim Ueq, Uanis(C29) \\sim Ueq: with sigma of
0.005 and sigma for terminal atoms of 0.01
3.a Ternary CH refined with riding coordinates:
 C1(H1), C7(H7), C13(H13), C19(H19), C25(H25), C31(H31), C37(H37), C43(H43),
 C49(H49), C55(H55), C61(H61)
3.b Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B), C3(H3A,H3B), C4(H4A,H4B), C5(H5A,H5B), C6(H6A,H6B), C8(H8A,H8B),
 C9(H9A,H9B), C10(H10A,H10B), C11(H11A,H11B), C12(H12A,H12B), C14(H14A,H14B),
 C15(H15A,H15B), C16(H16A,H16B), C17(H17A,H17B), C18(H18A,H18B), C20(H20A,H20B),
  C21(H21A,H21B), C22(H22A,H22B), C23(H23A,H23B), C24(H24A,H24B), C26(H26A,
 H26B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B), C30(H30A,H30B),
 C32(H32A,H32B), C33(H33A,H33B), C34(H34A,H34B), C35(H35A,H35B), C36(H36A,H36B),
  C38(H38A,H38B), C39(H39A,H39B), C40(H40A,H40B), C41(H41A,H41B), C42(H42A,
 H42B), C44(H44A,H44B), C45(H45A,H45B), C46(H46A,H46B), C47(H47A,H47B),
 C48(H48A,H48B), C50(H50A,H50B), C51(H51A,H51B), C52(H52A,H52B), C53(H53A,H53B),
  C54(H54A,H54B), C56(H56A,H56B), C57(H57A,H57B), C58(H58A,H58B), C59(H59A,
 H59B), C60(H60A,H60B), C62(H62A,H62B), C63(H63A,H63B), C64(H64A,H64B),
 C65(H65A,H65B), C66(H66A,H66B)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.57955(2) 0.75198(2) 0.29493(2) 0.01890(10) Uani 1 1 d . . . . .
Au2 Au 0.5000 0.80494(2) 0.2500 0.01840(13) Uani 1 2 d S T P . .
Au3 Au 0.5000 0.69761(2) 0.2500 0.01601(13) Uani 1 2 d S T P . .
Au4 Au 0.59535(2) 0.65087(2) 0.30435(2) 0.02056(11) Uani 1 1 d . . . . .
Au5 Au 0.59552(2) 0.69415(2) 0.20977(2) 0.02114(11) Uani 1 1 d . . . . .
Au6 Au 0.60092(2) 0.81131(2) 0.22317(2) 0.02242(11) Uani 1 1 d . . . . .
Au7 Au 0.56433(2) 0.84937(2) 0.30747(2) 0.02379(11) Uani 1 1 d . . . . .
Au8 Au 0.5000 0.92660(3) 0.2500 0.03091(16) Uani 1 2 d S T P . .
Au9 Au 0.45528(2) 0.86902(2) 0.34271(2) 0.02558(11) Uani 1 1 d . . . . .
Au10 Au 0.47684(2) 0.74896(2) 0.33388(2) 0.02024(11) Uani 1 1 d . . . . .
Au11 Au 0.48757(2) 0.65128(2) 0.33425(2) 0.02044(11) Uani 1 1 d . . . . .
Au12 Au 0.5000 0.58741(2) 0.2500 0.02135(14) Uani 1 2 d S T P . .
Au13 Au 0.57877(2) 0.60816(2) 0.40353(2) 0.02661(12) Uani 1 1 d . . . . .
Au14 Au 0.58017(2) 0.70867(2) 0.37968(2) 0.02295(11) Uani 1 1 d . . . . .
Au15 Au 0.66946(2) 0.71341(2) 0.32626(2) 0.02472(11) Uani 1 1 d . . . . .
Au16 Au 0.71874(2) 0.65030(2) 0.24955(2) 0.03386(13) Uani 1 1 d . . . . .
Au17 Au 0.71445(2) 0.78739(2) 0.25721(2) 0.02675(12) Uani 1 1 d . . . . .
Au18 Au 0.70745(2) 0.62012(2) 0.36168(2) 0.03474(13) Uani 1 1 d . . . . .
Au19 Au 0.59429(2) 0.81230(2) 0.40963(2) 0.02734(12) Uani 1 1 d . . . . .
S1 S 0.43018(12) 0.93371(11) 0.29797(12) 0.0317(6) Uani 1 1 d . . . . .
S2 S 0.46633(11) 0.80647(10) 0.39407(10) 0.0248(6) Uani 1 1 d . . . . .
S3 S 0.56388(12) 0.74778(10) 0.45234(10) 0.0279(6) Uani 1 1 d . . . . .
S4 S 0.62009(11) 0.87721(10) 0.36555(11) 0.0288(6) Uani 1 1 d . . . . .
S5 S 0.49661(12) 0.58487(11) 0.38511(11) 0.0308(6) Uani 1 1 d . . . . .
S6 S 0.66006(12) 0.62759(11) 0.42902(11) 0.0312(6) Uani 1 1 d . . . . .
S7 S 0.58760(11) 0.57907(9) 0.26020(10) 0.0226(5) Uani 1 1 d . . . . .
S8 S 0.76452(16) 0.60555(15) 0.30218(14) 0.0465(8) Uani 1 1 d . . . . .
S9 S 0.68212(11) 0.69189(11) 0.18870(12) 0.0297(6) Uani 1 1 d . . . . .
S10 S 0.68296(11) 0.81777(11) 0.18749(10) 0.0263(6) Uani 1 1 d . . . . .
S11 S 0.74846(11) 0.75433(10) 0.32443(11) 0.0271(6) Uani 1 1 d . . . . .
C1 C 0.4408(6) 0.9875(5) 0.3350(5) 0.037(3) Uani 1 1 d . U . . .
H1 H 0.4754 0.9860 0.3501 0.045 Uiso 1 1 calc R . . . .
C2 C 0.4370(7) 1.0328(6) 0.3017(6) 0.049(4) Uani 1 1 d . U . . .
H2A H 0.4651 1.0321 0.2782 0.058 Uiso 1 1 calc R . . . .
H2B H 0.4038 1.0328 0.2848 0.058 Uiso 1 1 calc R . . . .
C3 C 0.4415(8) 1.0768(7) 0.3318(7) 0.062(5) Uani 1 1 d . U . . .
H3A H 0.4385 1.1055 0.3117 0.075 Uiso 1 1 calc R . . . .
H3B H 0.4758 1.0773 0.3467 0.075 Uiso 1 1 calc R . . . .
C4 C 0.4006(8) 1.0787(7) 0.3696(7) 0.063(5) Uani 1 1 d . U . . .
H4A H 0.4056 1.1080 0.3887 0.076 Uiso 1 1 calc R . . . .
H4B H 0.3663 1.0806 0.3547 0.076 Uiso 1 1 calc R . . . .
C5 C 0.4026(9) 1.0359(8) 0.4008(8) 0.070(5) Uani 1 1 d . U . . .
H5A H 0.3736 1.0369 0.4232 0.084 Uiso 1 1 calc R . . . .
H5B H 0.4350 1.0362 0.4190 0.084 Uiso 1 1 calc R . . . .
C6 C 0.3996(7) 0.9899(6) 0.3717(6) 0.049(4) Uani 1 1 d . U . . .
H6A H 0.4029 0.9620 0.3929 0.058 Uiso 1 1 calc R . . . .
H6B H 0.3656 0.9882 0.3564 0.058 Uiso 1 1 calc R . . . .
C7 C 0.4003(6) 0.7998(5) 0.4170(5) 0.038(3) Uani 1 1 d . U . . .
H7 H 0.3760 0.8057 0.3905 0.046 Uiso 1 1 calc R . . . .
C8 C 0.3902(9) 0.8375(8) 0.4543(8) 0.075(6) Uani 1 1 d . U . . .
H8A H 0.4158 0.8340 0.4797 0.090 Uiso 1 1 calc R . . . .
H8B H 0.3945 0.8697 0.4403 0.090 Uiso 1 1 calc R . . . .
C9 C 0.3384(10) 0.8337(10) 0.4743(10) 0.088(7) Uani 1 1 d . U . . .
H9A H 0.3361 0.8564 0.5009 0.106 Uiso 1 1 calc R . . . .
H9B H 0.3135 0.8446 0.4502 0.106 Uiso 1 1 calc R . . . .
C10 C 0.3223(9) 0.7882(8) 0.4903(8) 0.071(5) Uani 1 1 d . U . . .
H10A H 0.2849 0.7888 0.4964 0.085 Uiso 1 1 calc R . . . .
H10B H 0.3400 0.7808 0.5202 0.085 Uiso 1 1 calc R . . . .
C11 C 0.3340(10) 0.7510(9) 0.4558(9) 0.086(7) Uani 1 1 d . U . . .
H11A H 0.3093 0.7535 0.4296 0.103 Uiso 1 1 calc R . . . .
H11B H 0.3293 0.7193 0.4706 0.103 Uiso 1 1 calc R . . . .
C12 C 0.3889(11) 0.7541(9) 0.4361(10) 0.089(7) Uani 1 1 d . U . . .
H12A H 0.4137 0.7469 0.4614 0.107 Uiso 1 1 calc R . . . .
H12B H 0.3931 0.7296 0.4113 0.107 Uiso 1 1 calc R . . . .
C13 C 0.6147(5) 0.7302(5) 0.4942(5) 0.033(3) Uani 1 1 d . U . . .
H13 H 0.6463 0.7220 0.4760 0.040 Uiso 1 1 calc R . . . .
C14 C 0.6275(6) 0.7713(5) 0.5270(5) 0.041(3) Uani 1 1 d . U . . .
H14A H 0.5966 0.7807 0.5450 0.049 Uiso 1 1 calc R . . . .
H14B H 0.6394 0.7993 0.5087 0.049 Uiso 1 1 calc R . . . .
C15 C 0.6702(9) 0.7546(8) 0.5606(8) 0.075(6) Uani 1 1 d . U . . .
H15A H 0.7014 0.7467 0.5423 0.090 Uiso 1 1 calc R . . . .
H15B H 0.6788 0.7808 0.5825 0.090 Uiso 1 1 calc R . . . .
C16 C 0.6537(8) 0.7113(7) 0.5882(7) 0.062(5) Uani 1 1 d . U . . .
H16A H 0.6236 0.7196 0.6078 0.074 Uiso 1 1 calc R . . . .
H16B H 0.6820 0.7012 0.6092 0.074 Uiso 1 1 calc R . . . .
C17 C 0.6400(8) 0.6707(7) 0.5562(7) 0.060(4) Uani 1 1 d . U . . .
H17A H 0.6276 0.6433 0.5750 0.072 Uiso 1 1 calc R . . . .
H17B H 0.6710 0.6603 0.5388 0.072 Uiso 1 1 calc R . . . .
C18 C 0.5975(6) 0.6859(5) 0.5207(5) 0.040(3) Uani 1 1 d . U . . .
H18A H 0.5910 0.6596 0.4983 0.049 Uiso 1 1 calc R . . . .
H18B H 0.5652 0.6927 0.5377 0.049 Uiso 1 1 calc R . . . .
C19 C 0.5939(6) 0.9303(5) 0.3940(5) 0.039(3) Uani 1 1 d . U . . .
H19 H 0.5576 0.9246 0.4037 0.047 Uiso 1 1 calc R . . . .
C20 C 0.5969(7) 0.9734(6) 0.3591(6) 0.054(4) Uani 1 1 d . U . . .
H20A H 0.6326 0.9772 0.3476 0.065 Uiso 1 1 calc R . . . .
H20B H 0.5743 0.9673 0.3318 0.065 Uiso 1 1 calc R . . . .
C21 C 0.5800(8) 1.0180(8) 0.3840(8) 0.068(5) Uani 1 1 d . U . . .
H21A H 0.5443 1.0140 0.3951 0.082 Uiso 1 1 calc R . . . .
H21B H 0.5807 1.0452 0.3618 0.082 Uiso 1 1 calc R . . . .
C22 C 0.6156(8) 1.0292(7) 0.4265(7) 0.061(4) Uani 1 1 d . U . . .
H22A H 0.6516 1.0331 0.4159 0.073 Uiso 1 1 calc R . . . .
H22B H 0.6046 1.0593 0.4419 0.073 Uiso 1 1 calc R . . . .
C23 C 0.6119(7) 0.9880(6) 0.4608(6) 0.054(4) Uani 1 1 d . U . . .
H23A H 0.6345 0.9942 0.4881 0.064 Uiso 1 1 calc R . . . .
H23B H 0.5761 0.9853 0.4724 0.064 Uiso 1 1 calc R . . . .
C24 C 0.6277(6) 0.9409(5) 0.4374(5) 0.038(3) Uani 1 1 d . U . . .
H24A H 0.6243 0.9144 0.4602 0.045 Uiso 1 1 calc R . . . .
H24B H 0.6642 0.9428 0.4278 0.045 Uiso 1 1 calc R . . . .
C25 C 0.4600(6) 0.5938(6) 0.4399(5) 0.045(3) Uani 1 1 d . U . . .
H25 H 0.4235 0.5846 0.4335 0.053 Uiso 1 1 calc R . . . .
C26 C 0.4600(9) 0.6431(8) 0.4568(7) 0.069(5) Uani 1 1 d . U . . .
H26A H 0.4460 0.6647 0.4324 0.082 Uiso 1 1 calc R . . . .
H26B H 0.4955 0.6533 0.4641 0.082 Uiso 1 1 calc R . . . .
C27 C 0.4266(12) 0.6456(11) 0.5011(11) 0.105(9) Uani 1 1 d . U . . .
H27A H 0.4269 0.6788 0.5134 0.126 Uiso 1 1 calc R . . . .
H27B H 0.3907 0.6374 0.4930 0.126 Uiso 1 1 calc R . . . .
C28 C 0.4460(9) 0.6114(8) 0.5391(8) 0.074(6) Uani 1 1 d . U . . .
H28A H 0.4805 0.6216 0.5498 0.089 Uiso 1 1 calc R . . . .
H28B H 0.4225 0.6124 0.5664 0.089 Uiso 1 1 calc R . . . .
C29 C 0.4485(10) 0.5649(9) 0.5215(8) 0.081(6) Uani 1 1 d . U . . .
H29A H 0.4132 0.5538 0.5143 0.097 Uiso 1 1 calc R . . . .
H29B H 0.4626 0.5435 0.5460 0.097 Uiso 1 1 calc R . . . .
C30 C 0.4806(8) 0.5604(7) 0.4785(7) 0.063(5) Uani 1 1 d . U . . .
H30A H 0.4799 0.5269 0.4673 0.075 Uiso 1 1 calc R . . . .
H30B H 0.5166 0.5689 0.4858 0.075 Uiso 1 1 calc R . . . .
C31 C 0.6810(5) 0.5768(5) 0.4660(5) 0.035(3) Uani 1 1 d . U . . .
H31 H 0.6618 0.5788 0.4963 0.042 Uiso 1 1 calc R . . . .
C32 C 0.6701(6) 0.5283(5) 0.4447(5) 0.039(3) Uani 1 1 d . U . . .
H32A H 0.6325 0.5239 0.4416 0.047 Uiso 1 1 calc R . . . .
H32B H 0.6853 0.5267 0.4129 0.047 Uiso 1 1 calc R . . . .
C33 C 0.6921(7) 0.4886(6) 0.4746(6) 0.052(4) Uani 1 1 d . U . . .
H33A H 0.6869 0.4576 0.4586 0.062 Uiso 1 1 calc R . . . .
H33B H 0.6735 0.4876 0.5049 0.062 Uiso 1 1 calc R . . . .
C34 C 0.7491(7) 0.4959(6) 0.4839(7) 0.054(4) Uani 1 1 d . U . . .
H34A H 0.7622 0.4694 0.5037 0.065 Uiso 1 1 calc R . . . .
H34B H 0.7681 0.4954 0.4538 0.065 Uiso 1 1 calc R . . . .
C35 C 0.7580(7) 0.5429(6) 0.5083(6) 0.052(4) Uani 1 1 d . U . . .
H35A H 0.7951 0.5471 0.5147 0.063 Uiso 1 1 calc R . . . .
H35B H 0.7395 0.5432 0.5386 0.063 Uiso 1 1 calc R . . . .
C36 C 0.7385(6) 0.5838(5) 0.4770(6) 0.044(3) Uani 1 1 d . U . . .
H36A H 0.7584 0.5845 0.4475 0.053 Uiso 1 1 calc R . . . .
H36B H 0.7436 0.6148 0.4932 0.053 Uiso 1 1 calc R . . . .
C37 C 0.5957(5) 0.5278(5) 0.3009(5) 0.033(3) Uani 1 1 d . U . . .
H37 H 0.5935 0.5398 0.3338 0.040 Uiso 1 1 calc R . . . .
C38 C 0.5574(8) 0.4903(7) 0.2943(7) 0.061(5) Uani 1 1 d . U . . .
H38A H 0.5570 0.4806 0.2610 0.073 Uiso 1 1 calc R . . . .
H38B H 0.5230 0.5033 0.3020 0.073 Uiso 1 1 calc R . . . .
C39 C 0.5673(9) 0.4467(8) 0.3244(8) 0.070(5) Uani 1 1 d . U . . .
H39A H 0.5647 0.4557 0.3578 0.084 Uiso 1 1 calc R . . . .
H39B H 0.5407 0.4223 0.3179 0.084 Uiso 1 1 calc R . . . .
C40 C 0.6189(7) 0.4258(6) 0.3154(6) 0.052(4) Uani 1 1 d . U . . .
H40A H 0.6203 0.4127 0.2831 0.063 Uiso 1 1 calc R . . . .
H40B H 0.6254 0.3992 0.3376 0.063 Uiso 1 1 calc R . . . .
C41 C 0.6592(7) 0.4634(7) 0.3213(7) 0.055(4) Uani 1 1 d . U . . .
H41A H 0.6930 0.4497 0.3126 0.066 Uiso 1 1 calc R . . . .
H41B H 0.6609 0.4726 0.3547 0.066 Uiso 1 1 calc R . . . .
C42 C 0.6502(6) 0.5079(6) 0.2923(6) 0.050(4) Uani 1 1 d . U . . .
H42A H 0.6544 0.5002 0.2586 0.060 Uiso 1 1 calc R . . . .
H42B H 0.6760 0.5325 0.3006 0.060 Uiso 1 1 calc R . . . .
C43 C 0.8216(6) 0.6436(6) 0.3140(5) 0.045(3) Uani 1 1 d . U . . .
H43 H 0.8139 0.6768 0.3029 0.054 Uiso 1 1 calc R . . . .
C44 C 0.8674(8) 0.6241(8) 0.2849(7) 0.068(5) Uani 1 1 d . U . . .
H44A H 0.8730 0.5899 0.2925 0.081 Uiso 1 1 calc R . . . .
H44B H 0.8593 0.6265 0.2510 0.081 Uiso 1 1 calc R . . . .
C45 C 0.9137(11) 0.6512(10) 0.2951(9) 0.089(7) Uani 1 1 d . U . . .
H45A H 0.9100 0.6833 0.2807 0.106 Uiso 1 1 calc R . . . .
H45B H 0.9428 0.6351 0.2792 0.106 Uiso 1 1 calc R . . . .
C46 C 0.9275(10) 0.6577(10) 0.3443(9) 0.084(7) Uani 1 1 d . U . . .
H46A H 0.9576 0.6793 0.3462 0.101 Uiso 1 1 calc R . . . .
H46B H 0.9378 0.6264 0.3576 0.101 Uiso 1 1 calc R . . . .
C47 C 0.8838(9) 0.6786(9) 0.3742(8) 0.076(6) Uani 1 1 d . U . . .
H47A H 0.8763 0.7120 0.3648 0.091 Uiso 1 1 calc R . . . .
H47B H 0.8931 0.6782 0.4079 0.091 Uiso 1 1 calc R . . . .
C48 C 0.8371(9) 0.6462(8) 0.3650(8) 0.069(5) Uani 1 1 d . U . . .
H48A H 0.8451 0.6135 0.3762 0.083 Uiso 1 1 calc R . . . .
H48B H 0.8076 0.6582 0.3835 0.083 Uiso 1 1 calc R . . . .
C49 C 0.6899(6) 0.6491(5) 0.1397(5) 0.036(3) Uani 1 1 d . U . . .
H49 H 0.6706 0.6618 0.1120 0.043 Uiso 1 1 calc R . . . .
C50 C 0.6710(6) 0.5988(6) 0.1494(6) 0.047(4) Uani 1 1 d . U . . .
H50A H 0.6865 0.5871 0.1790 0.056 Uiso 1 1 calc R . . . .
H50B H 0.6332 0.5993 0.1534 0.056 Uiso 1 1 calc R . . . .
C51 C 0.6849(8) 0.5656(7) 0.1102(7) 0.063(5) Uani 1 1 d . U . . .
H51A H 0.6665 0.5754 0.0814 0.075 Uiso 1 1 calc R . . . .
H51B H 0.6741 0.5327 0.1183 0.075 Uiso 1 1 calc R . . . .
C52 C 0.7418(8) 0.5666(7) 0.1015(7) 0.064(5) Uani 1 1 d . U . . .
H52A H 0.7600 0.5568 0.1304 0.077 Uiso 1 1 calc R . . . .
H52B H 0.7503 0.5431 0.0767 0.077 Uiso 1 1 calc R . . . .
C53 C 0.7595(8) 0.6139(7) 0.0872(7) 0.065(5) Uani 1 1 d . U . . .
H53A H 0.7415 0.6240 0.0583 0.078 Uiso 1 1 calc R . . . .
H53B H 0.7969 0.6130 0.0807 0.078 Uiso 1 1 calc R . . . .
C54 C 0.7480(6) 0.6500(6) 0.1278(6) 0.047(4) Uani 1 1 d . U . . .
H54A H 0.7683 0.6412 0.1560 0.057 Uiso 1 1 calc R . . . .
H54B H 0.7582 0.6827 0.1182 0.057 Uiso 1 1 calc R . . . .
C55 C 0.7002(5) 0.8818(5) 0.1864(4) 0.030(3) Uani 1 1 d . U . . .
H55 H 0.6719 0.8988 0.1695 0.036 Uiso 1 1 calc R . . . .
C56 C 0.7484(6) 0.8880(5) 0.1569(5) 0.041(3) Uani 1 1 d . U . . .
H56A H 0.7429 0.8739 0.1255 0.049 Uiso 1 1 calc R . . . .
H56B H 0.7775 0.8712 0.1719 0.049 Uiso 1 1 calc R . . . .
C57 C 0.7610(7) 0.9410(7) 0.1521(7) 0.056(4) Uani 1 1 d . U . . .
H57A H 0.7330 0.9575 0.1349 0.068 Uiso 1 1 calc R . . . .
H57B H 0.7931 0.9450 0.1340 0.068 Uiso 1 1 calc R . . . .
C58 C 0.7674(7) 0.9637(6) 0.2012(6) 0.053(4) Uani 1 1 d . U . . .
H58A H 0.7762 0.9979 0.1977 0.064 Uiso 1 1 calc R . . . .
H58B H 0.7960 0.9477 0.2178 0.064 Uiso 1 1 calc R . . . .
C59 C 0.7177(7) 0.9590(6) 0.2308(7) 0.055(4) Uani 1 1 d . U . . .
H59A H 0.6892 0.9765 0.2155 0.066 Uiso 1 1 calc R . . . .
H59B H 0.7231 0.9727 0.2624 0.066 Uiso 1 1 calc R . . . .
C60 C 0.7048(6) 0.9049(5) 0.2344(5) 0.041(3) Uani 1 1 d . U . . .
H60A H 0.7320 0.8885 0.2526 0.049 Uiso 1 1 calc R . . . .
H60B H 0.6719 0.9009 0.2515 0.049 Uiso 1 1 calc R . . . .
C61 C 0.7416(5) 0.8022(4) 0.3688(4) 0.026(2) Uani 1 1 d . U . . .
H61 H 0.7084 0.8195 0.3641 0.032 Uiso 1 1 calc R . . . .
C62 C 0.7858(6) 0.8365(6) 0.3636(6) 0.047(4) Uani 1 1 d . U . . .
H62A H 0.7851 0.8512 0.3320 0.056 Uiso 1 1 calc R . . . .
H62B H 0.8188 0.8192 0.3672 0.056 Uiso 1 1 calc R . . . .
C63 C 0.7810(8) 0.8756(7) 0.4016(6) 0.057(4) Uani 1 1 d . U . . .
H63A H 0.7478 0.8925 0.3982 0.068 Uiso 1 1 calc R . . . .
H63B H 0.8090 0.8992 0.3980 0.068 Uiso 1 1 calc R . . . .
C64 C 0.7843(7) 0.8516(7) 0.4510(6) 0.056(4) Uani 1 1 d . U . . .
H64A H 0.8175 0.8346 0.4544 0.067 Uiso 1 1 calc R . . . .
H64B H 0.7821 0.8764 0.4758 0.067 Uiso 1 1 calc R . . . .
C65 C 0.7417(6) 0.8177(6) 0.4559(5) 0.044(3) Uani 1 1 d . U . . .
H65A H 0.7088 0.8354 0.4540 0.053 Uiso 1 1 calc R . . . .
H65B H 0.7436 0.8025 0.4872 0.053 Uiso 1 1 calc R . . . .
C66 C 0.7423(6) 0.7781(5) 0.4177(5) 0.038(3) Uani 1 1 d . U . . .
H66A H 0.7735 0.7581 0.4211 0.046 Uiso 1 1 calc R . . . .
H66B H 0.7118 0.7571 0.4213 0.046 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Au1 Au2 2.8492(5) . ?
Au1 Au3 2.8698(5) . ?
Au1 Au4 2.8675(6) . ?
Au1 Au5 2.9468(6) . ?
Au1 Au6 2.6921(6) . ?
Au1 Au7 2.7729(6) . ?
Au1 Au10 2.8961(6) . ?
Au1 Au14 2.7036(6) . ?
Au1 Au15 2.7270(6) . ?
Au2 Au1 2.8492(5) 3_655 ?
Au2 Au3 2.9986(9) . ?
Au2 Au6 2.7416(5) . ?
Au2 Au6 2.7416(5) 3_655 ?
Au2 Au7 2.6519(5) . ?
Au2 Au7 2.6519(5) 3_655 ?
Au2 Au10 2.9214(6) . ?
Au2 Au10 2.9213(6) 3_655 ?
Au3 Au1 2.8699(5) 3_655 ?
Au3 Au4 3.2044(5) 3_655 ?
Au3 Au4 3.2043(5) . ?
Au3 Au5 2.7398(4) . ?
Au3 Au5 2.7398(4) 3_655 ?
Au3 Au10 2.8544(5) . ?
Au3 Au10 2.8543(5) 3_655 ?
Au3 Au11 2.7489(5) 3_655 ?
Au3 Au11 2.7489(5) . ?
Au3 Au12 3.0792(8) . ?
Au4 Au5 2.9565(7) . ?
Au4 Au11 2.9319(7) . ?
Au4 Au13 3.1005(7) . ?
Au4 Au14 2.7169(6) . ?
Au4 Au15 2.6769(6) . ?
Au4 S7 2.377(3) . ?
Au5 Au6 3.2989(7) . ?
Au5 Au10 2.7282(6) 3_655 ?
Au5 Au11 2.7727(6) 3_655 ?
Au5 S9 2.334(3) . ?
Au6 Au7 2.7964(7) . ?
Au6 Au9 2.8758(7) 3_655 ?
Au6 Au10 3.1273(7) 3_655 ?
Au6 Au17 3.1811(7) . ?
Au6 S10 2.372(3) . ?
Au7 Au8 3.1856(7) . ?
Au7 Au9 3.0607(7) . ?
Au7 Au19 3.1893(7) . ?
Au7 S4 2.336(3) . ?
Au8 Au7 3.1856(7) 3_655 ?
Au8 Au9 3.3070(6) . ?
Au8 Au9 3.3071(6) 3_655 ?
Au8 S1 2.283(3) 3_655 ?
Au8 S1 2.283(3) . ?
Au9 Au6 2.8759(7) 3_655 ?
Au9 S1 2.307(3) . ?
Au9 S2 2.299(3) . ?
Au10 Au5 2.7282(6) 3_655 ?
Au10 Au6 3.1273(7) 3_655 ?
Au10 Au11 2.7437(6) . ?
Au10 Au14 3.1947(7) . ?
Au10 S2 2.367(3) . ?
Au11 Au5 2.7728(6) 3_655 ?
Au11 Au12 3.0109(6) . ?
Au11 Au13 3.3151(7) . ?
Au11 Au14 3.1715(7) . ?
Au11 S5 2.367(3) . ?
Au12 Au11 3.0109(6) 3_655 ?
Au12 S7 2.310(3) 3_655 ?
Au12 S7 2.310(3) . ?
Au13 Au14 2.8898(7) . ?
Au13 S5 2.296(3) . ?
Au13 S6 2.302(3) . ?
Au14 Au15 2.7822(7) . ?
Au14 Au19 3.0413(7) . ?
Au14 S3 2.381(3) . ?
Au15 Au16 3.0892(7) . ?
Au15 Au17 3.0859(7) . ?
Au15 Au18 2.9654(7) . ?
Au15 S11 2.353(3) . ?
Au16 Au18 3.3207(8) . ?
Au16 S8 2.288(4) . ?
Au16 S9 2.296(3) . ?
Au17 S10 2.312(3) . ?
Au17 S11 2.305(3) . ?
Au18 S6 2.292(3) . ?
Au18 S8 2.292(4) . ?
Au19 S3 2.315(3) . ?
Au19 S4 2.307(3) . ?
S1 C1 1.857(14) . ?
S2 C7 1.848(15) . ?
S3 C13 1.848(14) . ?
S4 C19 1.823(15) . ?
S5 C25 1.847(16) . ?
S6 C31 1.849(14) . ?
S7 C37 1.856(14) . ?
S8 C43 1.859(17) . ?
S9 C49 1.851(14) . ?
S10 C55 1.846(13) . ?
S11 C61 1.850(13) . ?
C1 H1 1.0000 . ?
C1 C2 1.59(2) . ?
C1 C6 1.50(2) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C2 C3 1.50(2) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C3 C4 1.52(3) . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 C5 1.49(3) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C5 C6 1.53(3) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 H7 1.0000 . ?
C7 C8 1.52(3) . ?
C7 C12 1.42(3) . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C8 C9 1.47(3) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C9 C10 1.41(3) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C10 C11 1.47(3) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C11 C12 1.54(3) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 H13 1.0000 . ?
C13 C14 1.517(19) . ?
C13 C18 1.52(2) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C14 C15 1.54(3) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C15 C16 1.50(3) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 C17 1.50(3) . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C17 C18 1.56(2) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 H19 1.0000 . ?
C19 C20 1.56(2) . ?
C19 C24 1.55(2) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C20 C21 1.50(3) . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C21 C22 1.56(3) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C22 C23 1.51(3) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C23 C24 1.53(2) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 H25 1.0000 . ?
C25 C26 1.46(3) . ?
C25 C30 1.54(2) . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C26 C27 1.53(3) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C27 C28 1.53(4) . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C28 C29 1.40(3) . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C30 1.49(3) . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 H31 1.0000 . ?
C31 C32 1.513(19) . ?
C31 C36 1.54(2) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C32 C33 1.51(2) . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C33 C34 1.52(2) . ?
C34 H34A 0.9900 . ?
C34 H34B 0.9900 . ?
C34 C35 1.50(2) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C35 C36 1.54(2) . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C37 H37 1.0000 . ?
C37 C38 1.46(2) . ?
C37 C42 1.54(2) . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C38 C39 1.51(3) . ?
C39 H39A 0.9900 . ?
C39 H39B 0.9900 . ?
C39 C40 1.49(3) . ?
C40 H40A 0.9900 . ?
C40 H40B 0.9900 . ?
C40 C41 1.49(2) . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C41 C42 1.51(2) . ?
C42 H42A 0.9900 . ?
C42 H42B 0.9900 . ?
C43 H43 1.0000 . ?
C43 C44 1.55(3) . ?
C43 C48 1.51(3) . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
C44 C45 1.45(3) . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C45 C46 1.46(3) . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 C47 1.54(3) . ?
C47 H47A 0.9900 . ?
C47 H47B 0.9900 . ?
C47 C48 1.54(3) . ?
C48 H48A 0.9900 . ?
C48 H48B 0.9900 . ?
C49 H49 1.0000 . ?
C49 C50 1.51(2) . ?
C49 C54 1.55(2) . ?
C50 H50A 0.9900 . ?
C50 H50B 0.9900 . ?
C50 C51 1.50(2) . ?
C51 H51A 0.9900 . ?
C51 H51B 0.9900 . ?
C51 C52 1.50(3) . ?
C52 H52A 0.9900 . ?
C52 H52B 0.9900 . ?
C52 C53 1.46(3) . ?
C53 H53A 0.9900 . ?
C53 H53B 0.9900 . ?
C53 C54 1.57(3) . ?
C54 H54A 0.9900 . ?
C54 H54B 0.9900 . ?
C55 H55 1.0000 . ?
C55 C56 1.518(19) . ?
C55 C60 1.519(19) . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C56 C57 1.52(2) . ?
C57 H57A 0.9900 . ?
C57 H57B 0.9900 . ?
C57 C58 1.55(2) . ?
C58 H58A 0.9900 . ?
C58 H58B 0.9900 . ?
C58 C59 1.55(3) . ?
C59 H59A 0.9900 . ?
C59 H59B 0.9900 . ?
C59 C60 1.55(2) . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C61 H61 1.0000 . ?
C61 C62 1.505(19) . ?
C61 C66 1.550(18) . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C62 C63 1.54(2) . ?
C63 H63A 0.9900 . ?
C63 H63B 0.9900 . ?
C63 C64 1.56(3) . ?
C64 H64A 0.9900 . ?
C64 H64B 0.9900 . ?
C64 C65 1.46(2) . ?
C65 H65A 0.9900 . ?
C65 H65B 0.9900 . ?
C65 C66 1.55(2) . ?
C66 H66A 0.9900 . ?
C66 H66B 0.9900 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Au2 Au1 Au3 63.245(17) . . ?
Au2 Au1 Au4 131.15(2) . . ?
Au2 Au1 Au5 90.946(16) . . ?
Au2 Au1 Au10 61.120(13) . . ?
Au3 Au1 Au5 56.183(12) . . ?
Au3 Au1 Au10 59.343(13) . . ?
Au4 Au1 Au3 67.905(16) . . ?
Au4 Au1 Au5 61.108(16) . . ?
Au4 Au1 Au10 93.885(18) . . ?
Au6 Au1 Au2 59.228(14) . . ?
Au6 Au1 Au3 97.789(18) . . ?
Au6 Au1 Au4 130.42(2) . . ?
Au6 Au1 Au5 71.447(17) . . ?
Au6 Au1 Au7 61.532(17) . . ?
Au6 Au1 Au10 120.03(2) . . ?
Au6 Au1 Au14 162.61(2) . . ?
Au6 Au1 Au15 108.37(2) . . ?
Au7 Au1 Au2 56.268(16) . . ?
Au7 Au1 Au3 118.30(2) . . ?
Au7 Au1 Au4 167.20(2) . . ?
Au7 Au1 Au5 131.65(2) . . ?
Au7 Au1 Au10 81.212(17) . . ?
Au10 Au1 Au5 115.503(19) . . ?
Au14 Au1 Au2 129.72(2) . . ?
Au14 Au1 Au3 99.597(18) . . ?
Au14 Au1 Au4 58.287(16) . . ?
Au14 Au1 Au5 119.39(2) . . ?
Au14 Au1 Au7 108.94(2) . . ?
Au14 Au1 Au10 69.475(17) . . ?
Au14 Au1 Au15 61.634(17) . . ?
Au15 Au1 Au2 167.47(2) . . ?
Au15 Au1 Au3 123.80(2) . . ?
Au15 Au1 Au4 57.107(15) . . ?
Au15 Au1 Au5 86.129(18) . . ?
Au15 Au1 Au7 117.90(2) . . ?
Au15 Au1 Au10 130.90(2) . . ?
Au1 Au2 Au1 117.43(3) . 3_655 ?
Au1 Au2 Au3 58.713(13) . . ?
Au1 Au2 Au3 58.714(13) 3_655 . ?
Au1 Au2 Au10 60.232(15) . . ?
Au1 Au2 Au10 86.588(17) . 3_655 ?
Au1 Au2 Au10 60.232(15) 3_655 3_655 ?
Au1 Au2 Au10 86.588(17) 3_655 . ?
Au6 Au2 Au1 127.184(18) . 3_655 ?
Au6 Au2 Au1 127.183(18) 3_655 . ?
Au6 Au2 Au1 57.527(13) 3_655 3_655 ?
Au6 Au2 Au1 57.530(13) . . ?
Au6 Au2 Au3 93.725(16) 3_655 . ?
Au6 Au2 Au3 93.727(16) . . ?
Au6 Au2 Au6 172.55(3) . 3_655 ?
Au6 Au2 Au10 66.954(14) . 3_655 ?
Au6 Au2 Au10 66.953(14) 3_655 . ?
Au6 Au2 Au10 117.457(16) . . ?
Au6 Au2 Au10 117.453(16) 3_655 3_655 ?
Au7 Au2 Au1 168.514(15) 3_655 . ?
Au7 Au2 Au1 60.414(14) 3_655 3_655 ?
Au7 Au2 Au1 60.413(14) . . ?
Au7 Au2 Au1 168.513(15) . 3_655 ?
Au7 Au2 Au3 117.914(15) . . ?
Au7 Au2 Au3 117.915(15) 3_655 . ?
Au7 Au2 Au6 113.698(18) 3_655 . ?
Au7 Au2 Au6 113.701(18) . 3_655 ?
Au7 Au2 Au6 62.432(15) 3_655 3_655 ?
Au7 Au2 Au6 62.433(15) . . ?
Au7 Au2 Au7 124.17(3) . 3_655 ?
Au7 Au2 Au10 82.791(14) . . ?
Au7 Au2 Au10 128.807(14) . 3_655 ?
Au7 Au2 Au10 82.792(14) 3_655 3_655 ?
Au7 Au2 Au10 128.806(14) 3_655 . ?
Au10 Au2 Au3 57.635(13) . . ?
Au10 Au2 Au3 57.634(13) 3_655 . ?
Au10 Au2 Au10 115.27(3) 3_655 . ?
Au1 Au3 Au1 116.08(3) . 3_655 ?
Au1 Au3 Au2 58.041(13) . . ?
Au1 Au3 Au2 58.041(13) 3_655 . ?
Au1 Au3 Au4 56.012(11) 3_655 3_655 ?
Au1 Au3 Au4 56.013(11) . . ?
Au1 Au3 Au4 172.09(2) 3_655 . ?
Au1 Au3 Au4 172.09(2) . 3_655 ?
Au1 Au3 Au12 121.959(13) 3_655 . ?
Au1 Au3 Au12 121.958(13) . . ?
Au2 Au3 Au4 114.054(12) . . ?
Au2 Au3 Au4 114.053(12) . 3_655 ?
Au2 Au3 Au12 180.0 . . ?
Au4 Au3 Au4 131.89(2) . 3_655 ?
Au5 Au3 Au1 119.096(17) . 3_655 ?
Au5 Au3 Au1 63.330(14) . . ?
Au5 Au3 Au1 63.328(14) 3_655 3_655 ?
Au5 Au3 Au1 119.094(17) 3_655 . ?
Au5 Au3 Au2 92.025(15) . . ?
Au5 Au3 Au2 92.023(15) 3_655 . ?
Au5 Au3 Au4 59.038(13) . . ?
Au5 Au3 Au4 59.038(13) 3_655 3_655 ?
Au5 Au3 Au4 119.056(15) . 3_655 ?
Au5 Au3 Au4 119.057(15) 3_655 . ?
Au5 Au3 Au5 175.95(3) . 3_655 ?
Au5 Au3 Au10 124.088(17) . . ?
Au5 Au3 Au10 124.086(17) 3_655 3_655 ?
Au5 Au3 Au10 58.336(14) . 3_655 ?
Au5 Au3 Au10 58.335(14) 3_655 . ?
Au5 Au3 Au11 60.687(14) 3_655 . ?
Au5 Au3 Au11 60.685(14) . 3_655 ?
Au5 Au3 Au11 117.151(17) 3_655 3_655 ?
Au5 Au3 Au11 117.150(17) . . ?
Au5 Au3 Au12 87.975(15) . . ?
Au5 Au3 Au12 87.977(15) 3_655 . ?
Au10 Au3 Au1 60.786(15) 3_655 3_655 ?
Au10 Au3 Au1 60.786(15) . . ?
Au10 Au3 Au1 87.475(17) 3_655 . ?
Au10 Au3 Au1 87.474(17) . 3_655 ?
Au10 Au3 Au2 59.823(13) 3_655 . ?
Au10 Au3 Au2 59.823(13) . . ?
Au10 Au3 Au4 87.869(12) . . ?
Au10 Au3 Au4 87.868(13) 3_655 3_655 ?
Au10 Au3 Au4 116.548(13) . 3_655 ?
Au10 Au3 Au4 116.549(13) 3_655 . ?
Au10 Au3 Au10 119.65(3) 3_655 . ?
Au10 Au3 Au12 120.177(13) 3_655 . ?
Au10 Au3 Au12 120.177(13) . . ?
Au11 Au3 Au1 123.695(13) 3_655 . ?
Au11 Au3 Au1 123.695(13) . 3_655 ?
Au11 Au3 Au1 86.776(13) 3_655 3_655 ?
Au11 Au3 Au1 86.777(13) . . ?
Au11 Au3 Au2 118.096(14) . . ?
Au11 Au3 Au2 118.094(14) 3_655 . ?
Au11 Au3 Au4 98.043(17) . 3_655 ?
Au11 Au3 Au4 58.411(14) . . ?
Au11 Au3 Au4 58.411(14) 3_655 3_655 ?
Au11 Au3 Au4 98.043(17) 3_655 . ?
Au11 Au3 Au10 58.598(13) 3_655 3_655 ?
Au11 Au3 Au10 173.977(15) 3_655 . ?
Au11 Au3 Au10 58.600(13) . . ?
Au11 Au3 Au10 173.978(16) . 3_655 ?
Au11 Au3 Au11 123.81(3) 3_655 . ?
Au11 Au3 Au12 61.904(14) . . ?
Au11 Au3 Au12 61.906(14) 3_655 . ?
Au12 Au3 Au4 65.946(12) . . ?
Au12 Au3 Au4 65.947(12) . 3_655 ?
Au1 Au4 Au3 56.082(15) . . ?
Au1 Au4 Au5 60.770(15) . . ?
Au1 Au4 Au11 83.466(17) . . ?
Au1 Au4 Au13 116.41(2) . . ?
Au5 Au4 Au3 52.623(12) . . ?
Au5 Au4 Au13 171.99(2) . . ?
Au11 Au4 Au3 53.002(12) . . ?
Au11 Au4 Au5 105.385(18) . . ?
Au11 Au4 Au13 66.605(16) . . ?
Au13 Au4 Au3 119.378(17) . . ?
Au14 Au4 Au1 57.836(16) . . ?
Au14 Au4 Au3 91.591(17) . . ?
Au14 Au4 Au5 118.61(2) . . ?
Au14 Au4 Au11 68.190(17) . . ?
Au14 Au4 Au13 59.132(16) . . ?
Au15 Au4 Au1 58.806(16) . . ?
Au15 Au4 Au3 113.89(2) . . ?
Au15 Au4 Au5 86.845(19) . . ?
Au15 Au4 Au11 128.24(2) . . ?
Au15 Au4 Au13 97.96(2) . . ?
Au15 Au4 Au14 62.098(18) . . ?
S7 Au4 Au1 140.31(7) . . ?
S7 Au4 Au3 91.26(7) . . ?
S7 Au4 Au5 82.06(7) . . ?
S7 Au4 Au11 94.38(7) . . ?
S7 Au4 Au13 98.44(7) . . ?
S7 Au4 Au14 155.27(7) . . ?
S7 Au4 Au15 137.37(7) . . ?
Au1 Au5 Au4 58.122(15) . . ?
Au1 Au5 Au6 50.682(14) . . ?
Au3 Au5 Au1 60.487(15) . . ?
Au3 Au5 Au4 68.339(15) . . ?
Au3 Au5 Au6 87.425(18) . . ?
Au3 Au5 Au11 59.820(14) . 3_655 ?
Au4 Au5 Au6 107.471(18) . . ?
Au10 Au5 Au1 88.339(18) 3_655 . ?
Au10 Au5 Au3 62.932(15) 3_655 . ?
Au10 Au5 Au4 130.17(2) 3_655 . ?
Au10 Au5 Au6 61.655(15) 3_655 . ?
Au10 Au5 Au11 59.827(16) 3_655 3_655 ?
Au11 Au5 Au1 120.01(2) 3_655 . ?
Au11 Au5 Au4 103.617(19) 3_655 . ?
Au11 Au5 Au6 120.956(19) 3_655 . ?
S9 Au5 Au1 111.31(8) . . ?
S9 Au5 Au3 170.14(9) . . ?
S9 Au5 Au4 103.03(9) . . ?
S9 Au5 Au6 90.89(8) . . ?
S9 Au5 Au10 124.36(9) . 3_655 ?
S9 Au5 Au11 128.68(8) . 3_655 ?
Au1 Au6 Au2 63.242(16) . . ?
Au1 Au6 Au5 57.872(15) . . ?
Au1 Au6 Au7 60.658(17) . . ?
Au1 Au6 Au9 137.48(2) . 3_655 ?
Au1 Au6 Au10 85.347(17) . 3_655 ?
Au1 Au6 Au17 80.241(18) . . ?
Au2 Au6 Au5 85.815(19) . . ?
Au2 Au6 Au7 57.210(15) . . ?
Au2 Au6 Au9 74.430(17) . 3_655 ?
Au2 Au6 Au10 59.270(15) . 3_655 ?
Au2 Au6 Au17 142.28(2) . . ?
Au7 Au6 Au5 117.545(19) . . ?
Au7 Au6 Au9 100.11(2) . 3_655 ?
Au7 Au6 Au10 116.04(2) . 3_655 ?
Au7 Au6 Au17 97.69(2) . . ?
Au9 Au6 Au5 117.32(2) 3_655 . ?
Au9 Au6 Au10 69.089(16) 3_655 3_655 ?
Au9 Au6 Au17 142.15(2) 3_655 . ?
Au10 Au6 Au5 50.158(14) 3_655 . ?
Au10 Au6 Au17 130.01(2) 3_655 . ?
Au17 Au6 Au5 82.324(16) . . ?
S10 Au6 Au1 123.99(8) . . ?
S10 Au6 Au2 170.76(7) . . ?
S10 Au6 Au5 93.67(8) . . ?
S10 Au6 Au7 130.28(7) . . ?
S10 Au6 Au9 97.75(7) . 3_655 ?
S10 Au6 Au10 113.68(7) . 3_655 ?
S10 Au6 Au17 46.44(7) . . ?
Au1 Au7 Au6 57.810(16) . . ?
Au1 Au7 Au8 132.33(2) . . ?
Au1 Au7 Au9 110.54(2) . . ?
Au1 Au7 Au19 76.372(17) . . ?
Au2 Au7 Au1 63.319(17) . . ?
Au2 Au7 Au6 60.356(14) . . ?
Au2 Au7 Au8 70.556(19) . . ?
Au2 Au7 Au9 72.629(15) . . ?
Au2 Au7 Au19 124.56(2) . . ?
Au6 Au7 Au8 89.657(17) . . ?
Au6 Au7 Au9 131.79(2) . . ?
Au6 Au7 Au19 125.38(2) . . ?
Au8 Au7 Au19 144.951(19) . . ?
Au9 Au7 Au8 63.898(14) . . ?
Au9 Au7 Au19 89.139(18) . . ?
S4 Au7 Au1 109.25(7) . . ?
S4 Au7 Au2 170.64(8) . . ?
S4 Au7 Au6 121.66(8) . . ?
S4 Au7 Au8 117.77(7) . . ?
S4 Au7 Au9 106.47(8) . . ?
S4 Au7 Au19 46.23(8) . . ?
Au7 Au8 Au7 94.72(3) 3_655 . ?
Au7 Au8 Au9 56.214(15) 3_655 3_655 ?
Au7 Au8 Au9 56.214(15) . . ?
Au7 Au8 Au9 84.084(18) . 3_655 ?
Au7 Au8 Au9 84.084(18) 3_655 . ?
Au9 Au8 Au9 121.78(3) . 3_655 ?
S1 Au8 Au7 87.08(8) 3_655 . ?
S1 Au8 Au7 99.72(8) 3_655 3_655 ?
S1 Au8 Au7 99.72(8) . . ?
S1 Au8 Au7 87.08(8) . 3_655 ?
S1 Au8 Au9 44.20(8) . . ?
S1 Au8 Au9 143.28(8) . 3_655 ?
S1 Au8 Au9 143.29(8) 3_655 . ?
S1 Au8 Au9 44.20(8) 3_655 3_655 ?
S1 Au8 S1 170.02(16) 3_655 . ?
Au6 Au9 Au7 99.004(19) 3_655 . ?
Au6 Au9 Au8 85.944(18) 3_655 . ?
Au7 Au9 Au8 59.888(14) . . ?
S1 Au9 Au6 86.21(8) . 3_655 ?
S1 Au9 Au7 102.80(8) . . ?
S1 Au9 Au8 43.63(8) . . ?
S2 Au9 Au6 93.09(7) . 3_655 ?
S2 Au9 Au7 87.52(7) . . ?
S2 Au9 Au8 146.67(7) . . ?
S2 Au9 S1 169.65(11) . . ?
Au1 Au10 Au2 58.648(13) . . ?
Au1 Au10 Au6 112.423(19) . 3_655 ?
Au1 Au10 Au14 52.424(14) . . ?
Au2 Au10 Au6 53.776(12) . 3_655 ?
Au2 Au10 Au14 110.481(17) . . ?
Au3 Au10 Au1 59.871(13) . . ?
Au3 Au10 Au2 62.542(17) . . ?
Au3 Au10 Au6 88.875(16) . 3_655 ?
Au3 Au10 Au14 89.305(15) . . ?
Au5 Au10 Au1 118.58(2) 3_655 . ?
Au5 Au10 Au2 93.961(18) 3_655 . ?
Au5 Au10 Au3 58.732(14) 3_655 . ?
Au5 Au10 Au6 68.184(17) 3_655 3_655 ?
Au5 Au10 Au11 60.893(16) 3_655 . ?
Au5 Au10 Au14 124.744(19) 3_655 . ?
Au6 Au10 Au14 162.54(2) 3_655 . ?
Au11 Au10 Au1 86.357(18) . . ?
Au11 Au10 Au2 120.98(2) . . ?
Au11 Au10 Au3 58.779(16) . . ?
Au11 Au10 Au6 128.46(2) . 3_655 ?
Au11 Au10 Au14 64.035(16) . . ?
S2 Au10 Au1 111.42(7) . . ?
S2 Au10 Au2 104.74(7) . . ?
S2 Au10 Au3 166.79(7) . . ?
S2 Au10 Au5 129.22(7) . 3_655 ?
S2 Au10 Au6 85.67(7) . 3_655 ?
S2 Au10 Au11 133.17(7) . . ?
S2 Au10 Au14 92.29(7) . . ?
Au3 Au11 Au4 68.587(14) . . ?
Au3 Au11 Au5 59.495(13) . 3_655 ?
Au3 Au11 Au12 64.447(17) . . ?
Au3 Au11 Au13 127.446(18) . . ?
Au3 Au11 Au14 91.700(16) . . ?
Au4 Au11 Au12 70.286(13) . . ?
Au4 Au11 Au13 59.134(15) . . ?
Au4 Au11 Au14 52.686(14) . . ?
Au5 Au11 Au4 128.03(2) 3_655 . ?
Au5 Au11 Au12 88.760(17) 3_655 . ?
Au5 Au11 Au13 170.18(2) 3_655 . ?
Au5 Au11 Au14 124.00(2) 3_655 . ?
Au10 Au11 Au3 62.621(17) . . ?
Au10 Au11 Au4 95.748(18) . . ?
Au10 Au11 Au5 59.279(16) . 3_655 ?
Au10 Au11 Au12 126.69(2) . . ?
Au10 Au11 Au13 115.89(2) . . ?
Au10 Au11 Au14 64.908(16) . . ?
Au12 Au11 Au13 100.570(16) . . ?
Au12 Au11 Au14 122.968(18) . . ?
Au14 Au11 Au13 52.854(14) . . ?
S5 Au11 Au3 153.29(8) . . ?
S5 Au11 Au4 94.60(8) . . ?
S5 Au11 Au5 133.92(8) . 3_655 ?
S5 Au11 Au10 142.40(8) . . ?
S5 Au11 Au12 90.79(8) . . ?
S5 Au11 Au13 43.83(8) . . ?
S5 Au11 Au14 94.04(8) . . ?
Au11 Au12 Au3 53.649(13) . . ?
Au11 Au12 Au3 53.648(13) 3_655 . ?
Au11 Au12 Au11 107.30(3) . 3_655 ?
S7 Au12 Au3 95.79(7) . . ?
S7 Au12 Au3 95.79(7) 3_655 . ?
S7 Au12 Au11 93.11(7) . 3_655 ?
S7 Au12 Au11 93.11(7) 3_655 . ?
S7 Au12 Au11 93.74(7) 3_655 3_655 ?
S7 Au12 Au11 93.74(7) . . ?
S7 Au12 S7 168.43(13) 3_655 . ?
Au4 Au13 Au11 54.261(14) . . ?
Au14 Au13 Au4 53.803(15) . . ?
Au14 Au13 Au11 61.022(15) . . ?
S5 Au13 Au4 91.71(8) . . ?
S5 Au13 Au11 45.56(7) . . ?
S5 Au13 Au14 103.49(8) . . ?
S5 Au13 S6 174.27(11) . . ?
S6 Au13 Au4 93.99(8) . . ?
S6 Au13 Au11 139.51(8) . . ?
S6 Au13 Au14 80.42(7) . . ?
Au1 Au14 Au4 63.877(17) . . ?
Au1 Au14 Au10 58.101(15) . . ?
Au1 Au14 Au11 81.743(17) . . ?
Au1 Au14 Au13 130.19(2) . . ?
Au1 Au14 Au15 59.599(17) . . ?
Au1 Au14 Au19 79.965(18) . . ?
Au4 Au14 Au10 90.487(18) . . ?
Au4 Au14 Au11 59.124(15) . . ?
Au4 Au14 Au13 67.065(17) . . ?
Au4 Au14 Au15 58.246(17) . . ?
Au4 Au14 Au19 140.40(2) . . ?
Au11 Au14 Au10 51.057(13) . . ?
Au13 Au14 Au10 115.35(2) . . ?
Au13 Au14 Au11 66.124(16) . . ?
Au13 Au14 Au19 149.39(2) . . ?
Au15 Au14 Au10 117.54(2) . . ?
Au15 Au14 Au11 115.79(2) . . ?
Au15 Au14 Au13 100.70(2) . . ?
Au15 Au14 Au19 90.429(19) . . ?
Au19 Au14 Au10 83.169(17) . . ?
Au19 Au14 Au11 133.47(2) . . ?
S3 Au14 Au1 124.88(8) . . ?
S3 Au14 Au4 170.79(8) . . ?
S3 Au14 Au10 92.54(8) . . ?
S3 Au14 Au11 116.90(8) . . ?
S3 Au14 Au13 103.82(7) . . ?
S3 Au14 Au15 127.12(8) . . ?
S3 Au14 Au19 48.71(7) . . ?
Au1 Au15 Au14 58.768(17) . . ?
Au1 Au15 Au16 110.47(2) . . ?
Au1 Au15 Au17 81.471(18) . . ?
Au1 Au15 Au18 138.17(2) . . ?
Au4 Au15 Au1 64.088(17) . . ?
Au4 Au15 Au14 59.656(17) . . ?
Au4 Au15 Au16 76.177(19) . . ?
Au4 Au15 Au17 124.17(2) . . ?
Au4 Au15 Au18 75.281(19) . . ?
Au14 Au15 Au16 135.03(2) . . ?
Au14 Au15 Au17 134.30(2) . . ?
Au14 Au15 Au18 92.87(2) . . ?
Au17 Au15 Au16 76.863(19) . . ?
Au18 Au15 Au16 66.487(19) . . ?
Au18 Au15 Au17 132.82(2) . . ?
S11 Au15 Au1 123.41(7) . . ?
S11 Au15 Au4 160.33(8) . . ?
S11 Au15 Au14 139.93(8) . . ?
S11 Au15 Au16 84.20(8) . . ?
S11 Au15 Au17 47.85(8) . . ?
S11 Au15 Au18 98.24(7) . . ?
Au15 Au16 Au18 54.970(16) . . ?
S8 Au16 Au15 93.64(10) . . ?
S8 Au16 Au18 43.57(10) . . ?
S8 Au16 S9 171.35(12) . . ?
S9 Au16 Au15 94.25(8) . . ?
S9 Au16 Au18 145.08(7) . . ?
Au15 Au17 Au6 89.036(17) . . ?
S10 Au17 Au6 48.03(7) . . ?
S10 Au17 Au15 131.33(7) . . ?
S11 Au17 Au6 134.01(8) . . ?
S11 Au17 Au15 49.18(7) . . ?
S11 Au17 S10 176.96(11) . . ?
Au15 Au18 Au16 58.543(17) . . ?
S6 Au18 Au15 91.49(8) . . ?
S6 Au18 Au16 146.26(8) . . ?
S8 Au18 Au15 96.88(10) . . ?
S8 Au18 Au16 43.48(10) . . ?
S8 Au18 S6 170.22(13) . . ?
Au14 Au19 Au7 91.316(18) . . ?
S3 Au19 Au7 130.55(8) . . ?
S3 Au19 Au14 50.59(7) . . ?
S4 Au19 Au7 46.99(7) . . ?
S4 Au19 Au14 129.10(8) . . ?
S4 Au19 S3 176.87(11) . . ?
Au8 S1 Au9 92.18(11) . . ?
C1 S1 Au8 107.0(5) . . ?
C1 S1 Au9 106.1(5) . . ?
Au9 S2 Au10 93.92(10) . . ?
C7 S2 Au9 100.7(5) . . ?
C7 S2 Au10 107.2(5) . . ?
Au19 S3 Au14 80.70(10) . . ?
C13 S3 Au14 108.3(4) . . ?
C13 S3 Au19 107.6(5) . . ?
Au19 S4 Au7 86.78(10) . . ?
C19 S4 Au7 110.8(5) . . ?
C19 S4 Au19 106.8(5) . . ?
Au13 S5 Au11 90.61(10) . . ?
C25 S5 Au11 111.1(5) . . ?
C25 S5 Au13 104.4(5) . . ?
Au18 S6 Au13 102.02(13) . . ?
C31 S6 Au13 105.7(5) . . ?
C31 S6 Au18 104.4(5) . . ?
Au12 S7 Au4 93.74(10) . . ?
C37 S7 Au4 108.1(4) . . ?
C37 S7 Au12 105.6(4) . . ?
Au16 S8 Au18 92.95(15) . . ?
C43 S8 Au16 102.9(5) . . ?
C43 S8 Au18 106.4(5) . . ?
Au16 S9 Au5 102.71(12) . . ?
C49 S9 Au5 108.5(5) . . ?
C49 S9 Au16 101.4(5) . . ?
Au17 S10 Au6 85.53(9) . . ?
C55 S10 Au6 107.5(4) . . ?
C55 S10 Au17 106.5(4) . . ?
Au17 S11 Au15 82.97(10) . . ?
C61 S11 Au15 104.6(4) . . ?
C61 S11 Au17 104.0(4) . . ?
S1 C1 H1 110.2 . . ?
C2 C1 S1 107.2(10) . . ?
C2 C1 H1 110.2 . . ?
C6 C1 S1 109.2(11) . . ?
C6 C1 H1 110.2 . . ?
C6 C1 C2 109.7(12) . . ?
C1 C2 H2A 110.1 . . ?
C1 C2 H2B 110.1 . . ?
H2A C2 H2B 108.5 . . ?
C3 C2 C1 107.8(14) . . ?
C3 C2 H2A 110.1 . . ?
C3 C2 H2B 110.1 . . ?
C2 C3 H3A 109.1 . . ?
C2 C3 H3B 109.1 . . ?
C2 C3 C4 112.5(17) . . ?
H3A C3 H3B 107.8 . . ?
C4 C3 H3A 109.1 . . ?
C4 C3 H3B 109.1 . . ?
C3 C4 H4A 109.3 . . ?
C3 C4 H4B 109.3 . . ?
H4A C4 H4B 107.9 . . ?
C5 C4 C3 111.8(17) . . ?
C5 C4 H4A 109.3 . . ?
C5 C4 H4B 109.3 . . ?
C4 C5 H5A 109.6 . . ?
C4 C5 H5B 109.6 . . ?
C4 C5 C6 110.4(17) . . ?
H5A C5 H5B 108.1 . . ?
C6 C5 H5A 109.6 . . ?
C6 C5 H5B 109.6 . . ?
C1 C6 C5 112.4(15) . . ?
C1 C6 H6A 109.1 . . ?
C1 C6 H6B 109.1 . . ?
C5 C6 H6A 109.1 . . ?
C5 C6 H6B 109.1 . . ?
H6A C6 H6B 107.9 . . ?
S2 C7 H7 107.7 . . ?
C8 C7 S2 109.9(12) . . ?
C8 C7 H7 107.7 . . ?
C12 C7 S2 114.9(14) . . ?
C12 C7 H7 107.7 . . ?
C12 C7 C8 108.6(17) . . ?
C7 C8 H8A 109.1 . . ?
C7 C8 H8B 109.1 . . ?
H8A C8 H8B 107.8 . . ?
C9 C8 C7 112(2) . . ?
C9 C8 H8A 109.1 . . ?
C9 C8 H8B 109.1 . . ?
C8 C9 H9A 107.9 . . ?
C8 C9 H9B 107.9 . . ?
H9A C9 H9B 107.2 . . ?
C10 C9 C8 118(2) . . ?
C10 C9 H9A 107.9 . . ?
C10 C9 H9B 107.9 . . ?
C9 C10 H10A 109.4 . . ?
C9 C10 H10B 109.4 . . ?
C9 C10 C11 111(2) . . ?
H10A C10 H10B 108.0 . . ?
C11 C10 H10A 109.4 . . ?
C11 C10 H10B 109.4 . . ?
C10 C11 H11A 108.9 . . ?
C10 C11 H11B 108.9 . . ?
C10 C11 C12 114(2) . . ?
H11A C11 H11B 107.7 . . ?
C12 C11 H11A 108.9 . . ?
C12 C11 H11B 108.9 . . ?
C7 C12 C11 113(2) . . ?
C7 C12 H12A 109.0 . . ?
C7 C12 H12B 109.0 . . ?
C11 C12 H12A 109.0 . . ?
C11 C12 H12B 109.0 . . ?
H12A C12 H12B 107.8 . . ?
S3 C13 H13 108.2 . . ?
C14 C13 S3 110.8(10) . . ?
C14 C13 H13 108.2 . . ?
C14 C13 C18 112.1(12) . . ?
C18 C13 S3 109.2(10) . . ?
C18 C13 H13 108.2 . . ?
C13 C14 H14A 110.1 . . ?
C13 C14 H14B 110.1 . . ?
C13 C14 C15 108.2(14) . . ?
H14A C14 H14B 108.4 . . ?
C15 C14 H14A 110.1 . . ?
C15 C14 H14B 110.1 . . ?
C14 C15 H15A 109.4 . . ?
C14 C15 H15B 109.4 . . ?
H15A C15 H15B 108.0 . . ?
C16 C15 C14 111.3(18) . . ?
C16 C15 H15A 109.4 . . ?
C16 C15 H15B 109.4 . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
C15 C16 C17 110.9(17) . . ?
H16A C16 H16B 108.0 . . ?
C17 C16 H16A 109.5 . . ?
C17 C16 H16B 109.5 . . ?
C16 C17 H17A 109.4 . . ?
C16 C17 H17B 109.4 . . ?
C16 C17 C18 111.0(16) . . ?
H17A C17 H17B 108.0 . . ?
C18 C17 H17A 109.4 . . ?
C18 C17 H17B 109.4 . . ?
C13 C18 C17 109.7(13) . . ?
C13 C18 H18A 109.7 . . ?
C13 C18 H18B 109.7 . . ?
C17 C18 H18A 109.7 . . ?
C17 C18 H18B 109.7 . . ?
H18A C18 H18B 108.2 . . ?
S4 C19 H19 110.3 . . ?
C20 C19 S4 108.9(11) . . ?
C20 C19 H19 110.3 . . ?
C20 C19 C24 109.6(12) . . ?
C24 C19 S4 107.5(10) . . ?
C24 C19 H19 110.3 . . ?
C19 C20 H20A 109.9 . . ?
C19 C20 H20B 109.9 . . ?
H20A C20 H20B 108.3 . . ?
C21 C20 C19 108.9(15) . . ?
C21 C20 H20A 109.9 . . ?
C21 C20 H20B 109.9 . . ?
C20 C21 H21A 109.4 . . ?
C20 C21 H21B 109.4 . . ?
C20 C21 C22 111.2(17) . . ?
H21A C21 H21B 108.0 . . ?
C22 C21 H21A 109.4 . . ?
C22 C21 H21B 109.4 . . ?
C21 C22 H22A 110.1 . . ?
C21 C22 H22B 110.1 . . ?
H22A C22 H22B 108.4 . . ?
C23 C22 C21 108.1(16) . . ?
C23 C22 H22A 110.1 . . ?
C23 C22 H22B 110.1 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 108.1 . . ?
C24 C23 C22 110.8(14) . . ?
C24 C23 H23A 109.5 . . ?
C24 C23 H23B 109.5 . . ?
C19 C24 H24A 109.4 . . ?
C19 C24 H24B 109.4 . . ?
C23 C24 C19 111.1(13) . . ?
C23 C24 H24A 109.4 . . ?
C23 C24 H24B 109.4 . . ?
H24A C24 H24B 108.0 . . ?
S5 C25 H25 107.6 . . ?
C26 C25 S5 114.1(13) . . ?
C26 C25 H25 107.6 . . ?
C26 C25 C30 109.6(15) . . ?
C30 C25 S5 110.1(12) . . ?
C30 C25 H25 107.6 . . ?
C25 C26 H26A 110.0 . . ?
C25 C26 H26B 110.0 . . ?
C25 C26 C27 108(2) . . ?
H26A C26 H26B 108.4 . . ?
C27 C26 H26A 110.0 . . ?
C27 C26 H26B 110.0 . . ?
C26 C27 H27A 109.3 . . ?
C26 C27 H27B 109.3 . . ?
H27A C27 H27B 108.0 . . ?
C28 C27 C26 112(2) . . ?
C28 C27 H27A 109.3 . . ?
C28 C27 H27B 109.3 . . ?
C27 C28 H28A 109.7 . . ?
C27 C28 H28B 109.7 . . ?
H28A C28 H28B 108.2 . . ?
C29 C28 C27 110(2) . . ?
C29 C28 H28A 109.7 . . ?
C29 C28 H28B 109.7 . . ?
C28 C29 H29A 108.8 . . ?
C28 C29 H29B 108.8 . . ?
C28 C29 C30 114(2) . . ?
H29A C29 H29B 107.7 . . ?
C30 C29 H29A 108.8 . . ?
C30 C29 H29B 108.8 . . ?
C25 C30 H30A 109.6 . . ?
C25 C30 H30B 109.6 . . ?
C29 C30 C25 110.1(18) . . ?
C29 C30 H30A 109.6 . . ?
C29 C30 H30B 109.6 . . ?
H30A C30 H30B 108.2 . . ?
S6 C31 H31 107.6 . . ?
C32 C31 S6 113.8(10) . . ?
C32 C31 H31 107.6 . . ?
C32 C31 C36 112.2(12) . . ?
C36 C31 S6 107.8(10) . . ?
C36 C31 H31 107.6 . . ?
C31 C32 H32A 109.4 . . ?
C31 C32 H32B 109.4 . . ?
H32A C32 H32B 108.0 . . ?
C33 C32 C31 111.0(13) . . ?
C33 C32 H32A 109.4 . . ?
C33 C32 H32B 109.4 . . ?
C32 C33 H33A 109.3 . . ?
C32 C33 H33B 109.3 . . ?
C32 C33 C34 111.8(14) . . ?
H33A C33 H33B 107.9 . . ?
C34 C33 H33A 109.3 . . ?
C34 C33 H33B 109.3 . . ?
C33 C34 H34A 109.6 . . ?
C33 C34 H34B 109.6 . . ?
H34A C34 H34B 108.1 . . ?
C35 C34 C33 110.3(15) . . ?
C35 C34 H34A 109.6 . . ?
C35 C34 H34B 109.6 . . ?
C34 C35 H35A 109.8 . . ?
C34 C35 H35B 109.8 . . ?
C34 C35 C36 109.3(14) . . ?
H35A C35 H35B 108.3 . . ?
C36 C35 H35A 109.8 . . ?
C36 C35 H35B 109.8 . . ?
C31 C36 H36A 109.6 . . ?
C31 C36 H36B 109.6 . . ?
C35 C36 C31 110.2(13) . . ?
C35 C36 H36A 109.6 . . ?
C35 C36 H36B 109.6 . . ?
H36A C36 H36B 108.1 . . ?
S7 C37 H37 108.8 . . ?
C38 C37 S7 113.4(11) . . ?
C38 C37 H37 108.8 . . ?
C38 C37 C42 110.5(13) . . ?
C42 C37 S7 106.4(10) . . ?
C42 C37 H37 108.8 . . ?
C37 C38 H38A 109.0 . . ?
C37 C38 H38B 109.0 . . ?
C37 C38 C39 112.9(17) . . ?
H38A C38 H38B 107.8 . . ?
C39 C38 H38A 109.0 . . ?
C39 C38 H38B 109.0 . . ?
C38 C39 H39A 109.2 . . ?
C38 C39 H39B 109.2 . . ?
H39A C39 H39B 107.9 . . ?
C40 C39 C38 112.0(18) . . ?
C40 C39 H39A 109.2 . . ?
C40 C39 H39B 109.2 . . ?
C39 C40 H40A 109.7 . . ?
C39 C40 H40B 109.7 . . ?
C39 C40 C41 109.7(16) . . ?
H40A C40 H40B 108.2 . . ?
C41 C40 H40A 109.7 . . ?
C41 C40 H40B 109.7 . . ?
C40 C41 H41A 108.7 . . ?
C40 C41 H41B 108.7 . . ?
C40 C41 C42 114.1(15) . . ?
H41A C41 H41B 107.6 . . ?
C42 C41 H41A 108.7 . . ?
C42 C41 H41B 108.7 . . ?
C37 C42 H42A 109.5 . . ?
C37 C42 H42B 109.5 . . ?
C41 C42 C37 110.6(14) . . ?
C41 C42 H42A 109.5 . . ?
C41 C42 H42B 109.5 . . ?
H42A C42 H42B 108.1 . . ?
S8 C43 H43 108.2 . . ?
C44 C43 S8 108.3(12) . . ?
C44 C43 H43 108.2 . . ?
C48 C43 S8 114.5(13) . . ?
C48 C43 H43 108.2 . . ?
C48 C43 C44 109.1(16) . . ?
C43 C44 H44A 109.6 . . ?
C43 C44 H44B 109.6 . . ?
H44A C44 H44B 108.1 . . ?
C45 C44 C43 110.2(19) . . ?
C45 C44 H44A 109.6 . . ?
C45 C44 H44B 109.6 . . ?
C44 C45 H45A 107.9 . . ?
C44 C45 H45B 107.9 . . ?
C44 C45 C46 118(2) . . ?
H45A C45 H45B 107.2 . . ?
C46 C45 H45A 107.9 . . ?
C46 C45 H45B 107.9 . . ?
C45 C46 H46A 108.9 . . ?
C45 C46 H46B 108.9 . . ?
C45 C46 C47 113(2) . . ?
H46A C46 H46B 107.7 . . ?
C47 C46 H46A 108.9 . . ?
C47 C46 H46B 108.9 . . ?
C46 C47 H47A 110.7 . . ?
C46 C47 H47B 110.7 . . ?
C46 C47 C48 105(2) . . ?
H47A C47 H47B 108.8 . . ?
C48 C47 H47A 110.7 . . ?
C48 C47 H47B 110.7 . . ?
C43 C48 C47 113.8(18) . . ?
C43 C48 H48A 108.8 . . ?
C43 C48 H48B 108.8 . . ?
C47 C48 H48A 108.8 . . ?
C47 C48 H48B 108.8 . . ?
H48A C48 H48B 107.7 . . ?
S9 C49 H49 108.2 . . ?
C50 C49 S9 115.2(10) . . ?
C50 C49 H49 108.2 . . ?
C50 C49 C54 111.9(12) . . ?
C54 C49 S9 105.1(10) . . ?
C54 C49 H49 108.2 . . ?
C49 C50 H50A 109.4 . . ?
C49 C50 H50B 109.4 . . ?
H50A C50 H50B 108.0 . . ?
C51 C50 C49 111.1(14) . . ?
C51 C50 H50A 109.4 . . ?
C51 C50 H50B 109.4 . . ?
C50 C51 H51A 109.5 . . ?
C50 C51 H51B 109.5 . . ?
C50 C51 C52 110.5(16) . . ?
H51A C51 H51B 108.1 . . ?
C52 C51 H51A 109.5 . . ?
C52 C51 H51B 109.5 . . ?
C51 C52 H52A 109.2 . . ?
C51 C52 H52B 109.2 . . ?
H52A C52 H52B 107.9 . . ?
C53 C52 C51 112.0(18) . . ?
C53 C52 H52A 109.2 . . ?
C53 C52 H52B 109.2 . . ?
C52 C53 H53A 110.0 . . ?
C52 C53 H53B 110.0 . . ?
C52 C53 C54 108.5(16) . . ?
H53A C53 H53B 108.4 . . ?
C54 C53 H53A 110.0 . . ?
C54 C53 H53B 110.0 . . ?
C49 C54 C53 109.7(14) . . ?
C49 C54 H54A 109.7 . . ?
C49 C54 H54B 109.7 . . ?
C53 C54 H54A 109.7 . . ?
C53 C54 H54B 109.7 . . ?
H54A C54 H54B 108.2 . . ?
S10 C55 H55 106.8 . . ?
C56 C55 S10 108.7(9) . . ?
C56 C55 H55 106.8 . . ?
C60 C55 S10 114.5(9) . . ?
C60 C55 H55 106.8 . . ?
C60 C55 C56 112.8(12) . . ?
C55 C56 H56A 109.7 . . ?
C55 C56 H56B 109.7 . . ?
C55 C56 C57 109.8(13) . . ?
H56A C56 H56B 108.2 . . ?
C57 C56 H56A 109.7 . . ?
C57 C56 H56B 109.7 . . ?
C56 C57 H57A 109.7 . . ?
C56 C57 H57B 109.7 . . ?
C56 C57 C58 109.8(15) . . ?
H57A C57 H57B 108.2 . . ?
C58 C57 H57A 109.7 . . ?
C58 C57 H57B 109.7 . . ?
C57 C58 H58A 109.3 . . ?
C57 C58 H58B 109.3 . . ?
C57 C58 C59 111.7(15) . . ?
H58A C58 H58B 107.9 . . ?
C59 C58 H58A 109.3 . . ?
C59 C58 H58B 109.3 . . ?
C58 C59 H59A 110.2 . . ?
C58 C59 H59B 110.2 . . ?
C58 C59 C60 107.5(14) . . ?
H59A C59 H59B 108.5 . . ?
C60 C59 H59A 110.2 . . ?
C60 C59 H59B 110.2 . . ?
C55 C60 C59 111.7(13) . . ?
C55 C60 H60A 109.3 . . ?
C55 C60 H60B 109.3 . . ?
C59 C60 H60A 109.3 . . ?
C59 C60 H60B 109.3 . . ?
H60A C60 H60B 107.9 . . ?
S11 C61 H61 109.9 . . ?
C62 C61 S11 108.6(9) . . ?
C62 C61 H61 109.9 . . ?
C62 C61 C66 110.9(11) . . ?
C66 C61 S11 107.5(9) . . ?
C66 C61 H61 109.9 . . ?
C61 C62 H62A 110.0 . . ?
C61 C62 H62B 110.0 . . ?
C61 C62 C63 108.6(13) . . ?
H62A C62 H62B 108.3 . . ?
C63 C62 H62A 110.0 . . ?
C63 C62 H62B 110.0 . . ?
C62 C63 H63A 109.9 . . ?
C62 C63 H63B 109.9 . . ?
C62 C63 C64 109.0(15) . . ?
H63A C63 H63B 108.3 . . ?
C64 C63 H63A 109.9 . . ?
C64 C63 H63B 109.9 . . ?
C63 C64 H64A 109.9 . . ?
C63 C64 H64B 109.9 . . ?
H64A C64 H64B 108.3 . . ?
C65 C64 C63 108.8(15) . . ?
C65 C64 H64A 109.9 . . ?
C65 C64 H64B 109.9 . . ?
C64 C65 H65A 109.0 . . ?
C64 C65 H65B 109.0 . . ?
C64 C65 C66 112.7(14) . . ?
H65A C65 H65B 107.8 . . ?
C66 C65 H65A 109.0 . . ?
C66 C65 H65B 109.0 . . ?
C61 C66 C65 108.7(11) . . ?
C61 C66 H66A 109.9 . . ?
C61 C66 H66B 109.9 . . ?
C65 C66 H66A 109.9 . . ?
C65 C66 H66B 109.9 . . ?
H66A C66 H66B 108.3 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Au4 S7 C37 C38 134.2(11) . . . . ?
Au4 S7 C37 C42 -104.1(10) . . . . ?
Au5 S9 C49 C50 -56.7(12) . . . . ?
Au5 S9 C49 C54 179.7(8) . . . . ?
Au6 S10 C55 C56 -171.0(8) . . . . ?
Au6 S10 C55 C60 61.8(10) . . . . ?
Au7 S4 C19 C20 -71.6(11) . . . . ?
Au7 S4 C19 C24 169.8(8) . . . . ?
Au8 S1 C1 C2 69.0(10) . . . . ?
Au8 S1 C1 C6 -172.2(9) . . . . ?
Au9 S1 C1 C2 166.5(9) . . . . ?
Au9 S1 C1 C6 -74.7(11) . . . . ?
Au9 S2 C7 C8 -79.7(13) . . . . ?
Au9 S2 C7 C12 157.5(16) . . . . ?
Au10 S2 C7 C8 -177.2(12) . . . . ?
Au10 S2 C7 C12 60.0(16) . . . . ?
Au11 S5 C25 C26 -36.6(15) . . . . ?
Au11 S5 C25 C30 -160.2(11) . . . . ?
Au12 S7 C37 C38 34.9(13) . . . . ?
Au12 S7 C37 C42 156.6(9) . . . . ?
Au13 S5 C25 C26 59.8(14) . . . . ?
Au13 S5 C25 C30 -63.8(13) . . . . ?
Au13 S6 C31 C32 45.3(11) . . . . ?
Au13 S6 C31 C36 170.4(9) . . . . ?
Au14 S3 C13 C14 145.6(9) . . . . ?
Au14 S3 C13 C18 -90.5(10) . . . . ?
Au15 S11 C61 C62 -168.7(9) . . . . ?
Au15 S11 C61 C66 71.2(9) . . . . ?
Au16 S8 C43 C44 -100.6(12) . . . . ?
Au16 S8 C43 C48 137.3(13) . . . . ?
Au16 S9 C49 C50 51.0(11) . . . . ?
Au16 S9 C49 C54 -72.6(10) . . . . ?
Au17 S10 C55 C56 98.5(9) . . . . ?
Au17 S10 C55 C60 -28.6(11) . . . . ?
Au17 S11 C61 C62 -82.4(10) . . . . ?
Au17 S11 C61 C66 157.5(8) . . . . ?
Au18 S6 C31 C32 -61.9(11) . . . . ?
Au18 S6 C31 C36 63.2(10) . . . . ?
Au18 S8 C43 C44 162.4(11) . . . . ?
Au18 S8 C43 C48 40.3(15) . . . . ?
Au19 S3 C13 C14 59.8(10) . . . . ?
Au19 S3 C13 C18 -176.3(8) . . . . ?
Au19 S4 C19 C20 -164.5(9) . . . . ?
Au19 S4 C19 C24 76.9(10) . . . . ?
S1 C1 C2 C3 175.7(12) . . . . ?
S1 C1 C6 C5 -174.5(13) . . . . ?
S2 C7 C8 C9 -179.3(17) . . . . ?
S2 C7 C12 C11 178.4(17) . . . . ?
S3 C13 C14 C15 -179.5(12) . . . . ?
S3 C13 C18 C17 -180.0(11) . . . . ?
S4 C19 C20 C21 -174.7(13) . . . . ?
S4 C19 C24 C23 174.3(11) . . . . ?
S5 C25 C26 C27 177.8(16) . . . . ?
S5 C25 C30 C29 -175.6(15) . . . . ?
S6 C31 C32 C33 175.2(11) . . . . ?
S6 C31 C36 C35 179.3(11) . . . . ?
S7 C37 C38 C39 174.4(14) . . . . ?
S7 C37 C42 C41 -175.7(12) . . . . ?
S8 C43 C44 C45 -176.8(16) . . . . ?
S8 C43 C48 C47 -178.9(15) . . . . ?
S9 C49 C50 C51 -172.9(12) . . . . ?
S9 C49 C54 C53 178.7(11) . . . . ?
S10 C55 C56 C57 175.4(11) . . . . ?
S10 C55 C60 C59 -178.3(11) . . . . ?
S11 C61 C62 C63 -178.3(11) . . . . ?
S11 C61 C66 C65 174.8(10) . . . . ?
C1 C2 C3 C4 -58(2) . . . . ?
C2 C1 C6 C5 -57.3(19) . . . . ?
C2 C3 C4 C5 58(2) . . . . ?
C3 C4 C5 C6 -54(2) . . . . ?
C4 C5 C6 C1 56(2) . . . . ?
C6 C1 C2 C3 57.3(18) . . . . ?
C7 C8 C9 C10 51(3) . . . . ?
C8 C7 C12 C11 55(3) . . . . ?
C8 C9 C10 C11 -47(3) . . . . ?
C9 C10 C11 C12 47(3) . . . . ?
C10 C11 C12 C7 -54(3) . . . . ?
C12 C7 C8 C9 -53(3) . . . . ?
C13 C14 C15 C16 -58(2) . . . . ?
C14 C13 C18 C17 -56.8(17) . . . . ?
C14 C15 C16 C17 59(2) . . . . ?
C15 C16 C17 C18 -56(2) . . . . ?
C16 C17 C18 C13 54.9(19) . . . . ?
C18 C13 C14 C15 58.2(18) . . . . ?
C19 C20 C21 C22 61(2) . . . . ?
C20 C19 C24 C23 56.1(17) . . . . ?
C20 C21 C22 C23 -62(2) . . . . ?
C21 C22 C23 C24 59(2) . . . . ?
C22 C23 C24 C19 -58.0(18) . . . . ?
C24 C19 C20 C21 -57.5(18) . . . . ?
C25 C26 C27 C28 58(3) . . . . ?
C26 C25 C30 C29 58(2) . . . . ?
C26 C27 C28 C29 -56(3) . . . . ?
C27 C28 C29 C30 56(3) . . . . ?
C28 C29 C30 C25 -58(3) . . . . ?
C30 C25 C26 C27 -58(2) . . . . ?
C31 C32 C33 C34 -54.4(18) . . . . ?
C32 C31 C36 C35 -54.7(17) . . . . ?
C32 C33 C34 C35 59(2) . . . . ?
C33 C34 C35 C36 -60.3(19) . . . . ?
C34 C35 C36 C31 58.1(18) . . . . ?
C36 C31 C32 C33 52.5(17) . . . . ?
C37 C38 C39 C40 -57(2) . . . . ?
C38 C37 C42 C41 -52.2(19) . . . . ?
C38 C39 C40 C41 54(2) . . . . ?
C39 C40 C41 C42 -54(2) . . . . ?
C40 C41 C42 C37 53(2) . . . . ?
C42 C37 C38 C39 55(2) . . . . ?
C43 C44 C45 C46 50(3) . . . . ?
C44 C43 C48 C47 59(2) . . . . ?
C44 C45 C46 C47 -53(3) . . . . ?
C45 C46 C47 C48 52(3) . . . . ?
C46 C47 C48 C43 -58(2) . . . . ?
C48 C43 C44 C45 -51(2) . . . . ?
C49 C50 C51 C52 56(2) . . . . ?
C50 C49 C54 C53 53.0(18) . . . . ?
C50 C51 C52 C53 -62(2) . . . . ?
C51 C52 C53 C54 62(2) . . . . ?
C52 C53 C54 C49 -57(2) . . . . ?
C54 C49 C50 C51 -53.0(18) . . . . ?
C55 C56 C57 C58 57.1(18) . . . . ?
C56 C55 C60 C59 56.7(17) . . . . ?
C56 C57 C58 C59 -60(2) . . . . ?
C57 C58 C59 C60 57.8(19) . . . . ?
C58 C59 C60 C55 -55.5(18) . . . . ?
C60 C55 C56 C57 -56.5(17) . . . . ?
C61 C62 C63 C64 61.7(18) . . . . ?
C62 C61 C66 C65 56.2(16) . . . . ?
C62 C63 C64 C65 -61(2) . . . . ?
C63 C64 C65 C66 58.9(19) . . . . ?
C64 C65 C66 C61 -56.4(17) . . . . ?
C66 C61 C62 C63 -60.4(17) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 -0.500 0.008 2137.4 780.5 ?
2 0.172 0.424 0.417 7.3 0.0 ?
3 0.172 0.576 0.917 7.3 0.0 ?
4 0.198 0.434 0.793 12.5 0.0 ?
5 0.198 0.566 0.293 12.5 0.0 ?
6 0.227 0.512 0.642 27.9 7.8 ?
7 0.227 0.488 0.142 27.9 0.0 ?
8 0.273 -0.012 0.142 27.9 8.8 ?
9 0.273 0.012 0.642 27.9 0.0 ?
10 0.500 0.000 0.389 2137.4 780.5 ?
11 0.302 0.066 0.293 12.5 0.0 ?
12 0.302 0.934 0.793 12.5 0.0 ?
13 0.328 0.076 0.917 7.3 0.0 ?
14 0.328 0.924 0.417 7.3 0.0 ?
15 0.672 0.076 0.583 7.3 0.0 ?
16 0.672 0.924 0.083 7.3 0.0 ?
17 0.698 0.066 0.207 12.5 0.0 ?
18 0.698 0.934 0.707 12.5 0.0 ?
19 0.727 -0.012 0.358 27.9 4.7 ?
20 0.727 0.012 0.858 27.9 0.0 ?
21 0.773 0.488 0.358 27.9 0.0 ?
22 0.773 0.512 0.858 27.9 4.9 ?
23 0.802 0.434 0.707 12.5 0.0 ?
24 0.802 0.566 0.207 12.5 0.0 ?
25 0.828 0.424 0.083 7.3 0.0 ?
26 0.828 0.576 0.583 7.3 0.0 ?

_shelx_SHELXL_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_160520
_database_code_depnum_ccdc_archive 'CCDC 1523233'
_audit_update_record             
;
2016-12-17 deposited with the CCDC.
2017-01-20 downloaded from the CCDC.
;
_audit_creation_date             2016-06-19
_audit_creation_method           
;
Olex2 1.2
(compiled 2016.02.19 svn.r3266 for OlexSys, GUI svn.r5155)
;
_shelxl_version_number           2013-4
_chemical_name_common            ?
_chemical_name_systematic        Au42(SC6H11)26
_chemical_formula_moiety         'C156 H283 Au42 S26'
_chemical_formula_sum            'C156 H286 Au42 S26'
_chemical_formula_weight         11267.98
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -4.4197 7.2980 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   20.6257(11)
_cell_length_b                   20.7452(11)
_cell_length_c                   30.3877(16)
_cell_angle_alpha                78.427(3)
_cell_angle_beta                 80.789(3)
_cell_angle_gamma                62.667(2)
_cell_volume                     11281.4(11)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9597
_cell_measurement_temperature    173
_cell_measurement_theta_max      67.24
_cell_measurement_theta_min      2.42
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    52.356
_exptl_absorpt_correction_T_max  0.0211
_exptl_absorpt_correction_T_min  0.0001
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014) was used for absorption correction.
wR2(int) was 0.1677 before and 0.1037 after correction.
The Ratio of minimum to maximum transmission is 0.0047.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            black
_exptl_crystal_colour_primary    black
_exptl_crystal_density_diffrn    3.317
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             9912
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0913
_diffrn_reflns_av_unetI/netI     0.0776
_diffrn_reflns_Laue_measured_fraction_full 0.931
_diffrn_reflns_Laue_measured_fraction_max 0.955
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_number            151316
_diffrn_reflns_point_group_measured_fraction_full 0.931
_diffrn_reflns_point_group_measured_fraction_max 0.955
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         66.500
_diffrn_reflns_theta_min         2.423
_diffrn_ambient_temperature      172.99
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.931
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                25534
_reflns_number_total             38006
_reflns_special_details          
;
 Data were apparently pre-merged, so _diffrn_reflns_number
 etc. will have to be added later.
 
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'XT (Sheldrick, 2015)'
_refine_diff_density_max         10.495
_refine_diff_density_min         -6.544
_refine_diff_density_rms         1.161
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.514
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           fullcycle
_refine_ls_number_parameters     2017
_refine_ls_number_reflns         38006
_refine_ls_number_restraints     1244
_refine_ls_R_factor_all          0.1989
_refine_ls_R_factor_gt           0.1663
_refine_ls_restrained_S_all      1.489
_refine_ls_shift/su_max          0.009
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.2000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3875
_refine_ls_wR_factor_ref         0.4088
_refine_special_details          
;
 ?
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2. Restrained distances
 C84-C79 = C83-C84 = C80-C81
 1.52 with sigma of 0.02
 C79-C80
 1.52 with sigma of 0.02
 C83-C81
 2.48 with sigma of 0.02
 C84-C80
 2.48 with sigma of 0.02
 C83-C81
 2.48 with sigma of 0.02
 C82-C81
 1.52 with sigma of 0.02
 C84-C82
 2.48 with sigma of 0.02
 C84-S14
 2.74 with sigma of 0.02
 C80-C84
 2.49 with sigma of 0.02
 C83-C82
 1.52 with sigma of 0.02
 C81-C83
 2.48 with sigma of 0.02
 C83-C79
 2.48 with sigma of 0.02
 C17-C15
 2.48 with sigma of 0.02
 C14-C15
 1.52 with sigma of 0.02
 C14-C13 = C18-C13 = C17-C18 = C17-C16 = C15-C16
 1.52 with sigma of 0.02
 C14-C16
 2.48 with sigma of 0.02
 C153-C154 = C155-C154 = C155-C156 = C151-C156 = C152-C151 = C152-C153
 1.52 with sigma of 0.02
 C55-C56 = C55-C60 = C60-C59 = C58-C59 = C56-C57 = C58-C57
 1.52 with sigma of 0.02
 C56-C60 = C55-C59 = C56-C58 = C57-C59 = C55-C57
 2.48 with sigma of 0.02
 S14-C79
 1.78 with sigma of 0.02
 S10-C55
 1.78 with sigma of 0.02
 S13-C73
 1.78 with sigma of 0.02
 C73-C78
 1.52 with sigma of 0.02
 C74-C78
 2.48 with sigma of 0.02
 C78-C73 = C74-C75 = C74-C73
 1.52 with sigma of 0.02
 C78-C77 = C76-C77 = C76-C75 = C74-C75
 1.52 with sigma of 0.02
 C74-C76 = C78-C76 = C77-C75
 2.48 with sigma of 0.02
 C74-C129
 2.8 with sigma of 0.02
3. Rigid bond restraints
 C8, C9
 with sigma for 1-2 distances of 0.005 and sigma for 1-3 distances of 0.005
4. Uiso/Uaniso restraints and constraints
S14 \\sim C79 \\sim C80 \\sim C81 \\sim C82 \\sim C83 \\sim C84: within 2A with
sigma of 0.005 and sigma for terminal atoms of 0.01
S3 \\sim C13 \\sim C18 \\sim C17 \\sim C16 \\sim C15 \\sim C14: within 2A with
sigma of 0.005 and sigma for terminal atoms of 0.01
S10 \\sim C55 \\sim C60 \\sim C59 \\sim C58 \\sim C57 \\sim C56: within 2A with
sigma of 0.005 and sigma for terminal atoms of 0.01
S1 \\sim C1 \\sim C2 \\sim C3 \\sim C4 \\sim C5 \\sim C6: within 2A with sigma
of 0.005 and sigma for terminal atoms of 0.01
S5 \\sim C25 \\sim C30 \\sim C29 \\sim C28 \\sim C27 \\sim C26: within 2A with
sigma of 0.005 and sigma for terminal atoms of 0.01
S13 \\sim C73 \\sim C74 \\sim C75 \\sim C76 \\sim C77 \\sim C78: within 2A with
sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(C1) \\sim Ueq, Uanis(C2) \\sim Ueq, Uanis(C3) \\sim Ueq, Uanis(C4) \\sim
Ueq, Uanis(C5) \\sim Ueq, Uanis(C6) \\sim Ueq, Uanis(C7) \\sim Ueq, Uanis(C8)
\\sim Ueq, Uanis(C9) \\sim Ueq, Uanis(C10) \\sim Ueq, Uanis(C11) \\sim Ueq,
Uanis(C12) \\sim Ueq, Uanis(C13) \\sim Ueq, Uanis(C14) \\sim Ueq, Uanis(C15)
\\sim Ueq, Uanis(C16) \\sim Ueq, Uanis(C17) \\sim Ueq, Uanis(C18) \\sim Ueq,
Uanis(C19) \\sim Ueq, Uanis(C20) \\sim Ueq, Uanis(C21) \\sim Ueq, Uanis(C22)
\\sim Ueq, Uanis(C23) \\sim Ueq, Uanis(C24) \\sim Ueq, Uanis(C25) \\sim Ueq,
Uanis(C26) \\sim Ueq, Uanis(C27) \\sim Ueq, Uanis(C28) \\sim Ueq, Uanis(C29)
\\sim Ueq, Uanis(C30) \\sim Ueq, Uanis(C31) \\sim Ueq, Uanis(C32) \\sim Ueq,
Uanis(C33) \\sim Ueq, Uanis(C34) \\sim Ueq, Uanis(C35) \\sim Ueq, Uanis(C36)
\\sim Ueq, Uanis(C37) \\sim Ueq, Uanis(C38) \\sim Ueq, Uanis(C39) \\sim Ueq,
Uanis(C40) \\sim Ueq, Uanis(C41) \\sim Ueq, Uanis(C42) \\sim Ueq, Uanis(C43)
\\sim Ueq, Uanis(C44) \\sim Ueq, Uanis(C45) \\sim Ueq, Uanis(C46) \\sim Ueq,
Uanis(C47) \\sim Ueq, Uanis(C48) \\sim Ueq, Uanis(C49) \\sim Ueq, Uanis(C50)
\\sim Ueq, Uanis(C51) \\sim Ueq, Uanis(C52) \\sim Ueq, Uanis(C53) \\sim Ueq,
Uanis(C54) \\sim Ueq, Uanis(C55) \\sim Ueq, Uanis(C56) \\sim Ueq, Uanis(C57)
\\sim Ueq, Uanis(C58) \\sim Ueq, Uanis(C59) \\sim Ueq, Uanis(C60) \\sim Ueq,
Uanis(C61) \\sim Ueq, Uanis(C62) \\sim Ueq, Uanis(C63) \\sim Ueq, Uanis(C64)
\\sim Ueq, Uanis(C65) \\sim Ueq, Uanis(C66) \\sim Ueq, Uanis(C67) \\sim Ueq,
Uanis(C68) \\sim Ueq, Uanis(C69) \\sim Ueq, Uanis(C70) \\sim Ueq, Uanis(C71)
\\sim Ueq, Uanis(C72) \\sim Ueq, Uanis(C73) \\sim Ueq, Uanis(C74) \\sim Ueq,
Uanis(C75) \\sim Ueq, Uanis(C76) \\sim Ueq, Uanis(C77) \\sim Ueq, Uanis(C78)
\\sim Ueq, Uanis(C79) \\sim Ueq, Uanis(C80) \\sim Ueq, Uanis(C81) \\sim Ueq,
Uanis(C82) \\sim Ueq, Uanis(C83) \\sim Ueq, Uanis(C84) \\sim Ueq, Uanis(C85)
\\sim Ueq, Uanis(C86) \\sim Ueq, Uanis(C87) \\sim Ueq, Uanis(C88) \\sim Ueq,
Uanis(C89) \\sim Ueq, Uanis(C90) \\sim Ueq, Uanis(C91) \\sim Ueq, Uanis(C92)
\\sim Ueq, Uanis(C93) \\sim Ueq, Uanis(C94) \\sim Ueq, Uanis(C95) \\sim Ueq,
Uanis(C96) \\sim Ueq, Uanis(C97) \\sim Ueq, Uanis(C98) \\sim Ueq, Uanis(C99)
\\sim Ueq, Uanis(C100) \\sim Ueq, Uanis(C101) \\sim Ueq, Uanis(C102) \\sim Ueq,
Uanis(C103) \\sim Ueq, Uanis(C104) \\sim Ueq, Uanis(C105) \\sim Ueq,
Uanis(C106) \\sim Ueq, Uanis(C107) \\sim Ueq, Uanis(C108) \\sim Ueq,
Uanis(C109) \\sim Ueq, Uanis(C110) \\sim Ueq, Uanis(C111) \\sim Ueq,
Uanis(C112) \\sim Ueq, Uanis(C113) \\sim Ueq, Uanis(C114) \\sim Ueq,
Uanis(C115) \\sim Ueq, Uanis(C116) \\sim Ueq, Uanis(C117) \\sim Ueq,
Uanis(C118) \\sim Ueq, Uanis(C119) \\sim Ueq, Uanis(C120) \\sim Ueq,
Uanis(C121) \\sim Ueq, Uanis(C122) \\sim Ueq, Uanis(C123) \\sim Ueq,
Uanis(C124) \\sim Ueq, Uanis(C125) \\sim Ueq, Uanis(C126) \\sim Ueq,
Uanis(C127) \\sim Ueq, Uanis(C128) \\sim Ueq, Uanis(C129) \\sim Ueq,
Uanis(C130) \\sim Ueq, Uanis(C131) \\sim Ueq, Uanis(C132) \\sim Ueq,
Uanis(C133) \\sim Ueq, Uanis(C134) \\sim Ueq, Uanis(C135) \\sim Ueq,
Uanis(C136) \\sim Ueq, Uanis(C137) \\sim Ueq, Uanis(C138) \\sim Ueq,
Uanis(C139) \\sim Ueq, Uanis(C140) \\sim Ueq, Uanis(C141) \\sim Ueq,
Uanis(C142) \\sim Ueq, Uanis(C143) \\sim Ueq, Uanis(C144) \\sim Ueq,
Uanis(C145) \\sim Ueq, Uanis(C146) \\sim Ueq, Uanis(C147) \\sim Ueq,
Uanis(C148) \\sim Ueq, Uanis(C149) \\sim Ueq, Uanis(C150) \\sim Ueq,
Uanis(C151) \\sim Ueq, Uanis(C152) \\sim Ueq, Uanis(C153) \\sim Ueq,
Uanis(C154) \\sim Ueq, Uanis(C155) \\sim Ueq, Uanis(C156) \\sim Ueq: with sigma
of 0.005 and sigma for terminal atoms of 0.01
5.a Ternary CH refined with riding coordinates:
 C1(H1), C7(H7), C13(H13), C19(H19), C25(H25), C31(H31), C37(H37), C43(H43),
 C49(H49), C61(H61), C67(H67), C73(H73), C79(H79), C85(H85), C91(H91), C97(H97),
  C103(H103), C109(H109), C115(H115), C121(H121), C127(H127), C133(H133),
 C139(H139), C145(H145), C151(H151)
5.b Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B), C3(H3A,H3B), C4(H4A,H4B), C5(H5A,H5B), C6(H6A,H6B), C8(H8A,H8B),
 C9(H9A,H9B), C10(H10A,H10B), C11(H11A,H11B), C12(H12A,H12B), C14(H14A,H14B),
 C15(H15A,H15B), C16(H16A,H16B), C17(H17A,H17B), C18(H18A,H18B), C20(H20A,H20B),
  C21(H21A,H21B), C22(H22A,H22B), C23(H23A,H23B), C24(H24A,H24B), C26(H26A,
 H26B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B), C30(H30A,H30B),
 C32(H32A,H32B), C33(H33A,H33B), C34(H34A,H34B), C35(H35A,H35B), C36(H36A,H36B),
  C38(H38A,H38B), C39(H39A,H39B), C40(H40A,H40B), C41(H41A,H41B), C42(H42A,
 H42B), C44(H44A,H44B), C45(H45A,H45B), C46(H46A,H46B), C47(H47A,H47B),
 C48(H48A,H48B), C50(H50A,H50B), C51(H51A,H51B), C52(H52A,H52B), C53(H53A,H53B),
  C54(H54A,H54B), C56(H56A,H56B), C57(H57A,H57B), C58(H58A,H58B), C59(H59A,
 H59B), C60(H60A,H60B), C62(H62A,H62B), C63(H63A,H63B), C64(H64A,H64B),
 C65(H65A,H65B), C66(H66A,H66B), C68(H68A,H68B), C69(H69A,H69B), C70(H70A,H70B),
  C71(H71A,H71B), C72(H72A,H72B), C74(H74A,H74B), C75(H75A,H75B), C76(H76A,
 H76B), C77(H77A,H77B), C78(H78A,H78B), C80(H80A,H80B), C81(H81A,H81B),
 C82(H82A,H82B), C83(H83A,H83B), C84(H84A,H84B), C86(H86A,H86B), C87(H87A,H87B),
  C88(H88A,H88B), C89(H89A,H89B), C90(H90A,H90B), C92(H92A,H92B), C93(H93A,
 H93B), C94(H94A,H94B), C95(H95A,H95B), C96(H96A,H96B), C98(H98A,H98B),
 C99(H99A,H99B), C100(H10C,H10D), C101(H10E,H10F), C102(H10G,H10H), C104(H10I,
 H10J), C105(H10K,H10L), C106(H10M,H10N), C107(H10O,H10P), C108(H10Q,H10R),
 C110(H11C,H11D), C111(H11E,H11F), C112(H11G,H11H), C113(H11I,H11J), C114(H11K,
 H11L), C116(H11M,H11N), C117(H11O,H11P), C118(H11Q,H11R), C119(H11S,H11T),
 C120(H12C,H12D), C122(H12E,H12F), C123(H12G,H12H), C124(H12I,H12J), C125(H12K,
 H12L), C126(H12M,H12N), C128(H12O,H12P), C130(H13A,H13B), C131(H13C,H13D),
 C132(H13E,H13F), C134(H13G,H13H), C135(H13I,H13J), C136(H13K,H13L), C137(H13M,
 H13N), C138(H13O,H13P), C140(H14C,H14D), C141(H14E,H14F), C142(H14G,H14H),
 C143(H14I,H14J), C144(H14K,H14L), C146(H14M,H14N), C147(H14O,H14P), C148(H14Q,
 H14R), C149(H14S,H14T), C150(H15C,H15D), C152(H15E,H15F), C153(H15G,H15H),
 C154(H15I,H15J), C155(H15K,H15L), C156(H15M,H15N)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.3567 0.2850 0.7335 0.0542(4) Uani 1 1 d . . . . .
Au2 Au 0.4771 0.2022 0.7885 0.0507(4) Uani 1 1 d . . . . .
Au3 Au 0.5942 0.1239 0.8432 0.0560(4) Uani 1 1 d . . . . .
Au4 Au 0.5998 0.2345 0.7775 0.0539(4) Uani 1 1 d . . . . .
Au5 Au 0.4823 0.3228 0.7176 0.0516(4) Uani 1 1 d . . . . .
Au6 Au 0.5793 0.1734 0.7061 0.0534(4) Uani 1 1 d . . . . .
Au7 Au 0.3805 0.3583 0.7950 0.0540(4) Uani 1 1 d . . . . .
Au8 Au 0.3870 0.4669 0.7295 0.0578(4) Uani 1 1 d . . . . .
Au9 Au 0.3423 0.3970 0.6662 0.0612(4) Uani 1 1 d . . . . .
Au10 Au 0.4683 0.4310 0.5946 0.0655(5) Uani 1 1 d . . . . .
Au11 Au 0.5005 0.4946 0.6650 0.0710(5) Uani 1 1 d . . . . .
Au12 Au 0.4654 0.2532 0.6516 0.0568(4) Uani 1 1 d . . . . .
Au13 Au 0.5650 0.0913 0.6334 0.0638(4) Uani 1 1 d . . . . .
Au14 Au 0.6879 0.0409 0.6887 0.0613(4) Uani 1 1 d . . . . .
Au15 Au 0.5863 0.0533 0.7648 0.0581(4) Uani 1 1 d . . . . .
Au16 Au 0.4473 0.1418 0.7218 0.0552(4) Uani 1 1 d . . . . .
Au17 Au 0.3552 0.1735 0.7985 0.0566(4) Uani 1 1 d . . . . .
Au18 Au 0.4652 0.0256 0.8401 0.0632(4) Uani 1 1 d . . . . .
Au19 Au 0.2084 0.2317 0.7622 0.0632(4) Uani 1 1 d . . . . .
Au20 Au 0.2267 0.3563 0.6964 0.0635(4) Uani 1 1 d . . . . .
Au21 Au 0.3199 0.2187 0.6595 0.0616(4) Uani 1 1 d . . . . .
Au22 Au 0.5802 0.2879 0.6419 0.0575(4) Uani 1 1 d . . . . .
Au23 Au 0.6231 0.3417 0.7177 0.0662(5) Uani 1 1 d . . . . .
Au24 Au 0.7328 0.2329 0.7737 0.0663(5) Uani 1 1 d . . . . .
Au25 Au 0.8966 0.1096 0.7383 0.0744(5) Uani 1 1 d . . . . .
Au26 Au 0.7001 0.0860 0.7640 0.0597(4) Uani 1 1 d . . . . .
Au27 Au 0.6996 0.1533 0.6080 0.0669(5) Uani 1 1 d . . . . .
Au28 Au 0.6365 0.3001 0.8498 0.0721(5) Uani 1 1 d . . . . .
Au29 Au 0.4973 0.3918 0.7860 0.0583(4) Uani 1 1 d . . . . .
Au30 Au 0.3935 0.4423 0.8699 0.0668(5) Uani 1 1 d . . . . .
Au31 Au 0.2707 0.4160 0.8576 0.0680(5) Uani 1 1 d . . . . .
Au32 Au 0.2650 0.5537 0.7911 0.0723(5) Uani 1 1 d . . . . .
Au33 Au 0.2558 0.4382 0.7431 0.0640(5) Uani 1 1 d . . . . .
Au34 Au 0.2522 0.3266 0.8106 0.0638(4) Uani 1 1 d . . . . .
Au35 Au 0.3640 0.2609 0.8656 0.0624(4) Uani 1 1 d . . . . .
Au36 Au 0.5047 0.2670 0.8540 0.0576(4) Uani 1 1 d . . . . .
Au37 Au 0.4818 0.0972 0.9119 0.0643(4) Uani 1 1 d . . . . .
Au38 Au 0.7430 0.1116 0.8521 0.0642(4) Uani 1 1 d . . . . .
Au39 Au 0.7029 0.2022 0.6990 0.0635(4) Uani 1 1 d . . . . .
Au40 Au 0.0967 0.4998 0.8484 0.1311(14) Uani 1 1 d . . . . .
Au41 Au 0.0686 0.4600 0.7431 0.0760(5) Uani 1 1 d . . . . .
Au42 Au 0.8638 -0.0066 0.6743 0.0761(5) Uani 1 1 d . . . . .
S1 S 0.5923 0.3706 0.5781 0.070(2) Uani 1 1 d . U . . .
S2 S 0.6263 0.4366 0.6605 0.067(3) Uani 1 1 d . . . . .
S3 S 0.3786 0.5729 0.6776 0.080(3) Uani 1 1 d . U . . .
S4 S 0.3424 0.4857 0.6035 0.068(3) Uani 1 1 d . . . . .
S5 S 0.6260 0.1297 0.5706 0.075(3) Uani 1 1 d . U . . .
S6 S 0.7894 0.1625 0.6379 0.067(3) Uani 1 1 d . . . . .
S7 S 0.7888 -0.0474 0.6536 0.069(3) Uani 1 1 d . . . . .
S8 S 0.9472 0.0332 0.6837 0.081(3) Uani 1 1 d . . . . .
S9 S 0.8540 0.1878 0.7908 0.069(3) Uani 1 1 d . . . . .
S10 S 0.5905 0.4136 0.8065 0.098(4) Uani 1 1 d D U . . .
S11 S 0.3448 0.5602 0.8324 0.064(2) Uani 1 1 d . . . . .
S12 S 0.1748 0.5610 0.7522 0.074(3) Uani 1 1 d . . . . .
S13 S 0.1675 0.4489 0.9109 0.143(6) Uani 1 1 d D U . . .
S14 S 0.0179 0.5430 0.7936 0.101(4) Uani 1 1 d D U . . .
S15 S 0.1036 0.3882 0.6873 0.074(3) Uani 1 1 d . . . . .
S16 S 0.3777 0.2698 0.6040 0.063(2) Uani 1 1 d . . . . .
S17 S 0.5048 0.0361 0.6859 0.065(3) Uani 1 1 d . . . . .
S18 S 0.5839 -0.0463 0.8187 0.065(2) Uani 1 1 d . . . . .
S19 S 0.8029 0.0217 0.8061 0.062(2) Uani 1 1 d . . . . .
S20 S 0.6981 0.1974 0.9008 0.071(3) Uani 1 1 d . . . . .
S21 S 0.6059 0.0274 0.9043 0.064(2) Uani 1 1 d . . . . .
S22 S 0.3604 0.1734 0.9278 0.071(3) Uani 1 1 d . . . . .
S23 S 0.3377 0.0804 0.8519 0.063(2) Uani 1 1 d . . . . .
S24 S 0.2540 0.1622 0.7044 0.062(2) Uani 1 1 d . . . . .
S25 S 0.1482 0.3051 0.8175 0.069(3) Uani 1 1 d . . . . .
S26 S 0.4428 0.3313 0.9157 0.069(3) Uani 1 1 d . . . . .
C1 C 0.5960 0.3277 0.5268 0.076(3) Uani 1 1 d . U . . .
H1 H 0.5775 0.2897 0.5356 0.091 Uiso 1 1 calc R . . . .
C2 C 0.5542 0.3845 0.4910 0.076(4) Uani 1 1 d . U . . .
H2A H 0.5699 0.4241 0.4851 0.091 Uiso 1 1 calc R . . . .
H2B H 0.5015 0.4060 0.5013 0.091 Uiso 1 1 calc R . . . .
C3 C 0.5649 0.3543 0.4485 0.078(4) Uani 1 1 d . U . . .
H3A H 0.5369 0.3930 0.4247 0.094 Uiso 1 1 calc R . . . .
H3B H 0.5498 0.3143 0.4534 0.094 Uiso 1 1 calc R . . . .
C4 C 0.6592 0.3213 0.4346 0.080(4) Uani 1 1 d . U . . .
H4A H 0.6716 0.3060 0.4043 0.096 Uiso 1 1 calc R . . . .
H4B H 0.6744 0.3602 0.4342 0.096 Uiso 1 1 calc R . . . .
C5 C 0.6948 0.2624 0.4662 0.080(4) Uani 1 1 d . U . . .
H5A H 0.7480 0.2388 0.4573 0.097 Uiso 1 1 calc R . . . .
H5B H 0.6758 0.2256 0.4692 0.097 Uiso 1 1 calc R . . . .
C6 C 0.6811 0.2912 0.5099 0.078(4) Uani 1 1 d . U . . .
H6A H 0.7001 0.3281 0.5062 0.094 Uiso 1 1 calc R . . . .
H6B H 0.7083 0.2504 0.5332 0.094 Uiso 1 1 calc R . . . .
C7 C 0.6437 0.5055 0.6816 0.090(15) Uani 1 1 d . U . . .
H7 H 0.6078 0.5199 0.7083 0.108 Uiso 1 1 calc R . . . .
C8 C 0.6200 0.5749 0.6462 0.125(18) Uani 1 1 d . U . . .
H8A H 0.5671 0.5942 0.6427 0.151 Uiso 1 1 calc R . . . .
H8B H 0.6467 0.5613 0.6168 0.151 Uiso 1 1 calc R . . . .
C9 C 0.6355 0.6420 0.6592 0.131(18) Uani 1 1 d . U . . .
H9A H 0.6025 0.6644 0.6851 0.157 Uiso 1 1 calc R . . . .
H9B H 0.6312 0.6806 0.6332 0.157 Uiso 1 1 calc R . . . .
C10 C 0.7264 0.5889 0.6733 0.19(4) Uani 1 1 d . U . . .
H10A H 0.7576 0.5668 0.6469 0.222 Uiso 1 1 calc R . . . .
H10B H 0.7451 0.6203 0.6822 0.222 Uiso 1 1 calc R . . . .
C11 C 0.7293 0.5326 0.7096 0.12(2) Uani 1 1 d . U . . .
H11A H 0.6942 0.5553 0.7346 0.139 Uiso 1 1 calc R . . . .
H11B H 0.7789 0.5080 0.7205 0.139 Uiso 1 1 calc R . . . .
C12 C 0.7126 0.4783 0.6980 0.080(13) Uani 1 1 d . U . . .
H12A H 0.7505 0.4525 0.6749 0.096 Uiso 1 1 calc R . . . .
H12B H 0.7157 0.4416 0.7250 0.096 Uiso 1 1 calc R . . . .
C13 C 0.3725 0.6426 0.7133 0.090(4) Uani 1 1 d D U . . .
H13 H 0.3367 0.6396 0.7391 0.108 Uiso 1 1 calc R . . . .
C14 C 0.3295 0.7174 0.6864 0.094(5) Uani 1 1 d D U . . .
H14A H 0.2790 0.7245 0.6853 0.113 Uiso 1 1 calc R . . . .
H14B H 0.3521 0.7179 0.6552 0.113 Uiso 1 1 calc R . . . .
C15 C 0.3261 0.7817 0.7055 0.096(5) Uani 1 1 d D U . . .
H15A H 0.3115 0.8258 0.6823 0.115 Uiso 1 1 calc R . . . .
H15B H 0.2893 0.7931 0.7316 0.115 Uiso 1 1 calc R . . . .
C16 C 0.4013 0.7609 0.7200 0.096(5) Uani 1 1 d D U . . .
H16A H 0.4368 0.7554 0.6932 0.115 Uiso 1 1 calc R . . . .
H16B H 0.3991 0.8000 0.7351 0.115 Uiso 1 1 calc R . . . .
C17 C 0.4258 0.6891 0.7522 0.095(5) Uani 1 1 d D U . . .
H17A H 0.4707 0.6812 0.7648 0.114 Uiso 1 1 calc R . . . .
H17B H 0.3876 0.6963 0.7775 0.114 Uiso 1 1 calc R . . . .
C18 C 0.4419 0.6180 0.7361 0.093(5) Uani 1 1 d D U . . .
H18A H 0.4859 0.6021 0.7147 0.112 Uiso 1 1 calc R . . . .
H18B H 0.4478 0.5781 0.7616 0.112 Uiso 1 1 calc R . . . .
C19 C 0.3170 0.4575 0.5566 0.055(9) Uani 1 1 d . U . . .
H19 H 0.3538 0.4062 0.5529 0.066 Uiso 1 1 calc R . . . .
C20 C 0.2411 0.4594 0.5663 0.059(9) Uani 1 1 d . U . . .
H20A H 0.2042 0.5082 0.5735 0.070 Uiso 1 1 calc R . . . .
H20B H 0.2410 0.4220 0.5923 0.070 Uiso 1 1 calc R . . . .
C21 C 0.2232 0.4431 0.5233 0.071(11) Uani 1 1 d . U . . .
H21A H 0.2554 0.3910 0.5203 0.085 Uiso 1 1 calc R . . . .
H21B H 0.1722 0.4493 0.5278 0.085 Uiso 1 1 calc R . . . .
C22 C 0.2307 0.4863 0.4818 0.12(2) Uani 1 1 d . U . . .
H22A H 0.1938 0.5378 0.4826 0.141 Uiso 1 1 calc R . . . .
H22B H 0.2205 0.4686 0.4569 0.141 Uiso 1 1 calc R . . . .
C23 C 0.3115 0.4836 0.4713 0.078(12) Uani 1 1 d . U . . .
H23A H 0.3494 0.4334 0.4674 0.093 Uiso 1 1 calc R . . . .
H23B H 0.3136 0.5178 0.4438 0.093 Uiso 1 1 calc R . . . .
C24 C 0.3212 0.5077 0.5135 0.079(13) Uani 1 1 d . U . . .
H24A H 0.3693 0.5087 0.5099 0.095 Uiso 1 1 calc R . . . .
H24B H 0.2828 0.5581 0.5161 0.095 Uiso 1 1 calc R . . . .
C25 C 0.6911 0.0422 0.5465 0.081(4) Uani 1 1 d . U . . .
H25 H 0.7384 0.0241 0.5603 0.097 Uiso 1 1 calc R . . . .
C26 C 0.6691 -0.0133 0.5597 0.083(4) Uani 1 1 d . U . . .
H26A H 0.6209 0.0017 0.5485 0.099 Uiso 1 1 calc R . . . .
H26B H 0.6652 -0.0251 0.5929 0.099 Uiso 1 1 calc R . . . .
C27 C 0.7327 -0.0845 0.5372 0.084(5) Uani 1 1 d . U . . .
H27A H 0.7803 -0.0984 0.5487 0.101 Uiso 1 1 calc R . . . .
H27B H 0.7206 -0.1265 0.5464 0.101 Uiso 1 1 calc R . . . .
C28 C 0.7389 -0.0697 0.4902 0.083(5) Uani 1 1 d . U . . .
H28A H 0.7790 -0.1131 0.4781 0.100 Uiso 1 1 calc R . . . .
H28B H 0.6929 -0.0605 0.4784 0.100 Uiso 1 1 calc R . . . .
C29 C 0.7524 -0.0124 0.4763 0.083(4) Uani 1 1 d . U . . .
H29A H 0.7502 -0.0020 0.4431 0.100 Uiso 1 1 calc R . . . .
H29B H 0.8038 -0.0281 0.4820 0.100 Uiso 1 1 calc R . . . .
C30 C 0.7094 0.0563 0.4931 0.083(4) Uani 1 1 d . U . . .
H30A H 0.6633 0.0838 0.4779 0.100 Uiso 1 1 calc R . . . .
H30B H 0.7368 0.0862 0.4864 0.100 Uiso 1 1 calc R . . . .
C31 C 0.7978 0.2463 0.6089 0.069(11) Uani 1 1 d . U . . .
H31 H 0.7488 0.2863 0.6006 0.082 Uiso 1 1 calc R . . . .
C32 C 0.8507 0.2264 0.5664 0.063(10) Uani 1 1 d . U . . .
H32A H 0.8296 0.2110 0.5458 0.075 Uiso 1 1 calc R . . . .
H32B H 0.8976 0.1845 0.5752 0.075 Uiso 1 1 calc R . . . .
C33 C 0.8654 0.2918 0.5415 0.082(13) Uani 1 1 d . U . . .
H33A H 0.9021 0.2759 0.5157 0.098 Uiso 1 1 calc R . . . .
H33B H 0.8196 0.3315 0.5295 0.098 Uiso 1 1 calc R . . . .
C34 C 0.8916 0.3195 0.5708 0.099(17) Uani 1 1 d . U . . .
H34A H 0.8929 0.3655 0.5549 0.119 Uiso 1 1 calc R . . . .
H34B H 0.9424 0.2835 0.5771 0.119 Uiso 1 1 calc R . . . .
C35 C 0.8454 0.3349 0.6160 0.098(17) Uani 1 1 d . U . . .
H35A H 0.8712 0.3463 0.6358 0.117 Uiso 1 1 calc R . . . .
H35B H 0.7980 0.3784 0.6104 0.117 Uiso 1 1 calc R . . . .
C36 C 0.8310 0.2700 0.6399 0.070(11) Uani 1 1 d . U . . .
H36A H 0.8776 0.2284 0.6495 0.084 Uiso 1 1 calc R . . . .
H36B H 0.7973 0.2840 0.6671 0.084 Uiso 1 1 calc R . . . .
C37 C 0.8156 -0.1439 0.6851 0.074(12) Uani 1 1 d . U . . .
H37 H 0.7907 -0.1414 0.7162 0.089 Uiso 1 1 calc R . . . .
C38 C 0.7886 -0.1774 0.6601 0.096(16) Uani 1 1 d . U . . .
H38A H 0.8102 -0.1775 0.6285 0.115 Uiso 1 1 calc R . . . .
H38B H 0.7346 -0.1511 0.6601 0.115 Uiso 1 1 calc R . . . .
C39 C 0.8146 -0.2610 0.6866 0.101(17) Uani 1 1 d . U . . .
H39A H 0.7914 -0.2598 0.7178 0.121 Uiso 1 1 calc R . . . .
H39B H 0.7987 -0.2885 0.6712 0.121 Uiso 1 1 calc R . . . .
C40 C 0.8908 -0.2964 0.6876 0.087(14) Uani 1 1 d . U . . .
H40A H 0.9132 -0.2966 0.6562 0.104 Uiso 1 1 calc R . . . .
H40B H 0.9058 -0.3481 0.7016 0.104 Uiso 1 1 calc R . . . .
C41 C 0.9213 -0.2604 0.7139 0.095(16) Uani 1 1 d . U . . .
H41A H 0.8969 -0.2562 0.7447 0.114 Uiso 1 1 calc R . . . .
H41B H 0.9746 -0.2904 0.7161 0.114 Uiso 1 1 calc R . . . .
C42 C 0.9058 -0.1853 0.6881 0.107(19) Uani 1 1 d . U . . .
H42A H 0.9316 -0.1890 0.6576 0.128 Uiso 1 1 calc R . . . .
H42B H 0.9213 -0.1583 0.7042 0.128 Uiso 1 1 calc R . . . .
C43 C 1.0164 -0.0443 0.7108 0.089(15) Uani 1 1 d . U . . .
H43 H 1.0329 -0.0800 0.6889 0.106 Uiso 1 1 calc R . . . .
C44 C 1.0861 -0.0346 0.7124 0.071(11) Uani 1 1 d . U . . .
H44A H 1.0976 -0.0128 0.6819 0.086 Uiso 1 1 calc R . . . .
H44B H 1.0737 0.0018 0.7328 0.086 Uiso 1 1 calc R . . . .
C45 C 1.1552 -0.1012 0.7272 0.103(18) Uani 1 1 d . U . . .
H45A H 1.1959 -0.0881 0.7264 0.123 Uiso 1 1 calc R . . . .
H45B H 1.1703 -0.1397 0.7079 0.123 Uiso 1 1 calc R . . . .
C46 C 1.1320 -0.1270 0.7766 0.083(13) Uani 1 1 d . U . . .
H46A H 1.1176 -0.0876 0.7951 0.100 Uiso 1 1 calc R . . . .
H46B H 1.1743 -0.1707 0.7897 0.100 Uiso 1 1 calc R . . . .
C47 C 1.0621 -0.1476 0.7782 0.093(15) Uani 1 1 d . U . . .
H47A H 1.0786 -0.1932 0.7651 0.111 Uiso 1 1 calc R . . . .
H47B H 1.0425 -0.1552 0.8097 0.111 Uiso 1 1 calc R . . . .
C48 C 1.0054 -0.0859 0.7520 0.12(2) Uani 1 1 d . U . . .
H48A H 0.9722 -0.1050 0.7458 0.149 Uiso 1 1 calc R . . . .
H48B H 0.9768 -0.0498 0.7730 0.149 Uiso 1 1 calc R . . . .
C49 C 0.8876 0.2555 0.7675 0.060(9) Uani 1 1 d . U . . .
H49 H 0.8854 0.2664 0.7340 0.071 Uiso 1 1 calc R . . . .
C50 C 0.8419 0.3281 0.7888 0.071(11) Uani 1 1 d . U . . .
H50A H 0.7898 0.3477 0.7832 0.086 Uiso 1 1 calc R . . . .
H50B H 0.8456 0.3170 0.8218 0.086 Uiso 1 1 calc R . . . .
C51 C 0.8690 0.3869 0.7690 0.095(16) Uani 1 1 d . U . . .
H51A H 0.8386 0.4326 0.7822 0.114 Uiso 1 1 calc R . . . .
H51B H 0.8664 0.3983 0.7359 0.114 Uiso 1 1 calc R . . . .
C52 C 0.9549 0.3515 0.7820 0.081(13) Uani 1 1 d . U . . .
H52A H 0.9766 0.3856 0.7690 0.097 Uiso 1 1 calc R . . . .
H52B H 0.9572 0.3420 0.8151 0.097 Uiso 1 1 calc R . . . .
C53 C 0.9947 0.2822 0.7628 0.086(14) Uani 1 1 d . U . . .
H53A H 1.0469 0.2617 0.7685 0.104 Uiso 1 1 calc R . . . .
H53B H 0.9920 0.2943 0.7297 0.104 Uiso 1 1 calc R . . . .
C54 C 0.9696 0.2209 0.7796 0.071(11) Uani 1 1 d . U . . .
H54A H 0.9730 0.2059 0.8125 0.085 Uiso 1 1 calc R . . . .
H54B H 1.0004 0.1775 0.7642 0.085 Uiso 1 1 calc R . . . .
C55 C 0.5683 0.4764 0.8449 0.111(5) Uani 1 1 d D U . . .
C56 C 0.5327 0.5573 0.8252 0.114(5) Uani 1 1 d D U . . .
H56A H 0.4791 0.5754 0.8261 0.137 Uiso 1 1 calc R . . . .
H56B H 0.5516 0.5640 0.7934 0.137 Uiso 1 1 calc R . . . .
C57 C 0.5504 0.6002 0.8528 0.117(6) Uani 1 1 d D U . . .
H57A H 0.5267 0.5983 0.8837 0.140 Uiso 1 1 calc R . . . .
H57B H 0.5318 0.6522 0.8387 0.140 Uiso 1 1 calc R . . . .
C58 C 0.6333 0.5659 0.8543 0.117(6) Uani 1 1 d D U . . .
H58A H 0.6573 0.5618 0.8233 0.141 Uiso 1 1 calc R . . . .
H58B H 0.6469 0.5971 0.8679 0.141 Uiso 1 1 calc R . . . .
C59 C 0.6588 0.4901 0.8822 0.117(6) Uani 1 1 d D U . . .
H59A H 0.6735 0.4909 0.9115 0.140 Uiso 1 1 calc R . . . .
H59B H 0.7017 0.4541 0.8662 0.140 Uiso 1 1 calc R . . . .
C60 C 0.5964 0.4680 0.8900 0.114(5) Uani 1 1 d D U . . .
H60A H 0.6141 0.4165 0.9048 0.137 Uiso 1 1 calc R . . . .
H60B H 0.5564 0.4996 0.9099 0.137 Uiso 1 1 calc R . . . .
C61 C 0.2812 0.6233 0.8770 0.081(13) Uani 1 1 d . U . . .
H61 H 0.2484 0.6022 0.8949 0.097 Uiso 1 1 calc R . . . .
C62 C 0.2350 0.7016 0.8542 0.11(2) Uani 1 1 d . U . . .
H62A H 0.2661 0.7242 0.8368 0.138 Uiso 1 1 calc R . . . .
H62B H 0.2009 0.7028 0.8342 0.138 Uiso 1 1 calc R . . . .
C63 C 0.1960 0.7373 0.8937 0.14(3) Uani 1 1 d . U . . .
H63A H 0.1733 0.7077 0.9133 0.173 Uiso 1 1 calc R . . . .
H63B H 0.1565 0.7862 0.8839 0.173 Uiso 1 1 calc R . . . .
C64 C 0.2483 0.7455 0.9201 0.108(19) Uani 1 1 d . U . . .
H64A H 0.2758 0.7699 0.9000 0.130 Uiso 1 1 calc R . . . .
H64B H 0.2208 0.7749 0.9447 0.130 Uiso 1 1 calc R . . . .
C65 C 0.2930 0.6784 0.9367 0.14(3) Uani 1 1 d . U . . .
H65A H 0.2657 0.6599 0.9615 0.170 Uiso 1 1 calc R . . . .
H65B H 0.3327 0.6806 0.9499 0.170 Uiso 1 1 calc R . . . .
C66 C 0.3266 0.6249 0.9047 0.15(3) Uani 1 1 d . U . . .
H66A H 0.3654 0.6350 0.8854 0.175 Uiso 1 1 calc R . . . .
H66B H 0.3507 0.5754 0.9221 0.175 Uiso 1 1 calc R . . . .
C67 C 0.1799 0.6078 0.6957 0.082(13) Uani 1 1 d . U . . .
H67 H 0.2325 0.5881 0.6841 0.098 Uiso 1 1 calc R . . . .
C68 C 0.1398 0.5978 0.6642 0.060(9) Uani 1 1 d . U . . .
H68A H 0.0885 0.6121 0.6768 0.072 Uiso 1 1 calc R . . . .
H68B H 0.1620 0.5453 0.6608 0.072 Uiso 1 1 calc R . . . .
C69 C 0.1399 0.6449 0.6158 0.109(19) Uani 1 1 d . U . . .
H69A H 0.1911 0.6270 0.6024 0.131 Uiso 1 1 calc R . . . .
H69B H 0.1121 0.6353 0.5964 0.131 Uiso 1 1 calc R . . . .
C70 C 0.1073 0.7297 0.6145 0.107(19) Uani 1 1 d . U . . .
H70A H 0.0539 0.7522 0.6227 0.128 Uiso 1 1 calc R . . . .
H70B H 0.1179 0.7544 0.5847 0.128 Uiso 1 1 calc R . . . .
C71 C 0.1522 0.7304 0.6525 0.088(14) Uani 1 1 d . U . . .
H71A H 0.2043 0.7097 0.6409 0.105 Uiso 1 1 calc R . . . .
H71B H 0.1371 0.7826 0.6543 0.105 Uiso 1 1 calc R . . . .
C72 C 0.1500 0.6951 0.6978 0.075(12) Uani 1 1 d . U . . .
H72A H 0.0993 0.7157 0.7119 0.091 Uiso 1 1 calc R . . . .
H72B H 0.1815 0.7025 0.7157 0.091 Uiso 1 1 calc R . . . .
C73 C 0.1629 0.4720 0.9648 0.147(7) Uani 1 1 d D U . . .
H73 H 0.1095 0.5055 0.9690 0.176 Uiso 1 1 calc R . . . .
C74 C 0.1747 0.4243 1.0107 0.148(7) Uani 1 1 d D U . . .
H74A H 0.1969 0.3720 1.0067 0.178 Uiso 1 1 calc R . . . .
H74B H 0.1270 0.4361 1.0283 0.178 Uiso 1 1 calc R . . . .
C75 C 0.2247 0.4371 1.0361 0.149(7) Uani 1 1 d D U . . .
H75A H 0.2718 0.4273 1.0180 0.178 Uiso 1 1 calc R . . . .
H75B H 0.2350 0.4034 1.0650 0.178 Uiso 1 1 calc R . . . .
C76 C 0.1872 0.5165 1.0452 0.149(8) Uani 1 1 d D U . . .
H76A H 0.2150 0.5234 1.0661 0.179 Uiso 1 1 calc R . . . .
H76B H 0.1371 0.5284 1.0594 0.179 Uiso 1 1 calc R . . . .
C77 C 0.1838 0.5671 1.0007 0.148(7) Uani 1 1 d D U . . .
H77A H 0.1356 0.6107 0.9998 0.178 Uiso 1 1 calc R . . . .
H77B H 0.2223 0.5839 0.9978 0.178 Uiso 1 1 calc R . . . .
C78 C 0.1950 0.5257 0.9621 0.148(7) Uani 1 1 d D U . . .
H78A H 0.2485 0.4983 0.9556 0.177 Uiso 1 1 calc R . . . .
H78B H 0.1763 0.5629 0.9354 0.177 Uiso 1 1 calc R . . . .
C79 C -0.0597 0.5312 0.8226 0.107(5) Uani 1 1 d D U . . .
H79 H -0.0419 0.4785 0.8196 0.128 Uiso 1 1 calc R . . . .
C80 C -0.0894 0.5272 0.8719 0.110(5) Uani 1 1 d D U . . .
H80A H -0.0628 0.4768 0.8876 0.132 Uiso 1 1 calc R . . . .
H80B H -0.0809 0.5608 0.8866 0.132 Uiso 1 1 calc R . . . .
C81 C -0.1711 0.5481 0.8762 0.111(5) Uani 1 1 d D U . . .
H81A H -0.1812 0.5170 0.8601 0.134 Uiso 1 1 calc R . . . .
H81B H -0.1892 0.5424 0.9082 0.134 Uiso 1 1 calc R . . . .
C82 C -0.2067 0.6273 0.8550 0.111(6) Uani 1 1 d D U . . .
H82A H -0.2605 0.6450 0.8574 0.134 Uiso 1 1 calc R . . . .
H82B H -0.1957 0.6573 0.8714 0.134 Uiso 1 1 calc R . . . .
C83 C -0.1798 0.6364 0.8061 0.111(5) Uani 1 1 d D U . . .
H83A H -0.1582 0.6713 0.8010 0.134 Uiso 1 1 calc R . . . .
H83B H -0.2215 0.6568 0.7871 0.134 Uiso 1 1 calc R . . . .
C84 C -0.1230 0.5635 0.7927 0.110(5) Uani 1 1 d D U . . .
H84A H -0.1048 0.5705 0.7608 0.132 Uiso 1 1 calc R . . . .
H84B H -0.1453 0.5293 0.7960 0.132 Uiso 1 1 calc R . . . .
C85 C 0.0764 0.4583 0.6330 0.069(11) Uani 1 1 d . U . . .
H85 H 0.1165 0.4729 0.6206 0.083 Uiso 1 1 calc R . . . .
C86 C 0.0036 0.5269 0.6413 0.11(2) Uani 1 1 d . U . . .
H86A H 0.0099 0.5525 0.6633 0.138 Uiso 1 1 calc R . . . .
H86B H -0.0091 0.5611 0.6127 0.138 Uiso 1 1 calc R . . . .
C87 C -0.0575 0.5057 0.6589 0.077(12) Uani 1 1 d . U . . .
H87A H -0.1034 0.5502 0.6639 0.092 Uiso 1 1 calc R . . . .
H87B H -0.0459 0.4732 0.6881 0.092 Uiso 1 1 calc R . . . .
C88 C -0.0688 0.4636 0.6231 0.090(15) Uani 1 1 d . U . . .
H88A H -0.1083 0.4492 0.6357 0.108 Uiso 1 1 calc R . . . .
H88B H -0.0848 0.4982 0.5949 0.108 Uiso 1 1 calc R . . . .
C89 C -0.0038 0.3993 0.6122 0.092(15) Uani 1 1 d . U . . .
H89A H -0.0123 0.3821 0.5865 0.110 Uiso 1 1 calc R . . . .
H89B H 0.0050 0.3599 0.6384 0.110 Uiso 1 1 calc R . . . .
C90 C 0.0671 0.4130 0.5997 0.086(14) Uani 1 1 d . U . . .
H90A H 0.0649 0.4398 0.5687 0.103 Uiso 1 1 calc R . . . .
H90B H 0.1108 0.3650 0.5999 0.103 Uiso 1 1 calc R . . . .
C91 C 0.4195 0.2107 0.5583 0.070(11) Uani 1 1 d . U . . .
H91 H 0.4600 0.1633 0.5705 0.084 Uiso 1 1 calc R . . . .
C92 C 0.3621 0.1944 0.5437 0.058(9) Uani 1 1 d . U . . .
H92A H 0.3443 0.1681 0.5699 0.070 Uiso 1 1 calc R . . . .
H92B H 0.3199 0.2412 0.5339 0.070 Uiso 1 1 calc R . . . .
C93 C 0.3900 0.1499 0.5068 0.095(16) Uani 1 1 d . U . . .
H93A H 0.3517 0.1393 0.4986 0.114 Uiso 1 1 calc R . . . .
H93B H 0.4329 0.1029 0.5154 0.114 Uiso 1 1 calc R . . . .
C94 C 0.4150 0.2050 0.4615 0.107(19) Uani 1 1 d . U . . .
H94A H 0.4309 0.1821 0.4337 0.129 Uiso 1 1 calc R . . . .
H94B H 0.3743 0.2547 0.4555 0.129 Uiso 1 1 calc R . . . .
C95 C 0.4783 0.2069 0.4800 0.087(14) Uani 1 1 d . U . . .
H95A H 0.5007 0.2329 0.4567 0.105 Uiso 1 1 calc R . . . .
H95B H 0.5162 0.1562 0.4881 0.105 Uiso 1 1 calc R . . . .
C96 C 0.4497 0.2475 0.5233 0.097(16) Uani 1 1 d . U . . .
H96A H 0.4909 0.2503 0.5343 0.117 Uiso 1 1 calc R . . . .
H96B H 0.4121 0.2982 0.5149 0.117 Uiso 1 1 calc R . . . .
C97 C 0.4415 0.0237 0.6548 0.059(9) Uani 1 1 d . U . . .
H97 H 0.4027 0.0734 0.6441 0.071 Uiso 1 1 calc R . . . .
C98 C 0.4055 -0.0171 0.6879 0.071(11) Uani 1 1 d . U . . .
H98A H 0.4441 -0.0636 0.7017 0.085 Uiso 1 1 calc R . . . .
H98B H 0.3779 0.0127 0.7124 0.085 Uiso 1 1 calc R . . . .
C99 C 0.3548 -0.0340 0.6681 0.076(12) Uani 1 1 d . U . . .
H99A H 0.3095 0.0116 0.6615 0.092 Uiso 1 1 calc R . . . .
H99B H 0.3412 -0.0687 0.6902 0.092 Uiso 1 1 calc R . . . .
C100 C 0.3887 -0.0673 0.6250 0.099(17) Uani 1 1 d . U . . .
H10C H 0.3500 -0.0679 0.6098 0.118 Uiso 1 1 calc R . . . .
H10D H 0.4252 -0.1187 0.6328 0.118 Uiso 1 1 calc R . . . .
C101 C 0.4290 -0.0225 0.5896 0.071(11) Uani 1 1 d . U . . .
H10E H 0.4558 -0.0500 0.5642 0.085 Uiso 1 1 calc R . . . .
H10F H 0.3918 0.0264 0.5774 0.085 Uiso 1 1 calc R . . . .
C102 C 0.4801 -0.0143 0.6142 0.075(12) Uani 1 1 d . U . . .
H10G H 0.5030 0.0144 0.5938 0.090 Uiso 1 1 calc R . . . .
H10H H 0.5195 -0.0633 0.6240 0.090 Uiso 1 1 calc R . . . .
C103 C 0.5713 -0.1070 0.7858 0.067(10) Uani 1 1 d . U . . .
H103 H 0.5244 -0.0792 0.7708 0.080 Uiso 1 1 calc R . . . .
C104 C 0.5673 -0.1707 0.8220 0.076(12) Uani 1 1 d . U . . .
H10I H 0.6139 -0.1985 0.8367 0.091 Uiso 1 1 calc R . . . .
H10J H 0.5273 -0.1504 0.8454 0.091 Uiso 1 1 calc R . . . .
C105 C 0.5534 -0.2209 0.7985 0.080(13) Uani 1 1 d . U . . .
H10K H 0.5047 -0.1940 0.7863 0.096 Uiso 1 1 calc R . . . .
H10L H 0.5538 -0.2634 0.8204 0.096 Uiso 1 1 calc R . . . .
C106 C 0.6194 -0.2509 0.7558 0.107(19) Uani 1 1 d . U . . .
H10M H 0.6674 -0.2837 0.7681 0.128 Uiso 1 1 calc R . . . .
H10N H 0.6074 -0.2785 0.7380 0.128 Uiso 1 1 calc R . . . .
C107 C 0.6221 -0.1870 0.7278 0.079(13) Uani 1 1 d . U . . .
H10O H 0.5755 -0.1589 0.7132 0.095 Uiso 1 1 calc R . . . .
H10P H 0.6617 -0.2041 0.7036 0.095 Uiso 1 1 calc R . . . .
C108 C 0.6348 -0.1327 0.7508 0.059(9) Uani 1 1 d . U . . .
H10Q H 0.6819 -0.1580 0.7650 0.071 Uiso 1 1 calc R . . . .
H10R H 0.6350 -0.0909 0.7285 0.071 Uiso 1 1 calc R . . . .
C109 C 0.7928 -0.0610 0.8341 0.075(12) Uani 1 1 d . U . . .
H109 H 0.7442 -0.0451 0.8518 0.090 Uiso 1 1 calc R . . . .
C110 C 0.8577 -0.1047 0.8699 0.061(9) Uani 1 1 d . U . . .
H11C H 0.9066 -0.1189 0.8535 0.073 Uiso 1 1 calc R . . . .
H11D H 0.8520 -0.0726 0.8918 0.073 Uiso 1 1 calc R . . . .
C111 C 0.8492 -0.1785 0.8964 0.11(2) Uani 1 1 d . U . . .
H11E H 0.8896 -0.2082 0.9162 0.134 Uiso 1 1 calc R . . . .
H11F H 0.8024 -0.1637 0.9154 0.134 Uiso 1 1 calc R . . . .
C112 C 0.8509 -0.2232 0.8628 0.079(13) Uani 1 1 d . U . . .
H11G H 0.8405 -0.2645 0.8786 0.095 Uiso 1 1 calc R . . . .
H11H H 0.9002 -0.2439 0.8468 0.095 Uiso 1 1 calc R . . . .
C113 C 0.7925 -0.1746 0.8279 0.086(14) Uani 1 1 d . U . . .
H11I H 0.7977 -0.2047 0.8049 0.104 Uiso 1 1 calc R . . . .
H11J H 0.7432 -0.1611 0.8437 0.104 Uiso 1 1 calc R . . . .
C114 C 0.7965 -0.1060 0.8042 0.070(11) Uani 1 1 d . U . . .
H11K H 0.8429 -0.1191 0.7849 0.084 Uiso 1 1 calc R . . . .
H11L H 0.7557 -0.0784 0.7845 0.084 Uiso 1 1 calc R . . . .
C115 C 0.7794 0.2077 0.9040 0.072(11) Uani 1 1 d . U . . .
H115 H 0.7976 0.2229 0.8730 0.086 Uiso 1 1 calc R . . . .
C116 C 0.7476 0.2791 0.9357 0.089(15) Uani 1 1 d . U . . .
H11M H 0.7053 0.3220 0.9221 0.107 Uiso 1 1 calc R . . . .
H11N H 0.7316 0.2635 0.9667 0.107 Uiso 1 1 calc R . . . .
C117 C 0.8127 0.3007 0.9367 0.12(2) Uani 1 1 d . U . . .
H11O H 0.7981 0.3393 0.9558 0.138 Uiso 1 1 calc R . . . .
H11P H 0.8295 0.3169 0.9060 0.138 Uiso 1 1 calc R . . . .
C118 C 0.8743 0.2225 0.9588 0.14(3) Uani 1 1 d . U . . .
H11Q H 0.9170 0.2293 0.9636 0.164 Uiso 1 1 calc R . . . .
H11R H 0.8541 0.2076 0.9887 0.164 Uiso 1 1 calc R . . . .
C119 C 0.9010 0.1599 0.9305 0.092(15) Uani 1 1 d . U . . .
H11S H 0.9177 0.1756 0.8997 0.110 Uiso 1 1 calc R . . . .
H11T H 0.9431 0.1167 0.9441 0.110 Uiso 1 1 calc R . . . .
C120 C 0.8440 0.1399 0.9282 0.088(14) Uani 1 1 d . U . . .
H12C H 0.8263 0.1249 0.9589 0.106 Uiso 1 1 calc R . . . .
H12D H 0.8629 0.0980 0.9111 0.106 Uiso 1 1 calc R . . . .
C121 C 0.6421 0.0492 0.9534 0.065(10) Uani 1 1 d . U . . .
H121 H 0.6357 0.1009 0.9464 0.078 Uiso 1 1 calc R . . . .
C122 C 0.5944 0.0415 0.9962 0.066(10) Uani 1 1 d . U . . .
H12E H 0.5961 -0.0079 1.0017 0.079 Uiso 1 1 calc R . . . .
H12F H 0.5429 0.0783 0.9926 0.079 Uiso 1 1 calc R . . . .
C123 C 0.6237 0.0535 1.0369 0.086(14) Uani 1 1 d . U . . .
H12G H 0.6175 0.1045 1.0328 0.104 Uiso 1 1 calc R . . . .
H12H H 0.5958 0.0450 1.0653 0.104 Uiso 1 1 calc R . . . .
C124 C 0.7029 0.0008 1.0390 0.11(2) Uani 1 1 d . U . . .
H12I H 0.7220 0.0102 1.0637 0.132 Uiso 1 1 calc R . . . .
H12J H 0.7070 -0.0495 1.0469 0.132 Uiso 1 1 calc R . . . .
C125 C 0.7501 0.0039 0.9972 0.060(9) Uani 1 1 d . U . . .
H12K H 0.7987 -0.0391 0.9995 0.072 Uiso 1 1 calc R . . . .
H12L H 0.7572 0.0489 0.9930 0.072 Uiso 1 1 calc R . . . .
C126 C 0.7124 0.0041 0.9555 0.076(12) Uani 1 1 d . U . . .
H12M H 0.7390 0.0165 0.9275 0.091 Uiso 1 1 calc R . . . .
H12N H 0.7188 -0.0464 0.9559 0.091 Uiso 1 1 calc R . . . .
C127 C 0.3692 0.2097 0.9773 0.066(10) Uani 1 1 d . U . . .
H127 H 0.4135 0.2191 0.9711 0.079 Uiso 1 1 calc R . . . .
C128 C 0.3044 0.2785 0.9843 0.072(11) Uani 1 1 d . U . . .
H12O H 0.2602 0.2698 0.9904 0.086 Uiso 1 1 calc R . . . .
H12P H 0.2983 0.3150 0.9569 0.086 Uiso 1 1 calc R . . . .
C129 C 0.3134 0.3085 1.0253 0.079(13) Uani 1 1 d D U . . .
C130 C 0.3143 0.2508 1.0675 0.084(14) Uani 1 1 d . U . . .
H13A H 0.3154 0.2690 1.0950 0.101 Uiso 1 1 calc R . . . .
H13B H 0.2691 0.2445 1.0702 0.101 Uiso 1 1 calc R . . . .
C131 C 0.3785 0.1797 1.0638 0.089(14) Uani 1 1 d . U . . .
H13C H 0.3774 0.1439 1.0905 0.106 Uiso 1 1 calc R . . . .
H13D H 0.4238 0.1854 1.0630 0.106 Uiso 1 1 calc R . . . .
C132 C 0.3795 0.1498 1.0201 0.065(10) Uani 1 1 d . U . . .
H13E H 0.3397 0.1346 1.0236 0.077 Uiso 1 1 calc R . . . .
H13F H 0.4266 0.1061 1.0159 0.077 Uiso 1 1 calc R . . . .
C133 C 0.3210 0.0223 0.8212 0.070(11) Uani 1 1 d . U . . .
H133 H 0.3402 0.0281 0.7890 0.084 Uiso 1 1 calc R . . . .
C134 C 0.2372 0.0452 0.8232 0.078(12) Uani 1 1 d . U . . .
H13G H 0.2186 0.0369 0.8550 0.094 Uiso 1 1 calc R . . . .
H13H H 0.2111 0.0981 0.8119 0.094 Uiso 1 1 calc R . . . .
C135 C 0.2213 0.0016 0.7952 0.094(16) Uani 1 1 d . U . . .
H13I H 0.2410 0.0079 0.7635 0.113 Uiso 1 1 calc R . . . .
H13J H 0.1679 0.0183 0.7956 0.113 Uiso 1 1 calc R . . . .
C136 C 0.2616 -0.0849 0.8180 0.081(13) Uani 1 1 d . U . . .
H13K H 0.2442 -0.0914 0.8501 0.098 Uiso 1 1 calc R . . . .
H13L H 0.2524 -0.1165 0.8018 0.098 Uiso 1 1 calc R . . . .
C137 C 0.3408 -0.1024 0.8130 0.105(18) Uani 1 1 d . U . . .
H13M H 0.3551 -0.0902 0.7809 0.126 Uiso 1 1 calc R . . . .
H13N H 0.3697 -0.1558 0.8219 0.126 Uiso 1 1 calc R . . . .
C138 C 0.3616 -0.0595 0.8426 0.079(13) Uani 1 1 d . U . . .
H13O H 0.3441 -0.0668 0.8747 0.095 Uiso 1 1 calc R . . . .
H13P H 0.4151 -0.0760 0.8405 0.095 Uiso 1 1 calc R . . . .
C139 C 0.1684 0.1933 0.6713 0.075(12) Uani 1 1 d . U . . .
H139 H 0.1324 0.2451 0.6742 0.091 Uiso 1 1 calc R . . . .
C140 C 0.1377 0.1408 0.6932 0.075(12) Uani 1 1 d . U . . .
H14C H 0.1297 0.1411 0.7262 0.090 Uiso 1 1 calc R . . . .
H14D H 0.1721 0.0905 0.6874 0.090 Uiso 1 1 calc R . . . .
C141 C 0.0633 0.1661 0.6729 0.094(16) Uani 1 1 d . U . . .
H14E H 0.0325 0.2195 0.6723 0.113 Uiso 1 1 calc R . . . .
H14F H 0.0357 0.1395 0.6901 0.113 Uiso 1 1 calc R . . . .
C142 C 0.0894 0.1448 0.6218 0.084(14) Uani 1 1 d . U . . .
H14G H 0.0473 0.1533 0.6059 0.101 Uiso 1 1 calc R . . . .
H14H H 0.1261 0.0929 0.6223 0.101 Uiso 1 1 calc R . . . .
C143 C 0.1255 0.2009 0.5978 0.12(2) Uani 1 1 d . U . . .
H14I H 0.1409 0.1944 0.5658 0.143 Uiso 1 1 calc R . . . .
H14J H 0.0885 0.2524 0.5989 0.143 Uiso 1 1 calc R . . . .
C144 C 0.1946 0.1842 0.6235 0.077(12) Uani 1 1 d . U . . .
H14K H 0.2328 0.1335 0.6214 0.093 Uiso 1 1 calc R . . . .
H14L H 0.2157 0.2187 0.6099 0.093 Uiso 1 1 calc R . . . .
C145 C 0.1584 0.2405 0.8727 0.082(13) Uani 1 1 d . U . . .
H145 H 0.2075 0.1970 0.8743 0.098 Uiso 1 1 calc R . . . .
C146 C 0.1412 0.2891 0.9100 0.075(12) Uani 1 1 d . U . . .
H14M H 0.0924 0.3315 0.9069 0.090 Uiso 1 1 calc R . . . .
H14N H 0.1782 0.3080 0.9071 0.090 Uiso 1 1 calc R . . . .
C147 C 0.1429 0.2402 0.9573 0.082(13) Uani 1 1 d . U . . .
H14O H 0.1917 0.1978 0.9608 0.098 Uiso 1 1 calc R . . . .
H14P H 0.1317 0.2692 0.9821 0.098 Uiso 1 1 calc R . . . .
C148 C 0.0888 0.2162 0.9578 0.088(14) Uani 1 1 d . U . . .
H14Q H 0.0408 0.2597 0.9547 0.105 Uiso 1 1 calc R . . . .
H14R H 0.0863 0.1869 0.9875 0.105 Uiso 1 1 calc R . . . .
C149 C 0.1011 0.1711 0.9217 0.086(14) Uani 1 1 d . U . . .
H14S H 0.0628 0.1539 0.9251 0.103 Uiso 1 1 calc R . . . .
H14T H 0.1495 0.1278 0.9234 0.103 Uiso 1 1 calc R . . . .
C150 C 0.0977 0.2207 0.8766 0.075(12) Uani 1 1 d . U . . .
H15C H 0.1025 0.1947 0.8514 0.090 Uiso 1 1 calc R . . . .
H15D H 0.0503 0.2654 0.8757 0.090 Uiso 1 1 calc R . . . .
C151 C 0.5009 0.3328 0.9511 0.087(14) Uani 1 1 d D U . . .
H151 H 0.5433 0.3364 0.9316 0.105 Uiso 1 1 calc R . . . .
C152 C 0.5316 0.2628 0.9843 0.083(13) Uani 1 1 d D U . . .
H15E H 0.5596 0.2211 0.9671 0.100 Uiso 1 1 calc R . . . .
H15F H 0.4902 0.2553 1.0018 0.100 Uiso 1 1 calc R . . . .
C153 C 0.5813 0.2605 1.0174 0.103(18) Uani 1 1 d D U . . .
H15G H 0.5985 0.2139 1.0385 0.124 Uiso 1 1 calc R . . . .
H15H H 0.6241 0.2672 1.0015 0.124 Uiso 1 1 calc R . . . .
C154 C 0.5300 0.3254 1.0418 0.11(2) Uani 1 1 d D U . . .
H15I H 0.4836 0.3222 1.0527 0.136 Uiso 1 1 calc R . . . .
H15J H 0.5529 0.3250 1.0682 0.136 Uiso 1 1 calc R . . . .
C155 C 0.5151 0.3958 1.0090 0.108(19) Uani 1 1 d D U . . .
H15K H 0.4909 0.4390 1.0251 0.129 Uiso 1 1 calc R . . . .
H15L H 0.5613 0.3945 0.9929 0.129 Uiso 1 1 calc R . . . .
C156 C 0.4652 0.3986 0.9763 0.090(15) Uani 1 1 d D U . . .
H15M H 0.4523 0.4441 0.9543 0.108 Uiso 1 1 calc R . . . .
H15N H 0.4193 0.4001 0.9931 0.108 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Au1 Au2 2.8569 . ?
Au1 Au5 2.9789 . ?
Au1 Au7 2.8587 . ?
Au1 Au9 2.7056 . ?
Au1 Au12 3.0291 . ?
Au1 Au16 2.7494 . ?
Au1 Au17 2.7334 . ?
Au1 Au20 2.7023 . ?
Au1 Au21 3.2059 . ?
Au1 Au33 2.9361 . ?
Au1 Au34 2.8930 . ?
Au2 Au3 2.7998 . ?
Au2 Au4 2.8570 . ?
Au2 Au5 2.9876 . ?
Au2 Au6 2.9713 . ?
Au2 Au7 2.9501 . ?
Au2 Au15 3.0199 . ?
Au2 Au16 2.8615 . ?
Au2 Au17 2.7981 . ?
Au2 Au35 3.0336 . ?
Au2 Au36 2.8682 . ?
Au3 Au4 2.7556 . ?
Au3 Au15 3.0974 . ?
Au3 Au26 2.9482 . ?
Au3 Au36 2.7361 . ?
Au3 Au37 3.0345 . ?
Au3 Au38 3.0126 . ?
Au3 S21 2.3920 . ?
Au4 Au5 2.9230 . ?
Au4 Au6 2.8950 . ?
Au4 Au23 2.7509 . ?
Au4 Au24 2.7120 . ?
Au4 Au26 2.8854 . ?
Au4 Au28 3.1514 . ?
Au4 Au29 3.0023 . ?
Au4 Au36 2.7668 . ?
Au4 Au39 2.8944 . ?
Au5 Au6 2.8712 . ?
Au5 Au7 2.8615 . ?
Au5 Au8 2.7821 . ?
Au5 Au9 3.0894 . ?
Au5 Au12 2.8437 . ?
Au5 Au22 2.7807 . ?
Au5 Au23 3.1043 . ?
Au5 Au29 2.8777 . ?
Au6 Au12 2.7539 . ?
Au6 Au13 3.1716 . ?
Au6 Au14 2.7203 . ?
Au6 Au15 2.7172 . ?
Au6 Au16 3.0299 . ?
Au6 Au22 2.7600 . ?
Au6 Au26 2.9267 . ?
Au6 Au39 2.8393 . ?
Au7 Au8 2.7277 . ?
Au7 Au29 2.7587 . ?
Au7 Au30 3.2391 . ?
Au7 Au31 2.6861 . ?
Au7 Au33 2.8619 . ?
Au7 Au34 2.9562 . ?
Au7 Au35 2.7311 . ?
Au7 Au36 3.0014 . ?
Au8 Au9 3.0932 . ?
Au8 Au11 2.9964 . ?
Au8 Au29 2.7349 . ?
Au8 Au32 2.9585 . ?
Au8 Au33 2.9772 . ?
Au8 S3 2.3885 . ?
Au9 Au10 3.3540 . ?
Au9 Au12 2.9595 . ?
Au9 Au20 2.8403 . ?
Au9 Au33 2.7275 . ?
Au9 S4 2.3695 . ?
Au10 Au11 3.0234 . ?
Au10 Au22 3.0425 . ?
Au10 S1 2.2937 . ?
Au10 S4 2.3020 . ?
Au11 Au23 3.3028 . ?
Au11 S2 2.2980 . ?
Au11 S3 2.3017 . ?
Au12 Au13 3.1384 . ?
Au12 Au16 2.9311 . ?
Au12 Au21 3.3536 . ?
Au12 Au22 2.7341 . ?
Au12 S16 2.3529 . ?
Au13 Au14 2.9283 . ?
Au13 Au16 3.3040 . ?
Au13 S5 2.3236 . ?
Au13 S17 2.3101 . ?
Au14 Au15 2.8263 . ?
Au14 Au26 2.7245 . ?
Au14 Au27 3.0918 . ?
Au14 Au42 3.2736 . ?
Au14 S7 2.3247 . ?
Au15 Au16 2.9505 . ?
Au15 Au18 3.2800 . ?
Au15 Au26 2.7214 . ?
Au15 S18 2.3806 . ?
Au16 Au17 2.7442 . ?
Au16 Au21 3.0918 . ?
Au16 S17 2.3576 . ?
Au17 Au18 3.0200 . ?
Au17 Au19 3.0025 . ?
Au17 Au34 2.9604 . ?
Au17 Au35 3.0638 . ?
Au17 S23 2.3836 . ?
Au18 Au37 3.0168 . ?
Au18 S18 2.2723 . ?
Au18 S23 2.3357 . ?
Au19 Au20 3.0660 . ?
Au19 Au34 3.1734 . ?
Au19 S24 2.2994 . ?
Au19 S25 2.3029 . ?
Au20 Au21 2.9431 . ?
Au20 Au33 2.7255 . ?
Au20 Au41 3.2526 . ?
Au20 S15 2.3610 . ?
Au21 S16 2.2796 . ?
Au21 S24 2.3040 . ?
Au22 Au23 3.1522 . ?
Au22 Au27 2.9918 . ?
Au22 Au39 2.9345 . ?
Au22 S1 2.3782 . ?
Au23 Au24 2.8491 . ?
Au23 Au29 2.9643 . ?
Au23 Au39 2.7207 . ?
Au23 S2 2.3690 . ?
Au24 Au25 3.3349 . ?
Au24 Au28 2.9179 . ?
Au24 Au38 3.0529 . ?
Au24 Au39 2.7089 . ?
Au24 S9 2.3373 . ?
Au25 S8 2.3088 . ?
Au25 S9 2.2873 . ?
Au26 Au38 3.1627 . ?
Au26 Au39 2.8101 . ?
Au26 S19 2.3455 . ?
Au27 Au39 3.1500 . ?
Au27 S5 2.3021 . ?
Au27 S6 2.2847 . ?
Au28 Au29 3.3012 . ?
Au28 Au36 3.0748 . ?
Au28 S10 2.2969 . ?
Au28 S20 2.3186 . ?
Au29 Au30 3.0716 . ?
Au29 Au36 2.9300 . ?
Au29 S10 2.3624 . ?
Au30 Au31 2.9177 . ?
Au30 Au36 3.3788 . ?
Au30 S11 2.2976 . ?
Au30 S26 2.3012 . ?
Au31 Au32 3.1151 . ?
Au31 Au34 2.7397 . ?
Au31 Au35 2.8748 . ?
Au31 Au40 3.2205 . ?
Au31 S13 2.3729 . ?
Au32 Au33 3.1328 . ?
Au32 S11 2.2873 . ?
Au32 S12 2.2916 . ?
Au33 Au34 2.7887 . ?
Au33 S12 2.3629 . ?
Au34 Au35 2.7210 . ?
Au34 S25 2.3543 . ?
Au35 Au36 2.9243 . ?
Au35 Au37 3.3186 . ?
Au35 S22 2.3601 . ?
Au36 S26 2.3679 . ?
Au37 S21 2.2910 . ?
Au37 S22 2.2987 . ?
Au38 S19 2.3107 . ?
Au38 S20 2.3060 . ?
Au39 S6 2.3463 . ?
Au40 S13 2.3510 . ?
Au40 S14 2.2698 . ?
Au41 S14 2.3019 . ?
Au41 S15 2.2902 . ?
Au42 S7 2.2872 . ?
Au42 S8 2.2977 . ?
S1 C1 1.9195 . ?
S2 C7 1.8693 . ?
S3 C13 1.9245 . ?
S4 C19 1.8729 . ?
S5 C25 1.9013 . ?
S6 C31 1.8558 . ?
S7 C37 1.9027 . ?
S8 C43 1.7441 . ?
S9 C49 1.8168 . ?
S10 C55 1.7766 . ?
S11 C61 1.9585 . ?
S12 C67 1.8085 . ?
S13 C73 1.7730 . ?
S14 C79 1.7950 . ?
S15 C85 1.9335 . ?
S16 C91 1.8725 . ?
S17 C97 1.8594 . ?
S18 C103 1.8819 . ?
S19 C109 1.8418 . ?
S20 C115 1.8055 . ?
S21 C121 1.9814 . ?
S22 C127 1.8795 . ?
S23 C133 1.8377 . ?
S24 C139 1.9513 . ?
S25 C145 1.8995 . ?
S26 C151 1.7472 . ?
C1 H1 1.0000 . ?
C1 C2 1.4730 . ?
C1 C6 1.6015 . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C2 C3 1.4858 . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C3 C4 1.7485 . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 C5 1.3742 . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C5 C6 1.4978 . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 H7 1.0000 . ?
C7 C8 1.5396 . ?
C7 C12 1.4011 . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C8 C9 1.6936 . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C9 C10 1.7566 . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C10 C11 1.4215 . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C11 C12 1.4381 . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 H13 1.0000 . ?
C13 C14 1.5242 . ?
C13 C18 1.5139 . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C14 C15 1.5256 . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C15 C16 1.5221 . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 C17 1.5215 . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C17 C18 1.5189 . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 H19 1.0000 . ?
C19 C20 1.5292 . ?
C19 C24 1.5183 . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C20 C21 1.5510 . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C21 C22 1.4242 . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C22 C23 1.6226 . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C23 C24 1.5398 . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 H25 1.0000 . ?
C25 C26 1.3866 . ?
C25 C30 1.6077 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C26 C27 1.6458 . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C27 C28 1.3954 . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C28 C29 1.3169 . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C30 1.4370 . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 H31 1.0000 . ?
C31 C32 1.5401 . ?
C31 C36 1.5168 . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C32 C33 1.5490 . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C33 C34 1.4337 . ?
C34 H34A 0.9900 . ?
C34 H34B 0.9900 . ?
C34 C35 1.5402 . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C35 C36 1.5282 . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C37 H37 1.0000 . ?
C37 C38 1.4404 . ?
C37 C42 1.6617 . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C38 C39 1.6349 . ?
C39 H39A 0.9900 . ?
C39 H39B 0.9900 . ?
C39 C40 1.3998 . ?
C40 H40A 0.9900 . ?
C40 H40B 0.9900 . ?
C40 C41 1.5569 . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C41 C42 1.5085 . ?
C42 H42A 0.9900 . ?
C42 H42B 0.9900 . ?
C43 H43 1.0000 . ?
C43 C44 1.5493 . ?
C43 C48 1.4201 . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
C44 C45 1.5145 . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C45 C46 1.5668 . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 C47 1.6739 . ?
C47 H47A 0.9900 . ?
C47 H47B 0.9900 . ?
C47 C48 1.4684 . ?
C48 H48A 0.9900 . ?
C48 H48B 0.9900 . ?
C49 H49 1.0000 . ?
C49 C50 1.5712 . ?
C49 C54 1.5777 . ?
C50 H50A 0.9900 . ?
C50 H50B 0.9900 . ?
C50 C51 1.5442 . ?
C51 H51A 0.9900 . ?
C51 H51B 0.9900 . ?
C51 C52 1.6579 . ?
C52 H52A 0.9900 . ?
C52 H52B 0.9900 . ?
C52 C53 1.4757 . ?
C53 H53A 0.9900 . ?
C53 H53B 0.9900 . ?
C53 C54 1.5510 . ?
C54 H54A 0.9900 . ?
C54 H54B 0.9900 . ?
C55 C56 1.5229 . ?
C55 C60 1.5198 . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C56 C57 1.5237 . ?
C57 H57A 0.9900 . ?
C57 H57B 0.9900 . ?
C57 C58 1.5264 . ?
C58 H58A 0.9900 . ?
C58 H58B 0.9900 . ?
C58 C59 1.5222 . ?
C59 H59A 0.9900 . ?
C59 H59B 0.9900 . ?
C59 C60 1.5235 . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C61 H61 1.0000 . ?
C61 C62 1.5390 . ?
C61 C66 1.3714 . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C62 C63 1.4602 . ?
C63 H63A 0.9900 . ?
C63 H63B 0.9900 . ?
C63 C64 1.5288 . ?
C64 H64A 0.9900 . ?
C64 H64B 0.9900 . ?
C64 C65 1.3159 . ?
C65 H65A 0.9900 . ?
C65 H65B 0.9900 . ?
C65 C66 1.4713 . ?
C66 H66A 0.9900 . ?
C66 H66B 0.9900 . ?
C67 H67 1.0000 . ?
C67 C68 1.4611 . ?
C67 C72 1.6345 . ?
C68 H68A 0.9900 . ?
C68 H68B 0.9900 . ?
C68 C69 1.5934 . ?
C69 H69A 0.9900 . ?
C69 H69B 0.9900 . ?
C69 C70 1.5639 . ?
C70 H70A 0.9900 . ?
C70 H70B 0.9900 . ?
C70 C71 1.5985 . ?
C71 H71A 0.9900 . ?
C71 H71B 0.9900 . ?
C71 C72 1.4259 . ?
C72 H72A 0.9900 . ?
C72 H72B 0.9900 . ?
C73 H73 1.0000 . ?
C73 C74 1.5208 . ?
C73 C78 1.5189 . ?
C74 H74A 0.9900 . ?
C74 H74B 0.9900 . ?
C74 C75 1.5247 . ?
C75 H75A 0.9900 . ?
C75 H75B 0.9900 . ?
C75 C76 1.5260 . ?
C76 H76A 0.9900 . ?
C76 H76B 0.9900 . ?
C76 C77 1.5273 . ?
C77 H77A 0.9900 . ?
C77 H77B 0.9900 . ?
C77 C78 1.5169 . ?
C78 H78A 0.9900 . ?
C78 H78B 0.9900 . ?
C79 H79 1.0000 . ?
C79 C80 1.5271 . ?
C79 C84 1.5193 . ?
C80 H80A 0.9900 . ?
C80 H80B 0.9900 . ?
C80 C81 1.5242 . ?
C81 H81A 0.9900 . ?
C81 H81B 0.9900 . ?
C81 C82 1.5066 . ?
C82 H82A 0.9900 . ?
C82 H82B 0.9900 . ?
C82 C83 1.5062 . ?
C83 H83A 0.9900 . ?
C83 H83B 0.9900 . ?
C83 C84 1.5145 . ?
C84 H84A 0.9900 . ?
C84 H84B 0.9900 . ?
C85 H85 1.0000 . ?
C85 C86 1.5493 . ?
C85 C90 1.5975 . ?
C86 H86A 0.9900 . ?
C86 H86B 0.9900 . ?
C86 C87 1.5066 . ?
C87 H87A 0.9900 . ?
C87 H87B 0.9900 . ?
C87 C88 1.6268 . ?
C88 H88A 0.9900 . ?
C88 H88B 0.9900 . ?
C88 C89 1.4411 . ?
C89 H89A 0.9900 . ?
C89 H89B 0.9900 . ?
C89 C90 1.5892 . ?
C90 H90A 0.9900 . ?
C90 H90B 0.9900 . ?
C91 H91 1.0000 . ?
C91 C92 1.5197 . ?
C91 C96 1.4150 . ?
C92 H92A 0.9900 . ?
C92 H92B 0.9900 . ?
C92 C93 1.4699 . ?
C93 H93A 0.9900 . ?
C93 H93B 0.9900 . ?
C93 C94 1.7746 . ?
C94 H94A 0.9900 . ?
C94 H94B 0.9900 . ?
C94 C95 1.5198 . ?
C95 H95A 0.9900 . ?
C95 H95B 0.9900 . ?
C95 C96 1.5898 . ?
C96 H96A 0.9900 . ?
C96 H96B 0.9900 . ?
C97 H97 1.0000 . ?
C97 C98 1.5098 . ?
C97 C102 1.5104 . ?
C98 H98A 0.9900 . ?
C98 H98B 0.9900 . ?
C98 C99 1.4864 . ?
C99 H99A 0.9900 . ?
C99 H99B 0.9900 . ?
C99 C100 1.5180 . ?
C100 H10C 0.9900 . ?
C100 H10D 0.9900 . ?
C100 C101 1.6525 . ?
C101 H10E 0.9900 . ?
C101 H10F 0.9900 . ?
C101 C102 1.4718 . ?
C102 H10G 0.9900 . ?
C102 H10H 0.9900 . ?
C103 H103 1.0000 . ?
C103 C104 1.5655 . ?
C103 C108 1.5059 . ?
C104 H10I 0.9900 . ?
C104 H10J 0.9900 . ?
C104 C105 1.5227 . ?
C105 H10K 0.9900 . ?
C105 H10L 0.9900 . ?
C105 C106 1.7035 . ?
C106 H10M 0.9900 . ?
C106 H10N 0.9900 . ?
C106 C107 1.4439 . ?
C107 H10O 0.9900 . ?
C107 H10P 0.9900 . ?
C107 C108 1.5712 . ?
C108 H10Q 0.9900 . ?
C108 H10R 0.9900 . ?
C109 H109 1.0000 . ?
C109 C110 1.6593 . ?
C109 C114 1.3973 . ?
C110 H11C 0.9900 . ?
C110 H11D 0.9900 . ?
C110 C111 1.6513 . ?
C111 H11E 0.9900 . ?
C111 H11F 0.9900 . ?
C111 C112 1.4968 . ?
C112 H11G 0.9900 . ?
C112 H11H 0.9900 . ?
C112 C113 1.5674 . ?
C113 H11I 0.9900 . ?
C113 H11J 0.9900 . ?
C113 C114 1.4917 . ?
C114 H11K 0.9900 . ?
C114 H11L 0.9900 . ?
C115 H115 1.0000 . ?
C115 C116 1.7398 . ?
C115 C120 1.5726 . ?
C116 H11M 0.9900 . ?
C116 H11N 0.9900 . ?
C116 C117 1.6039 . ?
C117 H11O 0.9900 . ?
C117 H11P 0.9900 . ?
C117 C118 1.6253 . ?
C118 H11Q 0.9900 . ?
C118 H11R 0.9900 . ?
C118 C119 1.5373 . ?
C119 H11S 0.9900 . ?
C119 H11T 0.9900 . ?
C119 C120 1.4305 . ?
C120 H12C 0.9900 . ?
C120 H12D 0.9900 . ?
C121 H121 1.0000 . ?
C121 C122 1.5272 . ?
C121 C126 1.3204 . ?
C122 H12E 0.9900 . ?
C122 H12F 0.9900 . ?
C122 C123 1.5688 . ?
C123 H12G 0.9900 . ?
C123 H12H 0.9900 . ?
C123 C124 1.4955 . ?
C124 H12I 0.9900 . ?
C124 H12J 0.9900 . ?
C124 C125 1.4807 . ?
C125 H12K 0.9900 . ?
C125 H12L 0.9900 . ?
C125 C126 1.5892 . ?
C126 H12M 0.9900 . ?
C126 H12N 0.9900 . ?
C127 H127 1.0000 . ?
C127 C128 1.4660 . ?
C127 C132 1.5752 . ?
C128 H12O 0.9900 . ?
C128 H12P 0.9900 . ?
C128 C129 1.5699 . ?
C129 C130 1.5649 . ?
C130 H13A 0.9900 . ?
C130 H13B 0.9900 . ?
C130 C131 1.4730 . ?
C131 H13C 0.9900 . ?
C131 H13D 0.9900 . ?
C131 C132 1.5664 . ?
C132 H13E 0.9900 . ?
C132 H13F 0.9900 . ?
C133 H133 1.0000 . ?
C133 C134 1.5631 . ?
C133 C138 1.5591 . ?
C134 H13G 0.9900 . ?
C134 H13H 0.9900 . ?
C134 C135 1.5252 . ?
C135 H13I 0.9900 . ?
C135 H13J 0.9900 . ?
C135 C136 1.6444 . ?
C136 H13K 0.9900 . ?
C136 H13L 0.9900 . ?
C136 C137 1.4905 . ?
C137 H13M 0.9900 . ?
C137 H13N 0.9900 . ?
C137 C138 1.6062 . ?
C138 H13O 0.9900 . ?
C138 H13P 0.9900 . ?
C139 H139 1.0000 . ?
C139 C140 1.4958 . ?
C139 C144 1.4831 . ?
C140 H14C 0.9900 . ?
C140 H14D 0.9900 . ?
C140 C141 1.5641 . ?
C141 H14E 0.9900 . ?
C141 H14F 0.9900 . ?
C141 C142 1.6373 . ?
C142 H14G 0.9900 . ?
C142 H14H 0.9900 . ?
C142 C143 1.6500 . ?
C143 H14I 0.9900 . ?
C143 H14J 0.9900 . ?
C143 C144 1.5987 . ?
C144 H14K 0.9900 . ?
C144 H14L 0.9900 . ?
C145 H145 1.0000 . ?
C145 C146 1.5580 . ?
C145 C150 1.4678 . ?
C146 H14M 0.9900 . ?
C146 H14N 0.9900 . ?
C146 C147 1.5811 . ?
C147 H14O 0.9900 . ?
C147 H14P 0.9900 . ?
C147 C148 1.4131 . ?
C148 H14Q 0.9900 . ?
C148 H14R 0.9900 . ?
C148 C149 1.5015 . ?
C149 H14S 0.9900 . ?
C149 H14T 0.9900 . ?
C149 C150 1.5293 . ?
C150 H15C 0.9900 . ?
C150 H15D 0.9900 . ?
C151 H151 1.0000 . ?
C151 C152 1.5165 . ?
C151 C156 1.5187 . ?
C152 H15E 0.9900 . ?
C152 H15F 0.9900 . ?
C152 C153 1.5255 . ?
C153 H15G 0.9900 . ?
C153 H15H 0.9900 . ?
C153 C154 1.5243 . ?
C154 H15I 0.9900 . ?
C154 H15J 0.9900 . ?
C154 C155 1.5240 . ?
C155 H15K 0.9900 . ?
C155 H15L 0.9900 . ?
C155 C156 1.5171 . ?
C156 H15M 0.9900 . ?
C156 H15N 0.9900 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Au2 Au1 Au5 61.5 . . ?
Au2 Au1 Au7 62.1 . . ?
Au2 Au1 Au12 88.3 . . ?
Au2 Au1 Au21 123.3 . . ?
Au2 Au1 Au33 121.2 . . ?
Au2 Au1 Au34 92.8 . . ?
Au5 Au1 Au12 56.5 . . ?
Au5 Au1 Au21 121.3 . . ?
Au7 Au1 Au5 58.7 . . ?
Au7 Au1 Au12 115.1 . . ?
Au7 Au1 Au21 174.3 . . ?
Au7 Au1 Au33 59.2 . . ?
Au7 Au1 Au34 61.9 . . ?
Au9 Au1 Au2 127.2 . . ?
Au9 Au1 Au5 65.6 . . ?
Au9 Au1 Au7 90.9 . . ?
Au9 Au1 Au12 61.8 . . ?
Au9 Au1 Au16 121.4 . . ?
Au9 Au1 Au17 172.8 . . ?
Au9 Au1 Au21 84.2 . . ?
Au9 Au1 Au33 57.6 . . ?
Au9 Au1 Au34 114.4 . . ?
Au12 Au1 Au21 65.0 . . ?
Au16 Au1 Au2 61.3 . . ?
Au16 Au1 Au5 91.7 . . ?
Au16 Au1 Au7 123.4 . . ?
Au16 Au1 Au12 60.7 . . ?
Au16 Au1 Au21 62.0 . . ?
Au16 Au1 Au33 177.4 . . ?
Au16 Au1 Au34 123.4 . . ?
Au17 Au1 Au2 60.0 . . ?
Au17 Au1 Au5 121.6 . . ?
Au17 Au1 Au7 93.7 . . ?
Au17 Au1 Au12 120.6 . . ?
Au17 Au1 Au16 60.1 . . ?
Au17 Au1 Au21 90.9 . . ?
Au17 Au1 Au33 120.6 . . ?
Au17 Au1 Au34 63.4 . . ?
Au20 Au1 Au2 168.2 . . ?
Au20 Au1 Au5 128.6 . . ?
Au20 Au1 Au7 116.0 . . ?
Au20 Au1 Au9 63.4 . . ?
Au20 Au1 Au12 102.5 . . ?
Au20 Au1 Au16 119.8 . . ?
Au20 Au1 Au17 109.5 . . ?
Au20 Au1 Au21 59.0 . . ?
Au20 Au1 Au33 57.6 . . ?
Au20 Au1 Au34 76.9 . . ?
Au33 Au1 Au5 89.9 . . ?
Au33 Au1 Au12 118.8 . . ?
Au33 Au1 Au21 115.4 . . ?
Au34 Au1 Au5 120.5 . . ?
Au34 Au1 Au12 175.6 . . ?
Au34 Au1 Au21 117.6 . . ?
Au34 Au1 Au33 57.2 . . ?
Au1 Au2 Au4 121.2 . . ?
Au1 Au2 Au5 61.2 . . ?
Au1 Au2 Au6 89.8 . . ?
Au1 Au2 Au7 59.0 . . ?
Au1 Au2 Au15 117.1 . . ?
Au1 Au2 Au16 57.5 . . ?
Au1 Au2 Au35 84.5 . . ?
Au1 Au2 Au36 121.0 . . ?
Au3 Au2 Au1 178.7 . . ?
Au3 Au2 Au4 58.3 . . ?
Au3 Au2 Au5 118.3 . . ?
Au3 Au2 Au6 90.9 . . ?
Au3 Au2 Au7 119.8 . . ?
Au3 Au2 Au15 64.2 . . ?
Au3 Au2 Au16 123.8 . . ?
Au3 Au2 Au35 94.7 . . ?
Au3 Au2 Au36 57.7 . . ?
Au4 Au2 Au5 60.0 . . ?
Au4 Au2 Au6 59.5 . . ?
Au4 Au2 Au7 88.6 . . ?
Au4 Au2 Au15 85.5 . . ?
Au4 Au2 Au16 122.1 . . ?
Au4 Au2 Au35 116.5 . . ?
Au4 Au2 Au36 57.8 . . ?
Au5 Au2 Au15 111.5 . . ?
Au5 Au2 Au35 111.9 . . ?
Au6 Au2 Au5 57.6 . . ?
Au6 Au2 Au15 53.9 . . ?
Au6 Au2 Au35 169.5 . . ?
Au7 Au2 Au5 57.6 . . ?
Au7 Au2 Au6 115.2 . . ?
Au7 Au2 Au15 169.2 . . ?
Au7 Au2 Au35 54.3 . . ?
Au15 Au2 Au35 136.5 . . ?
Au16 Au2 Au5 89.3 . . ?
Au16 Au2 Au6 62.6 . . ?
Au16 Au2 Au7 116.4 . . ?
Au16 Au2 Au15 60.2 . . ?
Au16 Au2 Au35 120.5 . . ?
Au16 Au2 Au36 178.4 . . ?
Au17 Au2 Au1 57.8 . . ?
Au17 Au2 Au3 122.7 . . ?
Au17 Au2 Au4 178.9 . . ?
Au17 Au2 Au5 119.0 . . ?
Au17 Au2 Au6 120.5 . . ?
Au17 Au2 Au7 90.4 . . ?
Au17 Au2 Au15 95.4 . . ?
Au17 Au2 Au16 58.0 . . ?
Au17 Au2 Au35 63.2 . . ?
Au17 Au2 Au36 122.1 . . ?
Au36 Au2 Au5 89.3 . . ?
Au36 Au2 Au6 117.3 . . ?
Au36 Au2 Au7 62.1 . . ?
Au36 Au2 Au15 121.2 . . ?
Au36 Au2 Au35 59.3 . . ?
Au2 Au3 Au15 61.4 . . ?
Au2 Au3 Au26 91.5 . . ?
Au2 Au3 Au37 84.7 . . ?
Au2 Au3 Au38 139.9 . . ?
Au4 Au3 Au2 61.9 . . ?
Au4 Au3 Au15 85.8 . . ?
Au4 Au3 Au26 60.7 . . ?
Au4 Au3 Au37 138.0 . . ?
Au4 Au3 Au38 78.2 . . ?
Au26 Au3 Au15 53.4 . . ?
Au26 Au3 Au37 150.9 . . ?
Au26 Au3 Au38 64.1 . . ?
Au36 Au3 Au2 62.4 . . ?
Au36 Au3 Au4 60.5 . . ?
Au36 Au3 Au15 123.1 . . ?
Au36 Au3 Au26 121.1 . . ?
Au36 Au3 Au37 82.4 . . ?
Au36 Au3 Au38 102.0 . . ?
Au37 Au3 Au15 100.5 . . ?
Au38 Au3 Au15 115.0 . . ?
Au38 Au3 Au37 132.1 . . ?
S21 Au3 Au2 127.0 . . ?
S21 Au3 Au4 171.0 . . ?
S21 Au3 Au15 99.9 . . ?
S21 Au3 Au26 117.3 . . ?
S21 Au3 Au36 120.5 . . ?
S21 Au3 Au37 48.2 . . ?
S21 Au3 Au38 93.0 . . ?
Au2 Au4 Au5 62.2 . . ?
Au2 Au4 Au6 62.2 . . ?
Au2 Au4 Au26 91.7 . . ?
Au2 Au4 Au28 123.5 . . ?
Au2 Au4 Au29 89.5 . . ?
Au2 Au4 Au39 120.9 . . ?
Au3 Au4 Au2 59.8 . . ?
Au3 Au4 Au5 122.1 . . ?
Au3 Au4 Au6 93.4 . . ?
Au3 Au4 Au26 63.0 . . ?
Au3 Au4 Au28 89.7 . . ?
Au3 Au4 Au29 120.2 . . ?
Au3 Au4 Au36 59.4 . . ?
Au3 Au4 Au39 121.1 . . ?
Au5 Au4 Au28 122.7 . . ?
Au5 Au4 Au29 58.1 . . ?
Au6 Au4 Au5 59.1 . . ?
Au6 Au4 Au28 174.3 . . ?
Au6 Au4 Au29 117.2 . . ?
Au23 Au4 Au2 128.5 . . ?
Au23 Au4 Au3 171.6 . . ?
Au23 Au4 Au5 66.3 . . ?
Au23 Au4 Au6 92.4 . . ?
Au23 Au4 Au26 115.1 . . ?
Au23 Au4 Au28 84.0 . . ?
Au23 Au4 Au29 61.8 . . ?
Au23 Au4 Au36 121.5 . . ?
Au23 Au4 Au39 57.6 . . ?
Au24 Au4 Au2 167.3 . . ?
Au24 Au4 Au3 109.1 . . ?
Au24 Au4 Au5 128.5 . . ?
Au24 Au4 Au6 115.3 . . ?
Au24 Au4 Au23 62.9 . . ?
Au24 Au4 Au26 76.9 . . ?
Au24 Au4 Au28 59.1 . . ?
Au24 Au4 Au29 102.2 . . ?
Au24 Au4 Au36 120.1 . . ?
Au24 Au4 Au39 57.7 . . ?
Au26 Au4 Au5 119.9 . . ?
Au26 Au4 Au6 60.8 . . ?
Au26 Au4 Au28 116.8 . . ?
Au26 Au4 Au29 176.7 . . ?
Au26 Au4 Au39 58.2 . . ?
Au29 Au4 Au28 64.8 . . ?
Au36 Au4 Au2 61.3 . . ?
Au36 Au4 Au5 92.6 . . ?
Au36 Au4 Au6 123.5 . . ?
Au36 Au4 Au26 122.3 . . ?
Au36 Au4 Au28 62.2 . . ?
Au36 Au4 Au29 60.9 . . ?
Au36 Au4 Au39 177.8 . . ?
Au39 Au4 Au5 88.8 . . ?
Au39 Au4 Au6 58.7 . . ?
Au39 Au4 Au28 115.6 . . ?
Au39 Au4 Au29 118.6 . . ?
Au1 Au5 Au2 57.2 . . ?
Au1 Au5 Au9 52.9 . . ?
Au1 Au5 Au23 169.1 . . ?
Au2 Au5 Au9 110.1 . . ?
Au2 Au5 Au23 112.0 . . ?
Au4 Au5 Au1 115.0 . . ?
Au4 Au5 Au2 57.8 . . ?
Au4 Au5 Au9 167.9 . . ?
Au4 Au5 Au23 54.2 . . ?
Au6 Au5 Au1 89.3 . . ?
Au6 Au5 Au2 60.9 . . ?
Au6 Au5 Au4 59.9 . . ?
Au6 Au5 Au9 116.5 . . ?
Au6 Au5 Au23 86.0 . . ?
Au6 Au5 Au29 122.3 . . ?
Au7 Au5 Au1 58.6 . . ?
Au7 Au5 Au2 60.5 . . ?
Au7 Au5 Au4 89.0 . . ?
Au7 Au5 Au6 121.4 . . ?
Au7 Au5 Au9 83.5 . . ?
Au7 Au5 Au23 116.2 . . ?
Au7 Au5 Au29 57.5 . . ?
Au8 Au5 Au1 89.9 . . ?
Au8 Au5 Au2 118.3 . . ?
Au8 Au5 Au4 120.1 . . ?
Au8 Au5 Au6 179.2 . . ?
Au8 Au5 Au7 57.8 . . ?
Au8 Au5 Au9 63.3 . . ?
Au8 Au5 Au12 122.3 . . ?
Au8 Au5 Au23 94.7 . . ?
Au8 Au5 Au29 57.8 . . ?
Au9 Au5 Au23 137.8 . . ?
Au12 Au5 Au1 62.6 . . ?
Au12 Au5 Au2 89.3 . . ?
Au12 Au5 Au4 117.5 . . ?
Au12 Au5 Au6 57.6 . . ?
Au12 Au5 Au7 121.2 . . ?
Au12 Au5 Au9 59.7 . . ?
Au12 Au5 Au23 122.0 . . ?
Au12 Au5 Au29 178.5 . . ?
Au22 Au5 Au1 120.8 . . ?
Au22 Au5 Au2 119.3 . . ?
Au22 Au5 Au4 91.4 . . ?
Au22 Au5 Au6 58.4 . . ?
Au22 Au5 Au7 179.3 . . ?
Au22 Au5 Au8 122.3 . . ?
Au22 Au5 Au9 96.0 . . ?
Au22 Au5 Au12 58.2 . . ?
Au22 Au5 Au23 64.5 . . ?
Au22 Au5 Au29 123.2 . . ?
Au29 Au5 Au1 116.0 . . ?
Au29 Au5 Au2 89.4 . . ?
Au29 Au5 Au4 62.3 . . ?
Au29 Au5 Au9 120.1 . . ?
Au29 Au5 Au23 59.3 . . ?
Au2 Au6 Au13 121.0 . . ?
Au2 Au6 Au16 56.9 . . ?
Au4 Au6 Au2 58.3 . . ?
Au4 Au6 Au13 174.4 . . ?
Au4 Au6 Au16 115.2 . . ?
Au4 Au6 Au26 59.4 . . ?
Au5 Au6 Au2 61.5 . . ?
Au5 Au6 Au4 60.9 . . ?
Au5 Au6 Au13 124.2 . . ?
Au5 Au6 Au16 88.3 . . ?
Au5 Au6 Au26 120.3 . . ?
Au12 Au6 Au2 91.4 . . ?
Au12 Au6 Au4 121.5 . . ?
Au12 Au6 Au5 60.7 . . ?
Au12 Au6 Au13 63.5 . . ?
Au12 Au6 Au16 60.7 . . ?
Au12 Au6 Au22 59.5 . . ?
Au12 Au6 Au26 178.8 . . ?
Au12 Au6 Au39 122.6 . . ?
Au14 Au6 Au2 126.2 . . ?
Au14 Au6 Au4 116.4 . . ?
Au14 Au6 Au5 170.3 . . ?
Au14 Au6 Au12 121.6 . . ?
Au14 Au6 Au13 59.0 . . ?
Au14 Au6 Au16 101.0 . . ?
Au14 Au6 Au22 112.9 . . ?
Au14 Au6 Au26 57.6 . . ?
Au14 Au6 Au39 80.0 . . ?
Au15 Au6 Au2 63.9 . . ?
Au15 Au6 Au4 90.6 . . ?
Au15 Au6 Au5 125.4 . . ?
Au15 Au6 Au12 121.5 . . ?
Au15 Au6 Au13 84.4 . . ?
Au15 Au6 Au14 62.6 . . ?
Au15 Au6 Au16 61.5 . . ?
Au15 Au6 Au22 175.4 . . ?
Au15 Au6 Au26 57.5 . . ?
Au15 Au6 Au39 115.6 . . ?
Au16 Au6 Au13 64.3 . . ?
Au22 Au6 Au2 120.6 . . ?
Au22 Au6 Au4 92.4 . . ?
Au22 Au6 Au5 59.1 . . ?
Au22 Au6 Au13 92.5 . . ?
Au22 Au6 Au16 120.0 . . ?
Au22 Au6 Au26 121.5 . . ?
Au22 Au6 Au39 63.2 . . ?
Au26 Au6 Au2 88.6 . . ?
Au26 Au6 Au13 115.5 . . ?
Au26 Au6 Au16 118.4 . . ?
Au39 Au6 Au2 118.9 . . ?
Au39 Au6 Au4 60.6 . . ?
Au39 Au6 Au5 90.9 . . ?
Au39 Au6 Au13 119.6 . . ?
Au39 Au6 Au16 175.4 . . ?
Au39 Au6 Au26 58.3 . . ?
Au1 Au7 Au2 58.9 . . ?
Au1 Au7 Au5 62.8 . . ?
Au1 Au7 Au30 174.7 . . ?
Au1 Au7 Au33 61.8 . . ?
Au1 Au7 Au34 59.6 . . ?
Au1 Au7 Au36 116.5 . . ?
Au2 Au7 Au30 123.0 . . ?
Au2 Au7 Au34 89.6 . . ?
Au2 Au7 Au36 57.6 . . ?
Au5 Au7 Au2 61.8 . . ?
Au5 Au7 Au30 122.5 . . ?
Au5 Au7 Au33 93.8 . . ?
Au5 Au7 Au34 122.4 . . ?
Au5 Au7 Au36 89.1 . . ?
Au8 Au7 Au1 93.6 . . ?
Au8 Au7 Au2 121.5 . . ?
Au8 Au7 Au5 59.6 . . ?
Au8 Au7 Au29 59.8 . . ?
Au8 Au7 Au30 89.3 . . ?
Au8 Au7 Au33 64.3 . . ?
Au8 Au7 Au34 121.6 . . ?
Au8 Au7 Au35 174.1 . . ?
Au8 Au7 Au36 120.6 . . ?
Au29 Au7 Au1 124.3 . . ?
Au29 Au7 Au2 92.5 . . ?
Au29 Au7 Au5 61.6 . . ?
Au29 Au7 Au30 61.0 . . ?
Au29 Au7 Au33 124.0 . . ?
Au29 Au7 Au34 176.1 . . ?
Au29 Au7 Au36 61.0 . . ?
Au31 Au7 Au1 116.7 . . ?
Au31 Au7 Au2 128.3 . . ?
Au31 Au7 Au5 168.9 . . ?
Au31 Au7 Au8 110.1 . . ?
Au31 Au7 Au29 118.3 . . ?
Au31 Au7 Au30 58.1 . . ?
Au31 Au7 Au33 77.1 . . ?
Au31 Au7 Au34 57.9 . . ?
Au31 Au7 Au35 64.1 . . ?
Au31 Au7 Au36 100.4 . . ?
Au33 Au7 Au2 120.6 . . ?
Au33 Au7 Au30 115.9 . . ?
Au33 Au7 Au34 57.3 . . ?
Au33 Au7 Au36 175.0 . . ?
Au34 Au7 Au30 115.1 . . ?
Au34 Au7 Au36 117.8 . . ?
Au35 Au7 Au1 90.3 . . ?
Au35 Au7 Au2 64.4 . . ?
Au35 Au7 Au5 126.3 . . ?
Au35 Au7 Au29 121.2 . . ?
Au35 Au7 Au30 86.5 . . ?
Au35 Au7 Au33 113.9 . . ?
Au35 Au7 Au34 57.0 . . ?
Au35 Au7 Au36 61.1 . . ?
Au36 Au7 Au30 65.4 . . ?
Au5 Au8 Au9 63.2 . . ?
Au5 Au8 Au11 81.1 . . ?
Au5 Au8 Au32 141.6 . . ?
Au5 Au8 Au33 93.0 . . ?
Au7 Au8 Au5 62.6 . . ?
Au7 Au8 Au9 85.7 . . ?
Au7 Au8 Au11 137.9 . . ?
Au7 Au8 Au29 60.7 . . ?
Au7 Au8 Au32 79.1 . . ?
Au7 Au8 Au33 60.0 . . ?
Au11 Au8 Au9 96.8 . . ?
Au29 Au8 Au5 62.9 . . ?
Au29 Au8 Au9 125.0 . . ?
Au29 Au8 Au11 84.9 . . ?
Au29 Au8 Au32 101.5 . . ?
Au29 Au8 Au33 120.6 . . ?
Au32 Au8 Au9 114.0 . . ?
Au32 Au8 Au11 134.9 . . ?
Au32 Au8 Au33 63.7 . . ?
Au33 Au8 Au9 53.4 . . ?
Au33 Au8 Au11 147.9 . . ?
S3 Au8 Au5 125.0 . . ?
S3 Au8 Au7 172.3 . . ?
S3 Au8 Au9 97.1 . . ?
S3 Au8 Au11 49.0 . . ?
S3 Au8 Au29 122.2 . . ?
S3 Au8 Au32 93.2 . . ?
S3 Au8 Au33 116.2 . . ?
Au1 Au9 Au5 61.4 . . ?
Au1 Au9 Au8 89.0 . . ?
Au1 Au9 Au10 130.9 . . ?
Au1 Au9 Au12 64.5 . . ?
Au1 Au9 Au20 58.3 . . ?
Au1 Au9 Au33 65.4 . . ?
Au5 Au9 Au8 53.5 . . ?
Au5 Au9 Au10 75.1 . . ?
Au8 Au9 Au10 82.4 . . ?
Au12 Au9 Au5 56.0 . . ?
Au12 Au9 Au8 109.0 . . ?
Au12 Au9 Au10 73.0 . . ?
Au20 Au9 Au5 119.4 . . ?
Au20 Au9 Au8 118.9 . . ?
Au20 Au9 Au10 158.4 . . ?
Au20 Au9 Au12 100.9 . . ?
Au33 Au9 Au5 91.7 . . ?
Au33 Au9 Au8 61.1 . . ?
Au33 Au9 Au10 141.1 . . ?
Au33 Au9 Au12 129.0 . . ?
Au33 Au9 Au20 58.6 . . ?
S4 Au9 Au1 173.5 . . ?
S4 Au9 Au5 114.8 . . ?
S4 Au9 Au8 92.6 . . ?
S4 Au9 Au10 43.3 . . ?
S4 Au9 Au12 109.1 . . ?
S4 Au9 Au20 125.8 . . ?
S4 Au9 Au33 120.8 . . ?
Au11 Au10 Au9 91.0 . . ?
Au11 Au10 Au22 82.3 . . ?
Au22 Au10 Au9 85.9 . . ?
S1 Au10 Au9 136.3 . . ?
S1 Au10 Au11 87.6 . . ?
S1 Au10 Au22 50.6 . . ?
S1 Au10 S4 172.7 . . ?
S4 Au10 Au9 44.9 . . ?
S4 Au10 Au11 99.7 . . ?
S4 Au10 Au22 130.7 . . ?
Au8 Au11 Au10 89.8 . . ?
Au8 Au11 Au23 86.8 . . ?
Au10 Au11 Au23 99.2 . . ?
S2 Au11 Au8 132.3 . . ?
S2 Au11 Au10 101.4 . . ?
S2 Au11 Au23 45.8 . . ?
S2 Au11 S3 165.7 . . ?
S3 Au11 Au8 51.6 . . ?
S3 Au11 Au10 92.0 . . ?
S3 Au11 Au23 137.0 . . ?
Au1 Au12 Au13 120.7 . . ?
Au1 Au12 Au21 60.0 . . ?
Au5 Au12 Au1 60.9 . . ?
Au5 Au12 Au9 64.3 . . ?
Au5 Au12 Au13 126.4 . . ?
Au5 Au12 Au16 90.8 . . ?
Au5 Au12 Au21 120.7 . . ?
Au6 Au12 Au1 90.6 . . ?
Au6 Au12 Au5 61.7 . . ?
Au6 Au12 Au9 125.0 . . ?
Au6 Au12 Au13 64.7 . . ?
Au6 Au12 Au16 64.3 . . ?
Au6 Au12 Au21 122.7 . . ?
Au9 Au12 Au1 53.7 . . ?
Au9 Au12 Au13 166.0 . . ?
Au9 Au12 Au21 77.9 . . ?
Au13 Au12 Au21 88.3 . . ?
Au16 Au12 Au1 54.9 . . ?
Au16 Au12 Au9 107.7 . . ?
Au16 Au12 Au13 65.9 . . ?
Au16 Au12 Au21 58.5 . . ?
Au22 Au12 Au1 120.6 . . ?
Au22 Au12 Au5 59.8 . . ?
Au22 Au12 Au6 60.4 . . ?
Au22 Au12 Au9 100.1 . . ?
Au22 Au12 Au13 93.7 . . ?
Au22 Au12 Au16 124.5 . . ?
Au22 Au12 Au21 176.9 . . ?
S16 Au12 Au1 93.6 . . ?
S16 Au12 Au5 139.9 . . ?
S16 Au12 Au6 155.5 . . ?
S16 Au12 Au9 75.7 . . ?
S16 Au12 Au13 92.6 . . ?
S16 Au12 Au16 98.8 . . ?
S16 Au12 Au21 42.8 . . ?
S16 Au12 Au22 134.6 . . ?
Au6 Au13 Au16 55.7 . . ?
Au12 Au13 Au6 51.8 . . ?
Au12 Au13 Au16 54.1 . . ?
Au14 Au13 Au6 52.8 . . ?
Au14 Au13 Au12 103.9 . . ?
Au14 Au13 Au16 90.7 . . ?
S5 Au13 Au6 100.5 . . ?
S5 Au13 Au12 91.8 . . ?
S5 Au13 Au14 92.5 . . ?
S5 Au13 Au16 145.4 . . ?
S17 Au13 Au6 91.9 . . ?
S17 Au13 Au12 97.4 . . ?
S17 Au13 Au14 93.5 . . ?
S17 Au13 Au16 45.5 . . ?
S17 Au13 S5 167.5 . . ?
Au6 Au14 Au13 68.2 . . ?
Au6 Au14 Au15 58.6 . . ?
Au6 Au14 Au26 65.0 . . ?
Au6 Au14 Au27 74.3 . . ?
Au6 Au14 Au42 127.0 . . ?
Au13 Au14 Au27 70.7 . . ?
Au13 Au14 Au42 138.3 . . ?
Au15 Au14 Au13 87.2 . . ?
Au15 Au14 Au27 132.7 . . ?
Au15 Au14 Au42 134.5 . . ?
Au26 Au14 Au13 131.7 . . ?
Au26 Au14 Au15 58.7 . . ?
Au26 Au14 Au27 106.5 . . ?
Au26 Au14 Au42 82.2 . . ?
Au27 Au14 Au42 77.0 . . ?
S7 Au14 Au6 160.8 . . ?
S7 Au14 Au13 107.0 . . ?
S7 Au14 Au15 140.5 . . ?
S7 Au14 Au26 121.1 . . ?
S7 Au14 Au27 86.6 . . ?
S7 Au14 Au42 44.3 . . ?
Au2 Au15 Au3 54.5 . . ?
Au2 Au15 Au18 73.7 . . ?
Au3 Au15 Au18 78.7 . . ?
Au6 Au15 Au2 62.1 . . ?
Au6 Au15 Au3 89.8 . . ?
Au6 Au15 Au14 58.7 . . ?
Au6 Au15 Au16 64.5 . . ?
Au6 Au15 Au18 132.0 . . ?
Au6 Au15 Au26 65.1 . . ?
Au14 Au15 Au2 120.5 . . ?
Au14 Au15 Au3 118.8 . . ?
Au14 Au15 Au16 100.5 . . ?
Au14 Au15 Au18 161.4 . . ?
Au16 Au15 Au2 57.3 . . ?
Au16 Au15 Au3 111.3 . . ?
Au16 Au15 Au18 76.6 . . ?
Au26 Au15 Au2 91.6 . . ?
Au26 Au15 Au3 60.5 . . ?
Au26 Au15 Au14 58.8 . . ?
Au26 Au15 Au16 128.9 . . ?
Au26 Au15 Au18 136.9 . . ?
S18 Au15 Au2 113.8 . . ?
S18 Au15 Au3 88.4 . . ?
S18 Au15 Au6 175.8 . . ?
S18 Au15 Au14 125.4 . . ?
S18 Au15 Au16 112.7 . . ?
S18 Au15 Au18 43.9 . . ?
S18 Au15 Au26 117.1 . . ?
Au1 Au16 Au2 61.2 . . ?
Au1 Au16 Au6 90.6 . . ?
Au1 Au16 Au12 64.4 . . ?
Au1 Au16 Au13 124.4 . . ?
Au1 Au16 Au15 123.1 . . ?
Au1 Au16 Au21 66.3 . . ?
Au2 Au16 Au6 60.5 . . ?
Au2 Au16 Au12 90.1 . . ?
Au2 Au16 Au13 120.1 . . ?
Au2 Au16 Au15 62.6 . . ?
Au2 Au16 Au21 127.4 . . ?
Au6 Au16 Au13 59.9 . . ?
Au6 Au16 Au21 122.5 . . ?
Au12 Au16 Au6 55.0 . . ?
Au12 Au16 Au13 60.1 . . ?
Au12 Au16 Au15 108.5 . . ?
Au12 Au16 Au21 67.6 . . ?
Au15 Au16 Au6 54.0 . . ?
Au15 Au16 Au13 78.5 . . ?
Au15 Au16 Au21 168.1 . . ?
Au17 Au16 Au1 59.7 . . ?
Au17 Au16 Au2 59.8 . . ?
Au17 Au16 Au6 120.3 . . ?
Au17 Au16 Au12 123.9 . . ?
Au17 Au16 Au13 175.8 . . ?
Au17 Au16 Au15 98.2 . . ?
Au17 Au16 Au21 93.1 . . ?
Au21 Au16 Au13 90.0 . . ?
S17 Au16 Au1 158.5 . . ?
S17 Au16 Au2 138.5 . . ?
S17 Au16 Au6 94.6 . . ?
S17 Au16 Au12 102.1 . . ?
S17 Au16 Au13 44.4 . . ?
S17 Au16 Au15 76.0 . . ?
S17 Au16 Au17 132.4 . . ?
S17 Au16 Au21 93.6 . . ?
Au1 Au17 Au2 62.2 . . ?
Au1 Au17 Au16 60.3 . . ?
Au1 Au17 Au18 137.2 . . ?
Au1 Au17 Au19 78.5 . . ?
Au1 Au17 Au34 60.9 . . ?
Au1 Au17 Au35 86.1 . . ?
Au2 Au17 Au18 81.1 . . ?
Au2 Au17 Au19 140.6 . . ?
Au2 Au17 Au34 92.6 . . ?
Au2 Au17 Au35 62.1 . . ?
Au16 Au17 Au2 62.2 . . ?
Au16 Au17 Au18 84.3 . . ?
Au16 Au17 Au19 101.4 . . ?
Au16 Au17 Au34 121.1 . . ?
Au16 Au17 Au35 123.5 . . ?
Au18 Au17 Au35 96.0 . . ?
Au19 Au17 Au18 135.6 . . ?
Au19 Au17 Au35 115.5 . . ?
Au34 Au17 Au18 147.2 . . ?
Au34 Au17 Au19 64.3 . . ?
Au34 Au17 Au35 53.7 . . ?
S23 Au17 Au1 172.1 . . ?
S23 Au17 Au2 125.7 . . ?
S23 Au17 Au16 121.9 . . ?
S23 Au17 Au18 49.5 . . ?
S23 Au17 Au19 93.6 . . ?
S23 Au17 Au34 116.0 . . ?
S23 Au17 Au35 97.8 . . ?
Au17 Au18 Au15 86.1 . . ?
Au37 Au18 Au15 96.8 . . ?
Au37 Au18 Au17 89.6 . . ?
S18 Au18 Au15 46.5 . . ?
S18 Au18 Au17 132.0 . . ?
S18 Au18 Au37 101.7 . . ?
S18 Au18 S23 165.1 . . ?
S23 Au18 Au15 135.9 . . ?
S23 Au18 Au17 50.9 . . ?
S23 Au18 Au37 92.7 . . ?
Au17 Au19 Au20 94.0 . . ?
Au17 Au19 Au34 57.2 . . ?
Au20 Au19 Au34 67.8 . . ?
S24 Au19 Au17 93.8 . . ?
S24 Au19 Au20 87.9 . . ?
S24 Au19 Au34 138.6 . . ?
S24 Au19 S25 172.7 . . ?
S25 Au19 Au17 93.5 . . ?
S25 Au19 Au20 92.8 . . ?
S25 Au19 Au34 47.7 . . ?
Au1 Au20 Au9 58.4 . . ?
Au1 Au20 Au19 77.8 . . ?
Au1 Au20 Au21 69.1 . . ?
Au1 Au20 Au33 65.5 . . ?
Au1 Au20 Au41 127.8 . . ?
Au9 Au20 Au19 135.9 . . ?
Au9 Au20 Au21 86.9 . . ?
Au9 Au20 Au41 125.1 . . ?
Au19 Au20 Au41 84.2 . . ?
Au21 Au20 Au19 72.3 . . ?
Au21 Au20 Au41 147.8 . . ?
Au33 Au20 Au9 58.6 . . ?
Au33 Au20 Au19 109.1 . . ?
Au33 Au20 Au21 132.7 . . ?
Au33 Au20 Au41 75.3 . . ?
S15 Au20 Au1 157.8 . . ?
S15 Au20 Au9 143.6 . . ?
S15 Au20 Au19 80.4 . . ?
S15 Au20 Au21 108.1 . . ?
S15 Au20 Au33 118.8 . . ?
S15 Au20 Au41 44.7 . . ?
Au1 Au21 Au12 54.9 . . ?
Au16 Au21 Au1 51.7 . . ?
Au16 Au21 Au12 53.9 . . ?
Au20 Au21 Au1 51.9 . . ?
Au20 Au21 Au12 90.3 . . ?
Au20 Au21 Au16 102.8 . . ?
S16 Au21 Au1 90.5 . . ?
S16 Au21 Au12 44.5 . . ?
S16 Au21 Au16 96.1 . . ?
S16 Au21 Au20 94.5 . . ?
S16 Au21 S24 169.1 . . ?
S24 Au21 Au1 100.3 . . ?
S24 Au21 Au12 145.2 . . ?
S24 Au21 Au16 92.1 . . ?
S24 Au21 Au20 90.8 . . ?
Au5 Au22 Au10 84.8 . . ?
Au5 Au22 Au23 62.7 . . ?
Au5 Au22 Au27 137.7 . . ?
Au5 Au22 Au39 90.8 . . ?
Au6 Au22 Au5 62.4 . . ?
Au6 Au22 Au10 137.5 . . ?
Au6 Au22 Au23 86.9 . . ?
Au6 Au22 Au27 75.4 . . ?
Au6 Au22 Au39 59.7 . . ?
Au10 Au22 Au23 102.1 . . ?
Au12 Au22 Au5 62.1 . . ?
Au12 Au22 Au6 60.2 . . ?
Au12 Au22 Au10 81.3 . . ?
Au12 Au22 Au23 124.1 . . ?
Au12 Au22 Au27 100.0 . . ?
Au12 Au22 Au39 119.9 . . ?
Au27 Au22 Au10 132.7 . . ?
Au27 Au22 Au23 114.7 . . ?
Au39 Au22 Au10 153.0 . . ?
Au39 Au22 Au23 53.0 . . ?
Au39 Au22 Au27 64.2 . . ?
S1 Au22 Au5 127.2 . . ?
S1 Au22 Au6 170.0 . . ?
S1 Au22 Au10 48.2 . . ?
S1 Au22 Au12 119.7 . . ?
S1 Au22 Au23 100.2 . . ?
S1 Au22 Au27 95.1 . . ?
S1 Au22 Au39 119.3 . . ?
Au4 Au23 Au5 59.5 . . ?
Au4 Au23 Au11 128.1 . . ?
Au4 Au23 Au22 87.3 . . ?
Au4 Au23 Au24 57.9 . . ?
Au4 Au23 Au29 63.2 . . ?
Au5 Au23 Au11 71.8 . . ?
Au5 Au23 Au22 52.8 . . ?
Au22 Au23 Au11 76.4 . . ?
Au24 Au23 Au5 117.0 . . ?
Au24 Au23 Au11 166.6 . . ?
Au24 Au23 Au22 116.9 . . ?
Au24 Au23 Au29 99.9 . . ?
Au29 Au23 Au5 56.6 . . ?
Au29 Au23 Au11 76.1 . . ?
Au29 Au23 Au22 108.9 . . ?
Au39 Au23 Au4 63.9 . . ?
Au39 Au23 Au5 88.4 . . ?
Au39 Au23 Au11 134.4 . . ?
Au39 Au23 Au22 59.4 . . ?
Au39 Au23 Au24 58.1 . . ?
Au39 Au23 Au29 126.2 . . ?
S2 Au23 Au4 170.5 . . ?
S2 Au23 Au5 111.1 . . ?
S2 Au23 Au11 44.1 . . ?
S2 Au23 Au22 85.2 . . ?
S2 Au23 Au24 131.1 . . ?
S2 Au23 Au29 113.9 . . ?
S2 Au23 Au39 116.5 . . ?
Au4 Au24 Au23 59.2 . . ?
Au4 Au24 Au25 129.4 . . ?
Au4 Au24 Au28 68.0 . . ?
Au4 Au24 Au38 78.1 . . ?
Au23 Au24 Au25 125.9 . . ?
Au23 Au24 Au28 86.7 . . ?
Au23 Au24 Au38 137.0 . . ?
Au28 Au24 Au25 147.1 . . ?
Au28 Au24 Au38 71.5 . . ?
Au38 Au24 Au25 84.4 . . ?
Au39 Au24 Au4 64.5 . . ?
Au39 Au24 Au23 58.6 . . ?
Au39 Au24 Au25 77.8 . . ?
Au39 Au24 Au28 130.8 . . ?
Au39 Au24 Au38 109.5 . . ?
S9 Au24 Au4 156.4 . . ?
S9 Au24 Au23 144.2 . . ?
S9 Au24 Au25 43.3 . . ?
S9 Au24 Au28 108.3 . . ?
S9 Au24 Au38 78.7 . . ?
S9 Au24 Au39 120.3 . . ?
S8 Au25 Au24 138.9 . . ?
S9 Au25 Au24 44.4 . . ?
S9 Au25 S8 175.4 . . ?
Au3 Au26 Au38 58.9 . . ?
Au4 Au26 Au3 56.4 . . ?
Au4 Au26 Au6 59.7 . . ?
Au4 Au26 Au38 73.9 . . ?
Au6 Au26 Au3 88.9 . . ?
Au6 Au26 Au38 133.3 . . ?
Au14 Au26 Au3 128.1 . . ?
Au14 Au26 Au4 116.6 . . ?
Au14 Au26 Au6 57.4 . . ?
Au14 Au26 Au38 169.2 . . ?
Au14 Au26 Au39 80.5 . . ?
Au15 Au26 Au3 66.1 . . ?
Au15 Au26 Au4 90.7 . . ?
Au15 Au26 Au6 57.4 . . ?
Au15 Au26 Au14 62.5 . . ?
Au15 Au26 Au38 122.1 . . ?
Au15 Au26 Au39 116.5 . . ?
Au39 Au26 Au3 117.4 . . ?
Au39 Au26 Au4 61.1 . . ?
Au39 Au26 Au6 59.3 . . ?
Au39 Au26 Au38 103.9 . . ?
S19 Au26 Au3 94.7 . . ?
S19 Au26 Au4 119.2 . . ?
S19 Au26 Au6 174.6 . . ?
S19 Au26 Au14 122.4 . . ?
S19 Au26 Au15 127.9 . . ?
S19 Au26 Au38 46.8 . . ?
S19 Au26 Au39 115.4 . . ?
Au14 Au27 Au39 69.9 . . ?
Au22 Au27 Au14 97.3 . . ?
Au22 Au27 Au39 57.0 . . ?
S5 Au27 Au14 88.8 . . ?
S5 Au27 Au22 96.1 . . ?
S5 Au27 Au39 141.2 . . ?
S6 Au27 Au14 92.4 . . ?
S6 Au27 Au22 93.7 . . ?
S6 Au27 Au39 48.0 . . ?
S6 Au27 S5 169.9 . . ?
Au4 Au28 Au29 55.4 . . ?
Au24 Au28 Au4 52.9 . . ?
Au24 Au28 Au29 91.2 . . ?
Au24 Au28 Au36 104.8 . . ?
Au36 Au28 Au4 52.8 . . ?
Au36 Au28 Au29 54.6 . . ?
S10 Au28 Au4 90.1 . . ?
S10 Au28 Au24 91.4 . . ?
S10 Au28 Au29 45.7 . . ?
S10 Au28 Au36 98.6 . . ?
S10 Au28 S20 166.0 . . ?
S20 Au28 Au4 102.9 . . ?
S20 Au28 Au24 92.3 . . ?
S20 Au28 Au29 147.7 . . ?
S20 Au28 Au36 93.6 . . ?
Au4 Au29 Au28 59.8 . . ?
Au4 Au29 Au30 124.0 . . ?
Au5 Au29 Au4 59.6 . . ?
Au5 Au29 Au23 64.2 . . ?
Au5 Au29 Au28 119.2 . . ?
Au5 Au29 Au30 128.2 . . ?
Au5 Au29 Au36 90.2 . . ?
Au7 Au29 Au4 89.4 . . ?
Au7 Au29 Au5 61.0 . . ?
Au7 Au29 Au23 124.5 . . ?
Au7 Au29 Au28 122.4 . . ?
Au7 Au29 Au30 67.3 . . ?
Au7 Au29 Au36 63.6 . . ?
Au8 Au29 Au4 118.9 . . ?
Au8 Au29 Au5 59.4 . . ?
Au8 Au29 Au7 59.5 . . ?
Au8 Au29 Au23 99.0 . . ?
Au8 Au29 Au28 177.1 . . ?
Au8 Au29 Au30 92.7 . . ?
Au8 Au29 Au36 123.0 . . ?
Au23 Au29 Au4 54.9 . . ?
Au23 Au29 Au28 78.2 . . ?
Au23 Au29 Au30 166.7 . . ?
Au30 Au29 Au28 90.1 . . ?
Au36 Au29 Au4 55.6 . . ?
Au36 Au29 Au23 109.6 . . ?
Au36 Au29 Au28 58.8 . . ?
Au36 Au29 Au30 68.5 . . ?
S10 Au29 Au4 92.6 . . ?
S10 Au29 Au5 136.2 . . ?
S10 Au29 Au7 159.5 . . ?
S10 Au29 Au8 134.8 . . ?
S10 Au29 Au23 72.1 . . ?
S10 Au29 Au28 44.1 . . ?
S10 Au29 Au30 95.1 . . ?
S10 Au29 Au36 101.1 . . ?
Au7 Au30 Au36 53.9 . . ?
Au29 Au30 Au7 51.8 . . ?
Au29 Au30 Au36 53.8 . . ?
Au31 Au30 Au7 51.4 . . ?
Au31 Au30 Au29 102.6 . . ?
Au31 Au30 Au36 87.7 . . ?
S11 Au30 Au7 99.3 . . ?
S11 Au30 Au29 89.3 . . ?
S11 Au30 Au31 94.2 . . ?
S11 Au30 Au36 142.3 . . ?
S11 Au30 S26 172.0 . . ?
S26 Au30 Au7 88.7 . . ?
S26 Au30 Au29 96.2 . . ?
S26 Au30 Au31 90.2 . . ?
S26 Au30 Au36 44.4 . . ?
Au7 Au31 Au30 70.5 . . ?
Au7 Au31 Au32 77.0 . . ?
Au7 Au31 Au34 66.0 . . ?
Au7 Au31 Au35 58.7 . . ?
Au7 Au31 Au40 129.5 . . ?
Au30 Au31 Au32 70.9 . . ?
Au30 Au31 Au40 141.5 . . ?
Au32 Au31 Au40 81.7 . . ?
Au34 Au31 Au30 135.1 . . ?
Au34 Au31 Au32 108.4 . . ?
Au34 Au31 Au35 57.9 . . ?
Au34 Au31 Au40 78.6 . . ?
Au35 Au31 Au30 90.3 . . ?
Au35 Au31 Au32 135.6 . . ?
Au35 Au31 Au40 127.9 . . ?
S13 Au31 Au7 168.8 . . ?
S13 Au31 Au30 119.3 . . ?
S13 Au31 Au32 110.5 . . ?
S13 Au31 Au34 103.2 . . ?
S13 Au31 Au35 113.7 . . ?
S13 Au31 Au40 46.7 . . ?
Au8 Au32 Au31 93.8 . . ?
Au8 Au32 Au33 58.4 . . ?
Au31 Au32 Au33 67.2 . . ?
S11 Au32 Au8 91.3 . . ?
S11 Au32 Au31 89.4 . . ?
S11 Au32 Au33 138.4 . . ?
S11 Au32 S12 172.9 . . ?
S12 Au32 Au8 94.9 . . ?
S12 Au32 Au31 93.8 . . ?
S12 Au32 Au33 48.7 . . ?
Au1 Au33 Au8 87.1 . . ?
Au1 Au33 Au32 132.6 . . ?
Au7 Au33 Au1 59.1 . . ?
Au7 Au33 Au8 55.7 . . ?
Au7 Au33 Au32 74.3 . . ?
Au8 Au33 Au32 57.9 . . ?
Au9 Au33 Au1 56.9 . . ?
Au9 Au33 Au7 90.4 . . ?
Au9 Au33 Au8 65.5 . . ?
Au9 Au33 Au32 119.9 . . ?
Au9 Au33 Au34 117.1 . . ?
Au20 Au33 Au1 56.9 . . ?
Au20 Au33 Au7 115.2 . . ?
Au20 Au33 Au8 127.4 . . ?
Au20 Au33 Au9 62.8 . . ?
Au20 Au33 Au32 170.5 . . ?
Au20 Au33 Au34 78.3 . . ?
Au34 Au33 Au1 60.6 . . ?
Au34 Au33 Au7 63.1 . . ?
Au34 Au33 Au8 118.7 . . ?
Au34 Au33 Au32 106.6 . . ?
S12 Au33 Au1 179.0 . . ?
S12 Au33 Au7 120.1 . . ?
S12 Au33 Au8 92.9 . . ?
S12 Au33 Au9 124.0 . . ?
S12 Au33 Au20 123.8 . . ?
S12 Au33 Au32 46.7 . . ?
S12 Au33 Au34 118.5 . . ?
Au1 Au34 Au7 58.5 . . ?
Au1 Au34 Au17 55.7 . . ?
Au1 Au34 Au19 73.4 . . ?
Au7 Au34 Au17 87.2 . . ?
Au7 Au34 Au19 131.5 . . ?
Au17 Au34 Au19 58.5 . . ?
Au31 Au34 Au1 113.8 . . ?
Au31 Au34 Au7 56.1 . . ?
Au31 Au34 Au17 127.5 . . ?
Au31 Au34 Au19 172.2 . . ?
Au31 Au34 Au33 77.5 . . ?
Au33 Au34 Au1 62.2 . . ?
Au33 Au34 Au7 59.7 . . ?
Au33 Au34 Au17 117.9 . . ?
Au33 Au34 Au19 104.6 . . ?
Au35 Au34 Au1 89.8 . . ?
Au35 Au34 Au7 57.3 . . ?
Au35 Au34 Au17 65.1 . . ?
Au35 Au34 Au19 120.8 . . ?
Au35 Au34 Au31 63.5 . . ?
Au35 Au34 Au33 116.7 . . ?
S25 Au34 Au1 118.7 . . ?
S25 Au34 Au7 175.8 . . ?
S25 Au34 Au17 93.5 . . ?
S25 Au34 Au19 46.4 . . ?
S25 Au34 Au31 125.9 . . ?
S25 Au34 Au33 116.5 . . ?
S25 Au34 Au35 126.6 . . ?
Au2 Au35 Au17 54.6 . . ?
Au2 Au35 Au37 76.4 . . ?
Au7 Au35 Au2 61.3 . . ?
Au7 Au35 Au17 89.3 . . ?
Au7 Au35 Au31 57.2 . . ?
Au7 Au35 Au36 64.0 . . ?
Au7 Au35 Au37 131.9 . . ?
Au17 Au35 Au37 83.5 . . ?
Au31 Au35 Au2 118.3 . . ?
Au31 Au35 Au17 118.8 . . ?
Au31 Au35 Au36 97.9 . . ?
Au31 Au35 Au37 157.4 . . ?
Au34 Au35 Au2 92.5 . . ?
Au34 Au35 Au7 65.7 . . ?
Au34 Au35 Au17 61.2 . . ?
Au34 Au35 Au31 58.6 . . ?
Au34 Au35 Au36 129.2 . . ?
Au34 Au35 Au37 142.0 . . ?
Au36 Au35 Au2 57.5 . . ?
Au36 Au35 Au17 111.8 . . ?
Au36 Au35 Au37 74.9 . . ?
S22 Au35 Au2 116.3 . . ?
S22 Au35 Au7 175.0 . . ?
S22 Au35 Au17 92.4 . . ?
S22 Au35 Au31 125.5 . . ?
S22 Au35 Au34 119.2 . . ?
S22 Au35 Au36 111.0 . . ?
S22 Au35 Au37 43.8 . . ?
Au2 Au36 Au7 60.3 . . ?
Au2 Au36 Au28 125.9 . . ?
Au2 Au36 Au29 90.7 . . ?
Au2 Au36 Au30 120.9 . . ?
Au2 Au36 Au35 63.2 . . ?
Au3 Au36 Au2 59.9 . . ?
Au3 Au36 Au4 60.1 . . ?
Au3 Au36 Au7 120.1 . . ?
Au3 Au36 Au28 91.7 . . ?
Au3 Au36 Au29 123.6 . . ?
Au3 Au36 Au30 178.7 . . ?
Au3 Au36 Au35 98.6 . . ?
Au4 Au36 Au2 60.9 . . ?
Au4 Au36 Au7 89.3 . . ?
Au4 Au36 Au28 65.0 . . ?
Au4 Au36 Au29 63.5 . . ?
Au4 Au36 Au30 121.2 . . ?
Au4 Au36 Au35 123.3 . . ?
Au7 Au36 Au28 122.0 . . ?
Au7 Au36 Au30 60.7 . . ?
Au28 Au36 Au30 88.6 . . ?
Au29 Au36 Au7 55.4 . . ?
Au29 Au36 Au28 66.7 . . ?
Au29 Au36 Au30 57.7 . . ?
Au35 Au36 Au7 54.9 . . ?
Au35 Au36 Au28 169.1 . . ?
Au35 Au36 Au29 109.6 . . ?
Au35 Au36 Au30 81.0 . . ?
S26 Au36 Au2 139.5 . . ?
S26 Au36 Au3 135.8 . . ?
S26 Au36 Au4 155.8 . . ?
S26 Au36 Au7 93.3 . . ?
S26 Au36 Au28 93.6 . . ?
S26 Au36 Au29 98.6 . . ?
S26 Au36 Au30 42.9 . . ?
S26 Au36 Au35 76.7 . . ?
Au3 Au37 Au35 84.9 . . ?
Au18 Au37 Au3 84.0 . . ?
Au18 Au37 Au35 90.9 . . ?
S21 Au37 Au3 51.1 . . ?
S21 Au37 Au18 89.3 . . ?
S21 Au37 Au35 135.7 . . ?
S21 Au37 S22 171.8 . . ?
S22 Au37 Au3 130.0 . . ?
S22 Au37 Au18 98.9 . . ?
S22 Au37 Au35 45.3 . . ?
Au3 Au38 Au24 94.5 . . ?
Au3 Au38 Au26 57.0 . . ?
Au24 Au38 Au26 68.2 . . ?
S19 Au38 Au3 93.8 . . ?
S19 Au38 Au24 92.0 . . ?
S19 Au38 Au26 47.7 . . ?
S20 Au38 Au3 93.5 . . ?
S20 Au38 Au24 89.1 . . ?
S20 Au38 Au26 139.1 . . ?
S20 Au38 S19 172.5 . . ?
Au4 Au39 Au22 88.9 . . ?
Au4 Au39 Au27 132.1 . . ?
Au6 Au39 Au4 60.6 . . ?
Au6 Au39 Au22 57.1 . . ?
Au6 Au39 Au27 71.8 . . ?
Au22 Au39 Au27 58.8 . . ?
Au23 Au39 Au4 58.6 . . ?
Au23 Au39 Au6 94.3 . . ?
Au23 Au39 Au22 67.6 . . ?
Au23 Au39 Au26 118.7 . . ?
Au23 Au39 Au27 123.4 . . ?
Au24 Au39 Au4 57.8 . . ?
Au24 Au39 Au6 117.3 . . ?
Au24 Au39 Au22 130.0 . . ?
Au24 Au39 Au23 63.3 . . ?
Au24 Au39 Au26 78.3 . . ?
Au24 Au39 Au27 169.4 . . ?
Au26 Au39 Au4 60.7 . . ?
Au26 Au39 Au6 62.4 . . ?
Au26 Au39 Au22 119.5 . . ?
Au26 Au39 Au27 102.9 . . ?
S6 Au39 Au4 173.7 . . ?
S6 Au39 Au6 116.5 . . ?
S6 Au39 Au22 93.9 . . ?
S6 Au39 Au23 127.7 . . ?
S6 Au39 Au24 123.4 . . ?
S6 Au39 Au26 113.0 . . ?
S6 Au39 Au27 46.3 . . ?
S13 Au40 Au31 47.3 . . ?
S14 Au40 Au31 138.6 . . ?
S14 Au40 S13 172.2 . . ?
S14 Au41 Au20 140.6 . . ?
S15 Au41 Au20 46.5 . . ?
S15 Au41 S14 171.4 . . ?
S7 Au42 Au14 45.2 . . ?
S7 Au42 S8 171.0 . . ?
S8 Au42 Au14 140.6 . . ?
Au10 S1 Au22 81.2 . . ?
C1 S1 Au10 101.0 . . ?
C1 S1 Au22 105.2 . . ?
Au11 S2 Au23 90.1 . . ?
C7 S2 Au11 99.3 . . ?
C7 S2 Au23 113.2 . . ?
Au11 S3 Au8 79.4 . . ?
C13 S3 Au8 106.1 . . ?
C13 S3 Au11 107.6 . . ?
Au10 S4 Au9 91.8 . . ?
C19 S4 Au9 103.7 . . ?
C19 S4 Au10 102.7 . . ?
Au27 S5 Au13 97.9 . . ?
C25 S5 Au13 104.4 . . ?
C25 S5 Au27 104.1 . . ?
Au27 S6 Au39 85.7 . . ?
C31 S6 Au27 109.1 . . ?
C31 S6 Au39 104.2 . . ?
Au42 S7 Au14 90.4 . . ?
C37 S7 Au14 112.8 . . ?
C37 S7 Au42 106.5 . . ?
Au42 S8 Au25 107.7 . . ?
C43 S8 Au25 102.8 . . ?
C43 S8 Au42 104.0 . . ?
Au25 S9 Au24 92.3 . . ?
C49 S9 Au24 109.6 . . ?
C49 S9 Au25 103.7 . . ?
Au28 S10 Au29 90.2 . . ?
C55 S10 Au28 104.6 . . ?
C55 S10 Au29 119.6 . . ?
Au32 S11 Au30 99.7 . . ?
C61 S11 Au30 106.6 . . ?
C61 S11 Au32 104.0 . . ?
Au32 S12 Au33 84.6 . . ?
C67 S12 Au32 109.3 . . ?
C67 S12 Au33 101.4 . . ?
Au40 S13 Au31 86.0 . . ?
C73 S13 Au31 126.2 . . ?
C73 S13 Au40 136.6 . . ?
Au40 S14 Au41 106.1 . . ?
C79 S14 Au40 102.4 . . ?
C79 S14 Au41 106.1 . . ?
Au41 S15 Au20 88.7 . . ?
C85 S15 Au20 107.5 . . ?
C85 S15 Au41 103.8 . . ?
Au21 S16 Au12 92.7 . . ?
C91 S16 Au12 111.9 . . ?
C91 S16 Au21 109.7 . . ?
Au13 S17 Au16 90.1 . . ?
C97 S17 Au13 106.6 . . ?
C97 S17 Au16 113.3 . . ?
Au18 S18 Au15 89.6 . . ?
C103 S18 Au15 105.4 . . ?
C103 S18 Au18 100.2 . . ?
Au38 S19 Au26 85.6 . . ?
C109 S19 Au26 103.0 . . ?
C109 S19 Au38 108.3 . . ?
Au38 S20 Au28 98.0 . . ?
C115 S20 Au28 100.5 . . ?
C115 S20 Au38 100.1 . . ?
Au37 S21 Au3 80.7 . . ?
C121 S21 Au3 105.4 . . ?
C121 S21 Au37 103.7 . . ?
Au37 S22 Au35 90.8 . . ?
C127 S22 Au35 103.8 . . ?
C127 S22 Au37 99.1 . . ?
Au18 S23 Au17 79.6 . . ?
C133 S23 Au17 108.3 . . ?
C133 S23 Au18 97.3 . . ?
Au19 S24 Au21 100.7 . . ?
C139 S24 Au19 103.4 . . ?
C139 S24 Au21 103.7 . . ?
Au19 S25 Au34 85.9 . . ?
C145 S25 Au19 106.1 . . ?
C145 S25 Au34 102.9 . . ?
Au30 S26 Au36 92.7 . . ?
C151 S26 Au30 109.6 . . ?
C151 S26 Au36 114.1 . . ?
S1 C1 H1 110.7 . . ?
C2 C1 S1 110.9 . . ?
C2 C1 H1 110.7 . . ?
C2 C1 C6 109.6 . . ?
C6 C1 S1 104.1 . . ?
C6 C1 H1 110.7 . . ?
C1 C2 H2A 109.2 . . ?
C1 C2 H2B 109.2 . . ?
C1 C2 C3 111.8 . . ?
H2A C2 H2B 107.9 . . ?
C3 C2 H2A 109.2 . . ?
C3 C2 H2B 109.2 . . ?
C2 C3 H3A 111.1 . . ?
C2 C3 H3B 111.1 . . ?
C2 C3 C4 103.2 . . ?
H3A C3 H3B 109.1 . . ?
C4 C3 H3A 111.1 . . ?
C4 C3 H3B 111.1 . . ?
C3 C4 H4A 110.0 . . ?
C3 C4 H4B 110.0 . . ?
H4A C4 H4B 108.4 . . ?
C5 C4 C3 108.4 . . ?
C5 C4 H4A 110.0 . . ?
C5 C4 H4B 110.0 . . ?
C4 C5 H5A 110.3 . . ?
C4 C5 H5B 110.3 . . ?
C4 C5 C6 107.0 . . ?
H5A C5 H5B 108.6 . . ?
C6 C5 H5A 110.3 . . ?
C6 C5 H5B 110.3 . . ?
C1 C6 H6A 109.1 . . ?
C1 C6 H6B 109.1 . . ?
C5 C6 C1 112.5 . . ?
C5 C6 H6A 109.1 . . ?
C5 C6 H6B 109.1 . . ?
H6A C6 H6B 107.8 . . ?
S2 C7 H7 105.2 . . ?
C8 C7 S2 107.6 . . ?
C8 C7 H7 105.2 . . ?
C12 C7 S2 115.1 . . ?
C12 C7 H7 105.2 . . ?
C12 C7 C8 117.5 . . ?
C7 C8 H8A 108.8 . . ?
C7 C8 H8B 108.8 . . ?
C7 C8 C9 113.7 . . ?
H8A C8 H8B 107.7 . . ?
C9 C8 H8A 108.8 . . ?
C9 C8 H8B 108.8 . . ?
C8 C9 H9A 112.1 . . ?
C8 C9 H9B 112.0 . . ?
C8 C9 C10 98.6 . . ?
H9A C9 H9B 109.7 . . ?
C10 C9 H9A 112.0 . . ?
C10 C9 H9B 112.0 . . ?
C9 C10 H10A 109.8 . . ?
C9 C10 H10B 109.8 . . ?
H10A C10 H10B 108.3 . . ?
C11 C10 C9 109.3 . . ?
C11 C10 H10A 109.8 . . ?
C11 C10 H10B 109.8 . . ?
C10 C11 H11A 108.8 . . ?
C10 C11 H11B 108.8 . . ?
C10 C11 C12 114.0 . . ?
H11A C11 H11B 107.7 . . ?
C12 C11 H11A 108.8 . . ?
C12 C11 H11B 108.8 . . ?
C7 C12 C11 115.1 . . ?
C7 C12 H12A 108.5 . . ?
C7 C12 H12B 108.5 . . ?
C11 C12 H12A 108.5 . . ?
C11 C12 H12B 108.5 . . ?
H12A C12 H12B 107.5 . . ?
S3 C13 H13 103.0 . . ?
C14 C13 S3 104.9 . . ?
C14 C13 H13 103.0 . . ?
C18 C13 S3 113.0 . . ?
C18 C13 H13 103.0 . . ?
C18 C13 C14 126.9 . . ?
C13 C14 H14A 108.7 . . ?
C13 C14 H14B 108.7 . . ?
C13 C14 C15 114.3 . . ?
H14A C14 H14B 107.6 . . ?
C15 C14 H14A 108.7 . . ?
C15 C14 H14B 108.7 . . ?
C14 C15 H15A 110.0 . . ?
C14 C15 H15B 110.0 . . ?
H15A C15 H15B 108.4 . . ?
C16 C15 C14 108.6 . . ?
C16 C15 H15A 110.0 . . ?
C16 C15 H15B 110.0 . . ?
C15 C16 H16A 109.9 . . ?
C15 C16 H16B 109.9 . . ?
H16A C16 H16B 108.3 . . ?
C17 C16 C15 109.1 . . ?
C17 C16 H16A 109.9 . . ?
C17 C16 H16B 109.9 . . ?
C16 C17 H17A 107.1 . . ?
C16 C17 H17B 107.1 . . ?
H17A C17 H17B 106.8 . . ?
C18 C17 C16 120.9 . . ?
C18 C17 H17A 107.1 . . ?
C18 C17 H17B 107.1 . . ?
C13 C18 C17 99.7 . . ?
C13 C18 H18A 111.8 . . ?
C13 C18 H18B 111.8 . . ?
C17 C18 H18A 111.8 . . ?
C17 C18 H18B 111.8 . . ?
H18A C18 H18B 109.5 . . ?
S4 C19 H19 108.4 . . ?
C20 C19 S4 112.0 . . ?
C20 C19 H19 108.4 . . ?
C24 C19 S4 108.1 . . ?
C24 C19 H19 108.4 . . ?
C24 C19 C20 111.3 . . ?
C19 C20 H20A 110.3 . . ?
C19 C20 H20B 110.3 . . ?
C19 C20 C21 107.0 . . ?
H20A C20 H20B 108.6 . . ?
C21 C20 H20A 110.3 . . ?
C21 C20 H20B 110.3 . . ?
C20 C21 H21A 108.0 . . ?
C20 C21 H21B 108.0 . . ?
H21A C21 H21B 107.3 . . ?
C22 C21 C20 117.1 . . ?
C22 C21 H21A 108.0 . . ?
C22 C21 H21B 108.0 . . ?
C21 C22 H22A 109.0 . . ?
C21 C22 H22B 109.0 . . ?
C21 C22 C23 113.0 . . ?
H22A C22 H22B 107.8 . . ?
C23 C22 H22A 109.0 . . ?
C23 C22 H22B 109.0 . . ?
C22 C23 H23A 111.2 . . ?
C22 C23 H23B 111.2 . . ?
H23A C23 H23B 109.1 . . ?
C24 C23 C22 103.0 . . ?
C24 C23 H23A 111.2 . . ?
C24 C23 H23B 111.2 . . ?
C19 C24 C23 113.0 . . ?
C19 C24 H24A 109.0 . . ?
C19 C24 H24B 109.0 . . ?
C23 C24 H24A 109.0 . . ?
C23 C24 H24B 109.0 . . ?
H24A C24 H24B 107.8 . . ?
S5 C25 H25 105.8 . . ?
C26 C25 S5 112.7 . . ?
C26 C25 H25 105.8 . . ?
C26 C25 C30 113.2 . . ?
C30 C25 S5 112.8 . . ?
C30 C25 H25 105.8 . . ?
C25 C26 H26A 110.6 . . ?
C25 C26 H26B 110.6 . . ?
C25 C26 C27 105.7 . . ?
H26A C26 H26B 108.7 . . ?
C27 C26 H26A 110.6 . . ?
C27 C26 H26B 110.6 . . ?
C26 C27 H27A 109.2 . . ?
C26 C27 H27B 109.2 . . ?
H27A C27 H27B 107.9 . . ?
C28 C27 C26 111.9 . . ?
C28 C27 H27A 109.2 . . ?
C28 C27 H27B 109.2 . . ?
C27 C28 H28A 109.3 . . ?
C27 C28 H28B 109.3 . . ?
H28A C28 H28B 108.0 . . ?
C29 C28 C27 111.6 . . ?
C29 C28 H28A 109.3 . . ?
C29 C28 H28B 109.3 . . ?
C28 C29 H29A 106.7 . . ?
C28 C29 H29B 106.7 . . ?
C28 C29 C30 122.4 . . ?
H29A C29 H29B 106.6 . . ?
C30 C29 H29A 106.7 . . ?
C30 C29 H29B 106.7 . . ?
C25 C30 H30A 109.7 . . ?
C25 C30 H30B 109.7 . . ?
C29 C30 C25 110.0 . . ?
C29 C30 H30A 109.7 . . ?
C29 C30 H30B 109.7 . . ?
H30A C30 H30B 108.2 . . ?
S6 C31 H31 110.6 . . ?
C32 C31 S6 108.0 . . ?
C32 C31 H31 110.6 . . ?
C36 C31 S6 108.6 . . ?
C36 C31 H31 110.6 . . ?
C36 C31 C32 108.3 . . ?
C31 C32 H32A 109.2 . . ?
C31 C32 H32B 109.2 . . ?
C31 C32 C33 111.8 . . ?
H32A C32 H32B 107.9 . . ?
C33 C32 H32A 109.2 . . ?
C33 C32 H32B 109.2 . . ?
C32 C33 H33A 109.3 . . ?
C32 C33 H33B 109.3 . . ?
H33A C33 H33B 108.0 . . ?
C34 C33 C32 111.6 . . ?
C34 C33 H33A 109.3 . . ?
C34 C33 H33B 109.3 . . ?
C33 C34 H34A 108.6 . . ?
C33 C34 H34B 108.6 . . ?
C33 C34 C35 114.5 . . ?
H34A C34 H34B 107.6 . . ?
C35 C34 H34A 108.6 . . ?
C35 C34 H34B 108.6 . . ?
C34 C35 H35A 109.1 . . ?
C34 C35 H35B 109.1 . . ?
H35A C35 H35B 107.9 . . ?
C36 C35 C34 112.3 . . ?
C36 C35 H35A 109.1 . . ?
C36 C35 H35B 109.1 . . ?
C31 C36 C35 110.7 . . ?
C31 C36 H36A 109.5 . . ?
C31 C36 H36B 109.5 . . ?
C35 C36 H36A 109.5 . . ?
C35 C36 H36B 109.5 . . ?
H36A C36 H36B 108.1 . . ?
S7 C37 H37 109.6 . . ?
C38 C37 S7 104.9 . . ?
C38 C37 H37 109.6 . . ?
C38 C37 C42 114.6 . . ?
C42 C37 S7 108.4 . . ?
C42 C37 H37 109.6 . . ?
C37 C38 H38A 110.9 . . ?
C37 C38 H38B 110.9 . . ?
C37 C38 C39 104.3 . . ?
H38A C38 H38B 108.9 . . ?
C39 C38 H38A 110.9 . . ?
C39 C38 H38B 110.9 . . ?
C38 C39 H39A 109.7 . . ?
C38 C39 H39B 109.7 . . ?
H39A C39 H39B 108.2 . . ?
C40 C39 C38 109.9 . . ?
C40 C39 H39A 109.7 . . ?
C40 C39 H39B 109.7 . . ?
C39 C40 H40A 108.8 . . ?
C39 C40 H40B 108.8 . . ?
C39 C40 C41 113.9 . . ?
H40A C40 H40B 107.7 . . ?
C41 C40 H40A 108.8 . . ?
C41 C40 H40B 108.8 . . ?
C40 C41 H41A 110.3 . . ?
C40 C41 H41B 110.3 . . ?
H41A C41 H41B 108.6 . . ?
C42 C41 C40 107.1 . . ?
C42 C41 H41A 110.3 . . ?
C42 C41 H41B 110.3 . . ?
C37 C42 H42A 110.9 . . ?
C37 C42 H42B 110.9 . . ?
C41 C42 C37 104.3 . . ?
C41 C42 H42A 110.9 . . ?
C41 C42 H42B 110.9 . . ?
H42A C42 H42B 108.9 . . ?
S8 C43 H43 102.5 . . ?
C44 C43 S8 113.0 . . ?
C44 C43 H43 102.5 . . ?
C48 C43 S8 124.6 . . ?
C48 C43 H43 102.5 . . ?
C48 C43 C44 108.6 . . ?
C43 C44 H44A 107.6 . . ?
C43 C44 H44B 107.6 . . ?
H44A C44 H44B 107.0 . . ?
C45 C44 C43 118.8 . . ?
C45 C44 H44A 107.6 . . ?
C45 C44 H44B 107.6 . . ?
C44 C45 H45A 111.2 . . ?
C44 C45 H45B 111.2 . . ?
C44 C45 C46 102.9 . . ?
H45A C45 H45B 109.1 . . ?
C46 C45 H45A 111.2 . . ?
C46 C45 H45B 111.2 . . ?
C45 C46 H46A 109.3 . . ?
C45 C46 H46B 109.3 . . ?
C45 C46 C47 111.4 . . ?
H46A C46 H46B 108.0 . . ?
C47 C46 H46A 109.3 . . ?
C47 C46 H46B 109.3 . . ?
C46 C47 H47A 110.2 . . ?
C46 C47 H47B 110.2 . . ?
H47A C47 H47B 108.5 . . ?
C48 C47 C46 107.5 . . ?
C48 C47 H47A 110.2 . . ?
C48 C47 H47B 110.2 . . ?
C43 C48 C47 126.9 . . ?
C43 C48 H48A 105.6 . . ?
C43 C48 H48B 105.6 . . ?
C47 C48 H48A 105.6 . . ?
C47 C48 H48B 105.6 . . ?
H48A C48 H48B 106.1 . . ?
S9 C49 H49 109.9 . . ?
C50 C49 S9 111.0 . . ?
C50 C49 H49 109.9 . . ?
C50 C49 C54 109.3 . . ?
C54 C49 S9 106.7 . . ?
C54 C49 H49 109.9 . . ?
C49 C50 H50A 109.2 . . ?
C49 C50 H50B 109.2 . . ?
H50A C50 H50B 107.9 . . ?
C51 C50 C49 111.9 . . ?
C51 C50 H50A 109.2 . . ?
C51 C50 H50B 109.2 . . ?
C50 C51 H51A 110.5 . . ?
C50 C51 H51B 110.5 . . ?
C50 C51 C52 106.1 . . ?
H51A C51 H51B 108.7 . . ?
C52 C51 H51A 110.5 . . ?
C52 C51 H51B 110.5 . . ?
C51 C52 H52A 110.4 . . ?
C51 C52 H52B 110.4 . . ?
H52A C52 H52B 108.6 . . ?
C53 C52 C51 106.5 . . ?
C53 C52 H52A 110.4 . . ?
C53 C52 H52B 110.4 . . ?
C52 C53 H53A 107.8 . . ?
C52 C53 H53B 107.8 . . ?
C52 C53 C54 118.2 . . ?
H53A C53 H53B 107.1 . . ?
C54 C53 H53A 107.8 . . ?
C54 C53 H53B 107.8 . . ?
C49 C54 H54A 110.7 . . ?
C49 C54 H54B 110.7 . . ?
C53 C54 C49 105.4 . . ?
C53 C54 H54A 110.7 . . ?
C53 C54 H54B 110.7 . . ?
H54A C54 H54B 108.8 . . ?
C56 C55 S10 115.7 . . ?
C60 C55 S10 132.2 . . ?
C60 C55 C56 109.3 . . ?
C55 C56 H56A 109.9 . . ?
C55 C56 H56B 109.9 . . ?
C55 C56 C57 108.8 . . ?
H56A C56 H56B 108.3 . . ?
C57 C56 H56A 109.9 . . ?
C57 C56 H56B 109.9 . . ?
C56 C57 H57A 110.1 . . ?
C56 C57 H57B 110.1 . . ?
C56 C57 C58 108.2 . . ?
H57A C57 H57B 108.4 . . ?
C58 C57 H57A 110.1 . . ?
C58 C57 H57B 110.1 . . ?
C57 C58 H58A 109.9 . . ?
C57 C58 H58B 109.9 . . ?
H58A C58 H58B 108.3 . . ?
C59 C58 C57 108.9 . . ?
C59 C58 H58A 109.9 . . ?
C59 C58 H58B 109.9 . . ?
C58 C59 H59A 109.9 . . ?
C58 C59 H59B 109.9 . . ?
C58 C59 C60 109.0 . . ?
H59A C59 H59B 108.3 . . ?
C60 C59 H59A 109.9 . . ?
C60 C59 H59B 109.9 . . ?
C55 C60 C59 109.1 . . ?
C55 C60 H60A 109.9 . . ?
C55 C60 H60B 109.9 . . ?
C59 C60 H60A 109.9 . . ?
C59 C60 H60B 109.9 . . ?
H60A C60 H60B 108.3 . . ?
S11 C61 H61 110.0 . . ?
C62 C61 S11 111.1 . . ?
C62 C61 H61 110.0 . . ?
C66 C61 S11 106.3 . . ?
C66 C61 H61 110.0 . . ?
C66 C61 C62 109.3 . . ?
C61 C62 H62A 111.7 . . ?
C61 C62 H62B 111.7 . . ?
H62A C62 H62B 109.5 . . ?
C63 C62 C61 100.4 . . ?
C63 C62 H62A 111.7 . . ?
C63 C62 H62B 111.7 . . ?
C62 C63 H63A 109.5 . . ?
C62 C63 H63B 109.5 . . ?
C62 C63 C64 110.7 . . ?
H63A C63 H63B 108.1 . . ?
C64 C63 H63A 109.5 . . ?
C64 C63 H63B 109.5 . . ?
C63 C64 H64A 110.6 . . ?
C63 C64 H64B 110.6 . . ?
H64A C64 H64B 108.7 . . ?
C65 C64 C63 105.7 . . ?
C65 C64 H64A 110.6 . . ?
C65 C64 H64B 110.6 . . ?
C64 C65 H65A 108.3 . . ?
C64 C65 H65B 108.3 . . ?
C64 C65 C66 116.1 . . ?
H65A C65 H65B 107.4 . . ?
C66 C65 H65A 108.3 . . ?
C66 C65 H65B 108.3 . . ?
C61 C66 C65 117.1 . . ?
C61 C66 H66A 108.0 . . ?
C61 C66 H66B 108.0 . . ?
C65 C66 H66A 108.0 . . ?
C65 C66 H66B 108.0 . . ?
H66A C66 H66B 107.3 . . ?
S12 C67 H67 107.9 . . ?
C68 C67 S12 114.0 . . ?
C68 C67 H67 107.9 . . ?
C68 C67 C72 110.1 . . ?
C72 C67 S12 109.0 . . ?
C72 C67 H67 107.9 . . ?
C67 C68 H68A 109.0 . . ?
C67 C68 H68B 109.0 . . ?
C67 C68 C69 112.8 . . ?
H68A C68 H68B 107.8 . . ?
C69 C68 H68A 109.0 . . ?
C69 C68 H68B 109.0 . . ?
C68 C69 H69A 108.2 . . ?
C68 C69 H69B 108.2 . . ?
H69A C69 H69B 107.3 . . ?
C70 C69 C68 116.4 . . ?
C70 C69 H69A 108.2 . . ?
C70 C69 H69B 108.2 . . ?
C69 C70 H70A 112.0 . . ?
C69 C70 H70B 112.0 . . ?
C69 C70 C71 98.7 . . ?
H70A C70 H70B 109.7 . . ?
C71 C70 H70A 112.0 . . ?
C71 C70 H70B 112.0 . . ?
C70 C71 H71A 106.5 . . ?
C70 C71 H71B 106.5 . . ?
H71A C71 H71B 106.5 . . ?
C72 C71 C70 123.4 . . ?
C72 C71 H71A 106.5 . . ?
C72 C71 H71B 106.5 . . ?
C67 C72 H72A 110.3 . . ?
C67 C72 H72B 110.3 . . ?
C71 C72 C67 107.2 . . ?
C71 C72 H72A 110.3 . . ?
C71 C72 H72B 110.3 . . ?
H72A C72 H72B 108.5 . . ?
S13 C73 H73 100.4 . . ?
C74 C73 S13 130.0 . . ?
C74 C73 H73 100.4 . . ?
C78 C73 S13 111.0 . . ?
C78 C73 H73 100.4 . . ?
C78 C73 C74 109.2 . . ?
C73 C74 H74A 109.6 . . ?
C73 C74 H74B 109.6 . . ?
C73 C74 C75 110.4 . . ?
H74A C74 H74B 108.1 . . ?
C75 C74 H74A 109.6 . . ?
C75 C74 H74B 109.6 . . ?
C74 C75 H75A 109.9 . . ?
C74 C75 H75B 109.9 . . ?
C74 C75 C76 109.0 . . ?
H75A C75 H75B 108.3 . . ?
C76 C75 H75A 109.9 . . ?
C76 C75 H75B 109.9 . . ?
C75 C76 H76A 109.9 . . ?
C75 C76 H76B 109.9 . . ?
C75 C76 C77 109.0 . . ?
H76A C76 H76B 108.3 . . ?
C77 C76 H76A 109.9 . . ?
C77 C76 H76B 109.9 . . ?
C76 C77 H77A 109.9 . . ?
C76 C77 H77B 109.9 . . ?
H77A C77 H77B 108.3 . . ?
C78 C77 C76 109.1 . . ?
C78 C77 H77A 109.9 . . ?
C78 C77 H77B 109.9 . . ?
C73 C78 H78A 106.8 . . ?
C73 C78 H78B 106.8 . . ?
C77 C78 C73 122.1 . . ?
C77 C78 H78A 106.8 . . ?
C77 C78 H78B 106.8 . . ?
H78A C78 H78B 106.7 . . ?
S14 C79 H79 97.8 . . ?
C80 C79 S14 133.7 . . ?
C80 C79 H79 97.8 . . ?
C84 C79 S14 111.3 . . ?
C84 C79 H79 97.8 . . ?
C84 C79 C80 109.2 . . ?
C79 C80 H80A 109.4 . . ?
C79 C80 H80B 109.4 . . ?
H80A C80 H80B 108.0 . . ?
C81 C80 C79 111.2 . . ?
C81 C80 H80A 109.4 . . ?
C81 C80 H80B 109.4 . . ?
C80 C81 H81A 110.7 . . ?
C80 C81 H81B 110.7 . . ?
H81A C81 H81B 108.8 . . ?
C82 C81 C80 105.1 . . ?
C82 C81 H81A 110.7 . . ?
C82 C81 H81B 110.7 . . ?
C81 C82 H82A 109.4 . . ?
C81 C82 H82B 109.4 . . ?
H82A C82 H82B 108.0 . . ?
C83 C82 C81 111.1 . . ?
C83 C82 H82A 109.4 . . ?
C83 C82 H82B 109.4 . . ?
C82 C83 H83A 109.5 . . ?
C82 C83 H83B 109.5 . . ?
C82 C83 C84 110.7 . . ?
H83A C83 H83B 108.1 . . ?
C84 C83 H83A 109.5 . . ?
C84 C83 H83B 109.5 . . ?
C79 C84 H84A 109.8 . . ?
C79 C84 H84B 109.8 . . ?
C83 C84 C79 109.5 . . ?
C83 C84 H84A 109.8 . . ?
C83 C84 H84B 109.8 . . ?
H84A C84 H84B 108.2 . . ?
S15 C85 H85 110.5 . . ?
C86 C85 S15 111.6 . . ?
C86 C85 H85 110.5 . . ?
C86 C85 C90 110.9 . . ?
C90 C85 S15 102.8 . . ?
C90 C85 H85 110.5 . . ?
C85 C86 H86A 109.5 . . ?
C85 C86 H86B 109.5 . . ?
H86A C86 H86B 108.0 . . ?
C87 C86 C85 110.9 . . ?
C87 C86 H86A 109.5 . . ?
C87 C86 H86B 109.5 . . ?
C86 C87 H87A 109.6 . . ?
C86 C87 H87B 109.6 . . ?
C86 C87 C88 110.2 . . ?
H87A C87 H87B 108.1 . . ?
C88 C87 H87A 109.6 . . ?
C88 C87 H87B 109.6 . . ?
C87 C88 H88A 108.8 . . ?
C87 C88 H88B 108.8 . . ?
H88A C88 H88B 107.7 . . ?
C89 C88 C87 113.8 . . ?
C89 C88 H88A 108.8 . . ?
C89 C88 H88B 108.8 . . ?
C88 C89 H89A 108.9 . . ?
C88 C89 H89B 108.9 . . ?
C88 C89 C90 113.3 . . ?
H89A C89 H89B 107.7 . . ?
C90 C89 H89A 108.9 . . ?
C90 C89 H89B 108.9 . . ?
C85 C90 H90A 108.8 . . ?
C85 C90 H90B 108.8 . . ?
C89 C90 C85 114.0 . . ?
C89 C90 H90A 108.8 . . ?
C89 C90 H90B 108.8 . . ?
H90A C90 H90B 107.7 . . ?
S16 C91 H91 108.6 . . ?
C92 C91 S16 109.5 . . ?
C92 C91 H91 108.6 . . ?
C96 C91 S16 107.4 . . ?
C96 C91 H91 108.6 . . ?
C96 C91 C92 114.1 . . ?
C91 C92 H92A 109.0 . . ?
C91 C92 H92B 109.0 . . ?
H92A C92 H92B 107.8 . . ?
C93 C92 C91 112.9 . . ?
C93 C92 H92A 109.0 . . ?
C93 C92 H92B 109.0 . . ?
C92 C93 H93A 110.9 . . ?
C92 C93 H93B 110.9 . . ?
C92 C93 C94 104.3 . . ?
H93A C93 H93B 108.9 . . ?
C94 C93 H93A 110.9 . . ?
C94 C93 H93B 110.9 . . ?
C93 C94 H94A 111.6 . . ?
C93 C94 H94B 111.6 . . ?
H94A C94 H94B 109.4 . . ?
C95 C94 C93 101.0 . . ?
C95 C94 H94A 111.6 . . ?
C95 C94 H94B 111.6 . . ?
C94 C95 H95A 109.7 . . ?
C94 C95 H95B 109.7 . . ?
C94 C95 C96 110.0 . . ?
H95A C95 H95B 108.2 . . ?
C96 C95 H95A 109.7 . . ?
C96 C95 H95B 109.7 . . ?
C91 C96 C95 111.7 . . ?
C91 C96 H96A 109.3 . . ?
C91 C96 H96B 109.3 . . ?
C95 C96 H96A 109.3 . . ?
C95 C96 H96B 109.3 . . ?
H96A C96 H96B 107.9 . . ?
S17 C97 H97 108.1 . . ?
C98 C97 S17 107.5 . . ?
C98 C97 H97 108.1 . . ?
C98 C97 C102 112.7 . . ?
C102 C97 S17 112.2 . . ?
C102 C97 H97 108.1 . . ?
C97 C98 H98A 108.6 . . ?
C97 C98 H98B 108.6 . . ?
H98A C98 H98B 107.6 . . ?
C99 C98 C97 114.5 . . ?
C99 C98 H98A 108.6 . . ?
C99 C98 H98B 108.6 . . ?
C98 C99 H99A 109.2 . . ?
C98 C99 H99B 109.2 . . ?
C98 C99 C100 112.1 . . ?
H99A C99 H99B 107.9 . . ?
C100 C99 H99A 109.2 . . ?
C100 C99 H99B 109.2 . . ?
C99 C100 H10C 108.9 . . ?
C99 C100 H10D 108.9 . . ?
C99 C100 C101 113.3 . . ?
H10C C100 H10D 107.7 . . ?
C101 C100 H10C 108.9 . . ?
C101 C100 H10D 108.9 . . ?
C100 C101 H10E 110.0 . . ?
C100 C101 H10F 110.0 . . ?
H10E C101 H10F 108.4 . . ?
C102 C101 C100 108.4 . . ?
C102 C101 H10E 110.0 . . ?
C102 C101 H10F 110.0 . . ?
C97 C102 H10G 109.4 . . ?
C97 C102 H10H 109.4 . . ?
C101 C102 C97 111.4 . . ?
C101 C102 H10G 109.4 . . ?
C101 C102 H10H 109.4 . . ?
H10G C102 H10H 108.0 . . ?
S18 C103 H103 109.9 . . ?
C104 C103 S18 104.6 . . ?
C104 C103 H103 109.9 . . ?
C108 C103 S18 108.8 . . ?
C108 C103 H103 109.9 . . ?
C108 C103 C104 113.5 . . ?
C103 C104 H10I 110.0 . . ?
C103 C104 H10J 110.0 . . ?
H10I C104 H10J 108.4 . . ?
C105 C104 C103 108.3 . . ?
C105 C104 H10I 110.0 . . ?
C105 C104 H10J 110.0 . . ?
C104 C105 H10K 109.7 . . ?
C104 C105 H10L 109.7 . . ?
C104 C105 C106 109.8 . . ?
H10K C105 H10L 108.2 . . ?
C106 C105 H10K 109.7 . . ?
C106 C105 H10L 109.7 . . ?
C105 C106 H10M 110.2 . . ?
C105 C106 H10N 110.2 . . ?
H10M C106 H10N 108.5 . . ?
C107 C106 C105 107.3 . . ?
C107 C106 H10M 110.2 . . ?
C107 C106 H10N 110.2 . . ?
C106 C107 H10O 107.8 . . ?
C106 C107 H10P 107.8 . . ?
C106 C107 C108 118.0 . . ?
H10O C107 H10P 107.1 . . ?
C108 C107 H10O 107.8 . . ?
C108 C107 H10P 107.8 . . ?
C103 C108 C107 104.8 . . ?
C103 C108 H10Q 110.8 . . ?
C103 C108 H10R 110.8 . . ?
C107 C108 H10Q 110.8 . . ?
C107 C108 H10R 110.8 . . ?
H10Q C108 H10R 108.9 . . ?
S19 C109 H109 108.3 . . ?
C110 C109 S19 106.2 . . ?
C110 C109 H109 108.3 . . ?
C114 C109 S19 113.8 . . ?
C114 C109 H109 108.3 . . ?
C114 C109 C110 111.9 . . ?
C109 C110 H11C 110.2 . . ?
C109 C110 H11D 110.2 . . ?
H11C C110 H11D 108.5 . . ?
C111 C110 C109 107.5 . . ?
C111 C110 H11C 110.2 . . ?
C111 C110 H11D 110.2 . . ?
C110 C111 H11E 109.7 . . ?
C110 C111 H11F 109.7 . . ?
H11E C111 H11F 108.2 . . ?
C112 C111 C110 109.9 . . ?
C112 C111 H11E 109.7 . . ?
C112 C111 H11F 109.7 . . ?
C111 C112 H11G 109.6 . . ?
C111 C112 H11H 109.6 . . ?
C111 C112 C113 110.4 . . ?
H11G C112 H11H 108.1 . . ?
C113 C112 H11G 109.6 . . ?
C113 C112 H11H 109.6 . . ?
C112 C113 H11I 108.3 . . ?
C112 C113 H11J 108.3 . . ?
H11I C113 H11J 107.4 . . ?
C114 C113 C112 116.0 . . ?
C114 C113 H11I 108.3 . . ?
C114 C113 H11J 108.3 . . ?
C109 C114 C113 112.7 . . ?
C109 C114 H11K 109.1 . . ?
C109 C114 H11L 109.1 . . ?
C113 C114 H11K 109.1 . . ?
C113 C114 H11L 109.1 . . ?
H11K C114 H11L 107.8 . . ?
S20 C115 H115 109.6 . . ?
C116 C115 S20 102.9 . . ?
C116 C115 H115 109.6 . . ?
C120 C115 S20 116.7 . . ?
C120 C115 H115 109.6 . . ?
C120 C115 C116 108.0 . . ?
C115 C116 H11M 110.0 . . ?
C115 C116 H11N 110.0 . . ?
H11M C116 H11N 108.4 . . ?
C117 C116 C115 108.6 . . ?
C117 C116 H11M 110.0 . . ?
C117 C116 H11N 110.0 . . ?
C116 C117 H11O 111.7 . . ?
C116 C117 H11P 111.7 . . ?
C116 C117 C118 100.3 . . ?
H11O C117 H11P 109.5 . . ?
C118 C117 H11O 111.7 . . ?
C118 C117 H11P 111.7 . . ?
C117 C118 H11Q 108.6 . . ?
C117 C118 H11R 108.6 . . ?
H11Q C118 H11R 107.5 . . ?
C119 C118 C117 114.8 . . ?
C119 C118 H11Q 108.6 . . ?
C119 C118 H11R 108.6 . . ?
C118 C119 H11S 109.4 . . ?
C118 C119 H11T 109.4 . . ?
H11S C119 H11T 108.0 . . ?
C120 C119 C118 111.3 . . ?
C120 C119 H11S 109.4 . . ?
C120 C119 H11T 109.4 . . ?
C115 C120 H12C 109.9 . . ?
C115 C120 H12D 109.9 . . ?
C119 C120 C115 108.8 . . ?
C119 C120 H12C 109.9 . . ?
C119 C120 H12D 109.9 . . ?
H12C C120 H12D 108.3 . . ?
S21 C121 H121 109.2 . . ?
C122 C121 S21 106.5 . . ?
C122 C121 H121 109.2 . . ?
C126 C121 S21 108.1 . . ?
C126 C121 H121 109.2 . . ?
C126 C121 C122 114.4 . . ?
C121 C122 H12E 109.9 . . ?
C121 C122 H12F 109.9 . . ?
C121 C122 C123 108.8 . . ?
H12E C122 H12F 108.3 . . ?
C123 C122 H12E 109.9 . . ?
C123 C122 H12F 109.9 . . ?
C122 C123 H12G 110.0 . . ?
C122 C123 H12H 110.0 . . ?
H12G C123 H12H 108.4 . . ?
C124 C123 C122 108.4 . . ?
C124 C123 H12G 110.0 . . ?
C124 C123 H12H 110.0 . . ?
C123 C124 H12I 108.4 . . ?
C123 C124 H12J 108.4 . . ?
H12I C124 H12J 107.4 . . ?
C125 C124 C123 115.6 . . ?
C125 C124 H12I 108.4 . . ?
C125 C124 H12J 108.4 . . ?
C124 C125 H12K 109.8 . . ?
C124 C125 H12L 109.8 . . ?
C124 C125 C126 109.3 . . ?
H12K C125 H12L 108.3 . . ?
C126 C125 H12K 109.8 . . ?
C126 C125 H12L 109.8 . . ?
C121 C126 C125 116.6 . . ?
C121 C126 H12M 108.2 . . ?
C121 C126 H12N 108.2 . . ?
C125 C126 H12M 108.2 . . ?
C125 C126 H12N 108.2 . . ?
H12M C126 H12N 107.3 . . ?
S22 C127 H127 109.0 . . ?
C128 C127 S22 110.3 . . ?
C128 C127 H127 109.0 . . ?
C128 C127 C132 111.0 . . ?
C132 C127 S22 108.5 . . ?
C132 C127 H127 109.0 . . ?
C127 C128 H12O 109.8 . . ?
C127 C128 H12P 109.8 . . ?
C127 C128 C129 109.5 . . ?
H12O C128 H12P 108.2 . . ?
C129 C128 H12O 109.8 . . ?
C129 C128 H12P 109.8 . . ?
C130 C129 C128 105.5 . . ?
C129 C130 H13A 109.4 . . ?
C129 C130 H13B 109.4 . . ?
H13A C130 H13B 108.0 . . ?
C131 C130 C129 111.0 . . ?
C131 C130 H13A 109.4 . . ?
C131 C130 H13B 109.4 . . ?
C130 C131 H13C 109.4 . . ?
C130 C131 H13D 109.4 . . ?
C130 C131 C132 111.0 . . ?
H13C C131 H13D 108.0 . . ?
C132 C131 H13C 109.4 . . ?
C132 C131 H13D 109.4 . . ?
C127 C132 H13E 109.4 . . ?
C127 C132 H13F 109.4 . . ?
C131 C132 C127 111.3 . . ?
C131 C132 H13E 109.4 . . ?
C131 C132 H13F 109.4 . . ?
H13E C132 H13F 108.0 . . ?
S23 C133 H133 109.2 . . ?
C134 C133 S23 110.4 . . ?
C134 C133 H133 109.2 . . ?
C138 C133 S23 109.5 . . ?
C138 C133 H133 109.2 . . ?
C138 C133 C134 109.4 . . ?
C133 C134 H13G 109.3 . . ?
C133 C134 H13H 109.3 . . ?
H13G C134 H13H 108.0 . . ?
C135 C134 C133 111.5 . . ?
C135 C134 H13G 109.3 . . ?
C135 C134 H13H 109.3 . . ?
C134 C135 H13I 110.4 . . ?
C134 C135 H13J 110.4 . . ?
C134 C135 C136 106.6 . . ?
H13I C135 H13J 108.6 . . ?
C136 C135 H13I 110.4 . . ?
C136 C135 H13J 110.4 . . ?
C135 C136 H13K 111.0 . . ?
C135 C136 H13L 111.0 . . ?
H13K C136 H13L 109.0 . . ?
C137 C136 C135 103.9 . . ?
C137 C136 H13K 111.0 . . ?
C137 C136 H13L 111.0 . . ?
C136 C137 H13M 108.8 . . ?
C136 C137 H13N 108.8 . . ?
C136 C137 C138 113.9 . . ?
H13M C137 H13N 107.7 . . ?
C138 C137 H13M 108.8 . . ?
C138 C137 H13N 108.8 . . ?
C133 C138 C137 103.5 . . ?
C133 C138 H13O 111.1 . . ?
C133 C138 H13P 111.1 . . ?
C137 C138 H13O 111.1 . . ?
C137 C138 H13P 111.1 . . ?
H13O C138 H13P 109.0 . . ?
S24 C139 H139 111.3 . . ?
C140 C139 S24 103.1 . . ?
C140 C139 H139 111.3 . . ?
C144 C139 S24 107.6 . . ?
C144 C139 H139 111.3 . . ?
C144 C139 C140 111.8 . . ?
C139 C140 H14C 110.2 . . ?
C139 C140 H14D 110.2 . . ?
C139 C140 C141 107.6 . . ?
H14C C140 H14D 108.5 . . ?
C141 C140 H14C 110.2 . . ?
C141 C140 H14D 110.2 . . ?
C140 C141 H14E 111.2 . . ?
C140 C141 H14F 111.2 . . ?
C140 C141 C142 102.7 . . ?
H14E C141 H14F 109.1 . . ?
C142 C141 H14E 111.2 . . ?
C142 C141 H14F 111.2 . . ?
C141 C142 H14G 111.2 . . ?
C141 C142 H14H 111.2 . . ?
C141 C142 C143 103.0 . . ?
H14G C142 H14H 109.1 . . ?
C143 C142 H14G 111.2 . . ?
C143 C142 H14H 111.2 . . ?
C142 C143 H14I 109.7 . . ?
C142 C143 H14J 109.7 . . ?
H14I C143 H14J 108.2 . . ?
C144 C143 C142 109.7 . . ?
C144 C143 H14I 109.7 . . ?
C144 C143 H14J 109.7 . . ?
C139 C144 C143 107.2 . . ?
C139 C144 H14K 110.3 . . ?
C139 C144 H14L 110.3 . . ?
C143 C144 H14K 110.3 . . ?
C143 C144 H14L 110.3 . . ?
H14K C144 H14L 108.5 . . ?
S25 C145 H145 113.2 . . ?
C146 C145 S25 105.0 . . ?
C146 C145 H145 113.2 . . ?
C150 C145 S25 104.8 . . ?
C150 C145 H145 113.2 . . ?
C150 C145 C146 106.5 . . ?
C145 C146 H14M 110.1 . . ?
C145 C146 H14N 110.1 . . ?
C145 C146 C147 107.9 . . ?
H14M C146 H14N 108.4 . . ?
C147 C146 H14M 110.1 . . ?
C147 C146 H14N 110.1 . . ?
C146 C147 H14O 110.6 . . ?
C146 C147 H14P 110.6 . . ?
H14O C147 H14P 108.8 . . ?
C148 C147 C146 105.5 . . ?
C148 C147 H14O 110.6 . . ?
C148 C147 H14P 110.6 . . ?
C147 C148 H14Q 108.6 . . ?
C147 C148 H14R 108.6 . . ?
C147 C148 C149 114.8 . . ?
H14Q C148 H14R 107.5 . . ?
C149 C148 H14Q 108.6 . . ?
C149 C148 H14R 108.6 . . ?
C148 C149 H14S 110.4 . . ?
C148 C149 H14T 110.4 . . ?
C148 C149 C150 106.6 . . ?
H14S C149 H14T 108.6 . . ?
C150 C149 H14S 110.4 . . ?
C150 C149 H14T 110.4 . . ?
C145 C150 C149 107.3 . . ?
C145 C150 H15C 110.3 . . ?
C145 C150 H15D 110.3 . . ?
C149 C150 H15C 110.3 . . ?
C149 C150 H15D 110.3 . . ?
H15C C150 H15D 108.5 . . ?
S26 C151 H151 107.1 . . ?
C152 C151 S26 112.3 . . ?
C152 C151 H151 107.1 . . ?
C152 C151 C156 109.7 . . ?
C156 C151 S26 113.1 . . ?
C156 C151 H151 107.1 . . ?
C151 C152 H15E 108.4 . . ?
C151 C152 H15F 108.4 . . ?
C151 C152 C153 115.6 . . ?
H15E C152 H15F 107.4 . . ?
C153 C152 H15E 108.4 . . ?
C153 C152 H15F 108.4 . . ?
C152 C153 H15G 111.4 . . ?
C152 C153 H15H 111.4 . . ?
H15G C153 H15H 109.3 . . ?
C154 C153 C152 101.7 . . ?
C154 C153 H15G 111.4 . . ?
C154 C153 H15H 111.4 . . ?
C153 C154 H15I 110.0 . . ?
C153 C154 H15J 110.0 . . ?
H15I C154 H15J 108.4 . . ?
C155 C154 C153 108.3 . . ?
C155 C154 H15I 110.0 . . ?
C155 C154 H15J 110.0 . . ?
C154 C155 H15K 110.7 . . ?
C154 C155 H15L 110.7 . . ?
H15K C155 H15L 108.8 . . ?
C156 C155 C154 105.2 . . ?
C156 C155 H15K 110.7 . . ?
C156 C155 H15L 110.7 . . ?
C151 C156 H15M 109.2 . . ?
C151 C156 H15N 109.2 . . ?
C155 C156 C151 111.9 . . ?
C155 C156 H15M 109.2 . . ?
C155 C156 H15N 109.2 . . ?
H15M C156 H15N 107.9 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Au9 S4 C19 C20 61.3 . . . . ?
Au9 S4 C19 C24 -175.6 . . . . ?
Au10 S4 C19 C20 156.3 . . . . ?
Au10 S4 C19 C24 -80.6 . . . . ?
Au11 S2 C7 C8 -67.8 . . . . ?
Au11 S2 C7 C12 159.1 . . . . ?
Au12 S16 C91 C92 152.8 . . . . ?
Au12 S16 C91 C96 -82.9 . . . . ?
Au13 S17 C97 C98 176.1 . . . . ?
Au13 S17 C97 C102 51.7 . . . . ?
Au15 S18 C103 C104 -178.2 . . . . ?
Au15 S18 C103 C108 60.2 . . . . ?
Au16 S17 C97 C98 -86.3 . . . . ?
Au16 S17 C97 C102 149.2 . . . . ?
Au17 S23 C133 C134 -99.3 . . . . ?
Au17 S23 C133 C138 140.2 . . . . ?
Au18 S18 C103 C104 -85.8 . . . . ?
Au18 S18 C103 C108 152.6 . . . . ?
Au18 S23 C133 C134 179.3 . . . . ?
Au18 S23 C133 C138 58.8 . . . . ?
Au19 S25 C145 C146 161.8 . . . . ?
Au19 S25 C145 C150 -86.2 . . . . ?
Au21 S16 C91 C92 51.3 . . . . ?
Au21 S16 C91 C96 175.7 . . . . ?
Au23 S2 C7 C8 -161.9 . . . . ?
Au23 S2 C7 C12 65.0 . . . . ?
Au24 S9 C49 C50 61.9 . . . . ?
Au24 S9 C49 C54 -179.1 . . . . ?
Au25 S8 C43 C44 -79.0 . . . . ?
Au25 S8 C43 C48 56.6 . . . . ?
Au25 S9 C49 C50 159.4 . . . . ?
Au25 S9 C49 C54 -81.6 . . . . ?
Au26 S19 C109 C110 -172.8 . . . . ?
Au26 S19 C109 C114 63.7 . . . . ?
Au27 S6 C31 C32 -86.5 . . . . ?
Au27 S6 C31 C36 156.2 . . . . ?
Au28 S10 C55 C56 -177.2 . . . . ?
Au28 S10 C55 C60 23.9 . . . . ?
Au28 S20 C115 C116 73.9 . . . . ?
Au28 S20 C115 C120 -168.1 . . . . ?
Au29 S10 C55 C56 -78.4 . . . . ?
Au29 S10 C55 C60 122.7 . . . . ?
Au30 S26 C151 C152 176.4 . . . . ?
Au30 S26 C151 C156 51.6 . . . . ?
Au31 S13 C73 C74 -95.1 . . . . ?
Au31 S13 C73 C78 46.4 . . . . ?
Au32 S12 C67 C68 163.6 . . . . ?
Au32 S12 C67 C72 -73.0 . . . . ?
Au33 S12 C67 C68 75.4 . . . . ?
Au33 S12 C67 C72 -161.2 . . . . ?
Au34 S25 C145 C146 72.4 . . . . ?
Au34 S25 C145 C150 -175.6 . . . . ?
Au35 S22 C127 C128 66.7 . . . . ?
Au35 S22 C127 C132 -171.6 . . . . ?
Au36 S26 C151 C152 -81.2 . . . . ?
Au36 S26 C151 C156 153.9 . . . . ?
Au37 S22 C127 C128 159.8 . . . . ?
Au37 S22 C127 C132 -78.4 . . . . ?
Au38 S19 C109 C110 -83.2 . . . . ?
Au38 S19 C109 C114 153.2 . . . . ?
Au38 S20 C115 C116 174.0 . . . . ?
Au38 S20 C115 C120 -68.0 . . . . ?
Au39 S6 C31 C32 -176.9 . . . . ?
Au39 S6 C31 C36 65.9 . . . . ?
Au40 S13 C73 C74 134.7 . . . . ?
Au40 S13 C73 C78 -83.9 . . . . ?
Au40 S14 C79 C80 25.3 . . . . ?
Au40 S14 C79 C84 174.9 . . . . ?
Au41 S14 C79 C80 136.4 . . . . ?
Au41 S14 C79 C84 -74.1 . . . . ?
Au42 S8 C43 C44 168.8 . . . . ?
Au42 S8 C43 C48 -55.6 . . . . ?
S1 C1 C2 C3 171.8 . . . . ?
S1 C1 C6 C5 -172.9 . . . . ?
S2 C7 C8 C9 -177.7 . . . . ?
S2 C7 C12 C11 173.4 . . . . ?
S3 C13 C14 C15 -172.6 . . . . ?
S3 C13 C18 C17 168.5 . . . . ?
S4 C19 C20 C21 174.2 . . . . ?
S4 C19 C24 C23 172.4 . . . . ?
S5 C25 C26 C27 -178.3 . . . . ?
S5 C25 C30 C29 -173.9 . . . . ?
S6 C31 C32 C33 -176.1 . . . . ?
S6 C31 C36 C35 175.0 . . . . ?
S7 C37 C38 C39 178.1 . . . . ?
S7 C37 C42 C41 179.4 . . . . ?
S8 C43 C44 C45 -169.0 . . . . ?
S8 C43 C48 C47 -174.4 . . . . ?
S9 C49 C50 C51 -179.2 . . . . ?
S9 C49 C54 C53 -175.4 . . . . ?
S10 C55 C56 C57 -152.9 . . . . ?
S10 C55 C60 C59 93.4 . . . . ?
S11 C61 C62 C63 -177.7 . . . . ?
S11 C61 C66 C65 170.2 . . . . ?
S12 C67 C68 C69 175.4 . . . . ?
S12 C67 C72 C71 -177.8 . . . . ?
S13 C73 C74 C75 133.1 . . . . ?
S13 C73 C78 C77 166.6 . . . . ?
S14 C79 C80 C81 156.5 . . . . ?
S14 C79 C84 C83 -102.9 . . . . ?
S15 C85 C86 C87 -58.1 . . . . ?
S15 C85 C90 C89 72.1 . . . . ?
S16 C91 C92 C93 178.3 . . . . ?
S16 C91 C96 C95 -173.1 . . . . ?
S17 C97 C98 C99 -177.9 . . . . ?
S17 C97 C102 C101 -179.0 . . . . ?
S18 C103 C104 C105 177.3 . . . . ?
S18 C103 C108 C107 176.0 . . . . ?
S19 C109 C110 C111 178.9 . . . . ?
S19 C109 C114 C113 176.7 . . . . ?
S20 C115 C116 C117 -173.8 . . . . ?
S20 C115 C120 C119 -175.5 . . . . ?
S21 C121 C122 C123 176.6 . . . . ?
S21 C121 C126 C125 -171.3 . . . . ?
S22 C127 C128 C129 -179.0 . . . . ?
S22 C127 C132 C131 -173.7 . . . . ?
S23 C133 C134 C135 175.9 . . . . ?
S23 C133 C138 C137 179.1 . . . . ?
S24 C139 C140 C141 173.8 . . . . ?
S24 C139 C144 C143 173.7 . . . . ?
S25 C145 C146 C147 175.8 . . . . ?
S25 C145 C150 C149 -177.6 . . . . ?
S26 C151 C152 C153 -178.3 . . . . ?
S26 C151 C156 C155 176.2 . . . . ?
C1 C2 C3 C4 -60.4 . . . . ?
C2 C1 C6 C5 -54.3 . . . . ?
C2 C3 C4 C5 67.6 . . . . ?
C3 C4 C5 C6 -66.6 . . . . ?
C4 C5 C6 C1 61.8 . . . . ?
C6 C1 C2 C3 57.5 . . . . ?
C7 C8 C9 C10 48.1 . . . . ?
C8 C7 C12 C11 45.1 . . . . ?
C8 C9 C10 C11 -59.4 . . . . ?
C9 C10 C11 C12 67.4 . . . . ?
C10 C11 C12 C7 -58.0 . . . . ?
C12 C7 C8 C9 -45.9 . . . . ?
C13 C14 C15 C16 42.2 . . . . ?
C14 C13 C18 C17 36.5 . . . . ?
C14 C15 C16 C17 -54.1 . . . . ?
C15 C16 C17 C18 66.2 . . . . ?
C16 C17 C18 C13 -50.6 . . . . ?
C18 C13 C14 C15 -37.7 . . . . ?
C19 C20 C21 C22 -52.0 . . . . ?
C20 C19 C24 C23 -64.1 . . . . ?
C20 C21 C22 C23 55.5 . . . . ?
C21 C22 C23 C24 -55.3 . . . . ?
C22 C23 C24 C19 59.9 . . . . ?
C24 C19 C20 C21 52.9 . . . . ?
C25 C26 C27 C28 -60.9 . . . . ?
C26 C25 C30 C29 -44.5 . . . . ?
C26 C27 C28 C29 56.6 . . . . ?
C27 C28 C29 C30 -50.3 . . . . ?
C28 C29 C30 C25 41.1 . . . . ?
C30 C25 C26 C27 52.2 . . . . ?
C31 C32 C33 C34 55.2 . . . . ?
C32 C31 C36 C35 58.0 . . . . ?
C32 C33 C34 C35 -49.9 . . . . ?
C33 C34 C35 C36 50.2 . . . . ?
C34 C35 C36 C31 -53.6 . . . . ?
C36 C31 C32 C33 -58.7 . . . . ?
C37 C38 C39 C40 -58.5 . . . . ?
C38 C37 C42 C41 -63.8 . . . . ?
C38 C39 C40 C41 63.0 . . . . ?
C39 C40 C41 C42 -65.7 . . . . ?
C40 C41 C42 C37 57.2 . . . . ?
C42 C37 C38 C39 59.3 . . . . ?
C43 C44 C45 C46 -61.7 . . . . ?
C44 C43 C48 C47 -37.3 . . . . ?
C44 C45 C46 C47 59.7 . . . . ?
C45 C46 C47 C48 -49.8 . . . . ?
C46 C47 C48 C43 39.6 . . . . ?
C48 C43 C44 C45 48.4 . . . . ?
C49 C50 C51 C52 -61.7 . . . . ?
C50 C49 C54 C53 -55.4 . . . . ?
C50 C51 C52 C53 57.5 . . . . ?
C51 C52 C53 C54 -61.1 . . . . ?
C52 C53 C54 C49 60.2 . . . . ?
C54 C49 C50 C51 63.4 . . . . ?
C55 C56 C57 C58 54.2 . . . . ?
C56 C55 C60 C59 -66.5 . . . . ?
C56 C57 C58 C59 -68.3 . . . . ?
C57 C58 C59 C60 12.6 . . . . ?
C58 C59 C60 C55 52.5 . . . . ?
C60 C55 C56 C57 10.7 . . . . ?
C61 C62 C63 C64 70.3 . . . . ?
C62 C61 C66 C65 50.2 . . . . ?
C62 C63 C64 C65 -67.2 . . . . ?
C63 C64 C65 C66 49.0 . . . . ?
C64 C65 C66 C61 -46.9 . . . . ?
C66 C61 C62 C63 -60.7 . . . . ?
C67 C68 C69 C70 -58.2 . . . . ?
C68 C67 C72 C71 -52.1 . . . . ?
C68 C69 C70 C71 50.5 . . . . ?
C69 C70 C71 C72 -58.3 . . . . ?
C70 C71 C72 C67 60.2 . . . . ?
C72 C67 C68 C69 52.6 . . . . ?
C73 C74 C75 C76 63.5 . . . . ?
C74 C73 C78 C77 -43.8 . . . . ?
C74 C75 C76 C77 -69.2 . . . . ?
C75 C76 C77 C78 18.4 . . . . ?
C76 C77 C78 C73 38.3 . . . . ?
C78 C73 C74 C75 -8.8 . . . . ?
C79 C80 C81 C82 -63.9 . . . . ?
C80 C79 C84 C83 54.3 . . . . ?
C80 C81 C82 C83 60.8 . . . . ?
C81 C82 C83 C84 -1.5 . . . . ?
C82 C83 C84 C79 -57.9 . . . . ?
C84 C79 C80 C81 6.4 . . . . ?
C85 C86 C87 C88 -59.2 . . . . ?
C86 C85 C90 C89 -47.3 . . . . ?
C86 C87 C88 C89 57.1 . . . . ?
C87 C88 C89 C90 -48.5 . . . . ?
C88 C89 C90 C85 45.0 . . . . ?
C90 C85 C86 C87 55.9 . . . . ?
C91 C92 C93 C94 -61.9 . . . . ?
C92 C91 C96 C95 -51.5 . . . . ?
C92 C93 C94 C95 66.2 . . . . ?
C93 C94 C95 C96 -64.1 . . . . ?
C94 C95 C96 C91 61.4 . . . . ?
C96 C91 C92 C93 57.9 . . . . ?
C97 C98 C99 C100 47.9 . . . . ?
C98 C97 C102 C101 59.5 . . . . ?
C98 C99 C100 C101 -46.9 . . . . ?
C99 C100 C101 C102 52.0 . . . . ?
C100 C101 C102 C97 -56.5 . . . . ?
C102 C97 C98 C99 -53.7 . . . . ?
C103 C104 C105 C106 55.8 . . . . ?
C104 C103 C108 C107 60.0 . . . . ?
C104 C105 C106 C107 -52.9 . . . . ?
C105 C106 C107 C108 55.5 . . . . ?
C106 C107 C108 C103 -59.8 . . . . ?
C108 C103 C104 C105 -64.3 . . . . ?
C109 C110 C111 C112 54.6 . . . . ?
C110 C109 C114 C113 56.3 . . . . ?
C110 C111 C112 C113 -53.3 . . . . ?
C111 C112 C113 C114 53.7 . . . . ?
C112 C113 C114 C109 -55.5 . . . . ?
C114 C109 C110 C111 -56.4 . . . . ?
C115 C116 C117 C118 -58.4 . . . . ?
C116 C115 C120 C119 -60.3 . . . . ?
C116 C117 C118 C119 62.7 . . . . ?
C117 C118 C119 C120 -67.1 . . . . ?
C118 C119 C120 C115 62.3 . . . . ?
C120 C115 C116 C117 62.3 . . . . ?
C121 C122 C123 C124 -55.4 . . . . ?
C122 C121 C126 C125 -52.7 . . . . ?
C122 C123 C124 C125 55.3 . . . . ?
C123 C124 C125 C126 -47.6 . . . . ?
C124 C125 C126 C121 46.4 . . . . ?
C126 C121 C122 C123 57.2 . . . . ?
C127 C128 C129 C130 -65.2 . . . . ?
C128 C127 C132 C131 -52.3 . . . . ?
C128 C129 C130 C131 64.2 . . . . ?
C129 C130 C131 C132 -58.1 . . . . ?
C130 C131 C132 C127 50.4 . . . . ?
C132 C127 C128 C129 60.6 . . . . ?
C133 C134 C135 C136 62.8 . . . . ?
C134 C133 C138 C137 58.0 . . . . ?
C134 C135 C136 C137 -62.3 . . . . ?
C135 C136 C137 C138 66.9 . . . . ?
C136 C137 C138 C133 -65.8 . . . . ?
C138 C133 C134 C135 -63.6 . . . . ?
C139 C140 C141 C142 72.0 . . . . ?
C140 C139 C144 C143 61.2 . . . . ?
C140 C141 C142 C143 -66.8 . . . . ?
C141 C142 C143 C144 62.4 . . . . ?
C142 C143 C144 C139 -58.1 . . . . ?
C144 C139 C140 C141 -71.0 . . . . ?
C145 C146 C147 C148 -59.7 . . . . ?
C146 C145 C150 C149 -66.7 . . . . ?
C146 C147 C148 C149 60.7 . . . . ?
C147 C148 C149 C150 -63.3 . . . . ?
C148 C149 C150 C145 63.3 . . . . ?
C150 C145 C146 C147 65.0 . . . . ?
C151 C152 C153 C154 60.0 . . . . ?
C152 C151 C156 C155 50.0 . . . . ?
C152 C153 C154 C155 -69.6 . . . . ?
C153 C154 C155 C156 72.4 . . . . ?
C154 C155 C156 C151 -60.3 . . . . ?
C156 C151 C152 C153 -51.7 . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 -0.669 0.000 785.7 0.0 ?
2 0.388 -0.180 0.500 982.7 625.4 ?
3 0.354 0.545 0.009 12.6 5.9 ?
4 0.646 0.455 -0.009 12.6 6.1 ?

_olex2_submission_special_instructions 'No special instructions were received'
