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

####################################################################### 
# 
# 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. 
# 
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data_wen366
_database_code_depnum_ccdc_archive 'CCDC 1502873'
_audit_update_record             
;
2017-12-07 deposited with the CCDC.
2017-12-12 downloaded from the CCDC.
;
_audit_creation_date             2017-12-07
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'C160 H172 Au12 O12 P10 S4 Si8, 2(C24 H20 B), 4(C H2 Cl2)'
_chemical_formula_sum            'C212 H220 Au12 B2 Cl8 O12 P10 S4 Si8'
_chemical_formula_weight         6291.35
_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 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -2.0133 8.8022 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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                   14.0681(3)
_cell_length_b                   19.0681(4)
_cell_length_c                   25.8449(6)
_cell_angle_alpha                69.532(2)
_cell_angle_beta                 76.667(2)
_cell_angle_gamma                75.97(2)
_cell_volume                     6219.9(6)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    117321
_cell_measurement_temperature    150.15
_cell_measurement_theta_max      27.44
_cell_measurement_theta_min      1.21
_shelx_estimated_absorpt_T_max   0.450
_shelx_estimated_absorpt_T_min   0.284
_exptl_absorpt_coefficient_mu    7.317
_exptl_absorpt_correction_T_max  0.4539
_exptl_absorpt_correction_T_min  0.1978
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   
'face indexing via STOE Faceit, numerical absorption correction with STOE Xred reducing R(int) from 5.61 to 3.73'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'light yellow'
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.680
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             3008
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
2 0 4 0.1096
0 0 1 0.0550
-1 -4 3 0.1054
-2 0 -4 0.1156
-1 3 4 0.1289
0 -2 -4 0.0950
0 0 -1 0.0693
1 4 -3 0.0880

_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.13
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0373
_diffrn_reflns_av_unetI/netI     0.0441
_diffrn_reflns_Laue_measured_fraction_full 0.940
_diffrn_reflns_Laue_measured_fraction_max 0.936
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            45213
_diffrn_reflns_point_group_measured_fraction_full 0.940
_diffrn_reflns_point_group_measured_fraction_max 0.936
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.000
_diffrn_reflns_theta_min         1.638
_diffrn_ambient_temperature      150.15
_diffrn_detector                 'image plate (34 cm diameter)'
_diffrn_detector_area_resol_mean 6.67
_diffrn_detector_type            STOE
_diffrn_measured_fraction_theta_full 0.940
_diffrn_measured_fraction_theta_max 0.936
_diffrn_measurement_device       '2-circle goniometer'
_diffrn_measurement_device_type  'Stoe IPDS2'
_diffrn_measurement_method       'rotation method'
_diffrn_radiation_collimation    '0.5 mm diameter, monocapillary'
_diffrn_radiation_monochromator  'plane graphite'
_diffrn_radiation_polarisn_norm  0
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Bruker rotating anode'
_diffrn_source_current           150
_diffrn_source_power             7.500
_diffrn_source_target            Mo
_diffrn_source_type              'Rotating Anode'
_diffrn_source_voltage           50
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                17724
_reflns_number_total             22923
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _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         4.336
_refine_diff_density_min         -2.107
_refine_diff_density_rms         0.240
_refine_ls_extinction_coef       0.00081(7)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   0.958
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1219
_refine_ls_number_reflns         22923
_refine_ls_number_restraints     36
_refine_ls_R_factor_all          0.0682
_refine_ls_R_factor_gt           0.0574
_refine_ls_restrained_S_all      0.958
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1207P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1503
_refine_ls_wR_factor_ref         0.1575
_refine_special_details          'Olex2 Solvent Masking'
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All C(H,H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(C66) \\sim Ueq, Uanis(C67) \\sim Ueq, Uanis(C68) \\sim Ueq: with sigma of
0.06 and sigma for terminal atoms of 0.12
Uanis(C64) \\sim Ueq, Uanis(C63) \\sim Ueq, Uanis(C65) \\sim Ueq: with sigma of
0.02 and sigma for terminal atoms of 0.05
3.a Secondary CH2 refined with riding coordinates:
 C106(H10A,H10B), C107(H10C,H10D)
3.b Me refined with riding coordinates:
 C65(H65A,H65B,H65C)
3.c Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C6(H6), C8(H8), C9(H9), C10(H10), C11(H11),
 C12(H12), C18(H18), C19(H19), C20(H20), C21(H21), C22(H22), C24(H24), C25(H25),
  C26(H26), C27(H27), C28(H28), C30(H30), C31(H31), C32(H32), C33(H33),
 C34(H34), C36(H36), C37(H37), C38(H38), C39(H39), C40(H40), C46(H46), C47(H47),
  C48(H48), C49(H49), C50(H50), C52(H52), C53(H53), C54(H54), C55(H55),
 C56(H56), C71(H71), C72(H72), C73(H73), C74(H74), C75(H75), C77(H77), C78(H78),
  C79(H79), C80(H80), C81(H81), C83(H83), C84(H84), C85(H85), C86(H86),
 C87(H87), C89(H89), C90(H90), C91(H91), C92(H92), C93(H93), C95(H95), C96(H96),
  C97(H97), C98(H98), C99(H99), C101(H101), C102(H102), C103(H103), C104(H104),
 C105(H105)
3.d Idealised Me refined as rotating group:
 C57(H57A,H57B,H57C), C58(H58A,H58B,H58C), C59(H59A,H59B,H59C), C60(H60A,H60B,
 H60C), C61(H61A,H61B,H61C), C62(H62A,H62B,H62C), C63(H63A,H63B,H63C), C64(H64A,
 H64B,H64C), C66(H66A,H66B,H66C), C67(H67A,H67B,H67C), C68(H68A,H68B,H68C)
;
_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 0.41182(3) 0.28568(2) 0.07811(2) 0.04581(10) Uani 1 1 d . . . . .
Au2 Au 0.18987(3) 0.31472(2) 0.11063(2) 0.04694(10) Uani 1 1 d . . . . .
Au3 Au 0.26772(3) 0.34626(2) -0.03990(2) 0.04924(11) Uani 1 1 d . . . . .
Au4 Au 0.39014(2) 0.45899(2) -0.04994(2) 0.04518(10) Uani 1 1 d . . . . .
Au5 Au 0.39836(3) 0.60222(2) -0.01411(2) 0.04950(11) Uani 1 1 d . . . . .
Au6 Au 0.18647(3) 0.49511(2) 0.02091(2) 0.04802(11) Uani 1 1 d . . . . .
S1 S 0.14113(17) 0.38318(12) 0.02462(10) 0.0462(5) Uani 1 1 d . . . . .
S2 S 0.42981(17) 0.41141(11) 0.04054(10) 0.0454(5) Uani 1 1 d . . . . .
P1 P 0.41004(18) 0.16211(12) 0.12937(11) 0.0471(5) Uani 1 1 d . . . . .
P2 P 0.19472(18) 0.26597(13) 0.20378(10) 0.0476(5) Uani 1 1 d . . . . .
P3 P 0.3676(2) 0.29843(13) -0.10621(11) 0.0518(6) Uani 1 1 d . . . . .
P4 P 0.36843(17) 0.50144(12) -0.14082(10) 0.0437(5) Uani 1 1 d . . . . .
P5 P 0.23098(18) 0.60732(13) 0.01124(12) 0.0509(6) Uani 1 1 d . . . . .
Si1 Si 0.2657(2) 0.15444(16) 0.39576(12) 0.0577(7) Uani 1 1 d . . . . .
Si2 Si 0.5777(2) -0.00307(15) 0.29507(13) 0.0568(6) Uani 1 1 d . . . . .
Si3 Si 0.6305(3) 0.21678(19) -0.24145(18) 0.0763(10) Uani 1 1 d . . . . .
Si4 Si 0.5818(3) 0.55106(19) -0.31881(15) 0.0756(9) Uani 1 1 d . . . . .
O1 O 0.5102(6) 0.0505(4) 0.2439(3) 0.0631(18) Uani 1 1 d . . . . .
O2 O 0.3941(5) 0.1191(4) 0.2937(3) 0.0546(15) Uani 1 1 d . . . . .
O3 O 0.2625(5) 0.1994(4) 0.3264(3) 0.0576(16) Uani 1 1 d . . . . .
O4 O 0.5446(7) 0.2632(4) -0.2031(4) 0.091(3) Uani 1 1 d . . . . .
O5 O 0.5668(5) 0.3873(4) -0.2336(3) 0.0600(18) Uani 1 1 d . . . . .
O6 O 0.5627(5) 0.5118(4) -0.2486(3) 0.0591(18) Uani 1 1 d . . . . .
C1 C 0.5311(7) 0.1030(5) 0.1212(4) 0.049(2) Uani 1 1 d . . . . .
C2 C 0.5446(8) 0.0285(6) 0.1254(5) 0.061(3) Uani 1 1 d . . . . .
H2 H 0.4886 0.0051 0.1321 0.074 Uiso 1 1 calc R . . . .
C3 C 0.6398(9) -0.0140(7) 0.1198(6) 0.073(3) Uani 1 1 d . . . . .
H3 H 0.6487 -0.0656 0.1212 0.087 Uiso 1 1 calc R . . . .
C4 C 0.7222(8) 0.0191(7) 0.1122(5) 0.066(3) Uani 1 1 d . . . . .
H4 H 0.7871 -0.0103 0.1091 0.079 Uiso 1 1 calc R . . . .
C5 C 0.7101(8) 0.0926(7) 0.1092(5) 0.068(3) Uani 1 1 d . . . . .
H5 H 0.7664 0.1151 0.1039 0.082 Uiso 1 1 calc R . . . .
C6 C 0.6146(8) 0.1358(7) 0.1139(5) 0.060(2) Uani 1 1 d . . . . .
H6 H 0.6061 0.1875 0.1122 0.072 Uiso 1 1 calc R . . . .
C7 C 0.3237(7) 0.1170(5) 0.1164(4) 0.051(2) Uani 1 1 d . . . . .
C8 C 0.3209(9) 0.1226(6) 0.0618(4) 0.059(2) Uani 1 1 d . . . . .
H8 H 0.3648 0.1498 0.0318 0.071 Uiso 1 1 calc R . . . .
C9 C 0.2534(9) 0.0883(6) 0.0508(5) 0.068(3) Uani 1 1 d . . . . .
H9 H 0.2501 0.0937 0.0133 0.082 Uiso 1 1 calc R . . . .
C10 C 0.1932(9) 0.0477(7) 0.0932(6) 0.071(3) Uani 1 1 d . . . . .
H10 H 0.1505 0.0219 0.0858 0.086 Uiso 1 1 calc R . . . .
C11 C 0.1940(9) 0.0437(7) 0.1480(5) 0.074(3) Uani 1 1 d . . . . .
H11 H 0.1477 0.0187 0.1777 0.089 Uiso 1 1 calc R . . . .
C12 C 0.2600(9) 0.0751(6) 0.1592(5) 0.064(3) Uani 1 1 d . . . . .
H12 H 0.2631 0.0685 0.1970 0.077 Uiso 1 1 calc R . . . .
C13 C 0.3812(7) 0.1525(5) 0.2027(4) 0.048(2) Uani 1 1 d . . . . .
C14 C 0.4333(7) 0.1059(5) 0.2428(4) 0.050(2) Uani 1 1 d . . . . .
C15 C 0.3132(7) 0.1768(5) 0.2827(4) 0.051(2) Uani 1 1 d . . . . .
C16 C 0.3008(7) 0.2009(5) 0.2293(4) 0.051(2) Uani 1 1 d . . . . .
C17 C 0.1807(7) 0.3460(5) 0.2288(4) 0.053(2) Uani 1 1 d . . . . .
C18 C 0.1243(9) 0.3516(6) 0.2788(5) 0.064(3) Uani 1 1 d . . . . .
H18 H 0.0947 0.3095 0.3033 0.077 Uiso 1 1 calc R . . . .
C19 C 0.1095(10) 0.4142(7) 0.2943(6) 0.074(3) Uani 1 1 d . . . . .
H19 H 0.0691 0.4156 0.3290 0.089 Uiso 1 1 calc R . . . .
C20 C 0.1525(12) 0.4774(7) 0.2601(6) 0.087(4) Uani 1 1 d . . . . .
H20 H 0.1410 0.5222 0.2706 0.104 Uiso 1 1 calc R . . . .
C21 C 0.2123(10) 0.4720(6) 0.2109(6) 0.071(3) Uani 1 1 d . . . . .
H21 H 0.2464 0.5125 0.1883 0.085 Uiso 1 1 calc R . . . .
C22 C 0.2241(9) 0.4089(5) 0.1933(5) 0.062(3) Uani 1 1 d . . . . .
H22 H 0.2612 0.4082 0.1577 0.074 Uiso 1 1 calc R . . . .
C23 C 0.0884(7) 0.2194(6) 0.2409(4) 0.055(2) Uani 1 1 d . . . . .
C24 C 0.0992(8) 0.1442(6) 0.2756(4) 0.058(2) Uani 1 1 d . . . . .
H24 H 0.1634 0.1155 0.2813 0.070 Uiso 1 1 calc R . . . .
C25 C 0.0155(9) 0.1115(6) 0.3016(6) 0.071(3) Uani 1 1 d . . . . .
H25 H 0.0227 0.0603 0.3254 0.085 Uiso 1 1 calc R . . . .
C26 C -0.0777(9) 0.1526(7) 0.2934(6) 0.078(4) Uani 1 1 d . . . . .
H26 H -0.1348 0.1301 0.3119 0.093 Uiso 1 1 calc R . . . .
C27 C -0.0878(9) 0.2250(8) 0.2591(6) 0.085(4) Uani 1 1 d . . . . .
H27 H -0.1520 0.2532 0.2530 0.102 Uiso 1 1 calc R . . . .
C28 C -0.0052(8) 0.2583(6) 0.2329(5) 0.066(3) Uani 1 1 d . . . . .
H28 H -0.0136 0.3093 0.2088 0.079 Uiso 1 1 calc R . . . .
C29 C 0.4597(8) 0.2191(5) -0.0759(5) 0.057(2) Uani 1 1 d . . . . .
C30 C 0.5247(9) 0.2306(6) -0.0482(5) 0.062(3) Uani 1 1 d . . . . .
H30 H 0.5199 0.2798 -0.0455 0.075 Uiso 1 1 calc R . . . .
C31 C 0.5937(9) 0.1744(7) -0.0254(5) 0.070(3) Uani 1 1 d . . . . .
H31 H 0.6379 0.1844 -0.0071 0.083 Uiso 1 1 calc R . . . .
C32 C 0.6029(10) 0.1015(6) -0.0274(5) 0.071(3) Uani 1 1 d . . . . .
H32 H 0.6531 0.0620 -0.0110 0.085 Uiso 1 1 calc R . . . .
C33 C 0.5395(11) 0.0875(7) -0.0532(6) 0.078(3) Uani 1 1 d . . . . .
H33 H 0.5446 0.0373 -0.0540 0.093 Uiso 1 1 calc R . . . .
C34 C 0.4673(10) 0.1443(5) -0.0783(5) 0.071(3) Uani 1 1 d . . . . .
H34 H 0.4238 0.1339 -0.0967 0.085 Uiso 1 1 calc R . . . .
C35 C 0.2957(8) 0.2629(6) -0.1392(5) 0.058(2) Uani 1 1 d . . . . .
C36 C 0.3117(9) 0.2727(7) -0.1947(5) 0.069(3) Uani 1 1 d . . . . .
H36 H 0.3621 0.2998 -0.2186 0.082 Uiso 1 1 calc R . . . .
C37 C 0.2552(10) 0.2437(8) -0.2171(6) 0.079(3) Uani 1 1 d . . . . .
H37 H 0.2666 0.2520 -0.2563 0.095 Uiso 1 1 calc R . . . .
C38 C 0.1814(10) 0.2023(7) -0.1827(6) 0.075(3) Uani 1 1 d . . . . .
H38 H 0.1433 0.1816 -0.1978 0.090 Uiso 1 1 calc R . . . .
C39 C 0.1665(9) 0.1929(7) -0.1264(6) 0.075(3) Uani 1 1 d . . . . .
H39 H 0.1173 0.1649 -0.1022 0.090 Uiso 1 1 calc R . . . .
C40 C 0.2203(8) 0.2228(6) -0.1043(5) 0.062(3) Uani 1 1 d . . . . .
H40 H 0.2070 0.2167 -0.0654 0.075 Uiso 1 1 calc R . . . .
C41 C 0.4418(7) 0.3574(5) -0.1615(4) 0.052(2) Uani 1 1 d . . . . .
C42 C 0.5195(8) 0.3284(5) -0.1972(5) 0.064(3) Uani 1 1 d . . . . .
C43 C 0.5225(8) 0.4523(5) -0.2206(5) 0.058(2) Uani 1 1 d . . . . .
C44 C 0.4452(7) 0.4397(5) -0.1770(4) 0.046(2) Uani 1 1 d . . . . .
C45 C 0.3997(7) 0.5949(5) -0.1793(4) 0.047(2) Uani 1 1 d . . . . .
C46 C 0.4800(8) 0.6122(5) -0.1657(4) 0.051(2) Uani 1 1 d . . . . .
H46 H 0.5179 0.5750 -0.1392 0.062 Uiso 1 1 calc R . . . .
C47 C 0.5041(8) 0.6851(5) -0.1917(5) 0.058(3) Uani 1 1 d . . . . .
H47 H 0.5580 0.6983 -0.1828 0.070 Uiso 1 1 calc R . . . .
C48 C 0.4474(9) 0.7374(5) -0.2305(5) 0.063(3) Uani 1 1 d . . . . .
H48 H 0.4641 0.7866 -0.2485 0.076 Uiso 1 1 calc R . . . .
C49 C 0.3698(9) 0.7214(6) -0.2437(6) 0.070(3) Uani 1 1 d . . . . .
H49 H 0.3317 0.7586 -0.2701 0.084 Uiso 1 1 calc R . . . .
C50 C 0.3465(8) 0.6480(6) -0.2174(5) 0.065(3) Uani 1 1 d . . . . .
H50 H 0.2924 0.6355 -0.2266 0.077 Uiso 1 1 calc R . . . .
C51 C 0.2436(6) 0.5091(5) -0.1537(4) 0.0453(19) Uani 1 1 d . . . . .
C52 C 0.1648(8) 0.5435(5) -0.1224(5) 0.058(2) Uani 1 1 d . . . . .
H52 H 0.1755 0.5640 -0.0960 0.069 Uiso 1 1 calc R . . . .
C53 C 0.0682(8) 0.5472(6) -0.1311(5) 0.067(3) Uani 1 1 d . . . . .
H53 H 0.0125 0.5684 -0.1091 0.081 Uiso 1 1 calc R . . . .
C54 C 0.0539(8) 0.5209(7) -0.1705(6) 0.073(3) Uani 1 1 d . . . . .
H54 H -0.0119 0.5245 -0.1758 0.087 Uiso 1 1 calc R . . . .
C55 C 0.1318(10) 0.4893(7) -0.2030(7) 0.083(4) Uani 1 1 d . . . . .
H55 H 0.1206 0.4725 -0.2313 0.100 Uiso 1 1 calc R . . . .
C56 C 0.2275(8) 0.4822(6) -0.1937(5) 0.060(3) Uani 1 1 d . . . . .
H56 H 0.2823 0.4588 -0.2149 0.072 Uiso 1 1 calc R . . . .
C57 C 0.2308(10) 0.0603(7) 0.4120(5) 0.074(3) Uani 1 1 d . . . . .
H57A H 0.2773 0.0321 0.3885 0.089 Uiso 1 1 calc GR . . . .
H57B H 0.1633 0.0676 0.4044 0.089 Uiso 1 1 calc GR . . . .
H57C H 0.2334 0.0317 0.4515 0.089 Uiso 1 1 calc GR . . . .
C58 C 0.1716(10) 0.2173(7) 0.4293(5) 0.075(3) Uani 1 1 d . . . . .
H58A H 0.1071 0.2220 0.4189 0.090 Uiso 1 1 calc GR . . . .
H58B H 0.1902 0.2676 0.4168 0.090 Uiso 1 1 calc GR . . . .
H58C H 0.1672 0.1958 0.4700 0.090 Uiso 1 1 calc GR . . . .
C59 C 0.3926(9) 0.1503(7) 0.4071(5) 0.064(3) Uani 1 1 d . . . . .
H59A H 0.4252 0.1873 0.3752 0.077 Uiso 1 1 calc GR . . . .
H59B H 0.4311 0.0991 0.4105 0.077 Uiso 1 1 calc GR . . . .
H59C H 0.3887 0.1624 0.4414 0.077 Uiso 1 1 calc GR . . . .
C60 C 0.6666(9) -0.0729(6) 0.2655(6) 0.069(3) Uani 1 1 d . . . . .
H60A H 0.7139 -0.0468 0.2348 0.083 Uiso 1 1 calc GR . . . .
H60B H 0.6308 -0.0986 0.2513 0.083 Uiso 1 1 calc GR . . . .
H60C H 0.7026 -0.1106 0.2947 0.083 Uiso 1 1 calc GR . . . .
C61 C 0.6412(9) 0.0614(6) 0.3108(5) 0.069(3) Uani 1 1 d . . . . .
H61A H 0.5914 0.0968 0.3272 0.082 Uiso 1 1 calc GR . . . .
H61B H 0.6787 0.0901 0.2762 0.082 Uiso 1 1 calc GR . . . .
H61C H 0.6867 0.0309 0.3373 0.082 Uiso 1 1 calc GR . . . .
C62 C 0.4919(9) -0.0514(7) 0.3578(6) 0.075(3) Uani 1 1 d . . . . .
H62A H 0.4419 -0.0673 0.3455 0.090 Uiso 1 1 calc GR . . . .
H62B H 0.4588 -0.0160 0.3790 0.090 Uiso 1 1 calc GR . . . .
H62C H 0.5301 -0.0961 0.3817 0.090 Uiso 1 1 calc GR . . . .
C63 C 0.5744(18) 0.1405(11) -0.2403(10) 0.161(10) Uani 1 1 d . U . . .
H63A H 0.5189 0.1330 -0.2092 0.193 Uiso 1 1 calc GR . . . .
H63B H 0.6239 0.0935 -0.2353 0.193 Uiso 1 1 calc GR . . . .
H63C H 0.5501 0.1534 -0.2756 0.193 Uiso 1 1 calc GR . . . .
C64 C 0.679(2) 0.2722(13) -0.3030(12) 0.233(16) Uani 1 1 d . U . . .
H64A H 0.6690 0.3242 -0.3016 0.280 Uiso 1 1 calc GR . . . .
H64B H 0.6453 0.2722 -0.3324 0.280 Uiso 1 1 calc GR . . . .
H64C H 0.7497 0.2528 -0.3112 0.280 Uiso 1 1 calc GR . . . .
C65 C 0.716(3) 0.164(2) -0.1927(17) 0.259(18) Uani 1 1 d . U . . .
H65A H 0.7713 0.1336 -0.2104 0.311 Uiso 1 1 calc R . . . .
H65B H 0.7409 0.1998 -0.1818 0.311 Uiso 1 1 calc R . . . .
H65C H 0.6812 0.1306 -0.1593 0.311 Uiso 1 1 calc R . . . .
C66 C 0.465(2) 0.5582(15) -0.3399(10) 0.184(13) Uani 1 1 d . U . . .
H66A H 0.4103 0.5706 -0.3116 0.221 Uiso 1 1 calc GR . . . .
H66B H 0.4618 0.5096 -0.3438 0.221 Uiso 1 1 calc GR . . . .
H66C H 0.4602 0.5983 -0.3759 0.221 Uiso 1 1 calc GR . . . .
C67 C 0.6185(12) 0.6417(7) -0.3307(6) 0.087(4) Uani 1 1 d . U . . .
H67A H 0.6665 0.6342 -0.3064 0.104 Uiso 1 1 calc GR . . . .
H67B H 0.5599 0.6783 -0.3223 0.104 Uiso 1 1 calc GR . . . .
H67C H 0.6488 0.6612 -0.3699 0.104 Uiso 1 1 calc GR . . . .
C68 C 0.6812(17) 0.4907(9) -0.3494(8) 0.136(9) Uani 1 1 d . U . . .
H68A H 0.6552 0.4711 -0.3727 0.164 Uiso 1 1 calc GR . . . .
H68B H 0.7096 0.4481 -0.3197 0.164 Uiso 1 1 calc GR . . . .
H68C H 0.7327 0.5201 -0.3726 0.164 Uiso 1 1 calc GR . . . .
C70 C 0.1665(8) 0.6831(5) -0.0419(4) 0.055(2) Uani 1 1 d . . . . .
C71 C 0.0641(8) 0.7020(6) -0.0357(6) 0.068(3) Uani 1 1 d . . . . .
H71 H 0.0266 0.6740 -0.0027 0.082 Uiso 1 1 calc R . . . .
C72 C 0.0151(10) 0.7572(8) -0.0732(6) 0.086(4) Uani 1 1 d . . . . .
H72 H -0.0550 0.7713 -0.0652 0.103 Uiso 1 1 calc R . . . .
C73 C 0.0692(10) 0.7954(7) -0.1261(6) 0.075(3) Uani 1 1 d . . . . .
H73 H 0.0355 0.8329 -0.1544 0.090 Uiso 1 1 calc R . . . .
C74 C 0.1725(10) 0.7756(7) -0.1345(6) 0.078(3) Uani 1 1 d . . . . .
H74 H 0.2104 0.7994 -0.1691 0.094 Uiso 1 1 calc R . . . .
C75 C 0.2198(8) 0.7209(6) -0.0920(5) 0.067(3) Uani 1 1 d . . . . .
H75 H 0.2902 0.7091 -0.0974 0.080 Uiso 1 1 calc R . . . .
C76 C 0.1840(9) 0.6369(5) 0.0730(5) 0.063(3) Uani 1 1 d . . . . .
C77 C 0.0905(9) 0.6277(6) 0.1040(5) 0.067(3) Uani 1 1 d . . . . .
H77 H 0.0497 0.6040 0.0931 0.080 Uiso 1 1 calc R . . . .
C78 C 0.0555(10) 0.6527(7) 0.1507(6) 0.079(4) Uani 1 1 d . . . . .
H78 H -0.0105 0.6496 0.1696 0.095 Uiso 1 1 calc R . . . .
C79 C 0.1167(13) 0.6819(8) 0.1695(6) 0.092(4) Uani 1 1 d . . . . .
H79 H 0.0939 0.6971 0.2022 0.110 Uiso 1 1 calc R . . . .
C80 C 0.2116(12) 0.6890(8) 0.1405(6) 0.088(4) Uani 1 1 d . . . . .
H80 H 0.2540 0.7096 0.1528 0.105 Uiso 1 1 calc R . . . .
C81 C 0.2434(10) 0.6661(7) 0.0942(6) 0.080(4) Uani 1 1 d . . . . .
H81 H 0.3093 0.6701 0.0753 0.096 Uiso 1 1 calc R . . . .
B1 B 0.0343(9) 0.1604(6) 0.6552(5) 0.059(3) Uani 1 1 d . . . . .
C82 C 0.0403(7) 0.1090(6) 0.7203(4) 0.056(2) Uani 1 1 d . . . . .
C83 C -0.0097(10) 0.1354(9) 0.7648(5) 0.081(4) Uani 1 1 d . . . . .
H83 H -0.0477 0.1853 0.7568 0.097 Uiso 1 1 calc R . . . .
C84 C -0.0068(12) 0.0921(11) 0.8206(6) 0.095(5) Uani 1 1 d . . . . .
H84 H -0.0405 0.1126 0.8499 0.114 Uiso 1 1 calc R . . . .
C85 C 0.0459(13) 0.0194(12) 0.8322(7) 0.108(6) Uani 1 1 d . . . . .
H85 H 0.0473 -0.0113 0.8701 0.129 Uiso 1 1 calc R . . . .
C86 C 0.0942(11) -0.0082(8) 0.7921(7) 0.095(5) Uani 1 1 d . . . . .
H86 H 0.1303 -0.0588 0.8011 0.114 Uiso 1 1 calc R . . . .
C87 C 0.0935(9) 0.0357(7) 0.7360(6) 0.079(4) Uani 1 1 d . . . . .
H87 H 0.1309 0.0145 0.7077 0.095 Uiso 1 1 calc R . . . .
C88 C 0.1312(9) 0.1320(6) 0.6143(5) 0.062(3) Uani 1 1 d . . . . .
C89 C 0.2164(8) 0.1634(6) 0.5930(5) 0.063(3) Uani 1 1 d . . . . .
H89 H 0.2182 0.2086 0.6003 0.076 Uiso 1 1 calc R . . . .
C90 C 0.2999(9) 0.1327(7) 0.5615(5) 0.070(3) Uani 1 1 d . . . . .
H90 H 0.3566 0.1566 0.5476 0.084 Uiso 1 1 calc R . . . .
C91 C 0.2989(10) 0.0668(8) 0.5507(5) 0.081(4) Uani 1 1 d . . . . .
H91 H 0.3563 0.0446 0.5303 0.098 Uiso 1 1 calc R . . . .
C92 C 0.2168(10) 0.0330(7) 0.5687(6) 0.075(3) Uani 1 1 d . . . . .
H92 H 0.2158 -0.0118 0.5607 0.090 Uiso 1 1 calc R . . . .
C93 C 0.1353(10) 0.0660(7) 0.5991(6) 0.075(3) Uani 1 1 d . . . . .
H93 H 0.0777 0.0432 0.6107 0.090 Uiso 1 1 calc R . . . .
C94 C 0.0267(9) 0.2499(6) 0.6505(5) 0.064(3) Uani 1 1 d . . . . .
C95 C -0.0462(10) 0.3095(7) 0.6286(6) 0.076(3) Uani 1 1 d . . . . .
H95 H -0.0946 0.2995 0.6131 0.092 Uiso 1 1 calc R . . . .
C96 C -0.0513(12) 0.3843(7) 0.6282(7) 0.094(5) Uani 1 1 d . . . . .
H96 H -0.1048 0.4229 0.6147 0.113 Uiso 1 1 calc R . . . .
C97 C 0.0198(13) 0.4016(7) 0.6473(7) 0.093(4) Uani 1 1 d . . . . .
H97 H 0.0181 0.4525 0.6454 0.111 Uiso 1 1 calc R . . . .
C98 C 0.0932(12) 0.3451(7) 0.6690(6) 0.087(4) Uani 1 1 d . . . . .
H98 H 0.1427 0.3563 0.6829 0.104 Uiso 1 1 calc R . . . .
C99 C 0.0962(11) 0.2709(8) 0.6708(5) 0.077(3) Uani 1 1 d . . . . .
H99 H 0.1480 0.2325 0.6865 0.093 Uiso 1 1 calc R . . . .
C100 C -0.0630(8) 0.1487(6) 0.6370(5) 0.059(2) Uani 1 1 d . . . . .
C101 C -0.1297(8) 0.1010(6) 0.6714(6) 0.067(3) Uani 1 1 d . . . . .
H101 H -0.1198 0.0749 0.7090 0.080 Uiso 1 1 calc R . . . .
C102 C -0.2086(9) 0.0897(7) 0.6542(6) 0.072(3) Uani 1 1 d . . . . .
H102 H -0.2501 0.0553 0.6791 0.087 Uiso 1 1 calc R . . . .
C103 C -0.2276(10) 0.1293(8) 0.5995(6) 0.080(3) Uani 1 1 d . . . . .
H103 H -0.2826 0.1229 0.5871 0.096 Uiso 1 1 calc R . . . .
C104 C -0.1661(10) 0.1764(8) 0.5647(7) 0.083(4) Uani 1 1 d . . . . .
H104 H -0.1783 0.2035 0.5276 0.100 Uiso 1 1 calc R . . . .
C105 C -0.0860(9) 0.1861(7) 0.5820(5) 0.070(3) Uani 1 1 d . . . . .
H105 H -0.0441 0.2194 0.5560 0.085 Uiso 1 1 calc R . . . .
Cl1 Cl 0.8470(4) 0.1087(4) -0.0390(3) 0.1368(19) Uani 1 1 d . . . . .
Cl2 Cl 1.0171(6) 0.1012(4) 0.0043(3) 0.157(2) Uani 1 1 d . . . . .
C106 C 0.9139(13) 0.1595(9) -0.0232(8) 0.108(5) Uani 1 1 d . . . . .
H10A H 0.8718 0.1842 0.0042 0.130 Uiso 1 1 calc R . . . .
H10B H 0.9353 0.1999 -0.0575 0.130 Uiso 1 1 calc R . . . .
Cl3 Cl 0.0599(9) 0.4069(4) 0.4628(3) 0.236(6) Uani 1 1 d . . . . .
Cl4 Cl 0.2638(7) 0.3506(4) 0.4883(3) 0.184(3) Uani 1 1 d . . . . .
C107 C 0.133(2) 0.3554(13) 0.5143(9) 0.154(9) Uani 1 1 d . . . . .
H10C H 0.1179 0.3032 0.5307 0.184 Uiso 1 1 calc R . . . .
H10D H 0.1148 0.3792 0.5445 0.184 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 3.0065(5) . ?
Au1 S2 2.304(2) . ?
Au1 P1 2.267(2) . ?
Au2 S1 2.314(2) . ?
Au2 P2 2.268(3) . ?
Au3 Au4 2.9754(6) . ?
Au3 S1 2.300(2) . ?
Au3 P3 2.259(2) . ?
Au4 Au5 3.2097(5) . ?
Au4 Au6 3.0891(5) . ?
Au4 S2 2.340(2) . ?
Au4 P4 2.268(2) . ?
Au5 S2 2.331(2) 2_665 ?
Au5 P5 2.282(2) . ?
Au6 S1 2.337(2) . ?
Au6 P5 2.288(2) . ?
S2 Au5 2.331(2) 2_665 ?
P1 C1 1.813(10) . ?
P1 C7 1.796(9) . ?
P1 C13 1.796(10) . ?
P2 C16 1.784(11) . ?
P2 C17 1.808(10) . ?
P2 C23 1.825(9) . ?
P3 C29 1.808(11) . ?
P3 C35 1.827(11) . ?
P3 C41 1.776(10) . ?
P4 C44 1.766(9) . ?
P4 C45 1.816(9) . ?
P4 C51 1.824(9) . ?
P5 C70 1.830(11) . ?
P5 C76 1.806(12) . ?
Si1 O3 1.701(8) . ?
Si1 C57 1.855(11) . ?
Si1 C58 1.835(11) . ?
Si1 C59 1.854(12) . ?
Si2 O1 1.690(8) . ?
Si2 C60 1.840(12) . ?
Si2 C61 1.878(11) . ?
Si2 C62 1.878(12) . ?
Si3 O4 1.664(8) . ?
Si3 C63 1.804(16) . ?
Si3 C64 1.67(2) . ?
Si3 C65 1.81(3) . ?
Si4 O6 1.688(8) . ?
Si4 C66 1.81(2) . ?
Si4 C67 1.826(12) . ?
Si4 C68 1.803(16) . ?
O1 C14 1.315(12) . ?
O2 C14 1.388(12) . ?
O2 C15 1.382(12) . ?
O3 C15 1.336(11) . ?
O4 C42 1.260(12) . ?
O5 C42 1.387(11) . ?
O5 C43 1.363(11) . ?
O6 C43 1.295(11) . ?
C1 C2 1.356(13) . ?
C1 C6 1.407(13) . ?
C2 H2 0.9500 . ?
C2 C3 1.392(15) . ?
C3 H3 0.9500 . ?
C3 C4 1.393(16) . ?
C4 H4 0.9500 . ?
C4 C5 1.348(16) . ?
C5 H5 0.9500 . ?
C5 C6 1.398(16) . ?
C6 H6 0.9500 . ?
C7 C8 1.385(15) . ?
C7 C12 1.391(13) . ?
C8 H8 0.9500 . ?
C8 C9 1.403(16) . ?
C9 H9 0.9500 . ?
C9 C10 1.346(16) . ?
C10 H10 0.9500 . ?
C10 C11 1.396(18) . ?
C11 H11 0.9500 . ?
C11 C12 1.348(15) . ?
C12 H12 0.9500 . ?
C13 C14 1.338(14) . ?
C13 C16 1.478(13) . ?
C15 C16 1.334(14) . ?
C17 C18 1.377(14) . ?
C17 C22 1.407(13) . ?
C18 H18 0.9500 . ?
C18 C19 1.342(15) . ?
C19 H19 0.9500 . ?
C19 C20 1.401(18) . ?
C20 H20 0.9500 . ?
C20 C21 1.376(18) . ?
C21 H21 0.9500 . ?
C21 C22 1.389(14) . ?
C22 H22 0.9500 . ?
C23 C24 1.394(14) . ?
C23 C28 1.368(15) . ?
C24 H24 0.9500 . ?
C24 C25 1.387(14) . ?
C25 H25 0.9500 . ?
C25 C26 1.376(18) . ?
C26 H26 0.9500 . ?
C26 C27 1.348(19) . ?
C27 H27 0.9500 . ?
C27 C28 1.381(15) . ?
C28 H28 0.9500 . ?
C29 C30 1.382(16) . ?
C29 C34 1.424(13) . ?
C30 H30 0.9500 . ?
C30 C31 1.325(17) . ?
C31 H31 0.9500 . ?
C31 C32 1.383(16) . ?
C32 H32 0.9500 . ?
C32 C33 1.350(19) . ?
C33 H33 0.9500 . ?
C33 C34 1.380(18) . ?
C34 H34 0.9500 . ?
C35 C36 1.352(16) . ?
C35 C40 1.412(14) . ?
C36 H36 0.9500 . ?
C36 C37 1.386(17) . ?
C37 H37 0.9500 . ?
C37 C38 1.404(19) . ?
C38 H38 0.9500 . ?
C38 C39 1.375(19) . ?
C39 H39 0.9500 . ?
C39 C40 1.364(16) . ?
C40 H40 0.9500 . ?
C41 C42 1.396(13) . ?
C41 C44 1.488(12) . ?
C43 C44 1.371(13) . ?
C45 C46 1.399(13) . ?
C45 C50 1.352(15) . ?
C46 H46 0.9500 . ?
C46 C47 1.402(12) . ?
C47 H47 0.9500 . ?
C47 C48 1.387(16) . ?
C48 H48 0.9500 . ?
C48 C49 1.345(17) . ?
C49 H49 0.9500 . ?
C49 C50 1.409(14) . ?
C50 H50 0.9500 . ?
C51 C52 1.385(13) . ?
C51 C56 1.385(14) . ?
C52 H52 0.9500 . ?
C52 C53 1.411(16) . ?
C53 H53 0.9500 . ?
C53 C54 1.350(18) . ?
C54 H54 0.9500 . ?
C54 C55 1.372(19) . ?
C55 H55 0.9500 . ?
C55 C56 1.388(16) . ?
C56 H56 0.9500 . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
C60 H60A 0.9800 . ?
C60 H60B 0.9800 . ?
C60 H60C 0.9800 . ?
C61 H61A 0.9800 . ?
C61 H61B 0.9800 . ?
C61 H61C 0.9800 . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C63 H63A 0.9800 . ?
C63 H63B 0.9800 . ?
C63 H63C 0.9800 . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C66 H66A 0.9800 . ?
C66 H66B 0.9800 . ?
C66 H66C 0.9800 . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
C70 C71 1.383(15) . ?
C70 C75 1.385(14) . ?
C71 H71 0.9500 . ?
C71 C72 1.329(18) . ?
C72 H72 0.9500 . ?
C72 C73 1.438(19) . ?
C73 H73 0.9500 . ?
C73 C74 1.396(18) . ?
C74 H74 0.9500 . ?
C74 C75 1.393(17) . ?
C75 H75 0.9500 . ?
C76 C77 1.390(15) . ?
C76 C81 1.400(17) . ?
C77 H77 0.9500 . ?
C77 C78 1.394(17) . ?
C78 H78 0.9500 . ?
C78 C79 1.38(2) . ?
C79 H79 0.9500 . ?
C79 C80 1.38(2) . ?
C80 H80 0.9500 . ?
C80 C81 1.357(19) . ?
C81 H81 0.9500 . ?
B1 C82 1.635(17) . ?
B1 C88 1.626(16) . ?
B1 C94 1.647(15) . ?
B1 C100 1.632(17) . ?
C82 C83 1.388(17) . ?
C82 C87 1.384(16) . ?
C83 H83 0.9500 . ?
C83 C84 1.39(2) . ?
C84 H84 0.9500 . ?
C84 C85 1.37(2) . ?
C85 H85 0.9500 . ?
C85 C86 1.30(2) . ?
C86 H86 0.9500 . ?
C86 C87 1.40(2) . ?
C87 H87 0.9500 . ?
C88 C89 1.384(15) . ?
C88 C93 1.428(15) . ?
C89 H89 0.9500 . ?
C89 C90 1.395(17) . ?
C90 H90 0.9500 . ?
C90 C91 1.383(18) . ?
C91 H91 0.9500 . ?
C91 C92 1.368(18) . ?
C92 H92 0.9500 . ?
C92 C93 1.381(18) . ?
C93 H93 0.9500 . ?
C94 C95 1.385(18) . ?
C94 C99 1.400(17) . ?
C95 H95 0.9500 . ?
C95 C96 1.408(17) . ?
C96 H96 0.9500 . ?
C96 C97 1.36(2) . ?
C97 H97 0.9500 . ?
C97 C98 1.36(2) . ?
C98 H98 0.9500 . ?
C98 C99 1.390(16) . ?
C99 H99 0.9500 . ?
C100 C101 1.401(14) . ?
C100 C105 1.424(16) . ?
C101 H101 0.9500 . ?
C101 C102 1.375(17) . ?
C102 H102 0.9500 . ?
C102 C103 1.404(19) . ?
C103 H103 0.9500 . ?
C103 C104 1.347(19) . ?
C104 H104 0.9500 . ?
C104 C105 1.377(17) . ?
C105 H105 0.9500 . ?
Cl1 C106 1.700(19) . ?
Cl2 C106 1.730(19) . ?
C106 H10A 0.9900 . ?
C106 H10B 0.9900 . ?
Cl3 C107 1.73(3) . ?
Cl4 C107 1.80(3) . ?
C107 H10C 0.9900 . ?
C107 H10D 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
S2 Au1 Au2 96.59(6) . . ?
P1 Au1 Au2 87.71(7) . . ?
P1 Au1 S2 167.97(9) . . ?
S1 Au2 Au1 101.08(6) . . ?
P2 Au2 Au1 94.05(6) . . ?
P2 Au2 S1 163.39(8) . . ?
S1 Au3 Au4 95.55(5) . . ?
P3 Au3 Au4 96.10(6) . . ?
P3 Au3 S1 167.73(8) . . ?
Au3 Au4 Au5 145.178(16) . . ?
Au3 Au4 Au6 71.465(15) . . ?
Au6 Au4 Au5 73.738(19) . . ?
S2 Au4 Au3 98.68(5) . . ?
S2 Au4 Au5 72.83(5) . . ?
S2 Au4 Au6 78.39(6) . . ?
P4 Au4 Au3 83.61(5) . . ?
P4 Au4 Au5 108.32(5) . . ?
P4 Au4 Au6 107.49(6) . . ?
P4 Au4 S2 174.11(8) . . ?
S2 Au5 Au4 92.23(5) 2_665 . ?
P5 Au5 Au4 83.84(6) . . ?
P5 Au5 S2 175.98(8) . 2_665 ?
S1 Au6 Au4 91.85(6) . . ?
P5 Au6 Au4 86.59(6) . . ?
P5 Au6 S1 176.34(9) . . ?
Au2 S1 Au6 94.18(8) . . ?
Au3 S1 Au2 105.07(10) . . ?
Au3 S1 Au6 99.64(8) . . ?
Au1 S2 Au4 109.01(9) . . ?
Au1 S2 Au5 100.46(9) . 2_665 ?
Au5 S2 Au4 96.74(8) 2_665 . ?
C1 P1 Au1 112.0(3) . . ?
C7 P1 Au1 116.6(4) . . ?
C7 P1 C1 106.6(4) . . ?
C7 P1 C13 106.1(4) . . ?
C13 P1 Au1 110.2(3) . . ?
C13 P1 C1 104.5(5) . . ?
C16 P2 Au2 120.7(3) . . ?
C16 P2 C17 105.9(5) . . ?
C16 P2 C23 105.8(4) . . ?
C17 P2 Au2 106.5(3) . . ?
C17 P2 C23 105.9(4) . . ?
C23 P2 Au2 111.0(4) . . ?
C29 P3 Au3 110.9(4) . . ?
C29 P3 C35 107.0(5) . . ?
C35 P3 Au3 110.6(3) . . ?
C41 P3 Au3 119.1(3) . . ?
C41 P3 C29 102.1(5) . . ?
C41 P3 C35 106.3(5) . . ?
C44 P4 Au4 110.4(3) . . ?
C44 P4 C45 105.7(4) . . ?
C44 P4 C51 105.0(4) . . ?
C45 P4 Au4 114.2(3) . . ?
C45 P4 C51 104.2(4) . . ?
C51 P4 Au4 116.4(3) . . ?
Au5 P5 Au6 111.64(10) . . ?
C70 P5 Au5 109.9(3) . . ?
C70 P5 Au6 108.3(3) . . ?
C76 P5 Au5 111.9(4) . . ?
C76 P5 Au6 112.0(3) . . ?
C76 P5 C70 102.6(5) . . ?
O3 Si1 C57 106.6(5) . . ?
O3 Si1 C58 103.1(5) . . ?
O3 Si1 C59 106.6(4) . . ?
C58 Si1 C57 112.4(6) . . ?
C58 Si1 C59 112.4(6) . . ?
C59 Si1 C57 114.7(6) . . ?
O1 Si2 C60 104.7(5) . . ?
O1 Si2 C61 108.0(5) . . ?
O1 Si2 C62 108.5(5) . . ?
C60 Si2 C61 112.2(6) . . ?
C60 Si2 C62 111.0(6) . . ?
C61 Si2 C62 112.0(6) . . ?
O4 Si3 C63 104.1(7) . . ?
O4 Si3 C64 114.5(8) . . ?
O4 Si3 C65 100.9(13) . . ?
C63 Si3 C65 99.8(15) . . ?
C64 Si3 C63 118.7(15) . . ?
C64 Si3 C65 116(2) . . ?
O6 Si4 C66 104.9(9) . . ?
O6 Si4 C67 104.8(5) . . ?
O6 Si4 C68 109.5(7) . . ?
C66 Si4 C67 115.2(10) . . ?
C68 Si4 C66 111.8(13) . . ?
C68 Si4 C67 110.1(7) . . ?
C14 O1 Si2 131.4(7) . . ?
C15 O2 C14 104.7(7) . . ?
C15 O3 Si1 128.8(6) . . ?
C42 O4 Si3 139.5(7) . . ?
C43 O5 C42 108.6(7) . . ?
C43 O6 Si4 126.5(7) . . ?
C2 C1 P1 123.6(7) . . ?
C2 C1 C6 119.0(10) . . ?
C6 C1 P1 117.3(7) . . ?
C1 C2 H2 119.7 . . ?
C1 C2 C3 120.5(10) . . ?
C3 C2 H2 119.7 . . ?
C2 C3 H3 119.9 . . ?
C2 C3 C4 120.1(10) . . ?
C4 C3 H3 119.9 . . ?
C3 C4 H4 119.9 . . ?
C5 C4 C3 120.2(10) . . ?
C5 C4 H4 119.9 . . ?
C4 C5 H5 120.1 . . ?
C4 C5 C6 119.9(10) . . ?
C6 C5 H5 120.1 . . ?
C1 C6 H6 119.8 . . ?
C5 C6 C1 120.3(10) . . ?
C5 C6 H6 119.8 . . ?
C8 C7 P1 119.2(7) . . ?
C8 C7 C12 118.2(9) . . ?
C12 C7 P1 122.6(8) . . ?
C7 C8 H8 120.0 . . ?
C7 C8 C9 120.0(10) . . ?
C9 C8 H8 120.0 . . ?
C8 C9 H9 119.8 . . ?
C10 C9 C8 120.3(11) . . ?
C10 C9 H9 119.8 . . ?
C9 C10 H10 120.2 . . ?
C9 C10 C11 119.7(10) . . ?
C11 C10 H10 120.2 . . ?
C10 C11 H11 119.8 . . ?
C12 C11 C10 120.3(10) . . ?
C12 C11 H11 119.8 . . ?
C7 C12 H12 119.4 . . ?
C11 C12 C7 121.2(11) . . ?
C11 C12 H12 119.4 . . ?
C14 C13 P1 127.2(7) . . ?
C14 C13 C16 106.5(9) . . ?
C16 C13 P1 126.0(7) . . ?
O1 C14 O2 115.2(9) . . ?
O1 C14 C13 133.6(9) . . ?
C13 C14 O2 111.2(8) . . ?
O3 C15 O2 115.6(8) . . ?
C16 C15 O2 112.9(8) . . ?
C16 C15 O3 131.4(9) . . ?
C13 C16 P2 130.9(8) . . ?
C15 C16 P2 123.7(8) . . ?
C15 C16 C13 104.6(9) . . ?
C18 C17 P2 124.0(8) . . ?
C18 C17 C22 117.6(9) . . ?
C22 C17 P2 118.2(7) . . ?
C17 C18 H18 118.7 . . ?
C19 C18 C17 122.5(11) . . ?
C19 C18 H18 118.7 . . ?
C18 C19 H19 119.4 . . ?
C18 C19 C20 121.2(12) . . ?
C20 C19 H19 119.4 . . ?
C19 C20 H20 121.4 . . ?
C21 C20 C19 117.3(10) . . ?
C21 C20 H20 121.4 . . ?
C20 C21 H21 119.1 . . ?
C20 C21 C22 121.8(11) . . ?
C22 C21 H21 119.1 . . ?
C17 C22 H22 120.3 . . ?
C21 C22 C17 119.4(11) . . ?
C21 C22 H22 120.3 . . ?
C24 C23 P2 122.2(8) . . ?
C28 C23 P2 119.3(8) . . ?
C28 C23 C24 118.4(9) . . ?
C23 C24 H24 120.3 . . ?
C25 C24 C23 119.4(10) . . ?
C25 C24 H24 120.3 . . ?
C24 C25 H25 119.7 . . ?
C26 C25 C24 120.7(10) . . ?
C26 C25 H25 119.7 . . ?
C25 C26 H26 120.2 . . ?
C27 C26 C25 119.6(10) . . ?
C27 C26 H26 120.2 . . ?
C26 C27 H27 119.8 . . ?
C26 C27 C28 120.4(13) . . ?
C28 C27 H27 119.8 . . ?
C23 C28 C27 121.4(11) . . ?
C23 C28 H28 119.3 . . ?
C27 C28 H28 119.3 . . ?
C30 C29 P3 118.9(7) . . ?
C30 C29 C34 118.0(11) . . ?
C34 C29 P3 123.1(9) . . ?
C29 C30 H30 119.4 . . ?
C31 C30 C29 121.3(10) . . ?
C31 C30 H30 119.4 . . ?
C30 C31 H31 119.2 . . ?
C30 C31 C32 121.7(12) . . ?
C32 C31 H31 119.2 . . ?
C31 C32 H32 120.5 . . ?
C33 C32 C31 118.9(12) . . ?
C33 C32 H32 120.5 . . ?
C32 C33 H33 119.2 . . ?
C32 C33 C34 121.6(11) . . ?
C34 C33 H33 119.2 . . ?
C29 C34 H34 120.7 . . ?
C33 C34 C29 118.5(12) . . ?
C33 C34 H34 120.7 . . ?
C36 C35 P3 123.4(8) . . ?
C36 C35 C40 118.9(10) . . ?
C40 C35 P3 117.7(9) . . ?
C35 C36 H36 119.7 . . ?
C35 C36 C37 120.7(11) . . ?
C37 C36 H36 119.7 . . ?
C36 C37 H37 119.5 . . ?
C36 C37 C38 121.0(12) . . ?
C38 C37 H37 119.5 . . ?
C37 C38 H38 121.3 . . ?
C39 C38 C37 117.4(11) . . ?
C39 C38 H38 121.3 . . ?
C38 C39 H39 119.1 . . ?
C40 C39 C38 121.8(12) . . ?
C40 C39 H39 119.1 . . ?
C35 C40 H40 119.9 . . ?
C39 C40 C35 120.2(11) . . ?
C39 C40 H40 119.9 . . ?
C42 C41 P3 122.4(7) . . ?
C42 C41 C44 106.1(8) . . ?
C44 C41 P3 131.2(7) . . ?
O4 C42 O5 120.0(9) . . ?
O4 C42 C41 131.0(9) . . ?
O5 C42 C41 108.7(8) . . ?
O5 C43 C44 111.4(8) . . ?
O6 C43 O5 116.1(8) . . ?
O6 C43 C44 132.5(9) . . ?
C41 C44 P4 124.4(6) . . ?
C43 C44 P4 130.3(7) . . ?
C43 C44 C41 105.1(8) . . ?
C46 C45 P4 116.7(7) . . ?
C50 C45 P4 123.2(7) . . ?
C50 C45 C46 120.0(9) . . ?
C45 C46 H46 120.3 . . ?
C45 C46 C47 119.3(9) . . ?
C47 C46 H46 120.3 . . ?
C46 C47 H47 120.8 . . ?
C48 C47 C46 118.4(9) . . ?
C48 C47 H47 120.8 . . ?
C47 C48 H48 118.7 . . ?
C49 C48 C47 122.7(9) . . ?
C49 C48 H48 118.7 . . ?
C48 C49 H49 120.9 . . ?
C48 C49 C50 118.2(11) . . ?
C50 C49 H49 120.9 . . ?
C45 C50 C49 121.3(10) . . ?
C45 C50 H50 119.3 . . ?
C49 C50 H50 119.3 . . ?
C52 C51 P4 117.8(8) . . ?
C52 C51 C56 120.7(9) . . ?
C56 C51 P4 121.5(7) . . ?
C51 C52 H52 121.2 . . ?
C51 C52 C53 117.7(10) . . ?
C53 C52 H52 121.2 . . ?
C52 C53 H53 119.6 . . ?
C54 C53 C52 120.7(11) . . ?
C54 C53 H53 119.6 . . ?
C53 C54 H54 119.1 . . ?
C53 C54 C55 121.8(11) . . ?
C55 C54 H54 119.1 . . ?
C54 C55 H55 120.7 . . ?
C54 C55 C56 118.6(12) . . ?
C56 C55 H55 120.7 . . ?
C51 C56 C55 120.4(11) . . ?
C51 C56 H56 119.8 . . ?
C55 C56 H56 119.8 . . ?
Si1 C57 H57A 109.5 . . ?
Si1 C57 H57B 109.5 . . ?
Si1 C57 H57C 109.5 . . ?
H57A C57 H57B 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
Si1 C58 H58A 109.5 . . ?
Si1 C58 H58B 109.5 . . ?
Si1 C58 H58C 109.5 . . ?
H58A C58 H58B 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
Si1 C59 H59A 109.5 . . ?
Si1 C59 H59B 109.5 . . ?
Si1 C59 H59C 109.5 . . ?
H59A C59 H59B 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
Si2 C60 H60A 109.5 . . ?
Si2 C60 H60B 109.5 . . ?
Si2 C60 H60C 109.5 . . ?
H60A C60 H60B 109.5 . . ?
H60A C60 H60C 109.5 . . ?
H60B C60 H60C 109.5 . . ?
Si2 C61 H61A 109.5 . . ?
Si2 C61 H61B 109.5 . . ?
Si2 C61 H61C 109.5 . . ?
H61A C61 H61B 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?
Si2 C62 H62A 109.5 . . ?
Si2 C62 H62B 109.5 . . ?
Si2 C62 H62C 109.5 . . ?
H62A C62 H62B 109.5 . . ?
H62A C62 H62C 109.5 . . ?
H62B C62 H62C 109.5 . . ?
Si3 C63 H63A 109.5 . . ?
Si3 C63 H63B 109.5 . . ?
Si3 C63 H63C 109.5 . . ?
H63A C63 H63B 109.5 . . ?
H63A C63 H63C 109.5 . . ?
H63B C63 H63C 109.5 . . ?
Si3 C64 H64A 109.5 . . ?
Si3 C64 H64B 109.5 . . ?
Si3 C64 H64C 109.5 . . ?
H64A C64 H64B 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
Si3 C65 H65A 109.5 . . ?
Si3 C65 H65B 109.5 . . ?
Si3 C65 H65C 109.5 . . ?
H65A C65 H65B 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
Si4 C66 H66A 109.5 . . ?
Si4 C66 H66B 109.5 . . ?
Si4 C66 H66C 109.5 . . ?
H66A C66 H66B 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
Si4 C67 H67A 109.5 . . ?
Si4 C67 H67B 109.5 . . ?
Si4 C67 H67C 109.5 . . ?
H67A C67 H67B 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
Si4 C68 H68A 109.5 . . ?
Si4 C68 H68B 109.5 . . ?
Si4 C68 H68C 109.5 . . ?
H68A C68 H68B 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
C71 C70 P5 122.4(8) . . ?
C71 C70 C75 117.3(10) . . ?
C75 C70 P5 120.2(8) . . ?
C70 C71 H71 118.1 . . ?
C72 C71 C70 123.8(12) . . ?
C72 C71 H71 118.1 . . ?
C71 C72 H72 120.4 . . ?
C71 C72 C73 119.3(13) . . ?
C73 C72 H72 120.4 . . ?
C72 C73 H73 120.9 . . ?
C74 C73 C72 118.1(12) . . ?
C74 C73 H73 120.9 . . ?
C73 C74 H74 120.2 . . ?
C75 C74 C73 119.6(12) . . ?
C75 C74 H74 120.2 . . ?
C70 C75 C74 121.6(11) . . ?
C70 C75 H75 119.2 . . ?
C74 C75 H75 119.2 . . ?
C77 C76 P5 122.5(9) . . ?
C77 C76 C81 116.2(11) . . ?
C81 C76 P5 121.1(9) . . ?
C76 C77 H77 119.4 . . ?
C76 C77 C78 121.2(12) . . ?
C78 C77 H77 119.4 . . ?
C77 C78 H78 120.0 . . ?
C79 C78 C77 120.0(12) . . ?
C79 C78 H78 120.0 . . ?
C78 C79 H79 120.1 . . ?
C78 C79 C80 119.8(13) . . ?
C80 C79 H79 120.1 . . ?
C79 C80 H80 120.3 . . ?
C81 C80 C79 119.3(13) . . ?
C81 C80 H80 120.3 . . ?
C76 C81 H81 118.4 . . ?
C80 C81 C76 123.3(13) . . ?
C80 C81 H81 118.4 . . ?
C82 B1 C94 107.7(9) . . ?
C88 B1 C82 110.2(9) . . ?
C88 B1 C94 111.6(9) . . ?
C88 B1 C100 107.2(9) . . ?
C100 B1 C82 109.2(8) . . ?
C100 B1 C94 110.9(9) . . ?
C83 C82 B1 122.3(10) . . ?
C87 C82 B1 123.4(11) . . ?
C87 C82 C83 114.3(12) . . ?
C82 C83 H83 118.4 . . ?
C82 C83 C84 123.2(15) . . ?
C84 C83 H83 118.4 . . ?
C83 C84 H84 120.8 . . ?
C85 C84 C83 118.5(16) . . ?
C85 C84 H84 120.8 . . ?
C84 C85 H85 119.5 . . ?
C86 C85 C84 120.9(14) . . ?
C86 C85 H85 119.5 . . ?
C85 C86 H86 119.6 . . ?
C85 C86 C87 120.7(15) . . ?
C87 C86 H86 119.6 . . ?
C82 C87 C86 122.3(14) . . ?
C82 C87 H87 118.8 . . ?
C86 C87 H87 118.8 . . ?
C89 C88 B1 126.8(10) . . ?
C89 C88 C93 113.3(11) . . ?
C93 C88 B1 119.8(10) . . ?
C88 C89 H89 118.1 . . ?
C88 C89 C90 123.8(11) . . ?
C90 C89 H89 118.1 . . ?
C89 C90 H90 120.5 . . ?
C91 C90 C89 118.9(11) . . ?
C91 C90 H90 120.5 . . ?
C90 C91 H91 119.4 . . ?
C92 C91 C90 121.3(12) . . ?
C92 C91 H91 119.4 . . ?
C91 C92 H92 121.1 . . ?
C91 C92 C93 117.8(12) . . ?
C93 C92 H92 121.1 . . ?
C88 C93 H93 117.6 . . ?
C92 C93 C88 124.8(12) . . ?
C92 C93 H93 117.6 . . ?
C95 C94 B1 125.3(11) . . ?
C95 C94 C99 114.3(11) . . ?
C99 C94 B1 120.3(11) . . ?
C94 C95 H95 118.7 . . ?
C94 C95 C96 122.6(14) . . ?
C96 C95 H95 118.7 . . ?
C95 C96 H96 119.8 . . ?
C97 C96 C95 120.4(14) . . ?
C97 C96 H96 119.8 . . ?
C96 C97 H97 120.4 . . ?
C98 C97 C96 119.1(12) . . ?
C98 C97 H97 120.4 . . ?
C97 C98 H98 119.9 . . ?
C97 C98 C99 120.2(14) . . ?
C99 C98 H98 119.9 . . ?
C94 C99 H99 118.3 . . ?
C98 C99 C94 123.3(14) . . ?
C98 C99 H99 118.3 . . ?
C101 C100 B1 125.4(11) . . ?
C101 C100 C105 113.2(11) . . ?
C105 C100 B1 121.4(9) . . ?
C100 C101 H101 118.0 . . ?
C102 C101 C100 124.1(13) . . ?
C102 C101 H101 118.0 . . ?
C101 C102 H102 120.2 . . ?
C101 C102 C103 119.6(11) . . ?
C103 C102 H102 120.2 . . ?
C102 C103 H103 120.6 . . ?
C104 C103 C102 118.7(11) . . ?
C104 C103 H103 120.6 . . ?
C103 C104 H104 119.4 . . ?
C103 C104 C105 121.3(13) . . ?
C105 C104 H104 119.4 . . ?
C100 C105 H105 118.4 . . ?
C104 C105 C100 123.1(12) . . ?
C104 C105 H105 118.4 . . ?
Cl1 C106 Cl2 110.7(9) . . ?
Cl1 C106 H10A 109.5 . . ?
Cl1 C106 H10B 109.5 . . ?
Cl2 C106 H10A 109.5 . . ?
Cl2 C106 H10B 109.5 . . ?
H10A C106 H10B 108.1 . . ?
Cl3 C107 Cl4 112.8(12) . . ?
Cl3 C107 H10C 109.0 . . ?
Cl3 C107 H10D 109.0 . . ?
Cl4 C107 H10C 109.0 . . ?
Cl4 C107 H10D 109.0 . . ?
H10C C107 H10D 107.8 . . ?

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
Au1 P1 C1 C2 -150.1(9) . . . . ?
Au1 P1 C1 C6 34.2(9) . . . . ?
Au1 P1 C7 C8 50.0(9) . . . . ?
Au1 P1 C7 C12 -131.2(8) . . . . ?
Au1 P1 C13 C14 -126.6(8) . . . . ?
Au1 P1 C13 C16 46.1(8) . . . . ?
Au2 P2 C16 C13 -20.1(9) . . . . ?
Au2 P2 C16 C15 172.2(6) . . . . ?
Au2 P2 C17 C18 139.7(9) . . . . ?
Au2 P2 C17 C22 -35.5(9) . . . . ?
Au2 P2 C23 C24 125.2(9) . . . . ?
Au2 P2 C23 C28 -52.1(10) . . . . ?
Au3 P3 C29 C30 -59.5(9) . . . . ?
Au3 P3 C29 C34 119.2(9) . . . . ?
Au3 P3 C35 C36 139.6(9) . . . . ?
Au3 P3 C35 C40 -40.8(9) . . . . ?
Au3 P3 C41 C42 166.5(9) . . . . ?
Au3 P3 C41 C44 -6.7(12) . . . . ?
Au4 P4 C44 C41 58.8(9) . . . . ?
Au4 P4 C44 C43 -116.0(10) . . . . ?
Au4 P4 C45 C46 35.8(8) . . . . ?
Au4 P4 C45 C50 -140.8(8) . . . . ?
Au4 P4 C51 C52 46.6(8) . . . . ?
Au4 P4 C51 C56 -134.2(7) . . . . ?
Au5 P5 C70 C71 -176.0(8) . . . . ?
Au5 P5 C70 C75 7.9(10) . . . . ?
Au5 P5 C76 C77 -164.8(9) . . . . ?
Au5 P5 C76 C81 11.1(11) . . . . ?
Au6 P5 C70 C71 61.8(10) . . . . ?
Au6 P5 C70 C75 -114.3(9) . . . . ?
Au6 P5 C76 C77 -38.6(11) . . . . ?
Au6 P5 C76 C81 137.3(9) . . . . ?
P1 C1 C2 C3 -178.6(9) . . . . ?
P1 C1 C6 C5 177.9(9) . . . . ?
P1 C7 C8 C9 -179.5(9) . . . . ?
P1 C7 C12 C11 178.1(10) . . . . ?
P1 C13 C14 O1 -8.1(16) . . . . ?
P1 C13 C14 O2 174.1(6) . . . . ?
P1 C13 C16 P2 15.7(12) . . . . ?
P1 C13 C16 C15 -174.9(7) . . . . ?
P2 C17 C18 C19 -174.9(10) . . . . ?
P2 C17 C22 C21 178.3(9) . . . . ?
P2 C23 C24 C25 -178.5(9) . . . . ?
P2 C23 C28 C27 178.6(11) . . . . ?
P3 C29 C30 C31 -179.9(9) . . . . ?
P3 C29 C34 C33 -179.1(10) . . . . ?
P3 C35 C36 C37 179.3(10) . . . . ?
P3 C35 C40 C39 -177.9(9) . . . . ?
P3 C41 C42 O4 10(2) . . . . ?
P3 C41 C42 O5 -176.4(8) . . . . ?
P3 C41 C44 P4 -0.8(15) . . . . ?
P3 C41 C44 C43 175.1(9) . . . . ?
P4 C45 C46 C47 -176.3(7) . . . . ?
P4 C45 C50 C49 176.0(9) . . . . ?
P4 C51 C52 C53 -178.0(7) . . . . ?
P4 C51 C56 C55 -179.5(9) . . . . ?
P5 C70 C71 C72 179.3(11) . . . . ?
P5 C70 C75 C74 176.2(10) . . . . ?
P5 C76 C77 C78 -178.5(9) . . . . ?
P5 C76 C81 C80 -179.9(11) . . . . ?
Si1 O3 C15 O2 -16.1(12) . . . . ?
Si1 O3 C15 C16 165.0(8) . . . . ?
Si2 O1 C14 O2 -6.7(13) . . . . ?
Si2 O1 C14 C13 175.6(8) . . . . ?
Si3 O4 C42 O5 6(2) . . . . ?
Si3 O4 C42 C41 179.7(12) . . . . ?
Si4 O6 C43 O5 57.2(13) . . . . ?
Si4 O6 C43 C44 -127.0(12) . . . . ?
O2 C15 C16 P2 171.7(6) . . . . ?
O2 C15 C16 C13 1.3(10) . . . . ?
O3 C15 C16 P2 -9.4(15) . . . . ?
O3 C15 C16 C13 -179.8(9) . . . . ?
O5 C43 C44 P4 175.5(8) . . . . ?
O5 C43 C44 C41 0.0(12) . . . . ?
O6 C43 C44 P4 0(2) . . . . ?
O6 C43 C44 C41 -175.9(12) . . . . ?
C1 P1 C7 C8 -75.9(9) . . . . ?
C1 P1 C7 C12 102.9(9) . . . . ?
C1 P1 C13 C14 -6.1(9) . . . . ?
C1 P1 C13 C16 166.6(7) . . . . ?
C1 C2 C3 C4 3(2) . . . . ?
C2 C1 C6 C5 2.1(17) . . . . ?
C2 C3 C4 C5 -1(2) . . . . ?
C3 C4 C5 C6 0.2(19) . . . . ?
C4 C5 C6 C1 -0.6(18) . . . . ?
C6 C1 C2 C3 -3.0(17) . . . . ?
C7 P1 C1 C2 -21.5(11) . . . . ?
C7 P1 C1 C6 162.8(8) . . . . ?
C7 P1 C13 C14 106.4(8) . . . . ?
C7 P1 C13 C16 -80.9(8) . . . . ?
C7 C8 C9 C10 -2.1(18) . . . . ?
C8 C7 C12 C11 -3.1(17) . . . . ?
C8 C9 C10 C11 4(2) . . . . ?
C9 C10 C11 C12 -5(2) . . . . ?
C10 C11 C12 C7 5(2) . . . . ?
C12 C7 C8 C9 1.6(16) . . . . ?
C13 P1 C1 C2 90.5(10) . . . . ?
C13 P1 C1 C6 -85.1(9) . . . . ?
C13 P1 C7 C8 173.0(8) . . . . ?
C13 P1 C7 C12 -8.1(10) . . . . ?
C14 O2 C15 O3 179.8(7) . . . . ?
C14 O2 C15 C16 -1.1(10) . . . . ?
C14 C13 C16 P2 -170.4(7) . . . . ?
C14 C13 C16 C15 -0.9(10) . . . . ?
C15 O2 C14 O1 -177.8(8) . . . . ?
C15 O2 C14 C13 0.4(10) . . . . ?
C16 P2 C17 C18 -90.6(10) . . . . ?
C16 P2 C17 C22 94.1(9) . . . . ?
C16 P2 C23 C24 -7.4(10) . . . . ?
C16 P2 C23 C28 175.3(9) . . . . ?
C16 C13 C14 O1 178.1(10) . . . . ?
C16 C13 C14 O2 0.3(10) . . . . ?
C17 P2 C16 C13 -141.0(8) . . . . ?
C17 P2 C16 C15 51.3(9) . . . . ?
C17 P2 C23 C24 -119.6(9) . . . . ?
C17 P2 C23 C28 63.2(10) . . . . ?
C17 C18 C19 C20 -1(2) . . . . ?
C18 C17 C22 C21 2.7(17) . . . . ?
C18 C19 C20 C21 -1(2) . . . . ?
C19 C20 C21 C22 5(2) . . . . ?
C20 C21 C22 C17 -5(2) . . . . ?
C22 C17 C18 C19 0.3(18) . . . . ?
C23 P2 C16 C13 106.8(8) . . . . ?
C23 P2 C16 C15 -60.9(9) . . . . ?
C23 P2 C17 C18 21.5(11) . . . . ?
C23 P2 C17 C22 -153.8(9) . . . . ?
C23 C24 C25 C26 0.2(18) . . . . ?
C24 C23 C28 C27 1.2(19) . . . . ?
C24 C25 C26 C27 1(2) . . . . ?
C25 C26 C27 C28 -1(2) . . . . ?
C26 C27 C28 C23 0(2) . . . . ?
C28 C23 C24 C25 -1.2(17) . . . . ?
C29 P3 C35 C36 -99.5(11) . . . . ?
C29 P3 C35 C40 80.0(9) . . . . ?
C29 P3 C41 C42 44.1(11) . . . . ?
C29 P3 C41 C44 -129.2(10) . . . . ?
C29 C30 C31 C32 -0.9(18) . . . . ?
C30 C29 C34 C33 -0.4(17) . . . . ?
C30 C31 C32 C33 -0.4(19) . . . . ?
C31 C32 C33 C34 1(2) . . . . ?
C32 C33 C34 C29 -1(2) . . . . ?
C34 C29 C30 C31 1.4(17) . . . . ?
C35 P3 C29 C30 179.9(8) . . . . ?
C35 P3 C29 C34 -1.4(11) . . . . ?
C35 P3 C41 C42 -67.9(11) . . . . ?
C35 P3 C41 C44 118.9(10) . . . . ?
C35 C36 C37 C38 -1(2) . . . . ?
C36 C35 C40 C39 1.7(17) . . . . ?
C36 C37 C38 C39 1(2) . . . . ?
C37 C38 C39 C40 0(2) . . . . ?
C38 C39 C40 C35 -1.8(19) . . . . ?
C40 C35 C36 C37 -0.2(18) . . . . ?
C41 P3 C29 C30 68.4(9) . . . . ?
C41 P3 C29 C34 -112.9(10) . . . . ?
C41 P3 C35 C36 9.0(11) . . . . ?
C41 P3 C35 C40 -171.5(8) . . . . ?
C42 O5 C43 O6 175.6(10) . . . . ?
C42 O5 C43 C44 -1.1(13) . . . . ?
C42 C41 C44 P4 -174.9(9) . . . . ?
C42 C41 C44 C43 1.0(12) . . . . ?
C43 O5 C42 O4 176.4(12) . . . . ?
C43 O5 C42 C41 1.7(13) . . . . ?
C44 P4 C45 C46 -85.7(8) . . . . ?
C44 P4 C45 C50 97.6(10) . . . . ?
C44 P4 C51 C52 169.0(7) . . . . ?
C44 P4 C51 C56 -11.7(9) . . . . ?
C44 C41 C42 O4 -175.5(14) . . . . ?
C44 C41 C42 O5 -1.6(13) . . . . ?
C45 P4 C44 C41 -177.3(8) . . . . ?
C45 P4 C44 C43 8.0(12) . . . . ?
C45 P4 C51 C52 -80.1(8) . . . . ?
C45 P4 C51 C56 99.2(8) . . . . ?
C45 C46 C47 C48 -0.6(15) . . . . ?
C46 C45 C50 C49 -0.5(17) . . . . ?
C46 C47 C48 C49 0.8(17) . . . . ?
C47 C48 C49 C50 -0.9(19) . . . . ?
C48 C49 C50 C45 0.7(19) . . . . ?
C50 C45 C46 C47 0.5(15) . . . . ?
C51 P4 C44 C41 -67.4(9) . . . . ?
C51 P4 C44 C43 117.8(11) . . . . ?
C51 P4 C45 C46 163.9(7) . . . . ?
C51 P4 C45 C50 -12.8(10) . . . . ?
C51 C52 C53 C54 -2.9(15) . . . . ?
C52 C51 C56 C55 -0.2(16) . . . . ?
C52 C53 C54 C55 0.6(18) . . . . ?
C53 C54 C55 C56 2(2) . . . . ?
C54 C55 C56 C51 -2.2(18) . . . . ?
C56 C51 C52 C53 2.7(14) . . . . ?
C57 Si1 O3 C15 -58.3(9) . . . . ?
C58 Si1 O3 C15 -176.8(9) . . . . ?
C59 Si1 O3 C15 64.7(9) . . . . ?
C60 Si2 O1 C14 176.0(9) . . . . ?
C61 Si2 O1 C14 -64.3(10) . . . . ?
C62 Si2 O1 C14 57.3(10) . . . . ?
C63 Si3 O4 C42 -156.3(18) . . . . ?
C64 Si3 O4 C42 -25(2) . . . . ?
C65 Si3 O4 C42 101(2) . . . . ?
C66 Si4 O6 C43 47.9(13) . . . . ?
C67 Si4 O6 C43 169.7(9) . . . . ?
C68 Si4 O6 C43 -72.2(12) . . . . ?
C70 P5 C76 C77 77.4(10) . . . . ?
C70 P5 C76 C81 -106.7(10) . . . . ?
C70 C71 C72 C73 6(2) . . . . ?
C71 C70 C75 C74 -0.1(18) . . . . ?
C71 C72 C73 C74 -3.7(19) . . . . ?
C72 C73 C74 C75 -0.6(19) . . . . ?
C73 C74 C75 C70 3(2) . . . . ?
C75 C70 C71 C72 -4.5(18) . . . . ?
C76 P5 C70 C71 -56.8(10) . . . . ?
C76 P5 C70 C75 127.1(9) . . . . ?
C76 C77 C78 C79 -5(2) . . . . ?
C77 C76 C81 C80 -4(2) . . . . ?
C77 C78 C79 C80 2(2) . . . . ?
C78 C79 C80 C81 -1(2) . . . . ?
C79 C80 C81 C76 2(2) . . . . ?
C81 C76 C77 C78 5.4(17) . . . . ?
B1 C82 C83 C84 179.0(11) . . . . ?
B1 C82 C87 C86 -177.4(12) . . . . ?
B1 C88 C89 C90 174.9(12) . . . . ?
B1 C88 C93 C92 -174.1(13) . . . . ?
B1 C94 C95 C96 176.8(12) . . . . ?
B1 C94 C99 C98 -179.0(12) . . . . ?
B1 C100 C101 C102 -177.0(11) . . . . ?
B1 C100 C105 C104 178.5(12) . . . . ?
C82 B1 C88 C89 -97.5(13) . . . . ?
C82 B1 C88 C93 79.5(13) . . . . ?
C82 B1 C94 C95 -126.0(12) . . . . ?
C82 B1 C94 C99 52.6(13) . . . . ?
C82 B1 C100 C101 -1.2(14) . . . . ?
C82 B1 C100 C105 -179.3(10) . . . . ?
C82 C83 C84 C85 -1.6(19) . . . . ?
C83 C82 C87 C86 1.6(18) . . . . ?
C83 C84 C85 C86 2(2) . . . . ?
C84 C85 C86 C87 0(2) . . . . ?
C85 C86 C87 C82 -2(2) . . . . ?
C87 C82 C83 C84 0.1(17) . . . . ?
C88 B1 C82 C83 156.3(10) . . . . ?
C88 B1 C82 C87 -24.8(14) . . . . ?
C88 B1 C94 C95 112.8(13) . . . . ?
C88 B1 C94 C99 -68.6(14) . . . . ?
C88 B1 C100 C101 118.2(11) . . . . ?
C88 B1 C100 C105 -59.9(13) . . . . ?
C88 C89 C90 C91 -0.3(19) . . . . ?
C89 C88 C93 C92 3.2(19) . . . . ?
C89 C90 C91 C92 2(2) . . . . ?
C90 C91 C92 C93 -1(2) . . . . ?
C91 C92 C93 C88 -2(2) . . . . ?
C93 C88 C89 C90 -2.1(18) . . . . ?
C94 B1 C82 C83 34.3(14) . . . . ?
C94 B1 C82 C87 -146.8(10) . . . . ?
C94 B1 C88 C89 22.2(17) . . . . ?
C94 B1 C88 C93 -160.9(11) . . . . ?
C94 B1 C100 C101 -119.8(11) . . . . ?
C94 B1 C100 C105 62.2(13) . . . . ?
C94 C95 C96 C97 4(2) . . . . ?
C95 C94 C99 C98 -0.2(18) . . . . ?
C95 C96 C97 C98 -3(2) . . . . ?
C96 C97 C98 C99 1(2) . . . . ?
C97 C98 C99 C94 1(2) . . . . ?
C99 C94 C95 C96 -1.9(19) . . . . ?
C100 B1 C82 C83 -86.2(12) . . . . ?
C100 B1 C82 C87 92.7(12) . . . . ?
C100 B1 C88 C89 143.8(12) . . . . ?
C100 B1 C88 C93 -39.3(14) . . . . ?
C100 B1 C94 C95 -6.6(16) . . . . ?
C100 B1 C94 C99 172.0(10) . . . . ?
C100 C101 C102 C103 -2.1(18) . . . . ?
C101 C100 C105 C104 0.2(17) . . . . ?
C101 C102 C103 C104 1(2) . . . . ?
C102 C103 C104 C105 0(2) . . . . ?
C103 C104 C105 C100 -1(2) . . . . ?
C105 C100 C101 C102 1.2(16) . . . . ?

_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 0.024 -0.821 0.500 1157.8 374.0 '9(C H2 Cl2)'

_olex2_submission_special_instructions 'No special instructions were received'
_vrf_PLAT973_wen366              
;
PROBLEM: Check Calcd Positive Resid. Density on       Au6       2.10 eA-3  
RESPONSE: Typical Fourier ripple close to heavy atom
;
