#------------------------------------------------------------------------------
#$Date: 2021-07-23 04:52:16 +0300 (Fri, 23 Jul 2021) $
#$Revision: 267708 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/42/1564233.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1564233
loop_
_publ_author_name
'Takeda, Hiroto'
'Kojima, Tatsuhiro'
'Yoshinari, Nobuto'
'Konno, Takumi'
_publ_section_title
;
 A mesoporous ionic solid with 272 AuI6AgI3CuII3 complex cations in a
 super huge crystal lattice
;
_journal_name_full               'Chemical Science'
_journal_paper_doi               10.1039/D1SC02497C
_journal_year                    2021
_chemical_absolute_configuration rmad
_chemical_formula_moiety
'C112 H138 Ag3 Au6 N6 O12 P6 S6, 1.5(N O3), 1.5[NO3], 17[H2O]'
_chemical_formula_sum            'C112 H172 Ag3 Au6 N9 O38 P6 S6'
_chemical_formula_weight         4136.17
_space_group_crystal_system      orthorhombic
_space_group_IT_number           19
_space_group_name_Hall           'P 2ac 2ab'
_space_group_name_H-M_alt        'P 21 21 21'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2021-06-27 deposited with the CCDC.	2021-07-16 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   30.1406(4)
_cell_length_b                   32.9119(5)
_cell_length_c                   33.4887(7)
_cell_measurement_reflns_used    347480
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      19.479
_cell_measurement_theta_min      1.027
_cell_volume                     33220.3(10)
_computing_cell_refinement       HKL3000
_computing_data_collection
'PAL BL2D-SMDC Program(Shin et.al, 2016)'
_computing_data_reduction        HKL3000
_computing_molecular_graphics    Mercury
_computing_publication_material  WinGX
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Rayonix MX225HS CCD area detector'
_diffrn_measurement_method       'omega scan'
_diffrn_radiation_monochromator  'Si(111) double crystal monochromator'
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.600
_diffrn_reflns_av_R_equivalents  0.1548
_diffrn_reflns_av_unetI/netI     0.0831
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       33
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       36
_diffrn_reflns_limit_k_min       -36
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            347480
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        19.479
_diffrn_reflns_theta_max         19.479
_diffrn_reflns_theta_min         1.027
_diffrn_source                   'PLSII 2D bending magnet'
_exptl_absorpt_coefficient_mu    3.585
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   none
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.654
_exptl_crystal_description       stick
_exptl_crystal_F_000             16096
_exptl_crystal_size_max          0.070
_exptl_crystal_size_mid          0.020
_exptl_crystal_size_min          0.010
_refine_diff_density_max         1.113
_refine_diff_density_min         -1.318
_refine_diff_density_rms         0.123
_refine_ls_abs_structure_details
;
 Flack x determined using 12142 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.012(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.929
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2755
_refine_ls_number_reflns         47764
_refine_ls_number_restraints     7503
_refine_ls_restrained_S_all      0.882
_refine_ls_R_factor_all          0.0773
_refine_ls_R_factor_gt           0.0421
_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)+(0.0505P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0883
_refine_ls_wR_factor_ref         0.0977
_reflns_Friedel_coverage         0.883
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.999
_reflns_number_gt                32767
_reflns_number_total             47764
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1sc02497c2.cif
_cod_data_source_block           '[au6ag3](no3)3_sq'
_cod_database_code               1564233
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.787
_shelx_estimated_absorpt_t_max   0.965
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y+1/2, -z+1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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
S1 S 0.20625(15) 0.48163(16) 0.36364(18) 0.0683(16) Uani 1 1 d D U . . .
C1 C 0.2077(5) 0.4450(5) 0.4078(5) 0.073(6) Uani 1 1 d D U . . .
C4 C 0.1587(5) 0.4376(7) 0.4175(7) 0.106(9) Uani 1 1 d D U . . .
H4A H 0.143986 0.463706 0.422369 0.158 Uiso 1 1 calc R U . . .
H4B H 0.144465 0.423911 0.394911 0.158 Uiso 1 1 calc R U . . .
H4C H 0.156367 0.420553 0.441365 0.158 Uiso 1 1 calc R U . . .
C5 C 0.2286(8) 0.4664(7) 0.4431(6) 0.114(8) Uani 1 1 d D U . . .
H5A H 0.213306 0.492215 0.447827 0.171 Uiso 1 1 calc R U . . .
H5B H 0.226217 0.449200 0.466840 0.171 Uiso 1 1 calc R U . . .
H5C H 0.260013 0.471693 0.437349 0.171 Uiso 1 1 calc R U . . .
C2 C 0.2308(5) 0.4056(5) 0.4003(6) 0.090(6) Uani 1 1 d D U . . .
H2 H 0.234569 0.392260 0.426905 0.108 Uiso 1 1 calc R U . . .
N1 N 0.2040(6) 0.3764(5) 0.3749(6) 0.105(7) Uani 1 1 d D U . . .
H1A H 0.219698 0.353074 0.371258 0.158 Uiso 1 1 calc R U . . .
H1B H 0.177970 0.370696 0.387340 0.158 Uiso 1 1 calc R U . . .
H1C H 0.198395 0.388021 0.350718 0.158 Uiso 1 1 calc R U . . .
C3 C 0.2776(6) 0.4068(7) 0.3808(7) 0.095(7) Uani 1 1 d D U . . .
O1 O 0.3074(5) 0.4229(5) 0.4017(6) 0.137(7) Uani 1 1 d D U . . .
O2 O 0.2816(5) 0.3977(5) 0.3435(5) 0.107(6) Uani 1 1 d D U . . .
S2 S 0.19977(14) 0.70245(14) 0.30765(17) 0.0561(14) Uani 1 1 d D U . . .
C6 C 0.1984(5) 0.7596(4) 0.3117(5) 0.061(5) Uani 1 1 d D U . . .
C9 C 0.1491(5) 0.7706(6) 0.3075(8) 0.097(8) Uani 1 1 d D U . . .
H9A H 0.137510 0.759211 0.282579 0.145 Uiso 1 1 calc R U . . .
H9B H 0.132558 0.759381 0.330158 0.145 Uiso 1 1 calc R U . . .
H9C H 0.145851 0.800217 0.307140 0.145 Uiso 1 1 calc R U . . .
C10 C 0.2233(7) 0.7782(5) 0.2760(6) 0.081(6) Uani 1 1 d D U . . .
H10A H 0.211670 0.766749 0.251128 0.121 Uiso 1 1 calc R U . . .
H10B H 0.219039 0.807741 0.275962 0.121 Uiso 1 1 calc R U . . .
H10C H 0.254982 0.772029 0.278279 0.121 Uiso 1 1 calc R U . . .
C7 C 0.2161(4) 0.7771(5) 0.3500(5) 0.066(5) Uani 1 1 d D U . . .
H7 H 0.215238 0.807334 0.347184 0.079 Uiso 1 1 calc R U . . .
N2 N 0.1883(5) 0.7662(4) 0.3866(4) 0.068(4) Uani 1 1 d D U . . .
H2A H 0.200593 0.777665 0.408739 0.102 Uiso 1 1 calc R U . . .
H2B H 0.160173 0.775849 0.383392 0.102 Uiso 1 1 calc R U . . .
H2C H 0.187457 0.738768 0.389557 0.102 Uiso 1 1 calc R U . . .
C8 C 0.2651(5) 0.7652(5) 0.3612(5) 0.059(5) Uani 1 1 d D U . . .
O3 O 0.2956(4) 0.7819(4) 0.3429(5) 0.083(5) Uani 1 1 d D U . . .
O4 O 0.2707(4) 0.7385(4) 0.3882(4) 0.065(4) Uani 1 1 d D U . . .
S3 S 0.19959(17) 0.5519(2) 0.1534(2) 0.088(2) Uani 1 1 d D U . . .
C11 C 0.2002(5) 0.5313(6) 0.1011(5) 0.100(7) Uani 1 1 d D U . . .
C14 C 0.1590(7) 0.5488(9) 0.0809(7) 0.159(13) Uani 1 1 d D U . . .
H14A H 0.132421 0.539411 0.095034 0.238 Uiso 1 1 calc R U . . .
H14B H 0.160231 0.578516 0.081612 0.238 Uiso 1 1 calc R U . . .
H14C H 0.157865 0.539562 0.053091 0.238 Uiso 1 1 calc R U . . .
C15 C 0.1982(11) 0.4858(6) 0.1024(9) 0.188(15) Uani 1 1 d D U . . .
H15A H 0.170965 0.477276 0.116092 0.282 Uiso 1 1 calc R U . . .
H15B H 0.198132 0.475041 0.075093 0.282 Uiso 1 1 calc R U . . .
H15C H 0.224009 0.475257 0.116821 0.282 Uiso 1 1 calc R U . . .
C12 C 0.2415(7) 0.5450(6) 0.0803(6) 0.113(7) Uani 1 1 d D U . . .
H12 H 0.265848 0.542233 0.100429 0.136 Uiso 1 1 calc R U . . .
N3 N 0.2539(9) 0.5174(8) 0.0468(7) 0.175(11) Uani 1 1 d D U . . .
H3A H 0.279043 0.526729 0.034899 0.262 Uiso 1 1 calc R U . . .
H3B H 0.258594 0.491960 0.056410 0.262 Uiso 1 1 calc R U . . .
H3C H 0.231455 0.516832 0.028573 0.262 Uiso 1 1 calc R U . . .
C13 C 0.2441(11) 0.5894(7) 0.0653(8) 0.148(10) Uani 1 1 d D U . . .
O5 O 0.2611(9) 0.6164(7) 0.0880(7) 0.183(10) Uani 1 1 d D U . . .
O6 O 0.2255(9) 0.5942(7) 0.0304(6) 0.196(11) Uani 1 1 d D U . . .
C16 C 0.3811(4) 0.4884(3) 0.3229(4) 0.063(5) Uani 1 1 d G U . . .
C17 C 0.3611(3) 0.4510(4) 0.3160(5) 0.085(7) Uani 1 1 d G U . . .
H17 H 0.330165 0.447748 0.320170 0.102 Uiso 1 1 calc R U . . .
C18 C 0.3865(4) 0.4183(3) 0.3029(5) 0.085(7) Uani 1 1 d G U . . .
H18 H 0.372841 0.392742 0.298151 0.102 Uiso 1 1 calc R U . . .
C19 C 0.4318(4) 0.4230(3) 0.2967(5) 0.079(6) Uani 1 1 d G U . . .
H19 H 0.449126 0.400716 0.287808 0.095 Uiso 1 1 calc R U . . .
C20 C 0.4518(3) 0.4605(4) 0.3037(4) 0.068(6) Uani 1 1 d G U . . .
H20 H 0.482736 0.463696 0.299484 0.082 Uiso 1 1 calc R U . . .
C21 C 0.4264(4) 0.4931(3) 0.3168(4) 0.065(5) Uani 1 1 d G U . . .
H21 H 0.440061 0.518702 0.321503 0.078 Uiso 1 1 calc R U . . .
C22 C 0.3790(4) 0.5392(5) 0.3921(4) 0.076(5) Uani 1 1 d G U . . .
C23 C 0.3818(5) 0.5074(4) 0.4193(5) 0.124(9) Uani 1 1 d G U . . .
H23 H 0.367822 0.482204 0.413653 0.148 Uiso 1 1 calc R U . . .
C24 C 0.4052(6) 0.5125(5) 0.4548(5) 0.156(11) Uani 1 1 d G U . . .
H24 H 0.407092 0.490756 0.473341 0.187 Uiso 1 1 calc R U . . .
C25 C 0.4257(5) 0.5494(6) 0.4630(4) 0.107(8) Uani 1 1 d G U . . .
H25 H 0.441627 0.552841 0.487244 0.129 Uiso 1 1 calc R U . . .
C26 C 0.4229(4) 0.5812(4) 0.4358(5) 0.080(6) Uani 1 1 d G U . . .
H26 H 0.436892 0.606376 0.441460 0.096 Uiso 1 1 calc R U . . .
C27 C 0.3995(5) 0.5761(4) 0.4004(4) 0.073(5) Uani 1 1 d G U . . .
H27 H 0.397622 0.597825 0.381772 0.087 Uiso 1 1 calc R U . . .
C28 C 0.3578(5) 0.5766(6) 0.3163(6) 0.058(4) Uani 1 1 d . U . . .
H28A H 0.345698 0.599422 0.332117 0.070 Uiso 1 1 calc R U . . .
H28B H 0.390277 0.580792 0.314375 0.070 Uiso 1 1 calc R U . . .
C29 C 0.3782(5) 0.6718(5) 0.3240(6) 0.049(4) Uani 1 1 d . U . . .
C30 C 0.4216(5) 0.6597(5) 0.3243(6) 0.056(5) Uani 1 1 d . U . . .
H30 H 0.434249 0.647652 0.301124 0.067 Uiso 1 1 calc R U . . .
C31 C 0.4471(6) 0.6649(6) 0.3584(6) 0.069(6) Uani 1 1 d . U . . .
H31 H 0.477404 0.656855 0.357952 0.083 Uiso 1 1 calc R U . . .
C32 C 0.4302(6) 0.6811(7) 0.3920(7) 0.074(6) Uani 1 1 d . U . . .
H32 H 0.447993 0.683196 0.415344 0.089 Uiso 1 1 calc R U . . .
C33 C 0.3843(6) 0.6954(7) 0.3923(6) 0.069(6) Uani 1 1 d . U . . .
H33 H 0.372359 0.709048 0.414849 0.082 Uiso 1 1 calc R U . . .
C34 C 0.3596(6) 0.6886(6) 0.3598(6) 0.055(5) Uani 1 1 d . U . . .
H34 H 0.328854 0.695138 0.360464 0.066 Uiso 1 1 calc R U . . .
C35 C 0.3718(6) 0.7047(6) 0.2455(6) 0.055(4) Uani 1 1 d . U . . .
C36 C 0.3661(7) 0.7445(6) 0.2534(7) 0.088(7) Uani 1 1 d . U . . .
H36 H 0.346894 0.752146 0.274608 0.106 Uiso 1 1 calc R U . . .
C37 C 0.3872(9) 0.7747(7) 0.2317(9) 0.112(9) Uani 1 1 d . U . . .
H37 H 0.384248 0.802503 0.238762 0.135 Uiso 1 1 calc R U . . .
C38 C 0.4127(7) 0.7628(6) 0.1996(7) 0.082(7) Uani 1 1 d . U . . .
H38 H 0.428811 0.782350 0.184680 0.098 Uiso 1 1 calc R U . . .
C39 C 0.4145(7) 0.7231(6) 0.1894(6) 0.065(5) Uani 1 1 d . U . . .
H39 H 0.429335 0.715516 0.165544 0.078 Uiso 1 1 calc R U . . .
C40 C 0.3956(6) 0.6936(6) 0.2126(6) 0.059(5) Uani 1 1 d . U . . .
H40 H 0.398953 0.665728 0.205920 0.071 Uiso 1 1 calc R U . . .
C41 C 0.3549(6) 0.6202(5) 0.2554(6) 0.056(5) Uani 1 1 d . U . . .
H41A H 0.342882 0.621819 0.227983 0.067 Uiso 1 1 calc R U . . .
H41B H 0.387518 0.617775 0.252823 0.067 Uiso 1 1 calc R U . . .
C42 C 0.3711(5) 0.4916(6) 0.1828(7) 0.060(5) Uani 1 1 d . U . . .
C43 C 0.3653(7) 0.4812(7) 0.1427(7) 0.081(6) Uani 1 1 d . U . . .
H43 H 0.347974 0.497222 0.125012 0.097 Uiso 1 1 calc R U . . .
C44 C 0.3873(8) 0.4449(7) 0.1301(9) 0.100(7) Uani 1 1 d . U . . .
H44 H 0.385010 0.435854 0.103225 0.120 Uiso 1 1 calc R U . . .
C45 C 0.4119(7) 0.4231(6) 0.1574(8) 0.077(6) Uani 1 1 d . U . . .
H45 H 0.426846 0.399438 0.148371 0.092 Uiso 1 1 calc R U . . .
C46 C 0.4156(6) 0.4326(6) 0.1927(8) 0.072(6) Uani 1 1 d . U . . .
H46 H 0.432372 0.415942 0.210315 0.087 Uiso 1 1 calc R U . . .
C47 C 0.3949(6) 0.4680(6) 0.2070(7) 0.068(5) Uani 1 1 d . U . . .
H47 H 0.398046 0.475238 0.234317 0.081 Uiso 1 1 calc R U . . .
C48 C 0.3757(3) 0.5770(3) 0.1673(4) 0.053(4) Uani 1 1 d G U . . .
C49 C 0.4208(3) 0.5810(3) 0.1748(3) 0.050(4) Uani 1 1 d G U . . .
H49 H 0.434549 0.564631 0.194628 0.060 Uiso 1 1 calc R U . . .
C50 C 0.4458(3) 0.6090(4) 0.1534(4) 0.059(5) Uani 1 1 d G U . . .
H50 H 0.476668 0.611755 0.158564 0.070 Uiso 1 1 calc R U . . .
C51 C 0.4257(4) 0.6330(3) 0.1244(4) 0.065(5) Uani 1 1 d G U . . .
H51 H 0.442811 0.652106 0.109767 0.078 Uiso 1 1 calc R U . . .
C52 C 0.3806(4) 0.6290(4) 0.1168(4) 0.076(6) Uani 1 1 d G U . . .
H52 H 0.366834 0.645335 0.097033 0.091 Uiso 1 1 calc R U . . .
C53 C 0.3556(3) 0.6010(4) 0.1383(4) 0.067(5) Uani 1 1 d G U . . .
H53 H 0.324714 0.598212 0.133096 0.080 Uiso 1 1 calc R U . . .
C54 C 0.3567(6) 0.5449(6) 0.2477(6) 0.061(5) Uani 1 1 d . U . . .
H54A H 0.347062 0.519259 0.260559 0.073 Uiso 1 1 calc R U . . .
H54B H 0.389423 0.545906 0.250100 0.073 Uiso 1 1 calc R U . . .
C55 C 0.3383(5) 0.5798(5) 0.2733(6) 0.052(4) Uani 1 1 d . U . . .
C56 C 0.2875(5) 0.5798(5) 0.2750(6) 0.054(5) Uani 1 1 d . U . . .
H56A H 0.277388 0.602558 0.291543 0.081 Uiso 1 1 calc R U . . .
H56B H 0.275562 0.582773 0.247921 0.081 Uiso 1 1 calc R U . . .
H56C H 0.277140 0.554199 0.286560 0.081 Uiso 1 1 calc R U . . .
S4 S 0.26159(15) 0.45123(15) 0.23373(19) 0.0652(15) Uani 1 1 d D U . . .
C57 C 0.2584(5) 0.3994(4) 0.2103(5) 0.066(5) Uani 1 1 d D U . . .
C60 C 0.3077(5) 0.3926(6) 0.1995(6) 0.091(7) Uani 1 1 d D U . . .
H60A H 0.317725 0.414269 0.181573 0.137 Uiso 1 1 calc R U . . .
H60B H 0.325660 0.392826 0.223864 0.137 Uiso 1 1 calc R U . . .
H60C H 0.311035 0.366249 0.186073 0.137 Uiso 1 1 calc R U . . .
C61 C 0.2317(6) 0.4009(6) 0.1725(6) 0.092(7) Uani 1 1 d D U . . .
H61A H 0.242957 0.422755 0.155338 0.137 Uiso 1 1 calc R U . . .
H61B H 0.234191 0.374902 0.158442 0.137 Uiso 1 1 calc R U . . .
H61C H 0.200521 0.406158 0.178978 0.137 Uiso 1 1 calc R U . . .
C58 C 0.2425(5) 0.3664(5) 0.2377(5) 0.071(5) Uani 1 1 d D U . . .
H58 H 0.241468 0.341229 0.220944 0.085 Uiso 1 1 calc R U . . .
N4 N 0.2751(5) 0.3575(5) 0.2701(5) 0.091(6) Uani 1 1 d D U . . .
H4D H 0.264303 0.337430 0.285992 0.137 Uiso 1 1 calc R U . . .
H4E H 0.301252 0.349416 0.259077 0.137 Uiso 1 1 calc R U . . .
H4F H 0.279592 0.380341 0.284871 0.137 Uiso 1 1 calc R U . . .
C59 C 0.1953(6) 0.3715(7) 0.2546(6) 0.097(7) Uani 1 1 d D U . . .
O7 O 0.1917(5) 0.3825(4) 0.2904(5) 0.098(5) Uani 1 1 d D U . . .
O8 O 0.1627(5) 0.3639(6) 0.2305(6) 0.152(8) Uani 1 1 d D U . . .
S5 S 0.2566(2) 0.6811(2) 0.1861(2) 0.100(2) Uani 1 1 d D U . . .
C62 C 0.2570(8) 0.7252(6) 0.1499(6) 0.138(9) Uani 1 1 d D U . . .
C65 C 0.3059(8) 0.7325(9) 0.1408(9) 0.185(15) Uani 1 1 d D U . . .
H65A H 0.322219 0.736281 0.165880 0.277 Uiso 1 1 calc R U . . .
H65B H 0.318050 0.709069 0.126455 0.277 Uiso 1 1 calc R U . . .
H65C H 0.308999 0.756931 0.124285 0.277 Uiso 1 1 calc R U . . .
C66 C 0.2407(10) 0.7633(7) 0.1708(9) 0.169(13) Uani 1 1 d D U . . .
H66A H 0.256030 0.766322 0.196432 0.254 Uiso 1 1 calc R U . . .
H66B H 0.246822 0.787074 0.154017 0.254 Uiso 1 1 calc R U . . .
H66C H 0.208654 0.761242 0.175442 0.254 Uiso 1 1 calc R U . . .
C63 C 0.2343(9) 0.7198(10) 0.1109(8) 0.220(13) Uani 1 1 d D U . . .
H63 H 0.229573 0.748500 0.102207 0.264 Uiso 1 1 calc R U . . .
N5 N 0.2645(11) 0.7038(12) 0.0786(9) 0.269(18) Uani 1 1 d D U . . .
H5D H 0.248987 0.701046 0.055512 0.403 Uiso 1 1 calc R U . . .
H5E H 0.287363 0.721448 0.074853 0.403 Uiso 1 1 calc R U . . .
H5F H 0.275499 0.679148 0.086115 0.403 Uiso 1 1 calc R U . . .
C64 C 0.1869(9) 0.7017(12) 0.1075(15) 0.253(17) Uani 1 1 d D U . . .
O9 O 0.1802(11) 0.6677(8) 0.0907(11) 0.271(16) Uani 1 1 d D U . . .
O10 O 0.1528(11) 0.7236(10) 0.1198(14) 0.33(2) Uani 1 1 d D U . . .
S6 S 0.26696(15) 0.61096(15) 0.39676(16) 0.0576(13) Uani 1 1 d D U . . .
C67 C 0.2667(5) 0.6152(4) 0.4530(4) 0.059(5) Uani 1 1 d D U . . .
C70 C 0.2446(6) 0.5762(5) 0.4687(6) 0.079(7) Uani 1 1 d D U . . .
H70A H 0.259679 0.552437 0.457525 0.118 Uiso 1 1 calc R U . . .
H70B H 0.246663 0.575512 0.497925 0.118 Uiso 1 1 calc R U . . .
H70C H 0.213286 0.575856 0.460762 0.118 Uiso 1 1 calc R U . . .
C71 C 0.3156(5) 0.6146(6) 0.4655(6) 0.081(7) Uani 1 1 d D U . . .
H71A H 0.329790 0.589935 0.455178 0.122 Uiso 1 1 calc R U . . .
H71B H 0.330674 0.638548 0.454530 0.122 Uiso 1 1 calc R U . . .
H71C H 0.317722 0.614982 0.494671 0.122 Uiso 1 1 calc R U . . .
C68 C 0.2453(4) 0.6531(4) 0.4689(6) 0.061(5) Uani 1 1 d D U . . .
H68 H 0.244040 0.650075 0.498603 0.073 Uiso 1 1 calc R U . . .
N6 N 0.2704(4) 0.6917(4) 0.4607(5) 0.065(4) Uani 1 1 d D U . . .
H6A H 0.255411 0.713136 0.471213 0.098 Uiso 1 1 calc R U . . .
H6B H 0.297809 0.690106 0.472050 0.098 Uiso 1 1 calc R U . . .
H6C H 0.273304 0.695097 0.433859 0.098 Uiso 1 1 calc R U . . .
C69 C 0.1967(5) 0.6603(5) 0.4547(6) 0.064(5) Uani 1 1 d D U . . .
O11 O 0.1666(4) 0.6383(4) 0.4675(4) 0.077(4) Uani 1 1 d D U . . .
O12 O 0.1907(4) 0.6900(4) 0.4297(4) 0.073(4) Uani 1 1 d D U . . .
C72 C 0.0913(6) 0.4875(7) 0.1836(7) 0.068(5) Uani 1 1 d . U . . .
C73 C 0.0890(7) 0.4463(7) 0.1731(8) 0.082(6) Uani 1 1 d . U . . .
H73 H 0.100362 0.426108 0.190648 0.098 Uiso 1 1 calc R U . . .
C74 C 0.0692(7) 0.4345(8) 0.1353(8) 0.092(7) Uani 1 1 d . U . . .
H74 H 0.069484 0.407334 0.125827 0.110 Uiso 1 1 calc R U . . .
C75 C 0.0499(7) 0.4657(8) 0.1143(8) 0.087(7) Uani 1 1 d . U . . .
H75 H 0.035640 0.458499 0.089992 0.104 Uiso 1 1 calc R U . . .
C76 C 0.0491(6) 0.5054(7) 0.1243(7) 0.074(6) Uani 1 1 d . U . . .
H76 H 0.034322 0.524413 0.107647 0.089 Uiso 1 1 calc R U . . .
C77 C 0.0694(6) 0.5180(7) 0.1585(7) 0.071(5) Uani 1 1 d . U . . .
H77 H 0.069362 0.545867 0.165824 0.085 Uiso 1 1 calc R U . . .
C78 C 0.0839(5) 0.4719(5) 0.2669(6) 0.049(4) Uani 1 1 d . U . . .
C79 C 0.0376(5) 0.4817(6) 0.2672(6) 0.063(5) Uani 1 1 d . U . . .
H79 H 0.025072 0.500793 0.249210 0.076 Uiso 1 1 calc R U . . .
C80 C 0.0111(6) 0.4607(6) 0.2966(7) 0.071(6) Uani 1 1 d . U . . .
H80 H -0.019514 0.467275 0.299182 0.086 Uiso 1 1 calc R U . . .
C81 C 0.0298(6) 0.4304(6) 0.3218(6) 0.067(5) Uani 1 1 d . U . . .
H81 H 0.011782 0.415579 0.339948 0.081 Uiso 1 1 calc R U . . .
C82 C 0.0738(6) 0.4232(6) 0.3195(6) 0.066(5) Uani 1 1 d . U . . .
H82 H 0.087120 0.404221 0.337142 0.079 Uiso 1 1 calc R U . . .
C83 C 0.1005(6) 0.4436(5) 0.2911(6) 0.059(5) Uani 1 1 d . U . . .
H83 H 0.131039 0.436839 0.289198 0.071 Uiso 1 1 calc R U . . .
C84 C 0.1088(5) 0.5535(5) 0.2363(6) 0.053(4) Uani 1 1 d . U . . .
H84A H 0.120253 0.566540 0.211701 0.064 Uiso 1 1 calc R U . . .
H84B H 0.076285 0.557876 0.236442 0.064 Uiso 1 1 calc R U . . .
C85 C 0.0835(6) 0.7017(6) 0.2440(7) 0.065(5) Uani 1 1 d . U . . .
C86 C 0.0853(6) 0.7320(6) 0.2167(8) 0.074(6) Uani 1 1 d . U . . .
H86 H 0.100770 0.729005 0.192150 0.089 Uiso 1 1 calc R U . . .
C87 C 0.0620(8) 0.7697(7) 0.2270(9) 0.093(7) Uani 1 1 d . U . . .
H87 H 0.063440 0.792532 0.209780 0.111 Uiso 1 1 calc R U . . .
C88 C 0.0388(8) 0.7715(7) 0.2607(9) 0.090(7) Uani 1 1 d . U . . .
H88 H 0.022171 0.795429 0.266251 0.107 Uiso 1 1 calc R U . . .
C89 C 0.0379(6) 0.7408(6) 0.2874(8) 0.077(6) Uani 1 1 d . U . . .
H89 H 0.021983 0.743777 0.311686 0.093 Uiso 1 1 calc R U . . .
C90 C 0.0609(6) 0.7037(7) 0.2789(7) 0.076(6) Uani 1 1 d . U . . .
H90 H 0.060386 0.681539 0.297031 0.091 Uiso 1 1 calc R U . . .
C91 C 0.0796(7) 0.6365(6) 0.1872(7) 0.072(5) Uani 1 1 d . U . . .
C92 C 0.0369(7) 0.6290(7) 0.1944(8) 0.089(7) Uani 1 1 d . U . . .
H92 H 0.024367 0.632287 0.220255 0.107 Uiso 1 1 calc R U . . .
C93 C 0.0093(8) 0.6149(9) 0.1589(8) 0.109(8) Uani 1 1 d . U . . .
H93 H -0.021096 0.608356 0.162816 0.131 Uiso 1 1 calc R U . . .
C94 C 0.0262(8) 0.6117(9) 0.1237(9) 0.108(8) Uani 1 1 d . U . . .
H94 H 0.008227 0.603701 0.101782 0.129 Uiso 1 1 calc R U . . .
C95 C 0.0692(8) 0.6195(8) 0.1183(8) 0.107(8) Uani 1 1 d . U . . .
H95 H 0.081069 0.616517 0.092159 0.128 Uiso 1 1 calc R U . . .
C96 C 0.0993(8) 0.6325(7) 0.1503(7) 0.089(7) Uani 1 1 d . U . . .
H96 H 0.129945 0.637751 0.145889 0.107 Uiso 1 1 calc R U . . .
C97 C 0.1075(5) 0.6204(5) 0.2716(6) 0.050(4) Uani 1 1 d . U . . .
H97A H 0.118462 0.635033 0.295482 0.060 Uiso 1 1 calc R U . . .
H97B H 0.075194 0.616694 0.275315 0.060 Uiso 1 1 calc R U . . .
C98 C 0.1003(4) 0.5418(4) 0.3960(4) 0.060(5) Uani 1 1 d G U . . .
C99 C 0.1056(4) 0.5503(3) 0.4364(4) 0.081(6) Uani 1 1 d G U . . .
H99 H 0.122879 0.572878 0.444560 0.097 Uiso 1 1 calc R U . . .
C100 C 0.0855(4) 0.5256(4) 0.4648(3) 0.080(6) Uani 1 1 d G U . . .
H100 H 0.089036 0.531327 0.492383 0.096 Uiso 1 1 calc R U . . .
C101 C 0.0601(4) 0.4925(4) 0.4528(4) 0.077(6) Uani 1 1 d G U . . .
H101 H 0.046362 0.475596 0.472200 0.092 Uiso 1 1 calc R U . . .
C102 C 0.0549(4) 0.4840(3) 0.4124(5) 0.073(5) Uani 1 1 d G U . . .
H102 H 0.037531 0.461415 0.404193 0.088 Uiso 1 1 calc R U . . .
C103 C 0.0750(4) 0.5087(4) 0.3840(3) 0.064(5) Uani 1 1 d G U . . .
H103 H 0.071374 0.502965 0.356369 0.077 Uiso 1 1 calc R U . . .
C104 C 0.0883(5) 0.6237(5) 0.3694(6) 0.056(5) Uani 1 1 d . U . . .
C105 C 0.1041(6) 0.6593(6) 0.3806(7) 0.066(6) Uani 1 1 d . U . . .
H105 H 0.135304 0.662783 0.382846 0.080 Uiso 1 1 calc R U . . .
C106 C 0.0775(6) 0.6903(6) 0.3887(7) 0.072(6) Uani 1 1 d . U . . .
H106 H 0.089637 0.714519 0.399606 0.087 Uiso 1 1 calc R U . . .
C107 C 0.0327(6) 0.6878(6) 0.3816(7) 0.071(6) Uani 1 1 d . U . . .
H107 H 0.014720 0.710847 0.387113 0.086 Uiso 1 1 calc R U . . .
C108 C 0.0125(6) 0.6533(6) 0.3667(7) 0.072(6) Uani 1 1 d . U . . .
H108 H -0.018445 0.651984 0.361663 0.086 Uiso 1 1 calc R U . . .
C109 C 0.0417(6) 0.6194(5) 0.3592(6) 0.063(5) Uani 1 1 d . U . . .
H109 H 0.030726 0.594943 0.347888 0.075 Uiso 1 1 calc R U . . .
C110 C 0.1133(5) 0.5552(5) 0.3127(6) 0.050(4) Uani 1 1 d . U . . .
H11A H 0.127782 0.528228 0.312786 0.060 Uiso 1 1 calc R U . . .
H11B H 0.080947 0.550411 0.310759 0.060 Uiso 1 1 calc R U . . .
C111 C 0.1283(5) 0.5780(5) 0.2727(6) 0.049(4) Uani 1 1 d . U . . .
C112 C 0.1784(5) 0.5781(5) 0.2700(6) 0.052(5) Uani 1 1 d . U . . .
H11C H 0.189326 0.550020 0.270894 0.078 Uiso 1 1 calc R U . . .
H11D H 0.187615 0.590807 0.244924 0.078 Uiso 1 1 calc R U . . .
H11E H 0.190722 0.593339 0.292564 0.078 Uiso 1 1 calc R U . . .
S7 S 0.24009(14) -0.03388(14) 0.15338(15) 0.0515(12) Uani 1 1 d D U . . .
C113 C 0.2412(5) -0.0799(4) 0.1209(4) 0.050(4) Uani 1 1 d D U . . .
C116 C 0.2407(9) -0.1159(5) 0.1489(6) 0.115(9) Uani 1 1 d D U . . .
H11F H 0.215045 -0.113923 0.166741 0.173 Uiso 1 1 calc R U . . .
H11G H 0.238765 -0.141080 0.133341 0.173 Uiso 1 1 calc R U . . .
H11H H 0.268041 -0.116091 0.164745 0.173 Uiso 1 1 calc R U . . .
C117 C 0.1978(6) -0.0768(6) 0.0979(6) 0.088(7) Uani 1 1 d D U . . .
H11I H 0.172986 -0.074846 0.116731 0.132 Uiso 1 1 calc R U . . .
H11J H 0.198351 -0.052446 0.080984 0.132 Uiso 1 1 calc R U . . .
H11K H 0.194024 -0.100909 0.081108 0.132 Uiso 1 1 calc R U . . .
C114 C 0.2805(6) -0.0830(5) 0.0935(5) 0.077(5) Uani 1 1 d D U . . .
H114 H 0.307114 -0.076256 0.110066 0.092 Uiso 1 1 calc R U . . .
N7 N 0.2884(6) -0.1248(5) 0.0768(5) 0.092(6) Uani 1 1 d D U . . .
H7A H 0.312578 -0.124308 0.060546 0.137 Uiso 1 1 calc R U . . .
H7B H 0.293077 -0.142576 0.097133 0.137 Uiso 1 1 calc R U . . .
H7C H 0.264196 -0.132766 0.062486 0.137 Uiso 1 1 calc R U . . .
C115 C 0.2808(7) -0.0529(6) 0.0577(6) 0.085(6) Uani 1 1 d D U . . .
O13 O 0.3001(5) -0.0198(4) 0.0627(4) 0.084(4) Uani 1 1 d D U . . .
O14 O 0.2637(7) -0.0665(5) 0.0258(5) 0.129(7) Uani 1 1 d D U . . .
S8 S 0.24369(15) 0.05220(16) 0.36234(15) 0.0566(13) Uani 1 1 d D U . . .
C118 C 0.2483(5) 0.0510(5) 0.4181(4) 0.060(5) Uani 1 1 d D U . . .
C121 C 0.2043(5) 0.0315(6) 0.4317(6) 0.077(6) Uani 1 1 d D U . . .
H12A H 0.179288 0.047149 0.421092 0.116 Uiso 1 1 calc R U . . .
H12B H 0.202641 0.003486 0.421820 0.116 Uiso 1 1 calc R U . . .
H12C H 0.202891 0.031349 0.460983 0.116 Uiso 1 1 calc R U . . .
C122 C 0.2506(7) 0.0950(5) 0.4311(6) 0.076(6) Uani 1 1 d D U . . .
H12D H 0.224422 0.109566 0.421268 0.115 Uiso 1 1 calc R U . . .
H12E H 0.251537 0.096474 0.460287 0.115 Uiso 1 1 calc R U . . .
H12F H 0.277455 0.107573 0.420032 0.115 Uiso 1 1 calc R U . . .
C119 C 0.2887(6) 0.0286(5) 0.4332(5) 0.075(5) Uani 1 1 d D U . . .
H119 H 0.315421 0.040931 0.420303 0.090 Uiso 1 1 calc R U . . .
N8 N 0.2936(6) 0.0335(5) 0.4781(4) 0.094(6) Uani 1 1 d D U . . .
H8A H 0.318094 0.019871 0.486505 0.141 Uiso 1 1 calc R U . . .
H8B H 0.296447 0.060367 0.484145 0.141 Uiso 1 1 calc R U . . .
H8C H 0.269133 0.023331 0.490462 0.141 Uiso 1 1 calc R U . . .
C120 C 0.2896(6) -0.0179(5) 0.4251(5) 0.074(5) Uani 1 1 d D U . . .
O15 O 0.3131(4) -0.0297(4) 0.3958(4) 0.064(3) Uani 1 1 d D U . . .
O16 O 0.2683(5) -0.0419(4) 0.4485(4) 0.085(4) Uani 1 1 d D U . . .
S9 S 0.24073(14) 0.19299(14) 0.18018(17) 0.0586(14) Uani 1 1 d D U . . .
C123 C 0.2399(5) 0.2462(4) 0.1597(5) 0.070(5) Uani 1 1 d D U . . .
C126 C 0.1988(5) 0.2665(5) 0.1775(7) 0.080(7) Uani 1 1 d D U . . .
H12G H 0.172298 0.251219 0.169797 0.120 Uiso 1 1 calc R U . . .
H12H H 0.201354 0.266866 0.206720 0.120 Uiso 1 1 calc R U . . .
H12I H 0.196545 0.294418 0.167584 0.120 Uiso 1 1 calc R U . . .
C127 C 0.2833(5) 0.2671(5) 0.1695(7) 0.081(7) Uani 1 1 d D U . . .
H12J H 0.286514 0.269216 0.198572 0.122 Uiso 1 1 calc R U . . .
H12K H 0.308007 0.251158 0.158641 0.122 Uiso 1 1 calc R U . . .
H12L H 0.283581 0.294321 0.157732 0.122 Uiso 1 1 calc R U . . .
C124 C 0.2356(6) 0.2432(5) 0.1146(5) 0.080(5) Uani 1 1 d D U . . .
H124 H 0.264022 0.232300 0.103595 0.096 Uiso 1 1 calc R U . . .
N9 N 0.1983(5) 0.2148(5) 0.1025(6) 0.085(6) Uani 1 1 d D U . . .
H9D H 0.196632 0.213652 0.075369 0.127 Uiso 1 1 calc R U . . .
H9E H 0.203801 0.189496 0.112298 0.127 Uiso 1 1 calc R U . . .
H9F H 0.172189 0.224144 0.112500 0.127 Uiso 1 1 calc R U . . .
C125 C 0.2251(7) 0.2842(6) 0.0933(8) 0.111(8) Uani 1 1 d D U . . .
O17 O 0.2555(6) 0.3081(5) 0.0895(6) 0.129(7) Uani 1 1 d D U . . .
O18 O 0.1837(6) 0.2892(6) 0.0854(8) 0.159(9) Uani 1 1 d D U . . .
C128 C 0.4138(5) 0.0039(6) 0.1491(6) 0.053(4) Uani 1 1 d . U . . .
C129 C 0.3930(6) 0.0046(6) 0.1091(6) 0.058(5) Uani 1 1 d . U . . .
H129 H 0.362006 0.000206 0.106590 0.070 Uiso 1 1 calc R U . . .
C130 C 0.4173(6) 0.0114(6) 0.0764(6) 0.062(5) Uani 1 1 d . U . . .
H130 H 0.402942 0.011283 0.051190 0.075 Uiso 1 1 calc R U . . .
C131 C 0.4625(6) 0.0187(6) 0.0777(6) 0.059(5) Uani 1 1 d . U . . .
H131 H 0.479318 0.021615 0.053920 0.071 Uiso 1 1 calc R U . . .
C132 C 0.4825(6) 0.0215(5) 0.1150(6) 0.055(5) Uani 1 1 d . U . . .
H132 H 0.513142 0.028163 0.116743 0.066 Uiso 1 1 calc R U . . .
C133 C 0.4588(5) 0.0147(5) 0.1492(6) 0.052(5) Uani 1 1 d . U . . .
H133 H 0.473467 0.017401 0.174151 0.062 Uiso 1 1 calc R U . . .
C134 C 0.4131(3) -0.0515(3) 0.2090(4) 0.050(4) Uani 1 1 d G U . . .
C135 C 0.4121(4) -0.0855(4) 0.1844(3) 0.068(5) Uani 1 1 d G U . . .
H135 H 0.395759 -0.084814 0.160097 0.082 Uiso 1 1 calc R U . . .
C136 C 0.4349(4) -0.1205(3) 0.1952(4) 0.077(6) Uani 1 1 d G U . . .
H136 H 0.434231 -0.143703 0.178371 0.092 Uiso 1 1 calc R U . . .
C137 C 0.4588(4) -0.1215(3) 0.2307(4) 0.063(5) Uani 1 1 d G U . . .
H137 H 0.474394 -0.145413 0.238145 0.075 Uiso 1 1 calc R U . . .
C138 C 0.4598(4) -0.0875(4) 0.2554(3) 0.066(5) Uani 1 1 d G U . . .
H138 H 0.476087 -0.088233 0.279644 0.079 Uiso 1 1 calc R U . . .
C139 C 0.4369(4) -0.0526(3) 0.2445(4) 0.051(4) Uani 1 1 d G U . . .
H139 H 0.437615 -0.029343 0.261370 0.062 Uiso 1 1 calc R U . . .
C140 C 0.3947(5) 0.0311(5) 0.2312(5) 0.040(4) Uani 1 1 d . U . . .
H14D H 0.384540 0.019842 0.256993 0.048 Uiso 1 1 calc R U . . .
H14E H 0.427381 0.033708 0.232974 0.048 Uiso 1 1 calc R U . . .
C141 C 0.4194(5) 0.0370(6) 0.3291(6) 0.054(4) Uani 1 1 d . U . . .
C142 C 0.4643(5) 0.0374(6) 0.3189(6) 0.053(5) Uani 1 1 d . U . . .
H142 H 0.477031 0.060214 0.305815 0.064 Uiso 1 1 calc R U . . .
C143 C 0.4897(6) 0.0041(5) 0.3283(6) 0.058(5) Uani 1 1 d . U . . .
H143 H 0.520348 0.003688 0.321874 0.069 Uiso 1 1 calc R U . . .
C144 C 0.4701(6) -0.0295(6) 0.3474(6) 0.059(5) Uani 1 1 d . U . . .
H144 H 0.487843 -0.052735 0.352893 0.071 Uiso 1 1 calc R U . . .
C145 C 0.4273(6) -0.0297(6) 0.3581(6) 0.058(5) Uani 1 1 d . U . . .
H145 H 0.415285 -0.051820 0.372852 0.070 Uiso 1 1 calc R U . . .
C146 C 0.4002(6) 0.0038(6) 0.3470(6) 0.056(5) Uani 1 1 d . U . . .
H146 H 0.369178 0.003192 0.351923 0.067 Uiso 1 1 calc R U . . .
C147 C 0.4110(4) 0.1214(4) 0.3461(4) 0.066(5) Uani 1 1 d G U . . .
C148 C 0.4103(5) 0.1150(4) 0.3872(4) 0.090(7) Uani 1 1 d G U . . .
H148 H 0.396306 0.091490 0.397769 0.108 Uiso 1 1 calc R U . . .
C149 C 0.4299(5) 0.1430(5) 0.4127(3) 0.116(9) Uani 1 1 d G U . . .
H149 H 0.429404 0.138696 0.440695 0.139 Uiso 1 1 calc R U . . .
C150 C 0.4504(5) 0.1775(4) 0.3971(4) 0.096(7) Uani 1 1 d G U . . .
H150 H 0.463797 0.196624 0.414558 0.116 Uiso 1 1 calc R U . . .
C151 C 0.4511(4) 0.1838(3) 0.3561(4) 0.079(6) Uani 1 1 d G U . . .
H151 H 0.465091 0.207346 0.345493 0.094 Uiso 1 1 calc R U . . .
C152 C 0.4315(4) 0.1558(4) 0.3306(3) 0.068(5) Uani 1 1 d G U . . .
H152 H 0.431994 0.160141 0.302565 0.082 Uiso 1 1 calc R U . . .
C153 C 0.3951(5) 0.0988(5) 0.2655(5) 0.045(4) Uani 1 1 d . U . . .
H15D H 0.383749 0.126955 0.263108 0.054 Uiso 1 1 calc R U . . .
H15E H 0.427691 0.100243 0.262439 0.054 Uiso 1 1 calc R U . . .
C154 C 0.4124(5) 0.1539(6) 0.1303(6) 0.054(4) Uani 1 1 d . U . . .
C155 C 0.4108(8) 0.1896(7) 0.1138(8) 0.096(7) Uani 1 1 d . U . . .
H155 H 0.394894 0.210667 0.126986 0.115 Uiso 1 1 calc R U . . .
C156 C 0.4318(8) 0.1984(7) 0.0770(8) 0.093(7) Uani 1 1 d . U . . .
H156 H 0.428782 0.224256 0.064759 0.111 Uiso 1 1 calc R U . . .
C157 C 0.4553(6) 0.1700(7) 0.0606(7) 0.071(6) Uani 1 1 d . U . . .
H157 H 0.471465 0.176180 0.037042 0.085 Uiso 1 1 calc R U . . .
C158 C 0.4580(6) 0.1302(6) 0.0764(6) 0.065(5) Uani 1 1 d . U . . .
H158 H 0.473775 0.109189 0.063034 0.078 Uiso 1 1 calc R U . . .
C159 C 0.4361(6) 0.1232(7) 0.1132(6) 0.064(5) Uani 1 1 d . U . . .
H159 H 0.437814 0.097362 0.125849 0.077 Uiso 1 1 calc R U . . .
C160 C 0.4170(5) 0.1805(5) 0.2127(6) 0.049(4) Uani 1 1 d . U . . .
C161 C 0.4634(5) 0.1724(5) 0.2169(6) 0.053(5) Uani 1 1 d . U . . .
H161 H 0.476800 0.149816 0.204042 0.064 Uiso 1 1 calc R U . . .
C162 C 0.4881(6) 0.1986(5) 0.2405(6) 0.059(5) Uani 1 1 d . U . . .
H162 H 0.519011 0.193909 0.243895 0.071 Uiso 1 1 calc R U . . .
C163 C 0.4688(5) 0.2310(5) 0.2588(7) 0.065(6) Uani 1 1 d . U . . .
H163 H 0.486122 0.249116 0.274388 0.078 Uiso 1 1 calc R U . . .
C164 C 0.4240(6) 0.2373(6) 0.2546(6) 0.065(6) Uani 1 1 d . U . . .
H164 H 0.410747 0.259820 0.267780 0.078 Uiso 1 1 calc R U . . .
C165 C 0.3983(6) 0.2126(5) 0.2323(6) 0.060(5) Uani 1 1 d . U . . .
H165 H 0.367309 0.217566 0.230156 0.072 Uiso 1 1 calc R U . . .
C166 C 0.3952(5) 0.0941(5) 0.1908(5) 0.043(4) Uani 1 1 d . U . . .
H16A H 0.384526 0.078151 0.167673 0.052 Uiso 1 1 calc R U . . .
H16B H 0.427822 0.090440 0.191856 0.052 Uiso 1 1 calc R U . . .
C167 C 0.3763(5) 0.0738(5) 0.2283(5) 0.039(4) Uani 1 1 d . U . . .
C168 C 0.3257(4) 0.0746(5) 0.2285(5) 0.043(4) Uani 1 1 d . U . . .
H16C H 0.315341 0.102814 0.226551 0.065 Uiso 1 1 calc R U . . .
H16D H 0.314430 0.059108 0.205622 0.065 Uiso 1 1 calc R U . . .
H16E H 0.314679 0.062519 0.253291 0.065 Uiso 1 1 calc R U . . .
S10 S 0.29653(13) 0.09040(16) 0.10717(15) 0.0525(13) Uani 1 1 d D U . . .
C169 C 0.2997(5) 0.1088(4) 0.0545(4) 0.049(4) Uani 1 1 d D U . . .
C172 C 0.3490(5) 0.1082(7) 0.0429(6) 0.090(7) Uani 1 1 d D U . . .
H17A H 0.366210 0.123070 0.062984 0.136 Uiso 1 1 calc R U . . .
H17B H 0.359361 0.080008 0.041662 0.136 Uiso 1 1 calc R U . . .
H17C H 0.352767 0.121089 0.016795 0.136 Uiso 1 1 calc R U . . .
C173 C 0.2843(8) 0.1533(5) 0.0555(6) 0.097(8) Uani 1 1 d D U . . .
H17D H 0.301737 0.168361 0.075230 0.145 Uiso 1 1 calc R U . . .
H17E H 0.288416 0.165506 0.029057 0.145 Uiso 1 1 calc R U . . .
H17F H 0.252805 0.154376 0.062773 0.145 Uiso 1 1 calc R U . . .
C170 C 0.2726(5) 0.0861(5) 0.0241(5) 0.060(4) Uani 1 1 d D U . . .
H170 H 0.270398 0.104023 0.000066 0.072 Uiso 1 1 calc R U . . .
N10 N 0.2943(5) 0.0475(4) 0.0107(5) 0.067(4) Uani 1 1 d D U . . .
H10D H 0.276765 0.034935 -0.007631 0.100 Uiso 1 1 calc R U . . .
H10E H 0.321101 0.053324 -0.000551 0.100 Uiso 1 1 calc R U . . .
H10F H 0.298375 0.030851 0.032051 0.100 Uiso 1 1 calc R U . . .
C171 C 0.2249(5) 0.0743(6) 0.0356(7) 0.083(6) Uani 1 1 d D U . . .
O19 O 0.2161(4) 0.0375(5) 0.0422(5) 0.093(5) Uani 1 1 d D U . . .
O20 O 0.1959(5) 0.1037(5) 0.0362(5) 0.111(6) Uani 1 1 d D U . . .
S11 S 0.30505(14) -0.04848(14) 0.27964(14) 0.0471(12) Uani 1 1 d D U . . .
C174 C 0.3050(5) -0.1050(4) 0.2880(4) 0.052(4) Uani 1 1 d D U . . .
C177 C 0.2833(6) -0.1249(5) 0.2518(5) 0.066(5) Uani 1 1 d D U . . .
H17G H 0.298082 -0.115549 0.227442 0.099 Uiso 1 1 calc R U . . .
H17H H 0.286112 -0.154500 0.253941 0.099 Uiso 1 1 calc R U . . .
H17I H 0.251868 -0.117469 0.250895 0.099 Uiso 1 1 calc R U . . .
C178 C 0.3538(5) -0.1175(5) 0.2869(6) 0.069(6) Uani 1 1 d D U . . .
H17J H 0.366855 -0.109296 0.261394 0.103 Uiso 1 1 calc R U . . .
H17K H 0.369698 -0.104217 0.308851 0.103 Uiso 1 1 calc R U . . .
H17L H 0.356087 -0.147070 0.289881 0.103 Uiso 1 1 calc R U . . .
C175 C 0.2850(4) -0.1173(5) 0.3264(4) 0.050(4) Uani 1 1 d D U . . .
H175 H 0.284454 -0.147658 0.325930 0.060 Uiso 1 1 calc R U . . .
N11 N 0.3124(5) -0.1061(4) 0.3623(4) 0.064(4) Uani 1 1 d D U . . .
H11L H 0.298364 -0.114446 0.384857 0.096 Uiso 1 1 calc R U . . .
H11M H 0.339411 -0.118426 0.360588 0.096 Uiso 1 1 calc R U . . .
H11N H 0.316181 -0.078678 0.363034 0.096 Uiso 1 1 calc R U . . .
C176 C 0.2367(5) -0.1042(5) 0.3356(5) 0.061(5) Uani 1 1 d D U . . .
O21 O 0.2314(4) -0.0757(4) 0.3599(3) 0.059(3) Uani 1 1 d D U . . .
O22 O 0.2058(4) -0.1231(4) 0.3164(4) 0.069(4) Uani 1 1 d D U . . .
S12 S 0.30636(16) 0.17393(16) 0.30743(18) 0.0707(16) Uani 1 1 d D U . . .
C179 C 0.3012(5) 0.2148(4) 0.3467(5) 0.067(5) Uani 1 1 d D U . . .
C182 C 0.3083(8) 0.1931(6) 0.3863(6) 0.108(8) Uani 1 1 d D U . . .
H18A H 0.284430 0.173421 0.390558 0.161 Uiso 1 1 calc R U . . .
H18B H 0.336918 0.178932 0.385801 0.161 Uiso 1 1 calc R U . . .
H18C H 0.308275 0.213069 0.408016 0.161 Uiso 1 1 calc R U . . .
C183 C 0.3368(6) 0.2453(6) 0.3386(7) 0.091(7) Uani 1 1 d D U . . .
H18D H 0.365734 0.231709 0.338222 0.136 Uiso 1 1 calc R U . . .
H18E H 0.331479 0.258183 0.312606 0.136 Uiso 1 1 calc R U . . .
H18F H 0.336590 0.266086 0.359533 0.136 Uiso 1 1 calc R U . . .
C180 C 0.2560(6) 0.2346(5) 0.3474(5) 0.081(5) Uani 1 1 d D U . . .
H180 H 0.234300 0.212756 0.340390 0.098 Uiso 1 1 calc R U . . .
N12 N 0.2419(6) 0.2503(6) 0.3869(5) 0.100(6) Uani 1 1 d D U . . .
H12M H 0.214480 0.261657 0.384775 0.150 Uiso 1 1 calc R U . . .
H12N H 0.240933 0.229425 0.404744 0.150 Uiso 1 1 calc R U . . .
H12O H 0.261598 0.269314 0.395453 0.150 Uiso 1 1 calc R U . . .
C181 C 0.2488(8) 0.2691(5) 0.3160(6) 0.085(6) Uani 1 1 d D U . . .
O23 O 0.2500(5) 0.2615(4) 0.2794(5) 0.088(5) Uani 1 1 d D U . . .
O24 O 0.2467(6) 0.3055(4) 0.3308(5) 0.101(5) Uani 1 1 d D U . . .
C184 C 0.1180(5) 0.0613(5) 0.1313(6) 0.049(4) Uani 1 1 d . U . . .
C185 C 0.0716(6) 0.0627(6) 0.1415(6) 0.062(5) Uani 1 1 d . U . . .
H185 H 0.058934 0.083230 0.157869 0.074 Uiso 1 1 calc R U . . .
C186 C 0.0460(6) 0.0292(6) 0.1243(7) 0.066(5) Uani 1 1 d . U . . .
H186 H 0.015136 0.027958 0.130020 0.079 Uiso 1 1 calc R U . . .
C187 C 0.0630(6) 0.0006(6) 0.1013(7) 0.063(5) Uani 1 1 d . U . . .
H187 H 0.044669 -0.020812 0.091907 0.076 Uiso 1 1 calc R U . . .
C188 C 0.1059(6) 0.0017(6) 0.0913(6) 0.061(5) Uani 1 1 d . U . . .
H188 H 0.117724 -0.018874 0.074479 0.074 Uiso 1 1 calc R U . . .
C189 C 0.1345(5) 0.0337(5) 0.1056(6) 0.052(5) Uani 1 1 d . U . . .
H189 H 0.164517 0.035219 0.097118 0.062 Uiso 1 1 calc R U . . .
C190 C 0.1250(5) 0.1466(5) 0.1352(6) 0.052(4) Uani 1 1 d . U . . .
C191 C 0.1102(5) 0.1794(5) 0.1606(6) 0.050(4) Uani 1 1 d . U . . .
H191 H 0.114412 0.177662 0.188634 0.060 Uiso 1 1 calc R U . . .
C192 C 0.0907(5) 0.2125(6) 0.1449(7) 0.063(5) Uani 1 1 d . U . . .
H192 H 0.081155 0.233514 0.162276 0.076 Uiso 1 1 calc R U . . .
C193 C 0.0841(7) 0.2169(6) 0.1047(8) 0.071(6) Uani 1 1 d . U . . .
H193 H 0.070767 0.241101 0.094902 0.085 Uiso 1 1 calc R U . . .
C194 C 0.0961(6) 0.1877(6) 0.0787(7) 0.070(5) Uani 1 1 d . U . . .
H194 H 0.090994 0.190589 0.050879 0.084 Uiso 1 1 calc R U . . .
C195 C 0.1176(6) 0.1507(5) 0.0954(7) 0.057(5) Uani 1 1 d . U . . .
H195 H 0.126367 0.129471 0.077784 0.069 Uiso 1 1 calc R U . . .
C196 C 0.1454(5) 0.1034(5) 0.2064(5) 0.044(4) Uani 1 1 d . U . . .
H19A H 0.158100 0.129510 0.215732 0.053 Uiso 1 1 calc R U . . .
H19B H 0.113176 0.104426 0.211857 0.053 Uiso 1 1 calc R U . . .
C197 C 0.1368(6) -0.0603(5) 0.2185(6) 0.050(4) Uani 1 1 d . U . . .
C198 C 0.1431(7) -0.0987(5) 0.2334(7) 0.074(6) Uani 1 1 d . U . . .
H198 H 0.160463 -0.102794 0.256732 0.089 Uiso 1 1 calc R U . . .
C199 C 0.1240(8) -0.1311(6) 0.2142(7) 0.081(6) Uani 1 1 d . U . . .
H199 H 0.126435 -0.157565 0.225201 0.097 Uiso 1 1 calc R U . . .
C200 C 0.1013(7) -0.1253(6) 0.1788(7) 0.074(6) Uani 1 1 d . U . . .
H200 H 0.089541 -0.147967 0.164732 0.088 Uiso 1 1 calc R U . . .
C201 C 0.0958(6) -0.0863(6) 0.1637(6) 0.062(5) Uani 1 1 d . U . . .
H201 H 0.080526 -0.082641 0.139171 0.074 Uiso 1 1 calc R U . . .
C202 C 0.1115(5) -0.0539(5) 0.1832(6) 0.047(4) Uani 1 1 d . U . . .
H202 H 0.105908 -0.027159 0.173663 0.056 Uiso 1 1 calc R U . . .
C203 C 0.1257(5) -0.0174(5) 0.2938(6) 0.046(4) Uani 1 1 d . U . . .
C204 C 0.0797(6) -0.0131(6) 0.2897(6) 0.060(5) Uani 1 1 d . U . . .
H204 H 0.067079 -0.009057 0.263994 0.072 Uiso 1 1 calc R U . . .
C205 C 0.0533(6) -0.0147(7) 0.3224(6) 0.069(6) Uani 1 1 d . U . . .
H205 H 0.022087 -0.012502 0.319065 0.083 Uiso 1 1 calc R U . . .
C206 C 0.0703(6) -0.0193(6) 0.3602(6) 0.061(5) Uani 1 1 d . U . . .
H206 H 0.051782 -0.019731 0.383131 0.073 Uiso 1 1 calc R U . . .
C207 C 0.1156(6) -0.0232(6) 0.3631(6) 0.064(5) Uani 1 1 d . U . . .
H207 H 0.128412 -0.026204 0.388816 0.077 Uiso 1 1 calc R U . . .
C208 C 0.1433(6) -0.0231(5) 0.3304(5) 0.053(4) Uani 1 1 d . U . . .
H208 H 0.174359 -0.026933 0.333586 0.063 Uiso 1 1 calc R U . . .
C209 C 0.1473(5) 0.0265(4) 0.2201(5) 0.038(4) Uani 1 1 d . U . . .
H20A H 0.157287 0.021805 0.192341 0.045 Uiso 1 1 calc R U . . .
H20B H 0.114538 0.028796 0.219312 0.045 Uiso 1 1 calc R U . . .
C210 C 0.1382(7) 0.1175(6) 0.3495(6) 0.069(5) Uani 1 1 d . U . . .
C211 C 0.1445(9) 0.1496(8) 0.3764(8) 0.113(9) Uani 1 1 d . U . . .
H211 H 0.163328 0.171716 0.369788 0.136 Uiso 1 1 calc R U . . .
C212 C 0.1223(9) 0.1484(9) 0.4139(8) 0.115(9) Uani 1 1 d . U . . .
H212 H 0.124662 0.170556 0.431955 0.138 Uiso 1 1 calc R U . . .
C213 C 0.0980(7) 0.1157(7) 0.4235(8) 0.088(7) Uani 1 1 d . U . . .
H213 H 0.083530 0.114976 0.448682 0.106 Uiso 1 1 calc R U . . .
C214 C 0.0935(7) 0.0839(7) 0.3989(7) 0.073(6) Uani 1 1 d . U . . .
H214 H 0.077547 0.060693 0.407637 0.087 Uiso 1 1 calc R U . . .
C215 C 0.1117(7) 0.0843(6) 0.3605(7) 0.070(6) Uani 1 1 d . U . . .
H215 H 0.106336 0.062593 0.342397 0.084 Uiso 1 1 calc R U . . .
C216 C 0.1314(6) 0.1658(5) 0.2826(6) 0.057(5) Uani 1 1 d . U . . .
C217 C 0.0858(6) 0.1609(6) 0.2760(6) 0.063(5) Uani 1 1 d . U . . .
H217 H 0.071459 0.135567 0.280047 0.076 Uiso 1 1 calc R U . . .
C218 C 0.0627(6) 0.1946(6) 0.2633(7) 0.071(6) Uani 1 1 d . U . . .
H218 H 0.031626 0.191842 0.259279 0.086 Uiso 1 1 calc R U . . .
C219 C 0.0809(6) 0.2314(6) 0.2562(6) 0.060(5) Uani 1 1 d . U . . .
H219 H 0.063367 0.253229 0.246466 0.072 Uiso 1 1 calc R U . . .
C220 C 0.1239(6) 0.2363(5) 0.2631(6) 0.057(5) Uani 1 1 d . U . . .
H220 H 0.137397 0.262196 0.259731 0.069 Uiso 1 1 calc R U . . .
C221 C 0.1486(6) 0.2032(5) 0.2752(6) 0.060(5) Uani 1 1 d . U . . .
H221 H 0.179661 0.206837 0.278541 0.072 Uiso 1 1 calc R U . . .
C222 C 0.1515(5) 0.0756(5) 0.2773(5) 0.046(4) Uani 1 1 d . U . . .
H22A H 0.165096 0.053733 0.293488 0.055 Uiso 1 1 calc R U . . .
H22B H 0.118945 0.071576 0.278577 0.055 Uiso 1 1 calc R U . . .
C223 C 0.1658(5) 0.0686(5) 0.2333(5) 0.039(4) Uani 1 1 d . U . . .
C224 C 0.2167(5) 0.0700(5) 0.2311(5) 0.039(4) Uani 1 1 d . U . . .
H22C H 0.226140 0.065607 0.203409 0.059 Uiso 1 1 calc R U . . .
H22D H 0.227135 0.096600 0.240220 0.059 Uiso 1 1 calc R U . . .
H22E H 0.229157 0.048680 0.248125 0.059 Uiso 1 1 calc R U . . .
Ag1 Ag 0.23299(5) 0.44938(5) 0.30289(6) 0.0705(5) Uani 1 1 d . U . . .
Ag2 Ag 0.23089(6) 0.62025(6) 0.15252(7) 0.0982(7) Uani 1 1 d . U . . .
Ag3 Ag 0.23336(5) 0.67141(4) 0.36651(5) 0.0585(4) Uani 1 1 d . U . . .
Ag4 Ag 0.26588(5) 0.02220(5) 0.11271(5) 0.0626(4) Uani 1 1 d . U . . .
Ag5 Ag 0.27158(5) -0.01180(4) 0.33627(4) 0.0537(4) Uani 1 1 d . U . . .
Ag6 Ag 0.26878(5) 0.20067(5) 0.24807(5) 0.0659(5) Uani 1 1 d . U . . .
Au1 Au 0.27654(2) 0.50866(2) 0.35532(3) 0.0619(2) Uani 1 1 d . U . . .
Au2 Au 0.27214(2) 0.68514(2) 0.28976(2) 0.0525(2) Uani 1 1 d . U . . .
Au3 Au 0.27140(3) 0.54266(3) 0.17705(3) 0.0737(3) Uani 1 1 d . U . . .
Au4 Au 0.18934(2) 0.47750(2) 0.23162(3) 0.0610(2) Uani 1 1 d . U . . .
Au5 Au 0.18523(3) 0.66880(3) 0.20993(3) 0.0743(3) Uani 1 1 d . U . . .
Au6 Au 0.19540(2) 0.59205(2) 0.37714(3) 0.0533(2) Uani 1 1 d . U . . .
Au7 Au 0.31109(2) -0.02159(2) 0.17774(2) 0.04686(18) Uani 1 1 d . U . . .
Au8 Au 0.31275(2) 0.07074(2) 0.33717(2) 0.05083(19) Uani 1 1 d . U . . .
Au9 Au 0.31311(2) 0.16787(2) 0.17672(2) 0.0515(2) Uani 1 1 d . U . . .
Au10 Au 0.22390(2) 0.09863(2) 0.12988(2) 0.04589(18) Uani 1 1 d . U . . .
Au11 Au 0.23254(2) -0.03221(2) 0.26143(2) 0.04280(17) Uani 1 1 d . U . . .
Au12 Au 0.23663(2) 0.14224(2) 0.30670(3) 0.0564(2) Uani 1 1 d . U . . .
P1 P 0.34842(16) 0.52878(15) 0.34562(18) 0.0603(15) Uani 1 1 d . U . . .
P2 P 0.34428(15) 0.66863(15) 0.27853(16) 0.0520(14) Uani 1 1 d . U . . .
P3 P 0.34414(16) 0.54016(16) 0.19489(18) 0.0574(15) Uani 1 1 d . U . . .
P4 P 0.11781(15) 0.49949(16) 0.23099(19) 0.0609(15) Uani 1 1 d . U . . .
P5 P 0.11457(17) 0.65466(16) 0.22927(19) 0.0634(16) Uani 1 1 d . U . . .
P6 P 0.12374(14) 0.57825(15) 0.36069(16) 0.0499(13) Uani 1 1 d . U . . .
P7 P 0.38324(14) -0.00731(14) 0.19316(15) 0.0432(12) Uani 1 1 d . U . . .
P8 P 0.38364(15) 0.08171(15) 0.31782(16) 0.0495(13) Uani 1 1 d . U . . .
P9 P 0.38501(14) 0.14797(15) 0.17921(16) 0.0490(13) Uani 1 1 d . U . . .
P10 P 0.15259(14) 0.10139(15) 0.15201(15) 0.0466(13) Uani 1 1 d . U . . .
P11 P 0.16035(14) -0.01828(14) 0.24811(14) 0.0425(12) Uani 1 1 d . U . . .
P12 P 0.16397(16) 0.12451(15) 0.30248(16) 0.0517(14) Uani 1 1 d . U . . .
N13 N 0.4808(4) 0.5777(6) 0.2736(6) 0.054(4) Uani 1 1 d . U . . .
O25 O 0.4824(4) 0.5849(4) 0.3099(4) 0.064(4) Uani 1 1 d . U . . .
O26 O 0.4861(5) 0.5423(5) 0.2609(5) 0.096(5) Uani 1 1 d . U . . .
O27 O 0.4737(5) 0.6051(5) 0.2499(5) 0.088(5) Uani 1 1 d . U . . .
N14 N -0.0210(5) 0.5822(5) 0.2728(5) 0.085(5) Uani 1 1 d D U . . .
O28 O -0.0464(6) 0.5654(5) 0.2500(6) 0.127(7) Uani 1 1 d D U . . .
O29 O 0.0133(5) 0.5659(5) 0.2852(6) 0.140(7) Uani 1 1 d D U . . .
O30 O -0.0272(5) 0.6187(4) 0.2841(5) 0.113(6) Uani 1 1 d D U . . .
N15 N 0.3908(7) 0.3241(8) 0.2299(7) 0.214(13) Uani 1 1 d D U . . .
O31 O 0.4305(7) 0.3338(8) 0.2418(8) 0.214(11) Uani 1 1 d D U . . .
O32 O 0.3841(8) 0.3147(9) 0.1924(7) 0.224(11) Uani 1 1 d D U . . .
O33 O 0.3582(6) 0.3218(7) 0.2549(6) 0.167(8) Uani 1 1 d D U . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0018 0.0011 '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'
Ag Ag -1.3254 0.8130 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -0.8552 6.7200 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0038 0.0023 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0071 0.0042 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.0761 0.0670 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.0938 0.0881 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 S1 Au1 108.4(5) . . ?
C1 S1 Ag1 111.4(6) . . ?
Au1 S1 Ag1 76.33(15) . . ?
C2 C1 C5 110.0(15) . . ?
C2 C1 C4 110.4(14) . . ?
C5 C1 C4 108.2(16) . . ?
C2 C1 S1 115.3(13) . . ?
C5 C1 S1 108.7(13) . . ?
C4 C1 S1 104.0(12) . . ?
C1 C2 N1 113.3(14) . . ?
C1 C2 C3 118.2(15) . . ?
N1 C2 C3 105.3(14) . . ?
O1 C3 O2 125(2) . . ?
O1 C3 C2 115.3(18) . . ?
O2 C3 C2 119.0(17) . . ?
C6 S2 Au2 106.4(5) . . ?
C6 S2 Ag3 111.6(5) . . ?
Au2 S2 Ag3 73.58(14) . . ?
C7 C6 C9 109.3(14) . . ?
C7 C6 C10 109.7(13) . . ?
C9 C6 C10 107.9(14) . . ?
C7 C6 S2 115.8(11) . . ?
C9 C6 S2 104.5(11) . . ?
C10 C6 S2 109.3(11) . . ?
C6 C7 N2 113.6(12) . . ?
C6 C7 C8 116.2(13) . . ?
N2 C7 C8 105.3(12) . . ?
O3 C8 O4 124.4(15) . . ?
O3 C8 C7 117.8(14) . . ?
O4 C8 C7 117.8(13) . . ?
C8 O4 Ag3 109.5(11) . . ?
C11 S3 Au3 105.1(6) . . ?
C11 S3 Ag2 108.5(6) . . ?
Au3 S3 Ag2 76.39(18) . . ?
C12 C11 C15 110.4(17) . . ?
C12 C11 C14 111.0(16) . . ?
C15 C11 C14 110.7(18) . . ?
C12 C11 S3 109.6(13) . . ?
C15 C11 S3 109.5(15) . . ?
C14 C11 S3 105.6(14) . . ?
N3 C12 C11 112.1(17) . . ?
N3 C12 C13 108.5(17) . . ?
C11 C12 C13 118.5(18) . . ?
O5 C13 O6 128(2) . . ?
O5 C13 C12 119(2) . . ?
O6 C13 C12 113(2) . . ?
C13 O5 Ag2 116(2) . . ?
C17 C16 C21 120.0 . . ?
C17 C16 P1 118.8(7) . . ?
C21 C16 P1 120.8(7) . . ?
C16 C17 C18 120.0 . . ?
C17 C18 C19 120.0 . . ?
C18 C19 C20 120.0 . . ?
C21 C20 C19 120.0 . . ?
C20 C21 C16 120.0 . . ?
C23 C22 C27 120.0 . . ?
C23 C22 P1 116.4(10) . . ?
C27 C22 P1 123.6(10) . . ?
C22 C23 C24 120.0 . . ?
C25 C24 C23 120.0 . . ?
C24 C25 C26 120.0 . . ?
C27 C26 C25 120.0 . . ?
C26 C27 C22 120.0 . . ?
C55 C28 P1 118.9(13) . . ?
C30 C29 C34 118.8(17) . . ?
C30 C29 P2 121.4(15) . . ?
C34 C29 P2 119.8(12) . . ?
C29 C30 C31 120.0(18) . . ?
C32 C31 C30 121.8(18) . . ?
C31 C32 C33 119(2) . . ?
C34 C33 C32 118.0(19) . . ?
C33 C34 C29 121.7(17) . . ?
C36 C35 C40 119.1(19) . . ?
C36 C35 P2 117.0(15) . . ?
C40 C35 P2 123.7(15) . . ?
C35 C36 C37 122(2) . . ?
C38 C37 C36 117(2) . . ?
C39 C38 C37 120(2) . . ?
C38 C39 C40 122(2) . . ?
C35 C40 C39 119.2(19) . . ?
C55 C41 P2 122.7(13) . . ?
C47 C42 C43 121(2) . . ?
C47 C42 P3 127.6(18) . . ?
C43 C42 P3 111.8(17) . . ?
C42 C43 C44 116(2) . . ?
C45 C44 C43 119(3) . . ?
C46 C45 C44 124(3) . . ?
C45 C46 C47 120(3) . . ?
C42 C47 C46 121(2) . . ?
C49 C48 C53 120.0 . . ?
C49 C48 P3 119.2(7) . . ?
C53 C48 P3 120.8(7) . . ?
C50 C49 C48 120.0 . . ?
C49 C50 C51 120.0 . . ?
C50 C51 C52 120.0 . . ?
C53 C52 C51 120.0 . . ?
C52 C53 C48 120.0 . . ?
C55 C54 P3 122.1(13) . . ?
C56 C55 C54 112.5(15) . . ?
C56 C55 C41 109.8(15) . . ?
C54 C55 C41 108.2(15) . . ?
C56 C55 C28 110.0(15) . . ?
C54 C55 C28 109.1(15) . . ?
C41 C55 C28 107.1(15) . . ?
C57 S4 Au4 106.0(5) . . ?
C57 S4 Ag1 110.6(5) . . ?
Au4 S4 Ag1 73.35(15) . . ?
C58 C57 C61 111.7(14) . . ?
C58 C57 C60 110.2(13) . . ?
C61 C57 C60 108.8(14) . . ?
C58 C57 S4 114.7(12) . . ?
C61 C57 S4 110.4(12) . . ?
C60 C57 S4 100.4(11) . . ?
N4 C58 C57 112.1(13) . . ?
N4 C58 C59 111.2(14) . . ?
C57 C58 C59 116.1(14) . . ?
O7 C59 O8 125.8(18) . . ?
O7 C59 C58 117.6(16) . . ?
O8 C59 C58 116.6(17) . . ?
C59 O7 Ag1 111.0(14) . . ?
C62 S5 Au5 111.0(8) . . ?
C62 S5 Ag2 109.8(8) . . ?
Au5 S5 Ag2 73.72(19) . . ?
C63 C62 C66 111(2) . . ?
C63 C62 C65 106.8(18) . . ?
C66 C62 C65 106(2) . . ?
C63 C62 S5 118.0(18) . . ?
C66 C62 S5 109.7(16) . . ?
C65 C62 S5 104.8(15) . . ?
C62 C63 N5 113(2) . . ?
C62 C63 C64 122(3) . . ?
N5 C63 C64 112(2) . . ?
O9 C64 O10 120(3) . . ?
O9 C64 C63 121(2) . . ?
O10 C64 C63 119(3) . . ?
C67 S6 Au6 107.2(5) . . ?
C67 S6 Ag3 110.5(5) . . ?
Au6 S6 Ag3 73.68(14) . . ?
C68 C67 C71 109.1(12) . . ?
C68 C67 C70 112.7(13) . . ?
C71 C67 C70 108.2(13) . . ?
C68 C67 S6 114.6(11) . . ?
C71 C67 S6 105.4(11) . . ?
C70 C67 S6 106.4(11) . . ?
C67 C68 N6 114.8(12) . . ?
C67 C68 C69 114.9(13) . . ?
N6 C68 C69 106.8(12) . . ?
O11 C69 O12 124.2(14) . . ?
O11 C69 C68 119.6(15) . . ?
O12 C69 C68 116.3(13) . . ?
C69 O12 Ag3 106.5(11) . . ?
C73 C72 C77 120(2) . . ?
C73 C72 P4 116.7(18) . . ?
C77 C72 P4 123.3(17) . . ?
C72 C73 C74 120(2) . . ?
C75 C74 C73 115(2) . . ?
C76 C75 C74 127(2) . . ?
C75 C76 C77 120(2) . . ?
C76 C77 C72 118(2) . . ?
C83 C78 C79 121.1(17) . . ?
C83 C78 P4 122.7(13) . . ?
C79 C78 P4 116.2(15) . . ?
C78 C79 C80 116.0(18) . . ?
C81 C80 C79 121.2(17) . . ?
C82 C81 C80 118.6(19) . . ?
C81 C82 C83 121(2) . . ?
C78 C83 C82 121.9(17) . . ?
C111 C84 P4 121.5(13) . . ?
C90 C85 C86 124(2) . . ?
C90 C85 P5 121.3(17) . . ?
C86 C85 P5 114.2(18) . . ?
C85 C86 C87 116(2) . . ?
C88 C87 C86 119(2) . . ?
C87 C88 C89 122(3) . . ?
C88 C89 C90 120(3) . . ?
C85 C90 C89 117(2) . . ?
C92 C91 C96 124(2) . . ?
C92 C91 P5 118.0(19) . . ?
C96 C91 P5 117.7(17) . . ?
C91 C92 C93 116(2) . . ?
C94 C93 C92 122(3) . . ?
C93 C94 C95 120(3) . . ?
C94 C95 C96 124(3) . . ?
C91 C96 C95 115(2) . . ?
C111 C97 P5 122.3(13) . . ?
C99 C98 C103 120.0 . . ?
C99 C98 P6 117.1(8) . . ?
C103 C98 P6 122.7(8) . . ?
C98 C99 C100 120.0 . . ?
C101 C100 C99 120.0 . . ?
C100 C101 C102 120.0 . . ?
C103 C102 C101 120.0 . . ?
C102 C103 C98 120.0 . . ?
C105 C104 C109 120.1(17) . . ?
C105 C104 P6 123.4(14) . . ?
C109 C104 P6 116.2(14) . . ?
C104 C105 C106 121.6(19) . . ?
C105 C106 C107 121(2) . . ?
C106 C107 C108 122.9(18) . . ?
C107 C108 C109 115.5(18) . . ?
C108 C109 C104 118.3(17) . . ?
C111 C110 P6 119.9(12) . . ?
C112 C111 C97 114.0(14) . . ?
C112 C111 C84 109.1(15) . . ?
C97 C111 C84 107.2(14) . . ?
C112 C111 C110 109.4(14) . . ?
C97 C111 C110 109.3(14) . . ?
C84 C111 C110 107.6(14) . . ?
C113 S7 Au7 109.3(5) . . ?
C113 S7 Ag4 106.6(5) . . ?
Au7 S7 Ag4 76.67(14) . . ?
C114 C113 C116 109.5(14) . . ?
C114 C113 C117 111.9(14) . . ?
C116 C113 C117 111.1(15) . . ?
C114 C113 S7 115.0(10) . . ?
C116 C113 S7 106.0(11) . . ?
C117 C113 S7 103.0(10) . . ?
C113 C114 N7 114.4(13) . . ?
C113 C114 C115 115.7(14) . . ?
N7 C114 C115 107.1(14) . . ?
O13 C115 O14 127.8(18) . . ?
O13 C115 C114 117.1(16) . . ?
O14 C115 C114 114.9(16) . . ?
C115 O13 Ag4 113.3(14) . . ?
C118 S8 Au8 107.5(5) . . ?
C118 S8 Ag5 108.3(5) . . ?
Au8 S8 Ag5 77.75(14) . . ?
C119 C118 C122 109.4(14) . . ?
C119 C118 C121 113.1(14) . . ?
C122 C118 C121 110.7(13) . . ?
C119 C118 S8 113.9(10) . . ?
C122 C118 S8 105.6(11) . . ?
C121 C118 S8 103.9(11) . . ?
C118 C119 N8 111.0(13) . . ?
C118 C119 C120 115.7(14) . . ?
N8 C119 C120 106.1(14) . . ?
O15 C120 O16 124.1(16) . . ?
O15 C120 C119 116.6(15) . . ?
O16 C120 C119 119.3(15) . . ?
C120 O15 Ag5 105.8(12) . . ?
C123 S9 Au9 108.9(5) . . ?
C123 S9 Ag6 104.4(6) . . ?
Au9 S9 Ag6 76.06(15) . . ?
C127 C123 C124 108.7(14) . . ?
C127 C123 C126 114.7(14) . . ?
C124 C123 C126 110.4(14) . . ?
C127 C123 S9 109.3(11) . . ?
C124 C123 S9 107.6(10) . . ?
C126 C123 S9 106.0(11) . . ?
N9 C124 C123 111.7(14) . . ?
N9 C124 C125 105.2(13) . . ?
C123 C124 C125 114.5(16) . . ?
O17 C125 O18 129.0(19) . . ?
O17 C125 C124 117.1(17) . . ?
O18 C125 C124 113.6(16) . . ?
C133 C128 C129 114.1(16) . . ?
C133 C128 P7 123.5(14) . . ?
C129 C128 P7 122.4(13) . . ?
C130 C129 C128 120.8(16) . . ?
C129 C130 C131 122.9(19) . . ?
C130 C131 C132 117.9(18) . . ?
C133 C132 C131 120.9(17) . . ?
C132 C133 C128 123.0(18) . . ?
C135 C134 C139 120.0 . . ?
C135 C134 P7 117.8(7) . . ?
C139 C134 P7 122.2(7) . . ?
C136 C135 C134 120.0 . . ?
C135 C136 C137 120.0 . . ?
C136 C137 C138 120.0 . . ?
C139 C138 C137 120.0 . . ?
C138 C139 C134 120.0 . . ?
C167 C140 P7 121.9(12) . . ?
C146 C141 C142 121.5(17) . . ?
C146 C141 P8 118.2(13) . . ?
C142 C141 P8 120.2(15) . . ?
C143 C142 C141 118.3(18) . . ?
C142 C143 C144 120.0(17) . . ?
C145 C144 C143 121.9(18) . . ?
C144 C145 C146 118.6(19) . . ?
C141 C146 C145 119.3(17) . . ?
C148 C147 C152 120.0 . . ?
C148 C147 P8 113.6(9) . . ?
C152 C147 P8 126.4(9) . . ?
C149 C148 C147 120.0 . . ?
C150 C149 C148 120.0 . . ?
C149 C150 C151 120.0 . . ?
C152 C151 C150 120.0 . . ?
C151 C152 C147 120.0 . . ?
C167 C153 P8 120.7(11) . . ?
C155 C154 C159 121(2) . . ?
C155 C154 P9 117.1(18) . . ?
C159 C154 P9 121.8(15) . . ?
C154 C155 C156 122(2) . . ?
C157 C156 C155 118(2) . . ?
C156 C157 C158 123(2) . . ?
C157 C158 C159 117(2) . . ?
C154 C159 C158 119(2) . . ?
C165 C160 C161 120.0(16) . . ?
C165 C160 P9 122.1(13) . . ?
C161 C160 P9 117.9(14) . . ?
C162 C161 C160 117.8(17) . . ?
C163 C162 C161 120.8(16) . . ?
C162 C163 C164 119.7(18) . . ?
C165 C164 C163 122.0(19) . . ?
C164 C165 C160 119.7(16) . . ?
C167 C166 P9 122.0(12) . . ?
C140 C167 C168 112.5(13) . . ?
C140 C167 C166 108.6(13) . . ?
C168 C167 C166 111.6(14) . . ?
C140 C167 C153 107.3(13) . . ?
C168 C167 C153 110.1(13) . . ?
C166 C167 C153 106.4(13) . . ?
C169 S10 Au10 108.6(5) . . ?
C169 S10 Ag4 113.0(5) . . ?
Au10 S10 Ag4 74.11(13) . . ?
C170 C169 C172 110.3(13) . . ?
C170 C169 C173 108.8(13) . . ?
C172 C169 C173 108.1(14) . . ?
C170 C169 S10 116.7(10) . . ?
C172 C169 S10 106.5(11) . . ?
C173 C169 S10 105.9(11) . . ?
N10 C170 C169 112.8(12) . . ?
N10 C170 C171 105.7(12) . . ?
C169 C170 C171 117.6(14) . . ?
O19 C171 O20 124.7(17) . . ?
O19 C171 C170 119.0(15) . . ?
O20 C171 C170 116.3(16) . . ?
C174 S11 Au11 105.4(5) . . ?
C174 S11 Ag5 111.7(5) . . ?
Au11 S11 Ag5 72.84(13) . . ?
C175 C174 C177 113.5(12) . . ?
C175 C174 C178 109.9(13) . . ?
C177 C174 C178 106.2(13) . . ?
C175 C174 S11 113.6(10) . . ?
C177 C174 S11 107.9(10) . . ?
C178 C174 S11 105.2(10) . . ?
C174 C175 N11 113.8(11) . . ?
C174 C175 C176 118.8(13) . . ?
N11 C175 C176 106.9(12) . . ?
O21 C176 O22 126.3(14) . . ?
O21 C176 C175 117.2(14) . . ?
O22 C176 C175 116.4(14) . . ?
C176 O21 Ag5 110.8(11) . . ?
C179 S12 Au12 104.5(5) . . ?
C179 S12 Ag6 105.7(6) . . ?
Au12 S12 Ag6 74.77(15) . . ?
C183 C179 C180 111.1(14) . . ?
C183 C179 C182 111.8(16) . . ?
C180 C179 C182 108.4(15) . . ?
C183 C179 S12 107.1(12) . . ?
C180 C179 S12 113.2(11) . . ?
C182 C179 S12 105.2(11) . . ?
N12 C180 C179 115.1(15) . . ?
N12 C180 C181 108.1(13) . . ?
C179 C180 C181 115.2(15) . . ?
O23 C181 O24 124.1(18) . . ?
O23 C181 C180 120.8(16) . . ?
O24 C181 C180 114.7(15) . . ?
C181 O23 Ag6 128.3(12) . . ?
C189 C184 C185 122.1(16) . . ?
C189 C184 P10 121.4(13) . . ?
C185 C184 P10 116.3(14) . . ?
C184 C185 C186 113.3(18) . . ?
C187 C186 C185 124.2(18) . . ?
C186 C187 C188 120.3(19) . . ?
C187 C188 C189 120.9(19) . . ?
C184 C189 C188 119.0(17) . . ?
C195 C190 C191 116.9(17) . . ?
C195 C190 P10 117.8(16) . . ?
C191 C190 P10 125.3(16) . . ?
C192 C191 C190 121(2) . . ?
C191 C192 C193 122(2) . . ?
C194 C193 C192 121(2) . . ?
C193 C194 C195 117(2) . . ?
C190 C195 C194 121(2) . . ?
C223 C196 P10 119.6(12) . . ?
C198 C197 C202 120.9(17) . . ?
C198 C197 P11 116.2(16) . . ?
C202 C197 P11 122.8(13) . . ?
C197 C198 C199 119(2) . . ?
C198 C199 C200 120(2) . . ?
C199 C200 C201 120(2) . . ?
C202 C201 C200 121(2) . . ?
C201 C202 C197 118.4(17) . . ?
C208 C203 C204 119.5(17) . . ?
C208 C203 P11 121.8(13) . . ?
C204 C203 P11 118.5(15) . . ?
C205 C204 C203 119.9(19) . . ?
C204 C205 C206 122.0(18) . . ?
C207 C206 C205 116.4(18) . . ?
C206 C207 C208 123(2) . . ?
C203 C208 C207 119.0(18) . . ?
C223 C209 P11 120.3(11) . . ?
C215 C210 C211 120(2) . . ?
C215 C210 P12 125.9(16) . . ?
C211 C210 P12 114.4(18) . . ?
C210 C211 C212 119(2) . . ?
C213 C212 C211 119(2) . . ?
C214 C213 C212 122(2) . . ?
C213 C214 C215 121(2) . . ?
C214 C215 C210 118(2) . . ?
C221 C216 C217 116.7(17) . . ?
C221 C216 P12 122.8(15) . . ?
C217 C216 P12 120.4(15) . . ?
C218 C217 C216 116.9(19) . . ?
C219 C218 C217 124.8(19) . . ?
C220 C219 C218 118.5(19) . . ?
C219 C220 C221 118.8(18) . . ?
C216 C221 C220 124.2(18) . . ?
C223 C222 P12 120.2(12) . . ?
C224 C223 C222 108.7(14) . . ?
C224 C223 C209 111.7(13) . . ?
C222 C223 C209 107.6(13) . . ?
C224 C223 C196 109.7(13) . . ?
C222 C223 C196 109.0(13) . . ?
C209 C223 C196 110.1(13) . . ?
S1 Ag1 S4 152.69(18) . . ?
S1 Ag1 O7 110.5(4) . . ?
S4 Ag1 O7 92.2(4) . . ?
S1 Ag1 Au4 113.69(14) . . ?
S4 Ag1 Au4 51.28(12) . . ?
O7 Ag1 Au4 85.3(4) . . ?
S1 Ag1 Au1 50.03(12) . . ?
S4 Ag1 Au1 112.84(13) . . ?
O7 Ag1 Au1 152.3(4) . . ?
Au4 Ag1 Au1 119.13(6) . . ?
O5 Ag2 S5 110.3(5) . . ?
O5 Ag2 S3 96.4(5) . . ?
S5 Ag2 S3 151.6(2) . . ?
O5 Ag2 Au5 146.8(6) . . ?
S5 Ag2 Au5 51.62(16) . . ?
S3 Ag2 Au5 108.78(17) . . ?
O5 Ag2 Au3 92.8(6) . . ?
S5 Ag2 Au3 117.00(18) . . ?
S3 Ag2 Au3 50.06(13) . . ?
Au5 Ag2 Au3 119.81(8) . . ?
S2 Ag3 S6 147.66(18) . . ?
S2 Ag3 O12 111.1(3) . . ?
S6 Ag3 O12 93.5(3) . . ?
S2 Ag3 O4 92.8(3) . . ?
S6 Ag3 O4 113.5(3) . . ?
O12 Ag3 O4 77.4(4) . . ?
S2 Ag3 Au2 51.48(11) . . ?
S6 Ag3 Au2 109.32(12) . . ?
O12 Ag3 Au2 156.0(3) . . ?
O4 Ag3 Au2 86.5(3) . . ?
S2 Ag3 Au6 108.38(12) . . ?
S6 Ag3 Au6 51.37(11) . . ?
O12 Ag3 Au6 85.1(3) . . ?
O4 Ag3 Au6 156.3(3) . . ?
Au2 Ag3 Au6 114.69(6) . . ?
O13 Ag4 S7 95.2(3) . . ?
O13 Ag4 S10 108.3(3) . . ?
S7 Ag4 S10 150.15(18) . . ?
O13 Ag4 Au10 146.3(3) . . ?
S7 Ag4 Au10 114.40(12) . . ?
S10 Ag4 Au10 51.34(11) . . ?
O13 Ag4 Au7 92.0(3) . . ?
S7 Ag4 Au7 50.19(11) . . ?
S10 Ag4 Au7 109.39(12) . . ?
Au10 Ag4 Au7 118.94(6) . . ?
O15 Ag5 S8 95.4(3) . . ?
O15 Ag5 S11 107.6(3) . . ?
S8 Ag5 S11 147.44(17) . . ?
O15 Ag5 O21 77.9(4) . . ?
S8 Ag5 O21 116.0(3) . . ?
S11 Ag5 O21 91.7(3) . . ?
O15 Ag5 Au11 151.4(3) . . ?
S8 Ag5 Au11 112.18(13) . . ?
S11 Ag5 Au11 51.43(11) . . ?
O21 Ag5 Au11 83.2(3) . . ?
O15 Ag5 Au8 89.9(3) . . ?
S8 Ag5 Au8 49.59(12) . . ?
S11 Ag5 Au8 106.47(12) . . ?
O21 Ag5 Au8 160.6(3) . . ?
Au11 Ag5 Au8 113.27(5) . . ?
O23 Ag6 S9 115.1(4) . . ?
O23 Ag6 S12 93.2(4) . . ?
S9 Ag6 S12 151.51(18) . . ?
O23 Ag6 Au12 100.5(4) . . ?
S9 Ag6 Au12 116.38(12) . . ?
S12 Ag6 Au12 50.98(13) . . ?
O23 Ag6 Au9 142.3(4) . . ?
S9 Ag6 Au9 50.38(11) . . ?
S12 Ag6 Au9 108.48(14) . . ?
Au12 Ag6 Au9 117.13(6) . . ?
P1 Au1 S1 174.14(18) . . ?
P1 Au1 Ag1 122.07(15) . . ?
S1 Au1 Ag1 53.64(15) . . ?
P2 Au2 S2 174.6(2) . . ?
P2 Au2 Ag3 120.13(14) . . ?
S2 Au2 Ag3 54.94(14) . . ?
P3 Au3 S3 172.7(2) . . ?
P3 Au3 Ag2 120.27(14) . . ?
S3 Au3 Ag2 53.55(16) . . ?
P4 Au4 S4 176.68(19) . . ?
P4 Au4 Ag1 122.91(16) . . ?
S4 Au4 Ag1 55.37(16) . . ?
P5 Au5 S5 176.2(2) . . ?
P5 Au5 Ag2 121.94(16) . . ?
S5 Au5 Ag2 54.66(19) . . ?
P6 Au6 S6 175.32(18) . . ?
P6 Au6 Ag3 121.97(13) . . ?
S6 Au6 Ag3 54.95(12) . . ?
P7 Au7 S7 172.39(17) . . ?
P7 Au7 Ag4 120.46(13) . . ?
S7 Au7 Ag4 53.14(12) . . ?
P8 Au8 S8 172.14(18) . . ?
P8 Au8 Ag5 122.32(13) . . ?
S8 Au8 Ag5 52.67(13) . . ?
P9 Au9 S9 173.68(19) . . ?
P9 Au9 Ag6 120.70(15) . . ?
S9 Au9 Ag6 53.55(14) . . ?
P10 Au10 S10 175.62(18) . . ?
P10 Au10 Ag4 121.06(13) . . ?
S10 Au10 Ag4 54.55(13) . . ?
P11 Au11 S11 175.77(17) . . ?
P11 Au11 Ag5 121.44(13) . . ?
S11 Au11 Ag5 55.72(12) . . ?
P12 Au12 S12 168.16(19) . . ?
P12 Au12 Ag6 116.64(14) . . ?
S12 Au12 Ag6 54.25(15) . . ?
C16 P1 C22 102.6(7) . . ?
C16 P1 C28 108.2(8) . . ?
C22 P1 C28 102.1(8) . . ?
C16 P1 Au1 111.1(5) . . ?
C22 P1 Au1 114.1(5) . . ?
C28 P1 Au1 117.4(6) . . ?
C41 P2 C35 103.5(8) . . ?
C41 P2 C29 107.9(9) . . ?
C35 P2 C29 102.3(8) . . ?
C41 P2 Au2 116.9(6) . . ?
C35 P2 Au2 112.4(6) . . ?
C29 P2 Au2 112.4(6) . . ?
C48 P3 C54 109.5(8) . . ?
C48 P3 C42 103.8(8) . . ?
C54 P3 C42 101.4(10) . . ?
C48 P3 Au3 110.5(5) . . ?
C54 P3 Au3 117.0(6) . . ?
C42 P3 Au3 113.5(6) . . ?
C84 P4 C78 110.0(8) . . ?
C84 P4 C72 103.5(10) . . ?
C78 P4 C72 102.8(9) . . ?
C84 P4 Au4 117.1(6) . . ?
C78 P4 Au4 111.5(6) . . ?
C72 P4 Au4 110.8(7) . . ?
C97 P5 C91 109.0(9) . . ?
C97 P5 C85 104.3(9) . . ?
C91 P5 C85 100.4(9) . . ?
C97 P5 Au5 117.2(5) . . ?
C91 P5 Au5 112.4(8) . . ?
C85 P5 Au5 112.0(7) . . ?
C110 P6 C98 103.5(7) . . ?
C110 P6 C104 112.2(9) . . ?
C98 P6 C104 101.8(7) . . ?
C110 P6 Au6 117.7(5) . . ?
C98 P6 Au6 110.0(5) . . ?
C104 P6 Au6 110.3(6) . . ?
C128 P7 C134 98.9(7) . . ?
C128 P7 C140 109.7(8) . . ?
C134 P7 C140 105.1(7) . . ?
C128 P7 Au7 110.4(6) . . ?
C134 P7 Au7 112.2(4) . . ?
C140 P7 Au7 118.7(5) . . ?
C147 P8 C141 101.5(7) . . ?
C147 P8 C153 100.9(7) . . ?
C141 P8 C153 108.8(8) . . ?
C147 P8 Au8 113.3(5) . . ?
C141 P8 Au8 111.3(6) . . ?
C153 P8 Au8 119.3(5) . . ?
C160 P9 C166 110.2(8) . . ?
C160 P9 C154 104.3(8) . . ?
C166 P9 C154 102.4(8) . . ?
C160 P9 Au9 111.0(6) . . ?
C166 P9 Au9 116.5(5) . . ?
C154 P9 Au9 111.4(6) . . ?
C190 P10 C184 102.4(8) . . ?
C190 P10 C196 103.1(9) . . ?
C184 P10 C196 109.8(8) . . ?
C190 P10 Au10 111.6(6) . . ?
C184 P10 Au10 112.9(6) . . ?
C196 P10 Au10 115.8(5) . . ?
C209 P11 C197 104.5(8) . . ?
C209 P11 C203 107.2(8) . . ?
C197 P11 C203 103.8(8) . . ?
C209 P11 Au11 118.7(5) . . ?
C197 P11 Au11 108.9(6) . . ?
C203 P11 Au11 112.4(6) . . ?
C210 P12 C216 100.8(9) . . ?
C210 P12 C222 101.6(9) . . ?
C216 P12 C222 112.0(9) . . ?
C210 P12 Au12 113.7(7) . . ?
C216 P12 Au12 110.8(6) . . ?
C222 P12 Au12 116.6(6) . . ?
O27 N13 O25 120.3(19) . . ?
O27 N13 O26 119(2) . . ?
O25 N13 O26 120.4(19) . . ?
O28 N14 O29 122.7(15) . . ?
O28 N14 O30 121.6(15) . . ?
O29 N14 O30 115.6(14) . . ?
O33 N15 O31 121.0(18) . . ?
O33 N15 O32 119.4(17) . . ?
O31 N15 O32 119.5(17) . . ?
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
S1 C1 1.909(15) . ?
S1 Au1 2.315(5) . ?
S1 Ag1 2.432(6) . ?
C1 C2 1.495(17) . ?
C1 C5 1.512(18) . ?
C1 C4 1.530(16) . ?
C2 N1 1.516(17) . ?
C2 C3 1.553(18) . ?
C3 O1 1.256(17) . ?
C3 O2 1.292(18) . ?
S2 C6 1.886(14) . ?
S2 Au2 2.333(4) . ?
S2 Ag3 2.440(5) . ?
C6 C7 1.502(17) . ?
C6 C9 1.534(16) . ?
C6 C10 1.538(17) . ?
C7 N2 1.529(16) . ?
C7 C8 1.577(16) . ?
C8 O3 1.234(15) . ?
C8 O4 1.269(15) . ?
O4 Ag3 2.583(12) . ?
S3 C11 1.876(17) . ?
S3 Au3 2.325(5) . ?
S3 Ag2 2.439(7) . ?
C11 C12 1.495(17) . ?
C11 C15 1.502(18) . ?
C11 C14 1.527(18) . ?
C12 N3 1.491(18) . ?
C12 C13 1.547(19) . ?
C13 O5 1.279(19) . ?
C13 O6 1.305(19) . ?
O5 Ag2 2.35(2) . ?
C16 C17 1.3900 . ?
C16 C21 1.3900 . ?
C16 P1 1.821(10) . ?
C17 C18 1.3900 . ?
C18 C19 1.3900 . ?
C19 C20 1.3900 . ?
C20 C21 1.3900 . ?
C22 C23 1.3900 . ?
C22 C27 1.3900 . ?
C22 P1 1.842(12) . ?
C23 C24 1.3900 . ?
C24 C25 1.3900 . ?
C25 C26 1.3900 . ?
C26 C27 1.3900 . ?
C28 C55 1.56(3) . ?
C28 P1 1.875(18) . ?
C29 C30 1.37(2) . ?
C29 C34 1.44(2) . ?
C29 P2 1.837(18) . ?
C30 C31 1.39(3) . ?
C31 C32 1.35(3) . ?
C32 C33 1.46(2) . ?
C33 C34 1.34(2) . ?
C35 C36 1.35(3) . ?
C35 C40 1.36(2) . ?
C35 P2 1.823(19) . ?
C36 C37 1.38(3) . ?
C37 C38 1.38(3) . ?
C38 C39 1.35(3) . ?
C39 C40 1.37(2) . ?
C41 C55 1.54(2) . ?
C41 P2 1.800(18) . ?
C42 C47 1.33(3) . ?
C42 C43 1.39(3) . ?
C42 P3 1.838(19) . ?
C43 C44 1.43(3) . ?
C44 C45 1.38(3) . ?
C45 C46 1.23(3) . ?
C46 C47 1.41(3) . ?
C48 C49 1.3900 . ?
C48 C53 1.3900 . ?
C48 P3 1.797(10) . ?
C49 C50 1.3900 . ?
C50 C51 1.3900 . ?
C51 C52 1.3900 . ?
C52 C53 1.3900 . ?
C54 C55 1.54(2) . ?
C54 P3 1.82(2) . ?
C55 C56 1.53(2) . ?
S4 C57 1.881(14) . ?
S4 Au4 2.344(5) . ?
S4 Ag1 2.472(6) . ?
C57 C58 1.500(16) . ?
C57 C61 1.502(17) . ?
C57 C60 1.545(16) . ?
C58 N4 1.491(16) . ?
C58 C59 1.542(17) . ?
C59 O7 1.256(17) . ?
C59 O8 1.296(17) . ?
O7 Ag1 2.565(16) . ?
S5 C62 1.890(17) . ?
S5 Au5 2.330(6) . ?
S5 Ag2 2.425(8) . ?
C62 C63 1.485(19) . ?
C62 C66 1.519(19) . ?
C62 C65 1.526(19) . ?
C63 N5 1.51(2) . ?
C63 C64 1.55(2) . ?
C64 O9 1.27(2) . ?
C64 O10 1.32(2) . ?
S6 C67 1.889(15) . ?
S6 Au6 2.339(5) . ?
S6 Ag3 2.451(5) . ?
C67 C68 1.503(16) . ?
C67 C71 1.534(16) . ?
C67 C70 1.538(16) . ?
C68 N6 1.504(15) . ?
C68 C69 1.556(16) . ?
C69 O11 1.238(15) . ?
C69 O12 1.300(16) . ?
O12 Ag3 2.549(13) . ?
C72 C73 1.40(3) . ?
C72 C77 1.47(3) . ?
C72 P4 1.82(2) . ?
C73 C74 1.45(3) . ?
C74 C75 1.37(3) . ?
C75 C76 1.35(3) . ?
C76 C77 1.36(3) . ?
C78 C83 1.33(2) . ?
C78 C79 1.43(2) . ?
C78 P4 1.820(18) . ?
C79 C80 1.44(3) . ?
C80 C81 1.42(3) . ?
C81 C82 1.35(2) . ?
C82 C83 1.41(3) . ?
C84 C111 1.58(3) . ?
C84 P4 1.808(17) . ?
C85 C90 1.35(3) . ?
C85 C86 1.36(3) . ?
C85 P5 1.88(2) . ?
C86 C87 1.47(3) . ?
C87 C88 1.33(3) . ?
C88 C89 1.35(3) . ?
C89 C90 1.43(3) . ?
C91 C92 1.33(3) . ?
C91 C96 1.38(3) . ?
C91 P5 1.86(2) . ?
C92 C93 1.52(3) . ?
C93 C94 1.29(3) . ?
C94 C95 1.33(3) . ?
C95 C96 1.47(3) . ?
C97 C111 1.53(2) . ?
C97 P5 1.824(18) . ?
C98 C99 1.3900 . ?
C98 C103 1.3900 . ?
C98 P6 1.825(10) . ?
C99 C100 1.3900 . ?
C100 C101 1.3900 . ?
C101 C102 1.3900 . ?
C102 C103 1.3900 . ?
C104 C105 1.32(2) . ?
C104 C109 1.45(2) . ?
C104 P6 1.860(17) . ?
C105 C106 1.33(2) . ?
C106 C107 1.38(2) . ?
C107 C108 1.38(3) . ?
C108 C109 1.44(2) . ?
C110 C111 1.60(2) . ?
C110 P6 1.804(19) . ?
C111 C112 1.51(2) . ?
S7 C113 1.866(13) . ?
S7 Au7 2.326(4) . ?
S7 Ag4 2.422(5) . ?
C113 C114 1.501(16) . ?
C113 C116 1.510(16) . ?
C113 C117 1.522(16) . ?
C114 N7 1.506(16) . ?
C114 C115 1.556(18) . ?
C115 O13 1.246(16) . ?
C115 O14 1.268(17) . ?
O13 Ag4 2.403(15) . ?
S8 C118 1.873(14) . ?
S8 Au8 2.327(5) . ?
S8 Ag5 2.430(5) . ?
C118 C119 1.510(16) . ?
C118 C122 1.516(16) . ?
C118 C121 1.543(16) . ?
C119 N8 1.517(16) . ?
C119 C120 1.555(17) . ?
C120 O15 1.272(16) . ?
C120 O16 1.286(16) . ?
O15 Ag5 2.426(12) . ?
S9 C123 1.882(14) . ?
S9 Au9 2.336(4) . ?
S9 Ag6 2.439(6) . ?
C123 C127 1.515(16) . ?
C123 C124 1.519(17) . ?
C123 C126 1.527(16) . ?
C124 N9 1.516(16) . ?
C124 C125 1.559(17) . ?
C125 O17 1.214(17) . ?
C125 O18 1.285(17) . ?
C128 C133 1.40(2) . ?
C128 C129 1.48(2) . ?
C128 P7 1.778(18) . ?
C129 C130 1.33(2) . ?
C130 C131 1.38(2) . ?
C131 C132 1.39(2) . ?
C132 C133 1.37(2) . ?
C134 C135 1.3900 . ?
C134 C139 1.3900 . ?
C134 P7 1.792(9) . ?
C135 C136 1.3900 . ?
C136 C137 1.3900 . ?
C137 C138 1.3900 . ?
C138 C139 1.3900 . ?
C140 C167 1.51(2) . ?
C140 P7 1.828(16) . ?
C141 C146 1.38(2) . ?
C141 C142 1.40(2) . ?
C141 P8 1.864(18) . ?
C142 C143 1.37(2) . ?
C143 C144 1.41(2) . ?
C144 C145 1.34(2) . ?
C145 C146 1.42(2) . ?
C147 C148 1.3900 . ?
C147 C152 1.3900 . ?
C147 P8 1.813(10) . ?
C148 C149 1.3900 . ?
C149 C150 1.3900 . ?
C150 C151 1.3900 . ?
C151 C152 1.3900 . ?
C153 C167 1.60(2) . ?
C153 P8 1.871(17) . ?
C154 C155 1.30(3) . ?
C154 C159 1.36(3) . ?
C154 P9 1.85(2) . ?
C155 C156 1.42(3) . ?
C156 C157 1.29(3) . ?
C157 C158 1.42(3) . ?
C158 C159 1.42(3) . ?
C160 C165 1.37(2) . ?
C160 C161 1.43(2) . ?
C160 P9 1.825(18) . ?
C161 C162 1.39(2) . ?
C162 C163 1.36(2) . ?
C163 C164 1.37(2) . ?
C164 C165 1.35(2) . ?
C166 C167 1.53(2) . ?
C166 P9 1.842(16) . ?
C167 C168 1.525(19) . ?
S10 C169 1.867(14) . ?
S10 Au10 2.333(4) . ?
S10 Ag4 2.434(5) . ?
C169 C170 1.505(16) . ?
C169 C172 1.534(16) . ?
C169 C173 1.536(16) . ?
C170 N10 1.498(15) . ?
C170 C171 1.538(17) . ?
C171 O19 1.258(16) . ?
C171 O20 1.304(16) . ?
S11 C174 1.882(13) . ?
S11 Au11 2.331(4) . ?
S11 Ag5 2.464(5) . ?
C174 C175 1.476(15) . ?
C174 C177 1.524(16) . ?
C174 C178 1.527(15) . ?
C175 N11 1.504(15) . ?
C175 C176 1.548(16) . ?
C176 O21 1.251(15) . ?
C176 O22 1.290(15) . ?
O21 Ag5 2.554(12) . ?
S12 C179 1.887(14) . ?
S12 Au12 2.346(5) . ?
S12 Ag6 2.451(6) . ?
C179 C183 1.495(17) . ?
C179 C180 1.512(17) . ?
C179 C182 1.522(17) . ?
C180 N12 1.480(16) . ?
C180 C181 1.562(18) . ?
C181 O23 1.249(16) . ?
C181 O24 1.299(17) . ?
O23 Ag6 2.331(14) . ?
C184 C189 1.35(2) . ?
C184 C185 1.44(2) . ?
C184 P10 1.819(16) . ?
C185 C186 1.47(2) . ?
C186 C187 1.32(3) . ?
C187 C188 1.34(2) . ?
C188 C189 1.44(2) . ?
C190 C195 1.36(3) . ?
C190 C191 1.45(3) . ?
C190 P10 1.794(18) . ?
C191 C192 1.34(2) . ?
C192 C193 1.37(3) . ?
C193 C194 1.35(3) . ?
C194 C195 1.49(2) . ?
C196 C223 1.58(2) . ?
C196 P10 1.836(18) . ?
C197 C198 1.37(2) . ?
C197 C202 1.42(2) . ?
C197 P11 1.843(17) . ?
C198 C199 1.37(3) . ?
C199 C200 1.38(3) . ?
C200 C201 1.39(3) . ?
C201 C202 1.34(2) . ?
C203 C208 1.35(2) . ?
C203 C204 1.40(2) . ?
C203 P11 1.852(18) . ?
C204 C205 1.35(3) . ?
C205 C206 1.38(3) . ?
C206 C207 1.37(2) . ?
C207 C208 1.38(2) . ?
C209 C223 1.56(2) . ?
C209 P11 1.791(16) . ?
C210 C215 1.40(3) . ?
C210 C211 1.40(3) . ?
C210 P12 1.77(2) . ?
C211 C212 1.42(3) . ?
C212 C213 1.34(3) . ?
C213 C214 1.34(3) . ?
C214 C215 1.40(3) . ?
C216 C221 1.36(2) . ?
C216 C217 1.40(2) . ?
C216 P12 1.805(18) . ?
C217 C218 1.38(3) . ?
C218 C219 1.35(2) . ?
C219 C220 1.32(2) . ?
C220 C221 1.38(2) . ?
C222 C223 1.55(2) . ?
C222 P12 1.857(17) . ?
C223 C224 1.54(2) . ?
Ag1 Au4 2.878(2) . ?
Ag1 Au1 2.9347(19) . ?
Ag2 Au5 2.854(2) . ?
Ag2 Au3 2.947(2) . ?
Ag3 Au2 2.8597(17) . ?
Ag3 Au6 2.8737(16) . ?
Ag4 Au10 2.8739(16) . ?
Ag4 Au7 2.9457(17) . ?
Ag5 Au11 2.8491(16) . ?
Ag5 Au8 2.9868(16) . ?
Ag6 Au12 2.9141(18) . ?
Ag6 Au9 2.9428(18) . ?
Au1 P1 2.289(5) . ?
Au2 P2 2.272(5) . ?
Au3 P3 2.274(5) . ?
Au4 P4 2.274(5) . ?
Au5 P5 2.274(5) . ?
Au6 P6 2.275(5) . ?
Au7 P7 2.284(4) . ?
Au8 P8 2.262(5) . ?
Au9 P9 2.265(4) . ?
Au10 P10 2.275(5) . ?
Au11 P11 2.268(4) . ?
Au12 P12 2.271(5) . ?
N13 O27 1.22(2) . ?
N13 O25 1.241(19) . ?
N13 O26 1.25(2) . ?
N14 O28 1.215(14) . ?
N14 O29 1.238(14) . ?
N14 O30 1.272(14) . ?
N15 O33 1.291(16) . ?
N15 O31 1.303(16) . ?
N15 O32 1.309(16) . ?
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
C5 C1 C2 N1 161.9(17) . . . . ?
C4 C1 C2 N1 43(2) . . . . ?
S1 C1 C2 N1 -74.8(17) . . . . ?
C5 C1 C2 C3 -74(2) . . . . ?
C4 C1 C2 C3 166.5(17) . . . . ?
S1 C1 C2 C3 49(2) . . . . ?
C1 C2 C3 O1 66(3) . . . . ?
N1 C2 C3 O1 -167(2) . . . . ?
C1 C2 C3 O2 -104(2) . . . . ?
N1 C2 C3 O2 24(3) . . . . ?
Au2 S2 C6 C7 -80.5(11) . . . . ?
Ag3 S2 C6 C7 -2.1(12) . . . . ?
Au2 S2 C6 C9 159.2(11) . . . . ?
Ag3 S2 C6 C9 -122.4(12) . . . . ?
Au2 S2 C6 C10 43.9(12) . . . . ?
Ag3 S2 C6 C10 122.4(11) . . . . ?
C9 C6 C7 N2 51.8(18) . . . . ?
C10 C6 C7 N2 169.9(14) . . . . ?
S2 C6 C7 N2 -65.8(15) . . . . ?
C9 C6 C7 C8 174.3(14) . . . . ?
C10 C6 C7 C8 -67.7(18) . . . . ?
S2 C6 C7 C8 56.6(16) . . . . ?
C6 C7 C8 O3 76(2) . . . . ?
N2 C7 C8 O3 -157.5(17) . . . . ?
C6 C7 C8 O4 -103.3(18) . . . . ?
N2 C7 C8 O4 23(2) . . . . ?
O3 C8 O4 Ag3 -119.1(18) . . . . ?
C7 C8 O4 Ag3 59.9(17) . . . . ?
Au3 S3 C11 C12 -43.1(14) . . . . ?
Ag2 S3 C11 C12 37.3(14) . . . . ?
Au3 S3 C11 C15 78.1(16) . . . . ?
Ag2 S3 C11 C15 158.5(14) . . . . ?
Au3 S3 C11 C14 -162.7(13) . . . . ?
Ag2 S3 C11 C14 -82.3(14) . . . . ?
C15 C11 C12 N3 36(2) . . . . ?
C14 C11 C12 N3 -88(2) . . . . ?
S3 C11 C12 N3 156.2(16) . . . . ?
C15 C11 C12 C13 163(2) . . . . ?
C14 C11 C12 C13 40(3) . . . . ?
S3 C11 C12 C13 -76(2) . . . . ?
N3 C12 C13 O5 -138(3) . . . . ?
C11 C12 C13 O5 92(4) . . . . ?
N3 C12 C13 O6 45(3) . . . . ?
C11 C12 C13 O6 -84(3) . . . . ?
O6 C13 O5 Ag2 123(3) . . . . ?
C12 C13 O5 Ag2 -53(4) . . . . ?
C21 C16 C17 C18 0.0 . . . . ?
P1 C16 C17 C18 -172.8(11) . . . . ?
C16 C17 C18 C19 0.0 . . . . ?
C17 C18 C19 C20 0.0 . . . . ?
C18 C19 C20 C21 0.0 . . . . ?
C19 C20 C21 C16 0.0 . . . . ?
C17 C16 C21 C20 0.0 . . . . ?
P1 C16 C21 C20 172.6(11) . . . . ?
C27 C22 C23 C24 0.0 . . . . ?
P1 C22 C23 C24 178.6(10) . . . . ?
C22 C23 C24 C25 0.0 . . . . ?
C23 C24 C25 C26 0.0 . . . . ?
C24 C25 C26 C27 0.0 . . . . ?
C25 C26 C27 C22 0.0 . . . . ?
C23 C22 C27 C26 0.0 . . . . ?
P1 C22 C27 C26 -178.5(11) . . . . ?
C34 C29 C30 C31 -2(3) . . . . ?
P2 C29 C30 C31 175.8(15) . . . . ?
C29 C30 C31 C32 1(3) . . . . ?
C30 C31 C32 C33 -3(3) . . . . ?
C31 C32 C33 C34 6(3) . . . . ?
C32 C33 C34 C29 -6(3) . . . . ?
C30 C29 C34 C33 5(3) . . . . ?
P2 C29 C34 C33 -173.0(16) . . . . ?
C40 C35 C36 C37 -7(4) . . . . ?
P2 C35 C36 C37 176(2) . . . . ?
C35 C36 C37 C38 4(4) . . . . ?
C36 C37 C38 C39 3(4) . . . . ?
C37 C38 C39 C40 -7(4) . . . . ?
C36 C35 C40 C39 3(3) . . . . ?
P2 C35 C40 C39 179.1(15) . . . . ?
C38 C39 C40 C35 4(3) . . . . ?
C47 C42 C43 C44 -1(3) . . . . ?
P3 C42 C43 C44 176.7(16) . . . . ?
C42 C43 C44 C45 0(3) . . . . ?
C43 C44 C45 C46 1(4) . . . . ?
C44 C45 C46 C47 -2(4) . . . . ?
C43 C42 C47 C46 1(3) . . . . ?
P3 C42 C47 C46 -176.5(14) . . . . ?
C45 C46 C47 C42 0(3) . . . . ?
C53 C48 C49 C50 0.0 . . . . ?
P3 C48 C49 C50 179.2(9) . . . . ?
C48 C49 C50 C51 0.0 . . . . ?
C49 C50 C51 C52 0.0 . . . . ?
C50 C51 C52 C53 0.0 . . . . ?
C51 C52 C53 C48 0.0 . . . . ?
C49 C48 C53 C52 0.0 . . . . ?
P3 C48 C53 C52 -179.2(9) . . . . ?
P3 C54 C55 C56 61(2) . . . . ?
P3 C54 C55 C41 -60.0(19) . . . . ?
P3 C54 C55 C28 -176.3(12) . . . . ?
P2 C41 C55 C56 62(2) . . . . ?
P2 C41 C55 C54 -175.4(13) . . . . ?
P2 C41 C55 C28 -57.9(19) . . . . ?
P1 C28 C55 C56 65.9(18) . . . . ?
P1 C28 C55 C54 -57.9(17) . . . . ?
P1 C28 C55 C41 -174.8(12) . . . . ?
Au4 S4 C57 C58 -81.7(11) . . . . ?
Ag1 S4 C57 C58 -3.9(12) . . . . ?
Au4 S4 C57 C61 45.5(12) . . . . ?
Ag1 S4 C57 C61 123.3(11) . . . . ?
Au4 S4 C57 C60 160.2(10) . . . . ?
Ag1 S4 C57 C60 -122.0(10) . . . . ?
C61 C57 C58 N4 165.6(15) . . . . ?
C60 C57 C58 N4 45(2) . . . . ?
S4 C57 C58 N4 -67.9(16) . . . . ?
C61 C57 C58 C59 -65(2) . . . . ?
C60 C57 C58 C59 173.8(15) . . . . ?
S4 C57 C58 C59 61.4(17) . . . . ?
N4 C58 C59 O7 25(3) . . . . ?
C57 C58 C59 O7 -105(2) . . . . ?
N4 C58 C59 O8 -155(2) . . . . ?
C57 C58 C59 O8 76(3) . . . . ?
O8 C59 O7 Ag1 -124(2) . . . . ?
C58 C59 O7 Ag1 56(2) . . . . ?
Au5 S5 C62 C63 -67.7(19) . . . . ?
Ag2 S5 C62 C63 11.9(19) . . . . ?
Au5 S5 C62 C66 60.5(18) . . . . ?
Ag2 S5 C62 C66 140.0(16) . . . . ?
Au5 S5 C62 C65 173.7(16) . . . . ?
Ag2 S5 C62 C65 -106.7(17) . . . . ?
C66 C62 C63 N5 142(3) . . . . ?
C65 C62 C63 N5 27(3) . . . . ?
S5 C62 C63 N5 -91(3) . . . . ?
C66 C62 C63 C64 -80(3) . . . . ?
C65 C62 C63 C64 165(3) . . . . ?
S5 C62 C63 C64 48(3) . . . . ?
C62 C63 C64 O9 -114(5) . . . . ?
N5 C63 C64 O9 25(7) . . . . ?
C62 C63 C64 O10 71(6) . . . . ?
N5 C63 C64 O10 -150(5) . . . . ?
Au6 S6 C67 C68 -76.8(10) . . . . ?
Ag3 S6 C67 C68 1.8(11) . . . . ?
Au6 S6 C67 C71 163.2(9) . . . . ?
Ag3 S6 C67 C71 -118.2(10) . . . . ?
Au6 S6 C67 C70 48.4(11) . . . . ?
Ag3 S6 C67 C70 127.0(9) . . . . ?
C71 C67 C68 N6 49.1(19) . . . . ?
C70 C67 C68 N6 169.3(14) . . . . ?
S6 C67 C68 N6 -68.9(15) . . . . ?
C71 C67 C68 C69 173.6(14) . . . . ?
C70 C67 C68 C69 -66.2(19) . . . . ?
S6 C67 C68 C69 55.6(16) . . . . ?
C67 C68 C69 O11 71(2) . . . . ?
N6 C68 C69 O11 -160.4(18) . . . . ?
C67 C68 C69 O12 -109.3(18) . . . . ?
N6 C68 C69 O12 19(2) . . . . ?
O11 C69 O12 Ag3 -116.7(19) . . . . ?
C68 C69 O12 Ag3 63.6(17) . . . . ?
C77 C72 C73 C74 7(3) . . . . ?
P4 C72 C73 C74 -178.7(16) . . . . ?
C72 C73 C74 C75 -6(3) . . . . ?
C73 C74 C75 C76 3(4) . . . . ?
C74 C75 C76 C77 1(4) . . . . ?
C75 C76 C77 C72 -1(3) . . . . ?
C73 C72 C77 C76 -3(3) . . . . ?
P4 C72 C77 C76 -177.4(15) . . . . ?
C83 C78 C79 C80 3(3) . . . . ?
P4 C78 C79 C80 -178.0(15) . . . . ?
C78 C79 C80 C81 -4(3) . . . . ?
C79 C80 C81 C82 4(3) . . . . ?
C80 C81 C82 C83 -4(3) . . . . ?
C79 C78 C83 C82 -3(3) . . . . ?
P4 C78 C83 C82 178.3(15) . . . . ?
C81 C82 C83 C78 3(3) . . . . ?
C90 C85 C86 C87 2(3) . . . . ?
P5 C85 C86 C87 -179.2(15) . . . . ?
C85 C86 C87 C88 -4(3) . . . . ?
C86 C87 C88 C89 4(4) . . . . ?
C87 C88 C89 C90 -3(4) . . . . ?
C86 C85 C90 C89 -1(3) . . . . ?
P5 C85 C90 C89 -179.4(14) . . . . ?
C88 C89 C90 C85 1(3) . . . . ?
C96 C91 C92 C93 0(4) . . . . ?
P5 C91 C92 C93 179.0(17) . . . . ?
C91 C92 C93 C94 -2(4) . . . . ?
C92 C93 C94 C95 2(5) . . . . ?
C93 C94 C95 C96 -1(5) . . . . ?
C92 C91 C96 C95 1(4) . . . . ?
P5 C91 C96 C95 -177.9(17) . . . . ?
C94 C95 C96 C91 -1(4) . . . . ?
C103 C98 C99 C100 0.0 . . . . ?
P6 C98 C99 C100 174.8(9) . . . . ?
C98 C99 C100 C101 0.0 . . . . ?
C99 C100 C101 C102 0.0 . . . . ?
C100 C101 C102 C103 0.0 . . . . ?
C101 C102 C103 C98 0.0 . . . . ?
C99 C98 C103 C102 0.0 . . . . ?
P6 C98 C103 C102 -174.5(9) . . . . ?
C109 C104 C105 C106 10(3) . . . . ?
P6 C104 C105 C106 -176.1(18) . . . . ?
C104 C105 C106 C107 -7(4) . . . . ?
C105 C106 C107 C108 2(4) . . . . ?
C106 C107 C108 C109 0(3) . . . . ?
C107 C108 C109 C104 3(3) . . . . ?
C105 C104 C109 C108 -8(3) . . . . ?
P6 C104 C109 C108 178.0(16) . . . . ?
P5 C97 C111 C112 61(2) . . . . ?
P5 C97 C111 C84 -60.4(17) . . . . ?
P5 C97 C111 C110 -176.7(12) . . . . ?
P4 C84 C111 C112 66.0(18) . . . . ?
P4 C84 C111 C97 -170.0(11) . . . . ?
P4 C84 C111 C110 -52.5(16) . . . . ?
P6 C110 C111 C112 69.4(17) . . . . ?
P6 C110 C111 C97 -56.1(17) . . . . ?
P6 C110 C111 C84 -172.2(11) . . . . ?
Au7 S7 C113 C114 -41.5(12) . . . . ?
Ag4 S7 C113 C114 39.8(12) . . . . ?
Au7 S7 C113 C116 79.6(13) . . . . ?
Ag4 S7 C113 C116 160.9(12) . . . . ?
Au7 S7 C113 C117 -163.6(11) . . . . ?
Ag4 S7 C113 C117 -82.3(12) . . . . ?
C116 C113 C114 N7 44(2) . . . . ?
C117 C113 C114 N7 -80.2(18) . . . . ?
S7 C113 C114 N7 162.8(12) . . . . ?
C116 C113 C114 C115 168.7(16) . . . . ?
C117 C113 C114 C115 45.0(19) . . . . ?
S7 C113 C114 C115 -72.1(17) . . . . ?
C113 C114 C115 O13 92(2) . . . . ?
N7 C114 C115 O13 -139(2) . . . . ?
C113 C114 C115 O14 -92(2) . . . . ?
N7 C114 C115 O14 36(3) . . . . ?
O14 C115 O13 Ag4 121(3) . . . . ?
C114 C115 O13 Ag4 -64(2) . . . . ?
Au8 S8 C118 C119 -47.1(13) . . . . ?
Ag5 S8 C118 C119 35.4(13) . . . . ?
Au8 S8 C118 C122 72.9(11) . . . . ?
Ag5 S8 C118 C122 155.4(10) . . . . ?
Au8 S8 C118 C121 -170.5(9) . . . . ?
Ag5 S8 C118 C121 -88.0(10) . . . . ?
C122 C118 C119 N8 54.7(19) . . . . ?
C121 C118 C119 N8 -69.1(19) . . . . ?
S8 C118 C119 N8 172.5(12) . . . . ?
C122 C118 C119 C120 175.7(14) . . . . ?
C121 C118 C119 C120 51.8(19) . . . . ?
S8 C118 C119 C120 -66.5(17) . . . . ?
C118 C119 C120 O15 100(2) . . . . ?
N8 C119 C120 O15 -136.0(18) . . . . ?
C118 C119 C120 O16 -82(2) . . . . ?
N8 C119 C120 O16 42(2) . . . . ?
O16 C120 O15 Ag5 108(2) . . . . ?
C119 C120 O15 Ag5 -74.8(17) . . . . ?
Au9 S9 C123 C127 -33.6(14) . . . . ?
Ag6 S9 C123 C127 46.3(13) . . . . ?
Au9 S9 C123 C124 84.2(10) . . . . ?
Ag6 S9 C123 C124 164.2(9) . . . . ?
Au9 S9 C123 C126 -157.7(10) . . . . ?
Ag6 S9 C123 C126 -77.7(11) . . . . ?
C127 C123 C124 N9 167.4(13) . . . . ?
C126 C123 C124 N9 -66.0(16) . . . . ?
S9 C123 C124 N9 49.2(15) . . . . ?
C127 C123 C124 C125 -73.1(18) . . . . ?
C126 C123 C124 C125 53.5(18) . . . . ?
S9 C123 C124 C125 168.7(12) . . . . ?
N9 C124 C125 O17 -161(3) . . . . ?
C123 C124 C125 O17 76(3) . . . . ?
N9 C124 C125 O18 25(3) . . . . ?
C123 C124 C125 O18 -98(3) . . . . ?
C133 C128 C129 C130 6(3) . . . . ?
P7 C128 C129 C130 -177.1(16) . . . . ?
C128 C129 C130 C131 -1(3) . . . . ?
C129 C130 C131 C132 -4(3) . . . . ?
C130 C131 C132 C133 4(3) . . . . ?
C131 C132 C133 C128 1(3) . . . . ?
C129 C128 C133 C132 -6(3) . . . . ?
P7 C128 C133 C132 177.0(15) . . . . ?
C139 C134 C135 C136 0.0 . . . . ?
P7 C134 C135 C136 179.6(8) . . . . ?
C134 C135 C136 C137 0.0 . . . . ?
C135 C136 C137 C138 0.0 . . . . ?
C136 C137 C138 C139 0.0 . . . . ?
C137 C138 C139 C134 0.0 . . . . ?
C135 C134 C139 C138 0.0 . . . . ?
P7 C134 C139 C138 -179.6(9) . . . . ?
C146 C141 C142 C143 -2(3) . . . . ?
P8 C141 C142 C143 179.1(14) . . . . ?
C141 C142 C143 C144 1(3) . . . . ?
C142 C143 C144 C145 -2(3) . . . . ?
C143 C144 C145 C146 5(3) . . . . ?
C142 C141 C146 C145 5(3) . . . . ?
P8 C141 C146 C145 -176.3(14) . . . . ?
C144 C145 C146 C141 -6(3) . . . . ?
C152 C147 C148 C149 0.0 . . . . ?
P8 C147 C148 C149 -179.8(9) . . . . ?
C147 C148 C149 C150 0.0 . . . . ?
C148 C149 C150 C151 0.0 . . . . ?
C149 C150 C151 C152 0.0 . . . . ?
C150 C151 C152 C147 0.0 . . . . ?
C148 C147 C152 C151 0.0 . . . . ?
P8 C147 C152 C151 179.8(11) . . . . ?
C159 C154 C155 C156 2(4) . . . . ?
P9 C154 C155 C156 178(2) . . . . ?
C154 C155 C156 C157 -4(4) . . . . ?
C155 C156 C157 C158 5(4) . . . . ?
C156 C157 C158 C159 -4(3) . . . . ?
C155 C154 C159 C158 -2(3) . . . . ?
P9 C154 C159 C158 -177.2(14) . . . . ?
C157 C158 C159 C154 3(3) . . . . ?
C165 C160 C161 C162 -1(3) . . . . ?
P9 C160 C161 C162 176.1(15) . . . . ?
C160 C161 C162 C163 0(3) . . . . ?
C161 C162 C163 C164 1(3) . . . . ?
C162 C163 C164 C165 -1(3) . . . . ?
C163 C164 C165 C160 -1(3) . . . . ?
C161 C160 C165 C164 2(3) . . . . ?
P9 C160 C165 C164 -175.5(16) . . . . ?
P7 C140 C167 C168 61.2(18) . . . . ?
P7 C140 C167 C166 -62.9(16) . . . . ?
P7 C140 C167 C153 -177.5(11) . . . . ?
P9 C166 C167 C140 -174.1(11) . . . . ?
P9 C166 C167 C168 61.3(18) . . . . ?
P9 C166 C167 C153 -58.8(16) . . . . ?
P8 C153 C167 C140 -59.0(16) . . . . ?
P8 C153 C167 C168 63.8(17) . . . . ?
P8 C153 C167 C166 -175.1(11) . . . . ?
Au10 S10 C169 C170 -63.8(11) . . . . ?
Ag4 S10 C169 C170 16.4(12) . . . . ?
Au10 S10 C169 C172 172.5(10) . . . . ?
Ag4 S10 C169 C172 -107.3(11) . . . . ?
Au10 S10 C169 C173 57.5(12) . . . . ?
Ag4 S10 C169 C173 137.7(11) . . . . ?
C172 C169 C170 N10 41.8(18) . . . . ?
C173 C169 C170 N10 160.3(15) . . . . ?
S10 C169 C170 N10 -80.0(15) . . . . ?
C172 C169 C170 C171 165.1(15) . . . . ?
C173 C169 C170 C171 -76.4(19) . . . . ?
S10 C169 C170 C171 43.4(18) . . . . ?
N10 C170 C171 O19 18(3) . . . . ?
C169 C170 C171 O19 -109(2) . . . . ?
N10 C170 C171 O20 -159.2(18) . . . . ?
C169 C170 C171 O20 74(2) . . . . ?
Au11 S11 C174 C175 -77.0(10) . . . . ?
Ag5 S11 C174 C175 0.3(11) . . . . ?
Au11 S11 C174 C177 49.8(11) . . . . ?
Ag5 S11 C174 C177 127.1(10) . . . . ?
Au11 S11 C174 C178 162.8(10) . . . . ?
Ag5 S11 C174 C178 -119.9(10) . . . . ?
C177 C174 C175 N11 166.1(13) . . . . ?
C178 C174 C175 N11 47.4(17) . . . . ?
S11 C174 C175 N11 -70.2(14) . . . . ?
C177 C174 C175 C176 -66.7(18) . . . . ?
C178 C174 C175 C176 174.6(14) . . . . ?
S11 C174 C175 C176 57.0(16) . . . . ?
C174 C175 C176 O21 -104.4(18) . . . . ?
N11 C175 C176 O21 26(2) . . . . ?
C174 C175 C176 O22 74(2) . . . . ?
N11 C175 C176 O22 -156.1(15) . . . . ?
O22 C176 O21 Ag5 -119.7(17) . . . . ?
C175 C176 O21 Ag5 58.0(17) . . . . ?
Au12 S12 C179 C183 -159.4(12) . . . . ?
Ag6 S12 C179 C183 -81.5(13) . . . . ?
Au12 S12 C179 C180 -36.6(13) . . . . ?
Ag6 S12 C179 C180 41.3(13) . . . . ?
Au12 S12 C179 C182 81.5(13) . . . . ?
Ag6 S12 C179 C182 159.4(12) . . . . ?
C183 C179 C180 N12 -89(2) . . . . ?
C182 C179 C180 N12 34(2) . . . . ?
S12 C179 C180 N12 150.7(14) . . . . ?
C183 C179 C180 C181 38(2) . . . . ?
C182 C179 C180 C181 161.3(15) . . . . ?
S12 C179 C180 C181 -82.5(17) . . . . ?
N12 C180 C181 O23 -166(2) . . . . ?
C179 C180 C181 O23 64(3) . . . . ?
N12 C180 C181 O24 21(3) . . . . ?
C179 C180 C181 O24 -109(2) . . . . ?
O24 C181 O23 Ag6 165.6(15) . . . . ?
C180 C181 O23 Ag6 -7(3) . . . . ?
C189 C184 C185 C186 5(3) . . . . ?
P10 C184 C185 C186 -179.1(14) . . . . ?
C184 C185 C186 C187 -1(3) . . . . ?
C185 C186 C187 C188 -2(3) . . . . ?
C186 C187 C188 C189 1(3) . . . . ?
C185 C184 C189 C188 -7(3) . . . . ?
P10 C184 C189 C188 177.7(13) . . . . ?
C187 C188 C189 C184 4(3) . . . . ?
C195 C190 C191 C192 -1(2) . . . . ?
P10 C190 C191 C192 178.5(12) . . . . ?
C190 C191 C192 C193 0(3) . . . . ?
C191 C192 C193 C194 1(3) . . . . ?
C192 C193 C194 C195 -1(3) . . . . ?
C191 C190 C195 C194 1(2) . . . . ?
P10 C190 C195 C194 -178.3(12) . . . . ?
C193 C194 C195 C190 0(3) . . . . ?
C202 C197 C198 C199 -1(3) . . . . ?
P11 C197 C198 C199 176.0(17) . . . . ?
C197 C198 C199 C200 4(3) . . . . ?
C198 C199 C200 C201 -3(3) . . . . ?
C199 C200 C201 C202 -1(3) . . . . ?
C200 C201 C202 C197 4(3) . . . . ?
C198 C197 C202 C201 -3(3) . . . . ?
P11 C197 C202 C201 180.0(14) . . . . ?
C208 C203 C204 C205 0(3) . . . . ?
P11 C203 C204 C205 176.3(16) . . . . ?
C203 C204 C205 C206 2(3) . . . . ?
C204 C205 C206 C207 -2(3) . . . . ?
C205 C206 C207 C208 -1(3) . . . . ?
C204 C203 C208 C207 -2(3) . . . . ?
P11 C203 C208 C207 -178.2(14) . . . . ?
C206 C207 C208 C203 2(3) . . . . ?
C215 C210 C211 C212 -3(4) . . . . ?
P12 C210 C211 C212 175(2) . . . . ?
C210 C211 C212 C213 4(5) . . . . ?
C211 C212 C213 C214 -1(5) . . . . ?
C212 C213 C214 C215 -4(4) . . . . ?
C213 C214 C215 C210 5(3) . . . . ?
C211 C210 C215 C214 -2(3) . . . . ?
P12 C210 C215 C214 -179.3(16) . . . . ?
C221 C216 C217 C218 -1(3) . . . . ?
P12 C216 C217 C218 175.7(16) . . . . ?
C216 C217 C218 C219 1(3) . . . . ?
C217 C218 C219 C220 -3(4) . . . . ?
C218 C219 C220 C221 3(3) . . . . ?
C217 C216 C221 C220 2(3) . . . . ?
P12 C216 C221 C220 -174.5(16) . . . . ?
C219 C220 C221 C216 -3(3) . . . . ?
P12 C222 C223 C224 63.3(17) . . . . ?
P12 C222 C223 C209 -175.6(11) . . . . ?
P12 C222 C223 C196 -56.2(17) . . . . ?
P11 C209 C223 C224 63.7(18) . . . . ?
P11 C209 C223 C222 -55.5(16) . . . . ?
P11 C209 C223 C196 -174.2(11) . . . . ?
P10 C196 C223 C224 66.1(17) . . . . ?
P10 C196 C223 C222 -175.0(11) . . . . ?
P10 C196 C223 C209 -57.2(16) . . . . ?
C17 C16 P1 C22 119.3(9) . . . . ?
C21 C16 P1 C22 -53.4(10) . . . . ?
C17 C16 P1 C28 -133.3(9) . . . . ?
C21 C16 P1 C28 54.0(11) . . . . ?
C17 C16 P1 Au1 -3.1(9) . . . . ?
C21 C16 P1 Au1 -175.8(7) . . . . ?
C23 C22 P1 C16 -62.4(9) . . . . ?
C27 C22 P1 C16 116.2(9) . . . . ?
C23 C22 P1 C28 -174.4(9) . . . . ?
C27 C22 P1 C28 4.2(11) . . . . ?
C23 C22 P1 Au1 57.9(8) . . . . ?
C27 C22 P1 Au1 -123.5(8) . . . . ?
C55 C28 P1 C16 70.1(14) . . . . ?
C55 C28 P1 C22 177.9(12) . . . . ?
C55 C28 P1 Au1 -56.5(15) . . . . ?
C55 C41 P2 C35 179.2(15) . . . . ?
C55 C41 P2 C29 71.3(17) . . . . ?
C55 C41 P2 Au2 -56.6(17) . . . . ?
C36 C35 P2 C41 174.2(18) . . . . ?
C40 C35 P2 C41 -2.4(19) . . . . ?
C36 C35 P2 C29 -73.7(19) . . . . ?
C40 C35 P2 C29 109.7(18) . . . . ?
C36 C35 P2 Au2 47.1(19) . . . . ?
C40 C35 P2 Au2 -129.5(16) . . . . ?
C30 C29 P2 C41 43.8(17) . . . . ?
C34 C29 P2 C41 -138.4(15) . . . . ?
C30 C29 P2 C35 -65.0(17) . . . . ?
C34 C29 P2 C35 112.8(15) . . . . ?
C30 C29 P2 Au2 174.2(13) . . . . ?
C34 C29 P2 Au2 -8.0(16) . . . . ?
C49 C48 P3 C54 47.8(10) . . . . ?
C53 C48 P3 C54 -133.0(8) . . . . ?
C49 C48 P3 C42 -59.8(10) . . . . ?
C53 C48 P3 C42 119.4(9) . . . . ?
C49 C48 P3 Au3 178.1(5) . . . . ?
C53 C48 P3 Au3 -2.7(8) . . . . ?
C55 C54 P3 C48 75.2(15) . . . . ?
C55 C54 P3 C42 -175.5(14) . . . . ?
C55 C54 P3 Au3 -51.5(17) . . . . ?
C47 C42 P3 C48 110.9(18) . . . . ?
C43 C42 P3 C48 -66.9(15) . . . . ?
C47 C42 P3 C54 -2.7(19) . . . . ?
C43 C42 P3 C54 179.5(14) . . . . ?
C47 C42 P3 Au3 -129.0(16) . . . . ?
C43 C42 P3 Au3 53.1(16) . . . . ?
C111 C84 P4 C78 73.7(15) . . . . ?
C111 C84 P4 C72 -177.1(13) . . . . ?
C111 C84 P4 Au4 -54.9(15) . . . . ?
C83 C78 P4 C84 -129.3(17) . . . . ?
C79 C78 P4 C84 52.1(17) . . . . ?
C83 C78 P4 C72 121.0(18) . . . . ?
C79 C78 P4 C72 -57.6(16) . . . . ?
C83 C78 P4 Au4 2.3(19) . . . . ?
C79 C78 P4 Au4 -176.3(12) . . . . ?
C73 C72 P4 C84 -173.8(16) . . . . ?
C77 C72 P4 C84 0.6(18) . . . . ?
C73 C72 P4 C78 -59.3(17) . . . . ?
C77 C72 P4 C78 115.1(17) . . . . ?
C73 C72 P4 Au4 60.0(17) . . . . ?
C77 C72 P4 Au4 -125.6(15) . . . . ?
C111 C97 P5 C91 74.4(16) . . . . ?
C111 C97 P5 C85 -179.1(14) . . . . ?
C111 C97 P5 Au5 -54.7(16) . . . . ?
C92 C91 P5 C97 51(2) . . . . ?
C96 C91 P5 C97 -129.9(18) . . . . ?
C92 C91 P5 C85 -58(2) . . . . ?
C96 C91 P5 C85 120.9(19) . . . . ?
C92 C91 P5 Au5 -177.0(16) . . . . ?
C96 C91 P5 Au5 2(2) . . . . ?
C90 C85 P5 C97 -2.5(19) . . . . ?
C86 C85 P5 C97 178.6(15) . . . . ?
C90 C85 P5 C91 110.3(19) . . . . ?
C86 C85 P5 C91 -68.6(17) . . . . ?
C90 C85 P5 Au5 -130.2(16) . . . . ?
C86 C85 P5 Au5 50.9(16) . . . . ?
C111 C110 P6 C98 179.2(11) . . . . ?
C111 C110 P6 C104 70.3(14) . . . . ?
C111 C110 P6 Au6 -59.3(14) . . . . ?
C99 C98 P6 C110 176.5(8) . . . . ?
C103 C98 P6 C110 -8.9(9) . . . . ?
C99 C98 P6 C104 -67.0(9) . . . . ?
C103 C98 P6 C104 107.6(9) . . . . ?
C99 C98 P6 Au6 49.9(7) . . . . ?
C103 C98 P6 Au6 -135.5(6) . . . . ?
C105 C104 P6 C110 -128.4(19) . . . . ?
C109 C104 P6 C110 45.2(18) . . . . ?
C105 C104 P6 C98 121.6(19) . . . . ?
C109 C104 P6 C98 -64.8(17) . . . . ?
C105 C104 P6 Au6 5(2) . . . . ?
C109 C104 P6 Au6 178.5(14) . . . . ?
C133 C128 P7 C134 -63.7(17) . . . . ?
C129 C128 P7 C134 119.6(16) . . . . ?
C133 C128 P7 C140 46.0(18) . . . . ?
C129 C128 P7 C140 -130.8(15) . . . . ?
C133 C128 P7 Au7 178.6(14) . . . . ?
C129 C128 P7 Au7 1.8(18) . . . . ?
C135 C134 P7 C128 -63.7(8) . . . . ?
C139 C134 P7 C128 115.8(9) . . . . ?
C135 C134 P7 C140 -177.0(7) . . . . ?
C139 C134 P7 C140 2.6(9) . . . . ?
C135 C134 P7 Au7 52.7(7) . . . . ?
C139 C134 P7 Au7 -127.8(6) . . . . ?
C167 C140 P7 C128 73.1(14) . . . . ?
C167 C140 P7 C134 178.6(12) . . . . ?
C167 C140 P7 Au7 -55.0(14) . . . . ?
C148 C147 P8 C141 -64.2(9) . . . . ?
C152 C147 P8 C141 115.9(10) . . . . ?
C148 C147 P8 C153 -176.2(8) . . . . ?
C152 C147 P8 C153 4.0(10) . . . . ?
C148 C147 P8 Au8 55.1(8) . . . . ?
C152 C147 P8 Au8 -124.7(8) . . . . ?
C146 C141 P8 C147 120.9(15) . . . . ?
C142 C141 P8 C147 -60.2(16) . . . . ?
C146 C141 P8 C153 -133.3(15) . . . . ?
C142 C141 P8 C153 45.6(17) . . . . ?
C146 C141 P8 Au8 0.1(17) . . . . ?
C142 C141 P8 Au8 179.0(13) . . . . ?
C167 C153 P8 C147 -178.5(12) . . . . ?
C167 C153 P8 C141 75.3(14) . . . . ?
C167 C153 P8 Au8 -53.7(15) . . . . ?
C165 C160 P9 C166 -131.8(16) . . . . ?
C161 C160 P9 C166 50.7(16) . . . . ?
C165 C160 P9 C154 118.9(17) . . . . ?
C161 C160 P9 C154 -58.6(16) . . . . ?
C165 C160 P9 Au9 -1.2(18) . . . . ?
C161 C160 P9 Au9 -178.7(12) . . . . ?
C167 C166 P9 C160 72.8(14) . . . . ?
C167 C166 P9 C154 -176.6(13) . . . . ?
C167 C166 P9 Au9 -54.8(15) . . . . ?
C155 C154 P9 C160 -65.1(19) . . . . ?
C159 C154 P9 C160 110.3(17) . . . . ?
C155 C154 P9 C166 179.9(18) . . . . ?
C159 C154 P9 C166 -4.7(18) . . . . ?
C155 C154 P9 Au9 54.7(19) . . . . ?
C159 C154 P9 Au9 -129.9(15) . . . . ?
C195 C190 P10 C184 -54.9(16) . . . . ?
C191 C190 P10 C184 125.8(14) . . . . ?
C195 C190 P10 C196 -168.9(14) . . . . ?
C191 C190 P10 C196 11.8(16) . . . . ?
C195 C190 P10 Au10 66.1(15) . . . . ?
C191 C190 P10 Au10 -113.2(13) . . . . ?
C189 C184 P10 C190 120.2(16) . . . . ?
C185 C184 P10 C190 -55.5(16) . . . . ?
C189 C184 P10 C196 -130.8(16) . . . . ?
C185 C184 P10 C196 53.5(16) . . . . ?
C189 C184 P10 Au10 0.0(17) . . . . ?
C185 C184 P10 Au10 -175.7(12) . . . . ?
C223 C196 P10 C190 -179.4(12) . . . . ?
C223 C196 P10 C184 72.0(14) . . . . ?
C223 C196 P10 Au10 -57.2(13) . . . . ?
C223 C209 P11 C197 -174.0(12) . . . . ?
C223 C209 P11 C203 76.2(14) . . . . ?
C223 C209 P11 Au11 -52.4(14) . . . . ?
C198 C197 P11 C209 178.8(15) . . . . ?
C202 C197 P11 C209 -4.1(16) . . . . ?
C198 C197 P11 C203 -68.9(17) . . . . ?
C202 C197 P11 C203 108.1(15) . . . . ?
C198 C197 P11 Au11 51.0(16) . . . . ?
C202 C197 P11 Au11 -132.0(13) . . . . ?
C208 C203 P11 C209 -129.9(15) . . . . ?
C204 C203 P11 C209 53.9(16) . . . . ?
C208 C203 P11 C197 119.8(16) . . . . ?
C204 C203 P11 C197 -56.4(16) . . . . ?
C208 C203 P11 Au11 2.3(17) . . . . ?
C204 C203 P11 Au11 -173.9(13) . . . . ?
C215 C210 P12 C216 109(2) . . . . ?
C211 C210 P12 C216 -68(2) . . . . ?
C215 C210 P12 C222 -6(2) . . . . ?
C211 C210 P12 C222 176.4(19) . . . . ?
C215 C210 P12 Au12 -132.0(18) . . . . ?
C211 C210 P12 Au12 50(2) . . . . ?
C221 C216 P12 C210 114.8(19) . . . . ?
C217 C216 P12 C210 -61.7(19) . . . . ?
C221 C216 P12 C222 -137.8(17) . . . . ?
C217 C216 P12 C222 45.6(19) . . . . ?
C221 C216 P12 Au12 -6(2) . . . . ?
C217 C216 P12 Au12 177.6(15) . . . . ?
C223 C222 P12 C210 176.7(14) . . . . ?
C223 C222 P12 C216 69.8(15) . . . . ?
C223 C222 P12 Au12 -59.2(14) . . . . ?
