#------------------------------------------------------------------------------
#$Date: 2021-01-04 05:02:55 +0200 (Mon, 04 Jan 2021) $
#$Revision: 260408 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/51/83/4518316.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_4518316
loop_
_publ_author_name
'Huang, Ya-Zi'
'Shi, Lin-Xi'
'Wang, Jin-Yun'
'Su, Hai-Feng'
'Chen, Zhong-Ning'
_publ_section_title
;
 Elaborate Design of Ag₈Au₁₀ Cluster [2]Catenane
 Phosphors for High-Efficiency Light-Emitting Devices.
;
_journal_issue                   51
_journal_name_full               'ACS applied materials & interfaces'
_journal_page_first              57264
_journal_page_last               57270
_journal_paper_doi               10.1021/acsami.0c17091
_journal_volume                  12
_journal_year                    2020
_chemical_formula_sum            'C336 H304 Ag8 Au10 Cl2 N8 O8 P8'
_chemical_formula_weight         7733.14
_space_group_crystal_system      tetragonal
_space_group_IT_number           89
_space_group_name_Hall           'P 4 2'
_space_group_name_H-M_alt        'P 4 2 2'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   40.5381(12)
_cell_length_b                   40.5381(12)
_cell_length_c                   24.2982(6)
_cell_measurement_reflns_used    9904
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.06
_cell_measurement_theta_min      2.25
_cell_volume                     39930.1(19)
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0373
_diffrn_reflns_av_unetI/netI     0.0504
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       50
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       40
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            106419
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.377
_diffrn_reflns_theta_min         2.235
_exptl_absorpt_coefficient_mu    4.129
_exptl_absorpt_correction_T_max  0.7454
_exptl_absorpt_correction_T_min  0.5958
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            RED
_exptl_crystal_density_diffrn    1.286
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             15040
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.080
_platon_squeeze_details
;
The unit cell contains solvents molecules and eight ClO4- anions which have been treated as 
a diffuse contribution to the overall scattering without specific atom 
positions by SQUEEZE/PLATON. 
;
_refine_diff_density_max         5.705
_refine_diff_density_min         -1.803
_refine_diff_density_rms         0.147
_refine_ls_abs_structure_details
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   0.494(6)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1595
_refine_ls_number_reflns         40698
_refine_ls_number_restraints     761
_refine_ls_restrained_S_all      1.066
_refine_ls_R_factor_all          0.0708
_refine_ls_R_factor_gt           0.0529
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1464
_refine_ls_wR_factor_ref         0.1572
_reflns_Friedel_coverage         0.863
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.999
_reflns_number_gt                31797
_reflns_number_total             40698
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            am0c17091_si_003.cif
_cod_data_source_block           PPH3
_cod_depositor_comments
'Adding full bibliography for 4518314--4518316.cif.'
_cod_original_cell_volume        39930(3)
_cod_database_code               4518316
_shelx_shelxl_version_number     2016/6
_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   0.683
_shelx_estimated_absorpt_t_max   0.734
_platon_squeeze_void_probe_radius 1.20
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x, z'
'-x, -y, z'
'y, -x, z'
'x, -y, -z'
'y, x, -z'
'-x, y, -z'
'-y, -x, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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 0.78942(2) 0.71211(2) 0.69845(2) 0.04628(13) Uani 1 1 d . . . . .
Au2 Au 0.74946(2) 0.74875(2) 0.43778(2) 0.03195(10) Uani 1 1 d . . . . .
Au3 Au 0.71427(2) 0.77812(2) 0.70079(2) 0.03884(12) Uani 1 1 d . . . . .
Au4 Au 0.66315(2) 0.83015(2) 0.71806(2) 0.05234(15) Uani 1 1 d . . . . .
Au5 Au 0.83836(2) 0.65440(2) 0.76286(3) 0.0726(2) Uani 1 1 d . . . . .
Ag1 Ag 0.72070(2) 0.71063(2) 0.65760(3) 0.0388(2) Uani 1 1 d . . . . .
Ag2 Ag 0.77967(2) 0.77962(3) 0.65717(3) 0.0446(2) Uani 1 1 d . . . . .
Ag3 Ag 0.70909(3) 0.81124(3) 0.80660(4) 0.0530(3) Uani 1 1 d . . . . .
Ag4 Ag 0.86879(4) 0.70235(4) 0.68940(7) 0.0847(4) Uani 1 1 d . . . . .
P4 P 0.91163(13) 0.67284(18) 0.6429(3) 0.102(2) Uani 1 1 d D . . . .
C1 C 0.8561(6) 0.6982(6) 0.7883(7) 0.102(8) Uani 1 1 d . . . . .
C2 C 0.8679(4) 0.7252(4) 0.8035(7) 0.057(4) Uani 1 1 d . . . . .
C3 C 0.8804(4) 0.7546(4) 0.8271(5) 0.051(3) Uani 1 1 d . . . . .
C4 C 0.9105(4) 0.7555(4) 0.8585(6) 0.067(4) Uani 1 1 d . U . . .
H4A H 0.922864 0.735754 0.862028 0.081 Uiso 1 1 calc R U . . .
C5 C 0.9216(4) 0.7821(4) 0.8824(5) 0.060(3) Uani 1 1 d . U . . .
C6 C 0.9522(4) 0.7802(6) 0.9209(6) 0.077(6) Uani 1 1 d . . . . .
C7 C 0.9790(5) 0.7606(7) 0.8911(7) 0.107(8) Uani 1 1 d . . . . .
H7A H 0.983413 0.770723 0.855234 0.160 Uiso 1 1 calc R U . . .
H7B H 0.999249 0.760723 0.913212 0.160 Uiso 1 1 calc R U . . .
H7C H 0.971619 0.737806 0.885807 0.160 Uiso 1 1 calc R U . . .
C8 C 0.9447(5) 0.7673(8) 0.9717(7) 0.149(13) Uani 1 1 d . . . . .
H8A H 0.935125 0.745308 0.967282 0.224 Uiso 1 1 calc R U . . .
H8B H 0.964856 0.765820 0.993860 0.224 Uiso 1 1 calc R U . . .
H8C H 0.928803 0.781758 0.990271 0.224 Uiso 1 1 calc R U . . .
C9 C 0.9655(6) 0.8113(7) 0.9333(13) 0.155(13) Uani 1 1 d . . . . .
H9A H 0.971688 0.822504 0.899149 0.232 Uiso 1 1 calc R U . . .
H9B H 0.949022 0.824476 0.952973 0.232 Uiso 1 1 calc R U . . .
H9C H 0.985075 0.808538 0.956562 0.232 Uiso 1 1 calc R U . . .
C10 C 0.9032(3) 0.8121(4) 0.8788(5) 0.056(3) Uani 1 1 d . U . . .
H10A H 0.910199 0.831313 0.898110 0.067 Uiso 1 1 calc R U . . .
C11 C 0.8746(3) 0.8126(3) 0.8461(5) 0.042(3) Uani 1 1 d . . . . .
C12 C 0.8637(3) 0.7829(3) 0.8205(5) 0.047(3) Uani 1 1 d . . . . .
C13 C 0.8256(3) 0.8236(3) 0.7986(5) 0.047(3) Uani 1 1 d . . . . .
C14 C 0.8502(4) 0.8391(4) 0.8328(5) 0.061(4) Uani 1 1 d . . . . .
C15 C 0.8481(4) 0.8720(4) 0.8416(5) 0.051(4) Uani 1 1 d . . . . .
H15A H 0.864690 0.882722 0.862740 0.061 Uiso 1 1 calc R U . . .
C16 C 0.8219(3) 0.8907(3) 0.8198(5) 0.043(3) Uani 1 1 d . . . . .
C17 C 0.8195(5) 0.9261(3) 0.8321(6) 0.066(4) Uani 1 1 d . U . . .
C18 C 0.8541(6) 0.9396(5) 0.8241(9) 0.106(6) Uani 1 1 d . U . . .
H18A H 0.854166 0.963318 0.831758 0.159 Uiso 1 1 calc R U . . .
H18B H 0.869241 0.928402 0.849418 0.159 Uiso 1 1 calc R U . . .
H18C H 0.861168 0.935731 0.786118 0.159 Uiso 1 1 calc R U . . .
C19 C 0.7909(5) 0.9442(4) 0.7980(7) 0.086(5) Uani 1 1 d . U . . .
H19A H 0.790451 0.967691 0.807790 0.129 Uiso 1 1 calc R U . . .
H19B H 0.795187 0.941935 0.758507 0.129 Uiso 1 1 calc R U . . .
H19C H 0.769573 0.934191 0.806929 0.129 Uiso 1 1 calc R U . . .
C20 C 0.8112(5) 0.9310(4) 0.8934(6) 0.078(5) Uani 1 1 d . U . . .
H20A H 0.809645 0.954580 0.901515 0.116 Uiso 1 1 calc R U . . .
H20B H 0.790113 0.920274 0.901724 0.116 Uiso 1 1 calc R U . . .
H20C H 0.828638 0.921085 0.916035 0.116 Uiso 1 1 calc R U . . .
C21 C 0.7983(4) 0.8735(4) 0.7896(5) 0.054(4) Uani 1 1 d . . . . .
H21A H 0.779689 0.885448 0.776818 0.065 Uiso 1 1 calc R U . . .
C22 C 0.8001(3) 0.8392(3) 0.7763(6) 0.047(3) Uani 1 1 d . . . . .
C23 C 0.7734(3) 0.8223(3) 0.7516(5) 0.044(3) Uani 1 1 d . . . . .
C24 C 0.7509(3) 0.8055(3) 0.7294(5) 0.047(3) Uani 1 1 d . . . . .
C25 C 0.7519(3) 0.6858(3) 0.7273(4) 0.042(3) Uani 1 1 d . . . . .
C26 C 0.7276(3) 0.6718(3) 0.7463(5) 0.041(3) Uani 1 1 d . . . . .
C27 C 0.7007(3) 0.6563(3) 0.7755(4) 0.036(3) Uani 1 1 d . . . . .
C28 C 0.6993(3) 0.6228(3) 0.7856(5) 0.048(3) Uani 1 1 d . . . . .
H28A H 0.716512 0.609468 0.771096 0.057 Uiso 1 1 calc R U . . .
C29 C 0.6748(4) 0.6072(4) 0.8149(5) 0.050(3) Uani 1 1 d . . . . .
C30 C 0.6741(5) 0.5714(4) 0.8298(6) 0.079(6) Uani 1 1 d . . . . .
C31 C 0.7023(6) 0.5522(4) 0.7974(7) 0.086(6) Uani 1 1 d . . . . .
H31A H 0.700327 0.556753 0.757887 0.129 Uiso 1 1 calc R U . . .
H31B H 0.723964 0.559672 0.810414 0.129 Uiso 1 1 calc R U . . .
H31C H 0.700123 0.528457 0.803813 0.129 Uiso 1 1 calc R U . . .
C32 C 0.6391(5) 0.5573(5) 0.8128(10) 0.116(9) Uani 1 1 d . . . . .
H32A H 0.635795 0.560490 0.773250 0.175 Uiso 1 1 calc R U . . .
H32B H 0.638072 0.533768 0.821580 0.175 Uiso 1 1 calc R U . . .
H32C H 0.621875 0.569091 0.833188 0.175 Uiso 1 1 calc R U . . .
C33 C 0.6761(6) 0.5652(4) 0.8903(6) 0.101(8) Uani 1 1 d . . . . .
H33A H 0.675540 0.541364 0.897226 0.152 Uiso 1 1 calc R U . . .
H33B H 0.696803 0.574333 0.904573 0.152 Uiso 1 1 calc R U . . .
H33C H 0.657431 0.575756 0.908752 0.152 Uiso 1 1 calc R U . . .
C34 C 0.6499(4) 0.6272(4) 0.8351(5) 0.054(4) Uani 1 1 d . . . . .
H34A H 0.632765 0.617095 0.855855 0.065 Uiso 1 1 calc R U . . .
C35 C 0.6486(3) 0.6596(4) 0.8273(4) 0.047(4) Uani 1 1 d . . . . .
C36 C 0.6748(3) 0.6747(4) 0.7947(5) 0.050(3) Uani 1 1 d . . . . .
C37 C 0.6406(3) 0.7161(3) 0.8207(4) 0.038(3) Uani 1 1 d . . . . .
C38 C 0.6276(3) 0.6856(4) 0.8442(5) 0.047(3) Uani 1 1 d . . . . .
C39 C 0.5980(3) 0.6889(4) 0.8742(5) 0.046(3) Uani 1 1 d . . . . .
H39A H 0.587330 0.669517 0.886971 0.055 Uiso 1 1 calc R U . . .
C40 C 0.5843(3) 0.7177(5) 0.8854(6) 0.077(6) Uani 1 1 d D . . . .
C41 C 0.5529(4) 0.7197(5) 0.9219(6) 0.097(5) Uani 0.5 1 d D U P . .
C41' C 0.5529(4) 0.7197(5) 0.9219(6) 0.097(5) Uani 0.5 1 d D U P . .
C42 C 0.5500(8) 0.7545(6) 0.9450(15) 0.105(7) Uani 0.5 1 d D U P . .
H42A H 0.556272 0.776430 0.958386 0.158 Uiso 0.5 1 calc R U P . .
H42B H 0.558970 0.751199 0.907931 0.158 Uiso 0.5 1 calc R U P . .
H42C H 0.525894 0.752787 0.943786 0.158 Uiso 0.5 1 calc R U P . .
C42' C 0.5621(7) 0.7314(13) 0.9789(8) 0.102(7) Uani 0.5 1 d D U P . .
H42D H 0.567256 0.741441 1.014590 0.152 Uiso 0.5 1 calc R U P . .
H42E H 0.545683 0.713948 0.983954 0.152 Uiso 0.5 1 calc R U P . .
H42F H 0.582220 0.722026 0.962963 0.152 Uiso 0.5 1 calc R U P . .
C43 C 0.5253(5) 0.7347(12) 0.8891(13) 0.101(7) Uani 0.5 1 d D U P . .
H43A H 0.507440 0.744928 0.867852 0.151 Uiso 0.5 1 calc R U P . .
H43B H 0.523579 0.741452 0.927679 0.151 Uiso 0.5 1 calc R U P . .
H43C H 0.546611 0.741815 0.874191 0.151 Uiso 0.5 1 calc R U P . .
C43' C 0.5235(4) 0.7108(12) 0.8865(12) 0.097(8) Uani 0.5 1 d D U P . .
H43D H 0.504511 0.704952 0.863585 0.146 Uiso 0.5 1 calc R U P . .
H43E H 0.543681 0.701839 0.869924 0.146 Uiso 0.5 1 calc R U P . .
H43F H 0.520649 0.701476 0.923412 0.146 Uiso 0.5 1 calc R U P . .
C44 C 0.5407(8) 0.6852(6) 0.9344(14) 0.094(7) Uani 0.5 1 d D U P . .
H44A H 0.540816 0.661097 0.936388 0.141 Uiso 0.5 1 calc R U P . .
H44B H 0.518023 0.693313 0.938139 0.141 Uiso 0.5 1 calc R U P . .
H44C H 0.549665 0.692280 0.898794 0.141 Uiso 0.5 1 calc R U P . .
C44' C 0.5567(8) 0.6959(10) 0.9694(12) 0.107(7) Uani 0.5 1 d D U P . .
H44D H 0.558421 0.679627 0.999102 0.161 Uiso 0.5 1 calc R U P . .
H44E H 0.578754 0.700939 0.955251 0.161 Uiso 0.5 1 calc R U P . .
H44F H 0.546464 0.716070 0.983508 0.161 Uiso 0.5 1 calc R U P . .
C45 C 0.5976(4) 0.7472(5) 0.8627(5) 0.063(4) Uani 1 1 d . . . . .
H45A H 0.586870 0.767610 0.869690 0.076 Uiso 1 1 calc R U . . .
C46 C 0.6259(3) 0.7468(3) 0.8307(5) 0.040(3) Uani 1 1 d . . . . .
C47 C 0.6389(3) 0.7777(4) 0.8047(5) 0.044(3) Uani 1 1 d . . . . .
C48 C 0.6513(3) 0.7993(4) 0.7785(5) 0.051(4) Uani 1 1 d . . . . .
C49 C 0.7056(3) 0.7281(3) 0.4369(4) 0.030(2) Uani 1 1 d . U . . .
C50 C 0.6783(18) 0.7141(13) 0.437(3) 0.031(5) Uani 0.5 1 d . U P . .
C50' C 0.6806(17) 0.7096(12) 0.436(3) 0.027(5) Uani 0.5 1 d . U P . .
C51 C 0.6500(3) 0.6944(3) 0.4460(4) 0.031(2) Uani 1 1 d . U . . .
C52 C 0.6338(3) 0.6729(3) 0.4075(4) 0.033(2) Uani 1 1 d . U . . .
H52A H 0.643419 0.670596 0.372056 0.040 Uiso 1 1 calc R U . . .
C53 C 0.6057(3) 0.6556(3) 0.4182(4) 0.031(2) Uani 1 1 d . U . . .
C54 C 0.5891(3) 0.6321(3) 0.3764(5) 0.042(3) Uani 1 1 d . . . . .
C55 C 0.6120(4) 0.6282(3) 0.3244(5) 0.047(3) Uani 1 1 d . . . . .
H55A H 0.633783 0.620296 0.336014 0.071 Uiso 1 1 calc R U . . .
H55B H 0.602169 0.612350 0.298862 0.071 Uiso 1 1 calc R U . . .
H55C H 0.614399 0.649635 0.306082 0.071 Uiso 1 1 calc R U . . .
C56 C 0.5842(4) 0.5967(3) 0.4007(6) 0.058(4) Uani 1 1 d . . . . .
H56A H 0.605717 0.587451 0.410778 0.087 Uiso 1 1 calc R U . . .
H56B H 0.570155 0.597911 0.433431 0.087 Uiso 1 1 calc R U . . .
H56C H 0.573733 0.582570 0.373040 0.087 Uiso 1 1 calc R U . . .
C57 C 0.5550(3) 0.6443(4) 0.3622(6) 0.057(4) Uani 1 1 d . . . . .
H57A H 0.544752 0.629224 0.335705 0.086 Uiso 1 1 calc R U . . .
H57B H 0.541489 0.645259 0.395643 0.086 Uiso 1 1 calc R U . . .
H57C H 0.556488 0.666410 0.345980 0.086 Uiso 1 1 calc R U . . .
C58 C 0.5901(3) 0.6591(3) 0.4694(4) 0.033(2) Uani 1 1 d . . . . .
H58A H 0.570131 0.647668 0.476642 0.040 Uiso 1 1 calc R U . . .
C59 C 0.6040(2) 0.6797(3) 0.5101(4) 0.028(2) Uani 1 1 d . . . . .
C60 C 0.6336(3) 0.6969(3) 0.4982(4) 0.032(2) Uani 1 1 d . U . . .
C61 C 0.6770(3) 0.7498(3) 0.6735(5) 0.041(3) Uani 1 1 d . . . . .
C62 C 0.6534(3) 0.7342(3) 0.6601(4) 0.035(3) Uani 1 1 d . . . . .
C63 C 0.6255(3) 0.7161(3) 0.6420(4) 0.036(3) Uani 1 1 d . . . . .
C64 C 0.6004(3) 0.7054(3) 0.6771(5) 0.041(3) Uani 1 1 d . . . . .
H64A H 0.601213 0.711189 0.714941 0.049 Uiso 1 1 calc R U . . .
C65 C 0.5727(3) 0.6854(4) 0.6565(5) 0.047(3) Uani 1 1 d . . . . .
C66 C 0.5445(3) 0.6777(5) 0.6961(6) 0.070(5) Uani 1 1 d . . . . .
C67 C 0.5532(4) 0.6790(5) 0.7557(5) 0.078(6) Uani 1 1 d . . . . .
H67A H 0.573987 0.667320 0.761862 0.117 Uiso 1 1 calc R U . . .
H67B H 0.555528 0.702072 0.767122 0.117 Uiso 1 1 calc R U . . .
H67C H 0.535623 0.668526 0.777257 0.117 Uiso 1 1 calc R U . . .
C68 C 0.5153(4) 0.6931(6) 0.6787(7) 0.108(9) Uani 1 1 d . . . . .
H68A H 0.512826 0.690256 0.638820 0.162 Uiso 1 1 calc R U . . .
H68B H 0.496451 0.683119 0.697555 0.162 Uiso 1 1 calc R U . . .
H68C H 0.516357 0.716665 0.687421 0.162 Uiso 1 1 calc R U . . .
C69 C 0.5371(6) 0.6394(5) 0.6858(7) 0.118(10) Uani 1 1 d . . . . .
H69A H 0.556264 0.626262 0.696801 0.177 Uiso 1 1 calc R U . . .
H69B H 0.517849 0.632697 0.707529 0.177 Uiso 1 1 calc R U . . .
H69C H 0.532532 0.635745 0.646603 0.177 Uiso 1 1 calc R U . . .
C70 C 0.5716(3) 0.6769(3) 0.6023(5) 0.039(3) Uani 1 1 d . . . . .
H70A H 0.553496 0.664434 0.588529 0.047 Uiso 1 1 calc R U . . .
C71 C 0.5967(3) 0.6864(3) 0.5677(5) 0.037(3) Uani 1 1 d . . . . .
C72 C 0.6234(3) 0.7071(3) 0.5866(4) 0.035(3) Uani 1 1 d . . . . .
C73 C 0.8245(3) 0.7415(4) 0.6716(5) 0.052(4) Uani 1 1 d . . . . .
C74 C 0.8483(3) 0.7614(4) 0.6558(6) 0.049(3) Uani 1 1 d . . . . .
C75 C 0.8735(3) 0.7809(4) 0.6398(6) 0.047(3) Uani 1 1 d . . . . .
C76 C 0.8992(4) 0.7921(4) 0.6738(6) 0.065(4) Uani 1 1 d . . . . .
H76A H 0.897866 0.786674 0.711742 0.079 Uiso 1 1 calc R U . . .
C77 C 0.9250(4) 0.8093(8) 0.6580(7) 0.123(7) Uani 1 1 d . U . . .
C78 C 0.9562(4) 0.8075(6) 0.6966(6) 0.143(7) Uani 1 1 d D U . . .
C79 C 0.9432(4) 0.8216(7) 0.7491(7) 0.142(8) Uani 1 1 d D U . . .
H79A H 0.925733 0.807288 0.763565 0.213 Uiso 1 1 calc R U . . .
H79B H 0.961071 0.823207 0.776078 0.213 Uiso 1 1 calc R U . . .
H79C H 0.934128 0.843658 0.742120 0.213 Uiso 1 1 calc R U . . .
C80 C 0.9716(6) 0.7732(6) 0.7080(10) 0.184(9) Uani 1 1 d D U . . .
H80A H 0.955004 0.758690 0.724348 0.276 Uiso 1 1 calc R U . . .
H80B H 0.979466 0.763621 0.673314 0.276 Uiso 1 1 calc R U . . .
H80C H 0.990241 0.775639 0.733419 0.276 Uiso 1 1 calc R U . . .
C81 C 0.9826(5) 0.8277(7) 0.6722(7) 0.192(10) Uani 1 1 d D U . . .
H81A H 0.990201 0.817340 0.638039 0.287 Uiso 1 1 calc R U . . .
H81B H 0.974059 0.849777 0.664192 0.287 Uiso 1 1 calc R U . . .
H81C H 1.001002 0.829326 0.698150 0.287 Uiso 1 1 calc R U . . .
C82 C 0.9267(4) 0.8205(4) 0.6013(6) 0.060(4) Uani 1 1 d . . . . .
H82A H 0.945180 0.832894 0.588941 0.072 Uiso 1 1 calc R U . . .
C83 C 0.9006(3) 0.8128(3) 0.5643(5) 0.040(3) Uani 1 1 d . . . . .
C84 C 0.8751(3) 0.7920(3) 0.5828(5) 0.039(3) Uani 1 1 d . . . . .
C85 C 0.8925(3) 0.8200(3) 0.5067(5) 0.038(3) Uani 1 1 d . . . . .
C86 C 0.7941(4) 0.7722(3) 0.4357(4) 0.048(4) Uani 1 1 d . . . . .
C87 C 0.8189(3) 0.7874(3) 0.4325(4) 0.030(2) Uani 1 1 d . . . . .
C88 C 0.8488(3) 0.8043(3) 0.4449(5) 0.039(3) Uani 1 1 d . . . . .
C89 C 0.8641(3) 0.8026(3) 0.4938(5) 0.035(3) Uani 1 1 d . . . . .
C90 C 0.8645(4) 0.8240(4) 0.4048(6) 0.053(4) Uani 1 1 d . . . . .
H90A H 0.855391 0.825006 0.368834 0.064 Uiso 1 1 calc R U . . .
C91 C 0.8931(3) 0.8420(4) 0.4169(5) 0.047(3) Uani 1 1 d . . . . .
C92 C 0.9071(4) 0.8661(4) 0.3715(7) 0.064(4) Uani 1 1 d . . . . .
C93 C 0.8863(4) 0.8683(4) 0.3228(5) 0.062(4) Uani 1 1 d . . . . .
H93A H 0.885068 0.846672 0.304972 0.093 Uiso 1 1 calc R U . . .
H93B H 0.864135 0.875451 0.333485 0.093 Uiso 1 1 calc R U . . .
H93C H 0.895778 0.884369 0.297024 0.093 Uiso 1 1 calc R U . . .
C94 C 0.9414(4) 0.8501(5) 0.3525(8) 0.089(6) Uani 1 1 d . . . . .
H94A H 0.956096 0.848213 0.384260 0.133 Uiso 1 1 calc R U . . .
H94B H 0.937297 0.828179 0.336963 0.133 Uiso 1 1 calc R U . . .
H94C H 0.951630 0.864195 0.324499 0.133 Uiso 1 1 calc R U . . .
C95 C 0.9083(5) 0.9008(4) 0.3980(6) 0.070(5) Uani 1 1 d . . . . .
H95A H 0.922180 0.900098 0.430997 0.105 Uiso 1 1 calc R U . . .
H95B H 0.917589 0.916561 0.371627 0.105 Uiso 1 1 calc R U . . .
H95C H 0.885945 0.907642 0.408088 0.105 Uiso 1 1 calc R U . . .
C96 C 0.9072(3) 0.8391(4) 0.4711(5) 0.052(4) Uani 1 1 d . . . . .
H96A H 0.926659 0.850752 0.480627 0.063 Uiso 1 1 calc R U . . .
C97 C 0.7927(4) 0.5969(4) 0.6943(6) 0.056(4) Uani 1 1 d . . . . .
C98 C 0.7708(6) 0.5693(5) 0.6944(8) 0.097(7) Uani 1 1 d . . . . .
H98A H 0.772112 0.554053 0.723999 0.116 Uiso 1 1 calc R U . . .
C99 C 0.7474(5) 0.5638(5) 0.6524(7) 0.081(5) Uani 1 1 d . . . . .
H99A H 0.734751 0.544118 0.651161 0.097 Uiso 1 1 calc R U . . .
C100 C 0.7433(4) 0.5893(5) 0.6114(7) 0.076(5) Uani 1 1 d . . . . .
H10B H 0.726437 0.587892 0.584404 0.091 Uiso 1 1 calc R U . . .
C101 C 0.7649(4) 0.6160(4) 0.6124(8) 0.072(5) Uani 1 1 d . . . . .
H10C H 0.763988 0.632235 0.584227 0.087 Uiso 1 1 calc R U . . .
C102 C 0.7868(4) 0.6188(5) 0.6532(12) 0.115(9) Uani 1 1 d . . . . .
H10D H 0.799843 0.638298 0.653425 0.138 Uiso 1 1 calc R U . . .
C103 C 0.8566(6) 0.5752(6) 0.7297(10) 0.128(6) Uani 1 1 d D U . . .
C104 C 0.8544(5) 0.5474(6) 0.6966(11) 0.142(6) Uani 1 1 d D U . . .
H10E H 0.834379 0.542197 0.678275 0.170 Uiso 1 1 calc R U . . .
C105 C 0.8824(6) 0.5271(6) 0.6905(12) 0.157(6) Uani 1 1 d D U . . .
H10F H 0.881015 0.507608 0.668961 0.188 Uiso 1 1 calc R U . . .
C106 C 0.9122(6) 0.5355(6) 0.7158(12) 0.157(6) Uani 1 1 d D U . . .
H10G H 0.929846 0.520127 0.715449 0.189 Uiso 1 1 calc R U . . .
C107 C 0.9164(5) 0.5654(6) 0.7411(11) 0.149(6) Uani 1 1 d D U . . .
H10H H 0.937758 0.571263 0.753931 0.179 Uiso 1 1 calc R U . . .
C108 C 0.8906(6) 0.5872(6) 0.7484(11) 0.138(6) Uani 1 1 d D U . . .
H10I H 0.893806 0.608422 0.764151 0.165 Uiso 1 1 calc R U . . .
C115 C 0.7023(3) 0.89556(18) 0.8650(4) 0.069(4) Uani 1 1 d DG U . . .
C116 C 0.7090(3) 0.9197(3) 0.9041(3) 0.075(4) Uani 1 1 d G U . . .
H11A H 0.714777 0.913512 0.940519 0.090 Uiso 1 1 calc R U . . .
C117 C 0.7072(4) 0.9528(2) 0.8898(4) 0.087(4) Uani 1 1 d G U . . .
H11B H 0.711790 0.969334 0.916520 0.105 Uiso 1 1 calc R U . . .
C118 C 0.6987(4) 0.96188(18) 0.8365(5) 0.092(4) Uani 1 1 d G U . . .
H11C H 0.697530 0.984545 0.826718 0.111 Uiso 1 1 calc R U . . .
C119 C 0.6920(3) 0.9378(3) 0.7974(4) 0.090(4) Uani 1 1 d G U . . .
H11D H 0.686259 0.943934 0.760915 0.107 Uiso 1 1 calc R U . . .
C120 C 0.6938(3) 0.9046(2) 0.8116(4) 0.081(4) Uani 1 1 d G U . . .
H12A H 0.689247 0.888111 0.784913 0.097 Uiso 1 1 calc R U . . .
P3 P 0.66914(11) 0.86487(9) 0.64467(16) 0.0561(9) Uani 1 1 d . . . . .
C121 C 0.7378(4) 0.8478(3) 0.9362(4) 0.118(6) Uani 1 1 d DG U . . .
C122 C 0.7303(3) 0.8507(3) 0.9918(5) 0.129(6) Uani 1 1 d G U . . .
H12B H 0.707981 0.852117 1.003336 0.155 Uiso 1 1 calc R U . . .
C123 C 0.7555(4) 0.8513(3) 1.0306(4) 0.129(6) Uani 1 1 d G U . . .
H12C H 0.750404 0.853274 1.068614 0.155 Uiso 1 1 calc R U . . .
C124 C 0.7882(4) 0.8492(3) 1.0138(5) 0.136(6) Uani 1 1 d G U . . .
H12D H 0.805451 0.849684 1.040256 0.163 Uiso 1 1 calc R U . . .
C125 C 0.7957(3) 0.8464(3) 0.9581(6) 0.133(6) Uani 1 1 d G U . . .
H12E H 0.818075 0.844937 0.946618 0.160 Uiso 1 1 calc R U . . .
C126 C 0.7705(4) 0.8457(3) 0.9194(4) 0.134(6) Uani 1 1 d G U . . .
H12F H 0.775653 0.843780 0.881339 0.161 Uiso 1 1 calc R U . . .
N1 N 0.8337(3) 0.7892(3) 0.7918(4) 0.047(3) Uani 1 1 d . . . . .
H1B H 0.822088 0.774667 0.773131 0.056 Uiso 1 1 calc R U . . .
C127 C 0.6393(4) 0.8647(3) 0.9205(7) 0.136(6) Uani 1 1 d DG U . . .
H12G H 0.642486 0.886122 0.905689 0.164 Uiso 1 1 calc R U . . .
C128 C 0.6102(3) 0.8570(4) 0.9477(7) 0.141(6) Uani 1 1 d G U . . .
H12H H 0.593368 0.873161 0.951424 0.170 Uiso 1 1 calc R U . . .
C129 C 0.6055(3) 0.8256(4) 0.9693(7) 0.144(6) Uani 1 1 d G U . . .
H12I H 0.585594 0.820302 0.987879 0.173 Uiso 1 1 calc R U . . .
C130 C 0.6301(4) 0.8019(3) 0.9638(7) 0.133(6) Uani 1 1 d G U . . .
H13A H 0.626936 0.780404 0.978601 0.159 Uiso 1 1 calc R U . . .
C131 C 0.6593(3) 0.8096(3) 0.9366(7) 0.132(6) Uani 1 1 d DG U . . .
H13B H 0.676054 0.793364 0.932867 0.159 Uiso 1 1 calc R U . . .
C132 C 0.6639(3) 0.8410(3) 0.9150(6) 0.130(6) Uani 1 1 d DG U . . .
C133 C 0.6788(4) 0.8431(4) 0.5802(5) 0.068(3) Uani 1 1 d D U . . .
C134 C 0.6973(4) 0.8595(4) 0.5380(5) 0.073(4) Uani 1 1 d D U . . .
H13C H 0.704931 0.881304 0.544104 0.087 Uiso 1 1 calc R U . . .
C135 C 0.7041(4) 0.8440(4) 0.4886(5) 0.074(4) Uani 1 1 d D U . . .
H13D H 0.717672 0.854311 0.461787 0.089 Uiso 1 1 calc R U . . .
C136 C 0.6908(4) 0.8129(4) 0.4792(5) 0.085(4) Uani 1 1 d D U . . .
H13E H 0.694329 0.802317 0.444845 0.102 Uiso 1 1 calc R U . . .
C137 C 0.6723(4) 0.7974(3) 0.5195(5) 0.079(4) Uani 1 1 d D U . . .
H13F H 0.663051 0.776310 0.511842 0.095 Uiso 1 1 calc R U . . .
C138 C 0.6668(4) 0.8117(4) 0.5709(5) 0.068(3) Uani 1 1 d D U . . .
H13G H 0.655158 0.800103 0.598807 0.082 Uiso 1 1 calc R U . . .
C139 C 0.7012(3) 0.8976(3) 0.6536(5) 0.078(4) Uani 1 1 d G U . . .
C140 C 0.7337(3) 0.8870(2) 0.6586(5) 0.072(4) Uani 1 1 d G U . . .
H14A H 0.738478 0.864118 0.660824 0.087 Uiso 1 1 calc R U . . .
C141 C 0.7592(2) 0.9099(3) 0.6604(5) 0.081(4) Uani 1 1 d G U . . .
H14B H 0.781370 0.902704 0.663881 0.097 Uiso 1 1 calc R U . . .
C142 C 0.7522(3) 0.9435(3) 0.6572(6) 0.091(4) Uani 1 1 d G U . . .
H14C H 0.769597 0.959121 0.658484 0.109 Uiso 1 1 calc R U . . .
C143 C 0.7197(3) 0.9540(2) 0.6522(6) 0.097(4) Uani 1 1 d G U . . .
H14D H 0.714931 0.976953 0.650032 0.116 Uiso 1 1 calc R U . . .
C144 C 0.6942(2) 0.9311(3) 0.6504(6) 0.093(4) Uani 1 1 d G U . . .
H14E H 0.672038 0.938367 0.646976 0.112 Uiso 1 1 calc R U . . .
P1 P 0.82222(12) 0.60130(12) 0.74594(19) 0.0699(12) Uani 1 1 d . . . . .
C145 C 0.6297(3) 0.8850(4) 0.6349(6) 0.111(5) Uani 1 1 d G U . . .
C146 C 0.6164(4) 0.8894(4) 0.5827(5) 0.128(5) Uani 1 1 d G U . . .
H14F H 0.626956 0.880023 0.551498 0.153 Uiso 1 1 calc R U . . .
C147 C 0.5876(4) 0.9076(4) 0.5761(5) 0.131(5) Uani 1 1 d G U . . .
H14G H 0.578489 0.910660 0.540390 0.157 Uiso 1 1 calc R U . . .
C148 C 0.5721(3) 0.9214(4) 0.6217(6) 0.133(6) Uani 1 1 d G U . . .
H14H H 0.552419 0.933796 0.617154 0.160 Uiso 1 1 calc R U . . .
C149 C 0.5854(3) 0.9169(4) 0.6739(5) 0.120(5) Uani 1 1 d G U . . .
H14I H 0.574817 0.926297 0.705026 0.144 Uiso 1 1 calc R U . . .
C150 C 0.6142(3) 0.8987(4) 0.6805(4) 0.108(5) Uani 1 1 d G U . . .
H15B H 0.623284 0.895661 0.716134 0.130 Uiso 1 1 calc R U . . .
N3 N 0.6441(2) 0.7136(2) 0.5441(3) 0.031(2) Uani 1 1 d . . . . .
H3A H 0.661562 0.726451 0.545704 0.038 Uiso 1 1 calc R U . . .
C151 C 0.8943(4) 0.6342(3) 0.6151(6) 0.106(5) Uani 1 1 d G U . . .
C152 C 0.9134(3) 0.6060(4) 0.6080(6) 0.113(5) Uani 1 1 d G U . . .
H15C H 0.935405 0.605406 0.621488 0.135 Uiso 1 1 calc R U . . .
C153 C 0.9003(4) 0.5787(4) 0.5813(7) 0.128(5) Uani 1 1 d G U . . .
H15D H 0.913347 0.559404 0.576434 0.153 Uiso 1 1 calc R U . . .
C154 C 0.8681(4) 0.5795(4) 0.5615(6) 0.127(5) Uani 1 1 d G U . . .
H15E H 0.859176 0.560837 0.543255 0.153 Uiso 1 1 calc R U . . .
C155 C 0.8491(3) 0.6077(5) 0.5686(6) 0.119(5) Uani 1 1 d G U . . .
H15F H 0.827064 0.608272 0.555130 0.143 Uiso 1 1 calc R U . . .
C156 C 0.8622(4) 0.6350(4) 0.5954(6) 0.107(5) Uani 1 1 d G U . . .
H15G H 0.849121 0.654274 0.600184 0.129 Uiso 1 1 calc R U . . .
N2 N 0.6687(2) 0.7090(2) 0.7928(4) 0.037(2) Uani 1 1 d . . . . .
H2A H 0.681275 0.723534 0.775959 0.044 Uiso 1 1 calc R U . . .
C157 C 0.9424(5) 0.6757(4) 0.5400(11) 0.208(9) Uani 1 1 d G U . . .
H15H H 0.939037 0.652522 0.539541 0.250 Uiso 1 1 calc R U . . .
C158 C 0.9317(5) 0.6943(6) 0.5847(9) 0.207(9) Uani 1 1 d DG U . . .
C159 C 0.9366(5) 0.7282(6) 0.5854(8) 0.209(9) Uani 1 1 d G U . . .
H15I H 0.929352 0.740863 0.615961 0.251 Uiso 1 1 calc R U . . .
C160 C 0.9521(5) 0.7436(4) 0.5413(11) 0.203(9) Uani 1 1 d G U . . .
H16A H 0.955438 0.766791 0.541737 0.243 Uiso 1 1 calc R U . . .
C161 C 0.9627(4) 0.7251(6) 0.4965(8) 0.206(9) Uani 1 1 d G U . . .
H16B H 0.973323 0.735585 0.466415 0.248 Uiso 1 1 calc R U . . .
C162 C 0.9579(5) 0.6911(6) 0.4959(8) 0.203(9) Uani 1 1 d G U . . .
H16C H 0.965123 0.678451 0.465317 0.243 Uiso 1 1 calc R U . . .
P2 P 0.70351(12) 0.85116(10) 0.88203(13) 0.0625(12) Uani 1 1 d D . . . .
C163 C 0.9463(3) 0.6580(4) 0.6908(7) 0.119(5) Uani 1 1 d G U . . .
C164 C 0.9398(3) 0.6556(4) 0.7468(7) 0.124(5) Uani 1 1 d G U . . .
H16D H 0.918504 0.661040 0.760556 0.149 Uiso 1 1 calc R U . . .
C165 C 0.9644(4) 0.6454(4) 0.7827(5) 0.129(5) Uani 1 1 d G U . . .
H16E H 0.959970 0.643758 0.821030 0.154 Uiso 1 1 calc R U . . .
C166 C 0.9955(4) 0.6375(4) 0.7626(7) 0.139(6) Uani 1 1 d G U . . .
H16F H 1.012350 0.630473 0.787175 0.167 Uiso 1 1 calc R U . . .
C167 C 1.0020(3) 0.6399(4) 0.7066(7) 0.136(6) Uani 1 1 d G U . . .
H16G H 1.023265 0.634470 0.692845 0.163 Uiso 1 1 calc R U . . .
C168 C 0.9774(4) 0.6501(4) 0.6707(6) 0.131(5) Uani 1 1 d G U . . .
H16H H 0.981800 0.651752 0.632369 0.157 Uiso 1 1 calc R U . . .
N4 N 0.8534(2) 0.7853(2) 0.5413(4) 0.036(2) Uani 1 1 d . . . . .
H4B H 0.835865 0.772514 0.543589 0.043 Uiso 1 1 calc R U . . .
C169 C 0.8033(5) 0.5886(5) 0.8086(5) 0.149(7) Uani 1 1 d G U . . .
C170 C 0.8137(5) 0.5586(5) 0.8301(7) 0.158(7) Uani 1 1 d G U . . .
H17A H 0.826708 0.544084 0.808390 0.189 Uiso 1 1 calc R U . . .
C171 C 0.8051(5) 0.5498(4) 0.8835(7) 0.166(7) Uani 1 1 d G U . . .
H17B H 0.812218 0.529268 0.898273 0.199 Uiso 1 1 calc R U . . .
C172 C 0.7861(5) 0.5710(5) 0.9154(5) 0.170(7) Uani 1 1 d G U . . .
H17C H 0.780169 0.564952 0.951855 0.204 Uiso 1 1 calc R U . . .
C173 C 0.7756(5) 0.6010(5) 0.8938(7) 0.166(7) Uani 1 1 d G U . . .
H17D H 0.762610 0.615452 0.915555 0.199 Uiso 1 1 calc R U . . .
C174 C 0.7842(5) 0.6098(4) 0.8404(7) 0.154(7) Uani 1 1 d G U . . .
H17E H 0.777100 0.630268 0.825673 0.185 Uiso 1 1 calc R U . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 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'
Ag Ag -0.8971 1.1015 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
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
C73 Au1 C25 175.2(6) . . ?
C73 Au1 Ag2 54.6(4) . . ?
C25 Au1 Ag2 121.2(4) . . ?
C73 Au1 Ag1 125.6(3) . . ?
C25 Au1 Ag1 52.2(3) . . ?
Ag2 Au1 Ag1 77.18(3) . . ?
C73 Au1 Ag4 48.4(4) . . ?
C25 Au1 Ag4 135.8(4) . . ?
Ag2 Au1 Ag4 102.90(4) . . ?
Ag1 Au1 Ag4 155.15(4) . . ?
C49 Au2 C86 176.8(4) . . ?
C49 Au2 Ag2 123.9(3) . 6_556 ?
C86 Au2 Ag2 53.6(3) . 6_556 ?
C49 Au2 Ag1 50.3(3) . 6_556 ?
C86 Au2 Ag1 128.1(3) . 6_556 ?
Ag2 Au2 Ag1 76.82(3) 6_556 6_556 ?
C49 Au2 Au2 90.3(3) . 6_556 ?
C86 Au2 Au2 91.6(3) . 6_556 ?
Ag2 Au2 Au2 142.78(2) 6_556 6_556 ?
Ag1 Au2 Au2 139.907(19) 6_556 6_556 ?
C24 Au3 C61 178.7(5) . . ?
C24 Au3 Ag2 54.7(4) . . ?
C61 Au3 Ag2 125.9(3) . . ?
C24 Au3 Ag3 59.0(4) . . ?
C61 Au3 Ag3 120.1(3) . . ?
Ag2 Au3 Ag3 112.66(3) . . ?
C24 Au3 Ag1 125.5(4) . . ?
C61 Au3 Ag1 54.4(3) . . ?
Ag2 Au3 Ag1 78.76(3) . . ?
Ag3 Au3 Ag1 138.69(3) . . ?
C24 Au3 Au4 94.3(4) . . ?
C61 Au3 Au4 85.9(3) . . ?
Ag2 Au3 Au4 132.94(3) . . ?
Ag3 Au3 Au4 59.98(3) . . ?
Ag1 Au3 Au4 140.21(3) . . ?
C48 Au4 P3 171.8(4) . . ?
C48 Au4 Ag3 56.6(4) . . ?
P3 Au4 Ag3 131.53(11) . . ?
C48 Au4 Au3 80.0(4) . . ?
P3 Au4 Au3 104.58(10) . . ?
Ag3 Au4 Au3 58.69(2) . . ?
C1 Au5 P1 171.0(4) . . ?
C1 Au5 Ag4 56.5(5) . . ?
P1 Au5 Ag4 129.72(12) . . ?
C49 Ag1 C25 127.4(4) 6_556 . ?
C49 Ag1 C61 108.1(4) 6_556 . ?
C25 Ag1 C61 124.4(4) . . ?
C49 Ag1 C50' 28.7(16) 6_556 6_556 ?
C25 Ag1 C50' 121.4(13) . 6_556 ?
C61 Ag1 C50' 108.6(11) . 6_556 ?
C49 Ag1 C50 27.9(16) 6_556 6_556 ?
C25 Ag1 C50 117.8(14) . 6_556 ?
C61 Ag1 C50 112.9(12) . 6_556 ?
C50' Ag1 C50 4(2) 6_556 6_556 ?
C49 Ag1 C26 136.7(4) 6_556 . ?
C25 Ag1 C26 27.1(4) . . ?
C61 Ag1 C26 109.6(4) . . ?
C50' Ag1 C26 116.3(16) 6_556 . ?
C50 Ag1 C26 114.5(17) 6_556 . ?
C49 Ag1 Au3 116.5(3) 6_556 . ?
C25 Ag1 Au3 101.0(3) . . ?
C61 Ag1 Au3 42.7(3) . . ?
C50' Ag1 Au3 136.6(14) 6_556 . ?
C50 Ag1 Au3 139.3(16) 6_556 . ?
C26 Ag1 Au3 105.6(3) . . ?
C49 Ag1 Au1 102.2(3) 6_556 . ?
C25 Ag1 Au1 42.0(3) . . ?
C61 Ag1 Au1 128.7(3) . . ?
C50' Ag1 Au1 117.6(11) 6_556 . ?
C50 Ag1 Au1 113.3(11) 6_556 . ?
C26 Ag1 Au1 69.1(3) . . ?
Au3 Ag1 Au1 86.84(3) . . ?
C49 Ag1 Au2 40.6(3) 6_556 6_556 ?
C25 Ag1 Au2 125.1(3) . 6_556 ?
C61 Ag1 Au2 93.2(3) . 6_556 ?
C50' Ag1 Au2 69.0(16) 6_556 6_556 ?
C50 Ag1 Au2 68.5(16) 6_556 6_556 ?
C26 Ag1 Au2 151.8(3) . 6_556 ?
Au3 Ag1 Au2 79.78(3) . 6_556 ?
Au1 Ag1 Au2 83.83(3) . 6_556 ?
C86 Ag2 C24 122.7(4) 6_556 . ?
C86 Ag2 C73 113.4(4) 6_556 . ?
C24 Ag2 C73 123.5(4) . . ?
C86 Ag2 Au3 104.0(3) 6_556 . ?
C24 Ag2 Au3 43.3(4) . . ?
C73 Ag2 Au3 129.2(4) . . ?
C86 Ag2 Au2 44.4(4) 6_556 6_556 ?
C24 Ag2 Au2 124.5(3) . 6_556 ?
C73 Ag2 Au2 99.9(3) . 6_556 ?
Au3 Ag2 Au2 83.39(3) . 6_556 ?
C86 Ag2 Au1 125.2(4) 6_556 . ?
C24 Ag2 Au1 103.1(3) . . ?
C73 Ag2 Au1 41.7(4) . . ?
Au3 Ag2 Au1 88.76(3) . . ?
Au2 Ag2 Au1 86.39(3) 6_556 . ?
P2 Ag3 C48 104.3(3) . . ?
P2 Ag3 C24 132.4(3) . . ?
C48 Ag3 C24 114.1(4) . . ?
P2 Ag3 Au3 166.13(10) . . ?
C48 Ag3 Au3 74.7(3) . . ?
C24 Ag3 Au3 41.9(3) . . ?
P2 Ag3 Au4 108.38(11) . . ?
C48 Ag3 Au4 41.9(4) . . ?
C24 Ag3 Au4 84.6(3) . . ?
Au3 Ag3 Au4 61.33(2) . . ?
P4 Ag4 C73 141.0(3) . . ?
P4 Ag4 C1 125.3(5) . . ?
C73 Ag4 C1 93.7(5) . . ?
P4 Ag4 C74 122.1(4) . . ?
C73 Ag4 C74 29.5(4) . . ?
C1 Ag4 C74 107.2(6) . . ?
P4 Ag4 Au5 105.26(16) . . ?
C73 Ag4 Au5 103.4(4) . . ?
C1 Ag4 Au5 43.0(7) . . ?
C74 Ag4 Au5 131.0(3) . . ?
P4 Ag4 Au1 144.25(17) . . ?
C73 Ag4 Au1 37.1(4) . . ?
C1 Ag4 Au1 74.7(5) . . ?
C74 Ag4 Au1 66.6(3) . . ?
Au5 Ag4 Au1 67.69(4) . . ?
C151 P4 C158 106.7(11) . . ?
C151 P4 C163 103.5(8) . . ?
C158 P4 C163 106.7(9) . . ?
C151 P4 Ag4 108.8(6) . . ?
C158 P4 Ag4 116.5(8) . . ?
C163 P4 Ag4 113.6(6) . . ?
C2 C1 Au5 178.6(19) . . ?
C2 C1 Ag4 98.6(15) . . ?
Au5 C1 Ag4 80.5(7) . . ?
C1 C2 C3 173.4(18) . . ?
C12 C3 C2 119.5(12) . . ?
C12 C3 C4 117.8(13) . . ?
C2 C3 C4 122.7(14) . . ?
C5 C4 C3 123.5(16) . . ?
C5 C4 H4A 118.3 . . ?
C3 C4 H4A 118.3 . . ?
C4 C5 C10 119.7(12) . . ?
C4 C5 C6 120.1(16) . . ?
C10 C5 C6 119.7(14) . . ?
C8 C6 C9 103(2) . . ?
C8 C6 C7 112.8(18) . . ?
C9 C6 C7 107.1(19) . . ?
C8 C6 C5 112.6(15) . . ?
C9 C6 C5 112.9(18) . . ?
C7 C6 C5 108.0(13) . . ?
C6 C7 H7A 109.5 . . ?
C6 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C6 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C6 C9 H9A 109.5 . . ?
C6 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C6 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C11 C10 C5 118.5(13) . . ?
C11 C10 H10A 120.8 . . ?
C5 C10 H10A 120.8 . . ?
C10 C11 C12 119.2(13) . . ?
C10 C11 C14 132.8(13) . . ?
C12 C11 C14 108.0(10) . . ?
C3 C12 C11 121.2(11) . . ?
C3 C12 N1 129.9(11) . . ?
C11 C12 N1 108.9(11) . . ?
C22 C13 C14 124.6(13) . . ?
C22 C13 N1 126.2(11) . . ?
C14 C13 N1 109.2(11) . . ?
C15 C14 C13 118.5(13) . . ?
C15 C14 C11 135.5(13) . . ?
C13 C14 C11 105.8(12) . . ?
C14 C15 C16 121.0(11) . . ?
C14 C15 H15A 119.5 . . ?
C16 C15 H15A 119.5 . . ?
C21 C16 C15 116.7(12) . . ?
C21 C16 C17 123.4(14) . . ?
C15 C16 C17 119.8(12) . . ?
C16 C17 C18 105.4(16) . . ?
C16 C17 C20 109.6(12) . . ?
C18 C17 C20 106.2(14) . . ?
C16 C17 C19 113.0(12) . . ?
C18 C17 C19 115.9(15) . . ?
C20 C17 C19 106.4(16) . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C17 C19 H19A 109.5 . . ?
C17 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C17 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C17 C20 H20A 109.5 . . ?
C17 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C17 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C16 C21 C22 124.8(14) . . ?
C16 C21 H21A 117.6 . . ?
C22 C21 H21A 117.6 . . ?
C13 C22 C23 122.6(13) . . ?
C13 C22 C21 114.2(12) . . ?
C23 C22 C21 121.9(12) . . ?
C24 C23 C22 175.9(14) . . ?
C23 C24 Au3 175.2(12) . . ?
C23 C24 Ag2 101.6(9) . . ?
Au3 C24 Ag2 82.0(5) . . ?
C23 C24 Ag3 96.7(9) . . ?
Au3 C24 Ag3 79.1(5) . . ?
Ag2 C24 Ag3 157.3(6) . . ?
C26 C25 Au1 175.0(12) . . ?
C26 C25 Ag1 92.1(8) . . ?
Au1 C25 Ag1 85.8(4) . . ?
C25 C26 C27 172.7(12) . . ?
C25 C26 Ag1 60.7(7) . . ?
C27 C26 Ag1 124.8(8) . . ?
C36 C27 C28 116.4(12) . . ?
C36 C27 C26 120.6(11) . . ?
C28 C27 C26 123.1(12) . . ?
C29 C28 C27 124.9(14) . . ?
C29 C28 H28A 117.5 . . ?
C27 C28 H28A 117.5 . . ?
C28 C29 C34 116.3(13) . . ?
C28 C29 C30 125.8(15) . . ?
C34 C29 C30 117.8(15) . . ?
C33 C30 C29 113.6(15) . . ?
C33 C30 C32 104.3(17) . . ?
C29 C30 C32 107.6(15) . . ?
C33 C30 C31 111.4(16) . . ?
C29 C30 C31 109.8(14) . . ?
C32 C30 C31 109.9(16) . . ?
C30 C31 H31A 109.5 . . ?
C30 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C30 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C30 C32 H32A 109.5 . . ?
C30 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C30 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C30 C33 H33A 109.5 . . ?
C30 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C30 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C35 C34 C29 123.9(13) . . ?
C35 C34 H34A 118.1 . . ?
C29 C34 H34A 118.1 . . ?
C34 C35 C38 135.9(12) . . ?
C34 C35 C36 117.5(14) . . ?
C38 C35 C36 106.5(12) . . ?
C27 C36 N2 131.2(10) . . ?
C27 C36 C35 121.0(13) . . ?
N2 C36 C35 107.7(12) . . ?
N2 C37 C46 129.2(11) . . ?
N2 C37 C38 108.5(11) . . ?
C46 C37 C38 122.1(11) . . ?
C39 C38 C35 137.3(13) . . ?
C39 C38 C37 115.2(13) . . ?
C35 C38 C37 107.4(10) . . ?
C40 C39 C38 123.4(13) . . ?
C40 C39 H39A 118.3 . . ?
C38 C39 H39A 118.3 . . ?
C39 C40 C45 120.2(11) . . ?
C39 C40 C41 120.5(13) . . ?
C45 C40 C41 119.3(13) . . ?
C43 C41 C42' 123(3) . . ?
C43 C41 C44' 138(2) . . ?
C42' C41 C44' 58(2) . . ?
C43 C41 C44 104(2) . . ?
C42' C41 C44 101(2) . . ?
C44' C41 C44 45(2) . . ?
C43 C41 C43' 38(2) . . ?
C42' C41 C43' 142.2(19) . . ?
C44' C41 C43' 111(3) . . ?
C44 C41 C43' 69(2) . . ?
C43 C41 C42 76(3) . . ?
C42' C41 C42 52(2) . . ?
C44' C41 C42 109(2) . . ?
C44 C41 C42 139.1(19) . . ?
C43' C41 C42 112(3) . . ?
C43 C41 C40 109.1(12) . . ?
C42' C41 C40 109.8(12) . . ?
C44' C41 C40 108.7(12) . . ?
C44 C41 C40 109.6(12) . . ?
C43' C41 C40 107.9(12) . . ?
C42 C41 C40 108.8(12) . . ?
C42' C42 C41 63.3(13) . . ?
C42' C42 C43 110(2) . . ?
C41 C42 C43 51.4(14) . . ?
C42' C42 H42A 109.5 . . ?
C41 C42 H42A 160.4 . . ?
C43 C42 H42A 140.4 . . ?
C42' C42 H42B 109.5 . . ?
C41 C42 H42B 60.4 . . ?
C43 C42 H42B 58.2 . . ?
H42A C42 H42B 109.5 . . ?
C42' C42 H42C 109.5 . . ?
C41 C42 H42C 90.0 . . ?
C43 C42 H42C 54.1 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C42 C42' C44' 122(2) . . ?
C42 C42' C41 64.3(14) . . ?
C44' C42' C41 60.8(13) . . ?
C42 C42' H42D 109.5 . . ?
C44' C42' H42D 125.1 . . ?
C41 C42' H42D 173.7 . . ?
C42 C42' H42E 109.5 . . ?
C44' C42' H42E 38.1 . . ?
C41 C42' H42E 73.8 . . ?
H42D C42' H42E 109.5 . . ?
C42 C42' H42F 109.5 . . ?
C44' C42' H42F 71.5 . . ?
C41 C42' H42F 73.8 . . ?
H42D C42' H42F 109.5 . . ?
H42E C42' H42F 109.5 . . ?
C43' C43 C41 71.7(15) . . ?
C43' C43 C42 121(2) . . ?
C41 C43 C42 52.3(14) . . ?
C43' C43 H43A 109.5 . . ?
C41 C43 H43A 178.9 . . ?
C42 C43 H43A 126.6 . . ?
C43' C43 H43B 109.5 . . ?
C41 C43 H43B 70.0 . . ?
C42 C43 H43B 38.9 . . ?
H43A C43 H43B 109.5 . . ?
C43' C43 H43C 109.5 . . ?
C41 C43 H43C 70.0 . . ?
C42 C43 H43C 70.7 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
C43 C43' C41 70.6(14) . . ?
C43 C43' C44 122(2) . . ?
C41 C43' C44 55.7(13) . . ?
C43 C43' H43D 109.5 . . ?
C41 C43' H43D 179.9 . . ?
C44 C43' H43D 124.2 . . ?
C43 C43' H43E 109.5 . . ?
C41 C43' H43E 70.5 . . ?
C44 C43' H43E 73.5 . . ?
H43D C43' H43E 109.5 . . ?
C43 C43' H43F 109.5 . . ?
C41 C43' H43F 70.5 . . ?
C44 C43' H43F 36.0 . . ?
H43D C43' H43F 109.5 . . ?
H43E C43' H43F 109.5 . . ?
C44' C44 C41 67.6(13) . . ?
C44' C44 C43' 120(2) . . ?
C41 C44 C43' 55.7(13) . . ?
C44' C44 H44A 109.5 . . ?
C41 C44 H44A 158.5 . . ?
C43' C44 H44A 130.0 . . ?
C44' C44 H44B 109.5 . . ?
C41 C44 H44B 91.0 . . ?
C43' C44 H44B 58.6 . . ?
H44A C44 H44B 109.5 . . ?
C44' C44 H44C 109.5 . . ?
C41 C44 H44C 55.5 . . ?
C43' C44 H44C 51.2 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
C44 C44' C42' 124(2) . . ?
C44 C44' C41 67.6(13) . . ?
C42' C44' C41 60.7(13) . . ?
C44 C44' H44D 109.5 . . ?
C42' C44' H44D 122.0 . . ?
C41 C44' H44D 177.1 . . ?
C44 C44' H44E 109.5 . . ?
C42' C44' H44E 73.4 . . ?
C41 C44' H44E 72.0 . . ?
H44D C44' H44E 109.5 . . ?
C44 C44' H44F 109.5 . . ?
C42' C44' H44F 36.1 . . ?
C41 C44' H44F 72.0 . . ?
H44D C44' H44F 109.5 . . ?
H44E C44' H44F 109.5 . . ?
C46 C45 C40 121.4(16) . . ?
C46 C45 H45A 119.3 . . ?
C40 C45 H45A 119.3 . . ?
C45 C46 C37 117.4(14) . . ?
C45 C46 C47 121.1(13) . . ?
C37 C46 C47 121.4(10) . . ?
C48 C47 C46 170.5(14) . . ?
C47 C48 Au4 163.2(11) . . ?
C47 C48 Ag3 113.2(10) . . ?
Au4 C48 Ag3 81.5(5) . . ?
C50 C49 C50' 9(5) . . ?
C50 C49 Au2 178(3) . . ?
C50' C49 Au2 169(2) . . ?
C50 C49 Ag1 91(4) . 6_556 ?
C50' C49 Ag1 89(3) . 6_556 ?
Au2 C49 Ag1 89.1(4) . 6_556 ?
C49 C50 C51 168(6) . . ?
C49 C50 Ag1 61(3) . 6_556 ?
C51 C50 Ag1 127(4) . 6_556 ?
C49 C50' C51 165(6) . . ?
C49 C50' Ag1 62(3) . 6_556 ?
C51 C50' Ag1 129(4) . 6_556 ?
C50' C51 C50 8(4) . . ?
C50' C51 C52 124(3) . . ?
C50 C51 C52 127(3) . . ?
C50' C51 C60 122(3) . . ?
C50 C51 C60 119(3) . . ?
C52 C51 C60 113.8(10) . . ?
C53 C52 C51 124.9(10) . . ?
C53 C52 H52A 117.6 . . ?
C51 C52 H52A 117.6 . . ?
C52 C53 C58 119.5(10) . . ?
C52 C53 C54 123.8(10) . . ?
C58 C53 C54 116.7(10) . . ?
C57 C54 C53 110.4(10) . . ?
C57 C54 C56 105.7(12) . . ?
C53 C54 C56 111.9(10) . . ?
C57 C54 C55 112.9(10) . . ?
C53 C54 C55 109.3(10) . . ?
C56 C54 C55 106.5(11) . . ?
C54 C55 H55A 109.5 . . ?
C54 C55 H55B 109.5 . . ?
H55A C55 H55B 109.5 . . ?
C54 C55 H55C 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
C54 C56 H56A 109.5 . . ?
C54 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
C54 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
C54 C57 H57A 109.5 . . ?
C54 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
C54 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
C53 C58 C59 120.2(10) . . ?
C53 C58 H58A 119.9 . . ?
C59 C58 H58A 119.9 . . ?
C58 C59 C60 119.0(10) . . ?
C58 C59 C71 134.7(10) . . ?
C60 C59 C71 106.0(10) . . ?
N3 C60 C59 109.8(10) . . ?
N3 C60 C51 127.4(10) . . ?
C59 C60 C51 122.7(10) . . ?
C62 C61 Au3 174.9(11) . . ?
C62 C61 Ag1 101.4(10) . . ?
Au3 C61 Ag1 83.0(4) . . ?
C61 C62 C63 177.6(12) . . ?
C64 C63 C72 117.6(11) . . ?
C64 C63 C62 123.5(10) . . ?
C72 C63 C62 118.8(10) . . ?
C63 C64 C65 121.3(10) . . ?
C63 C64 H64A 119.3 . . ?
C65 C64 H64A 119.3 . . ?
C70 C65 C64 119.7(11) . . ?
C70 C65 C66 122.0(12) . . ?
C64 C65 C66 118.1(12) . . ?
C68 C66 C67 118.3(17) . . ?
C68 C66 C65 110.5(13) . . ?
C67 C66 C65 115.3(11) . . ?
C68 C66 C69 103.0(17) . . ?
C67 C66 C69 103.4(14) . . ?
C65 C66 C69 104.0(15) . . ?
C66 C67 H67A 109.5 . . ?
C66 C67 H67B 109.5 . . ?
H67A C67 H67B 109.5 . . ?
C66 C67 H67C 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
C66 C68 H68A 109.5 . . ?
C66 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
C66 C68 H68C 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
C66 C69 H69A 109.5 . . ?
C66 C69 H69B 109.5 . . ?
H69A C69 H69B 109.5 . . ?
C66 C69 H69C 109.5 . . ?
H69A C69 H69C 109.5 . . ?
H69B C69 H69C 109.5 . . ?
C65 C70 C71 119.5(12) . . ?
C65 C70 H70A 120.2 . . ?
C71 C70 H70A 120.2 . . ?
C70 C71 C72 121.6(10) . . ?
C70 C71 C59 133.2(12) . . ?
C72 C71 C59 105.2(9) . . ?
N3 C72 C63 130.3(10) . . ?
N3 C72 C71 109.5(9) . . ?
C63 C72 C71 120.1(10) . . ?
C74 C73 Au1 177.5(10) . . ?
C74 C73 Ag2 96.7(10) . . ?
Au1 C73 Ag2 83.8(5) . . ?
C74 C73 Ag4 84.9(9) . . ?
Au1 C73 Ag4 94.5(6) . . ?
Ag2 C73 Ag4 177.8(6) . . ?
C73 C74 C75 177.9(15) . . ?
C73 C74 Ag4 65.7(8) . . ?
C75 C74 Ag4 112.2(9) . . ?
C74 C75 C76 125.6(13) . . ?
C74 C75 C84 119.4(12) . . ?
C76 C75 C84 115.0(12) . . ?
C77 C76 C75 126.2(15) . . ?
C77 C76 H76A 116.9 . . ?
C75 C76 H76A 116.9 . . ?
C76 C77 C82 118.8(14) . . ?
C76 C77 C78 116.1(18) . . ?
C82 C77 C78 122.7(14) . . ?
C81 C78 C79 112.8(14) . . ?
C81 C78 C80 106.1(15) . . ?
C79 C78 C80 109.5(15) . . ?
C81 C78 C77 108.5(15) . . ?
C79 C78 C77 101.9(14) . . ?
C80 C78 C77 118.2(19) . . ?
C78 C79 H79A 109.5 . . ?
C78 C79 H79B 109.5 . . ?
H79A C79 H79B 109.5 . . ?
C78 C79 H79C 109.5 . . ?
H79A C79 H79C 109.5 . . ?
H79B C79 H79C 109.5 . . ?
C78 C80 H80A 109.5 . . ?
C78 C80 H80B 109.5 . . ?
H80A C80 H80B 109.5 . . ?
C78 C80 H80C 109.5 . . ?
H80A C80 H80C 109.5 . . ?
H80B C80 H80C 109.5 . . ?
C78 C81 H81A 109.5 . . ?
C78 C81 H81B 109.5 . . ?
H81A C81 H81B 109.5 . . ?
C78 C81 H81C 109.5 . . ?
H81A C81 H81C 109.5 . . ?
H81B C81 H81C 109.5 . . ?
C83 C82 C77 119.6(13) . . ?
C83 C82 H82A 120.2 . . ?
C77 C82 H82A 120.2 . . ?
C84 C83 C82 118.5(11) . . ?
C84 C83 C85 105.0(10) . . ?
C82 C83 C85 136.5(12) . . ?
N4 C84 C83 111.0(10) . . ?
N4 C84 C75 127.5(11) . . ?
C83 C84 C75 121.5(11) . . ?
C96 C85 C89 122.0(12) . . ?
C96 C85 C83 130.5(12) . . ?
C89 C85 C83 107.5(10) . . ?
C87 C86 Au2 175.4(11) . . ?
C87 C86 Ag2 94.6(8) . 6_556 ?
Au2 C86 Ag2 82.1(4) . 6_556 ?
C86 C87 C88 163.8(11) . . ?
C89 C88 C90 115.8(12) . . ?
C89 C88 C87 123.7(11) . . ?
C90 C88 C87 120.5(11) . . ?
C88 C89 C85 123.9(11) . . ?
C88 C89 N4 127.2(11) . . ?
C85 C89 N4 108.8(10) . . ?
C91 C90 C88 121.5(13) . . ?
C91 C90 H90A 119.3 . . ?
C88 C90 H90A 119.3 . . ?
C90 C91 C96 118.4(12) . . ?
C90 C91 C92 118.4(12) . . ?
C96 C91 C92 123.1(12) . . ?
C93 C92 C95 107.5(15) . . ?
C93 C92 C91 113.4(13) . . ?
C95 C92 C91 106.4(12) . . ?
C93 C92 C94 107.0(13) . . ?
C95 C92 C94 117.5(14) . . ?
C91 C92 C94 105.3(13) . . ?
C92 C93 H93A 109.5 . . ?
C92 C93 H93B 109.5 . . ?
H93A C93 H93B 109.5 . . ?
C92 C93 H93C 109.5 . . ?
H93A C93 H93C 109.5 . . ?
H93B C93 H93C 109.5 . . ?
C92 C94 H94A 109.5 . . ?
C92 C94 H94B 109.5 . . ?
H94A C94 H94B 109.5 . . ?
C92 C94 H94C 109.5 . . ?
H94A C94 H94C 109.5 . . ?
H94B C94 H94C 109.5 . . ?
C92 C95 H95A 109.5 . . ?
C92 C95 H95B 109.5 . . ?
H95A C95 H95B 109.5 . . ?
C92 C95 H95C 109.5 . . ?
H95A C95 H95C 109.5 . . ?
H95B C95 H95C 109.5 . . ?
C85 C96 C91 118.4(12) . . ?
C85 C96 H96A 120.8 . . ?
C91 C96 H96A 120.8 . . ?
C102 C97 C98 114.0(17) . . ?
C102 C97 P1 125.6(15) . . ?
C98 C97 P1 120.3(13) . . ?
C99 C98 C97 122.7(16) . . ?
C99 C98 H98A 118.7 . . ?
C97 C98 H98A 118.7 . . ?
C98 C99 C100 117.5(16) . . ?
C98 C99 H99A 121.2 . . ?
C100 C99 H99A 121.2 . . ?
C101 C100 C99 118.2(16) . . ?
C101 C100 H10B 120.9 . . ?
C99 C100 H10B 120.9 . . ?
C102 C101 C100 119.8(18) . . ?
C102 C101 H10C 120.1 . . ?
C100 C101 H10C 120.1 . . ?
C101 C102 C97 127.3(19) . . ?
C101 C102 H10D 116.4 . . ?
C97 C102 H10D 116.4 . . ?
C104 C103 C108 119.2(17) . . ?
C104 C103 P1 123.8(16) . . ?
C108 C103 P1 116.6(15) . . ?
C103 C104 C105 118.9(16) . . ?
C103 C104 H10E 120.5 . . ?
C105 C104 H10E 120.5 . . ?
C106 C105 C104 120.5(15) . . ?
C106 C105 H10F 119.8 . . ?
C104 C105 H10F 119.8 . . ?
C107 C106 C105 121.5(15) . . ?
C107 C106 H10G 119.3 . . ?
C105 C106 H10G 119.3 . . ?
C106 C107 C108 121.9(17) . . ?
C106 C107 H10H 119.0 . . ?
C108 C107 H10H 119.0 . . ?
C107 C108 C103 116.1(18) . . ?
C107 C108 H10I 121.9 . . ?
C103 C108 H10I 121.9 . . ?
C116 C115 C120 120.0 . . ?
C116 C115 P2 121.8(6) . . ?
C120 C115 P2 118.2(6) . . ?
C117 C116 C115 120.0 . . ?
C117 C116 H11A 120.0 . . ?
C115 C116 H11A 120.0 . . ?
C116 C117 C118 120.0 . . ?
C116 C117 H11B 120.0 . . ?
C118 C117 H11B 120.0 . . ?
C119 C118 C117 120.0 . . ?
C119 C118 H11C 120.0 . . ?
C117 C118 H11C 120.0 . . ?
C118 C119 C120 120.0 . . ?
C118 C119 H11D 120.0 . . ?
C120 C119 H11D 120.0 . . ?
C119 C120 C115 120.0 . . ?
C119 C120 H12A 120.0 . . ?
C115 C120 H12A 120.0 . . ?
C145 P3 C133 107.0(7) . . ?
C145 P3 C139 108.1(7) . . ?
C133 P3 C139 106.9(7) . . ?
C145 P3 Au4 106.6(5) . . ?
C133 P3 Au4 113.1(5) . . ?
C139 P3 Au4 114.8(4) . . ?
C122 C121 C126 120.0 . . ?
C122 C121 P2 120.2(8) . . ?
C126 C121 P2 119.6(8) . . ?
C123 C122 C121 120.0 . . ?
C123 C122 H12B 120.0 . . ?
C121 C122 H12B 120.0 . . ?
C122 C123 C124 120.0 . . ?
C122 C123 H12C 120.0 . . ?
C124 C123 H12C 120.0 . . ?
C123 C124 C125 120.0 . . ?
C123 C124 H12D 120.0 . . ?
C125 C124 H12D 120.0 . . ?
C126 C125 C124 120.0 . . ?
C126 C125 H12E 120.0 . . ?
C124 C125 H12E 120.0 . . ?
C125 C126 C121 120.0 . . ?
C125 C126 H12F 120.0 . . ?
C121 C126 H12F 120.0 . . ?
C12 N1 C13 108.2(10) . . ?
C12 N1 H1B 125.9 . . ?
C13 N1 H1B 125.9 . . ?
C128 C127 C132 120.0 . . ?
C128 C127 H12G 120.0 . . ?
C132 C127 H12G 120.0 . . ?
C129 C128 C127 120.0 . . ?
C129 C128 H12H 120.0 . . ?
C127 C128 H12H 120.0 . . ?
C130 C129 C128 120.0 . . ?
C130 C129 H12I 120.0 . . ?
C128 C129 H12I 120.0 . . ?
C129 C130 C131 120.0 . . ?
C129 C130 H13A 120.0 . . ?
C131 C130 H13A 120.0 . . ?
C132 C131 C130 120.0 . . ?
C132 C131 H13B 120.0 . . ?
C130 C131 H13B 120.0 . . ?
C131 C132 C127 120.0 . . ?
C131 C132 P2 119.2(7) . . ?
C127 C132 P2 120.8(8) . . ?
C138 C133 C134 119.6(12) . . ?
C138 C133 P3 120.4(10) . . ?
C134 C133 P3 119.9(10) . . ?
C135 C134 C133 121.1(13) . . ?
C135 C134 H13C 119.5 . . ?
C133 C134 H13C 119.5 . . ?
C134 C135 C136 118.4(12) . . ?
C134 C135 H13D 120.8 . . ?
C136 C135 H13D 120.8 . . ?
C137 C136 C135 120.5(12) . . ?
C137 C136 H13E 119.8 . . ?
C135 C136 H13E 119.8 . . ?
C136 C137 C138 122.0(13) . . ?
C136 C137 H13F 119.0 . . ?
C138 C137 H13F 119.0 . . ?
C133 C138 C137 118.2(13) . . ?
C133 C138 H13G 120.9 . . ?
C137 C138 H13G 120.9 . . ?
C140 C139 C144 120.0 . . ?
C140 C139 P3 116.7(7) . . ?
C144 C139 P3 123.0(7) . . ?
C141 C140 C139 120.0 . . ?
C141 C140 H14A 120.0 . . ?
C139 C140 H14A 120.0 . . ?
C142 C141 C140 120.0 . . ?
C142 C141 H14B 120.0 . . ?
C140 C141 H14B 120.0 . . ?
C143 C142 C141 120.0 . . ?
C143 C142 H14C 120.0 . . ?
C141 C142 H14C 120.0 . . ?
C144 C143 C142 120.0 . . ?
C144 C143 H14D 120.0 . . ?
C142 C143 H14D 120.0 . . ?
C143 C144 C139 120.0 . . ?
C143 C144 H14E 120.0 . . ?
C139 C144 H14E 120.0 . . ?
C97 P1 C169 106.8(9) . . ?
C97 P1 C103 108.4(8) . . ?
C169 P1 C103 110.7(12) . . ?
C97 P1 Au5 115.0(6) . . ?
C169 P1 Au5 104.0(7) . . ?
C103 P1 Au5 111.8(8) . . ?
C146 C145 C150 120.0 . . ?
C146 C145 P3 121.4(8) . . ?
C150 C145 P3 118.3(8) . . ?
C145 C146 C147 120.0 . . ?
C145 C146 H14F 120.0 . . ?
C147 C146 H14F 120.0 . . ?
C148 C147 C146 120.0 . . ?
C148 C147 H14G 120.0 . . ?
C146 C147 H14G 120.0 . . ?
C149 C148 C147 120.0 . . ?
C149 C148 H14H 120.0 . . ?
C147 C148 H14H 120.0 . . ?
C148 C149 C150 120.0 . . ?
C148 C149 H14I 120.0 . . ?
C150 C149 H14I 120.0 . . ?
C149 C150 C145 120.0 . . ?
C149 C150 H15B 120.0 . . ?
C145 C150 H15B 120.0 . . ?
C72 N3 C60 109.4(9) . . ?
C72 N3 H3A 125.3 . . ?
C60 N3 H3A 125.3 . . ?
C152 C151 C156 120.0 . . ?
C152 C151 P4 122.1(11) . . ?
C156 C151 P4 117.5(11) . . ?
C153 C152 C151 120.0 . . ?
C153 C152 H15C 120.0 . . ?
C151 C152 H15C 120.0 . . ?
C152 C153 C154 120.0 . . ?
C152 C153 H15D 120.0 . . ?
C154 C153 H15D 120.0 . . ?
C155 C154 C153 120.0 . . ?
C155 C154 H15E 120.0 . . ?
C153 C154 H15E 120.0 . . ?
C156 C155 C154 120.0 . . ?
C156 C155 H15F 120.0 . . ?
C154 C155 H15F 120.0 . . ?
C155 C156 C151 120.0 . . ?
C155 C156 H15G 120.0 . . ?
C151 C156 H15G 120.0 . . ?
C37 N2 C36 109.8(10) . . ?
C37 N2 H2A 125.1 . . ?
C36 N2 H2A 125.1 . . ?
C158 C157 C162 120.0 . . ?
C158 C157 H15H 120.0 . . ?
C162 C157 H15H 120.0 . . ?
C159 C158 C157 120.0 . . ?
C159 C158 P4 121.3(17) . . ?
C157 C158 P4 118.7(17) . . ?
C158 C159 C160 120.0 . . ?
C158 C159 H15I 120.0 . . ?
C160 C159 H15I 120.0 . . ?
C161 C160 C159 120.0 . . ?
C161 C160 H16A 120.0 . . ?
C159 C160 H16A 120.0 . . ?
C160 C161 C162 120.0 . . ?
C160 C161 H16B 120.0 . . ?
C162 C161 H16B 120.0 . . ?
C161 C162 C157 120.0 . . ?
C161 C162 H16C 120.0 . . ?
C157 C162 H16C 120.0 . . ?
C132 P2 C115 107.0(6) . . ?
C132 P2 C121 108.6(7) . . ?
C115 P2 C121 104.0(5) . . ?
C132 P2 Ag3 104.9(6) . . ?
C115 P2 Ag3 118.5(3) . . ?
C121 P2 Ag3 113.5(4) . . ?
C164 C163 C168 120.0 . . ?
C164 C163 P4 118.5(10) . . ?
C168 C163 P4 121.5(10) . . ?
C163 C164 C165 120.0 . . ?
C163 C164 H16D 120.0 . . ?
C165 C164 H16D 120.0 . . ?
C166 C165 C164 120.0 . . ?
C166 C165 H16E 120.0 . . ?
C164 C165 H16E 120.0 . . ?
C165 C166 C167 120.0 . . ?
C165 C166 H16F 120.0 . . ?
C167 C166 H16F 120.0 . . ?
C166 C167 C168 120.0 . . ?
C166 C167 H16G 120.0 . . ?
C168 C167 H16G 120.0 . . ?
C167 C168 C163 120.0 . . ?
C167 C168 H16H 120.0 . . ?
C163 C168 H16H 120.0 . . ?
C84 N4 C89 107.6(9) . . ?
C84 N4 H4B 126.2 . . ?
C89 N4 H4B 126.2 . . ?
C170 C169 C174 120.0 . . ?
C170 C169 P1 116.4(11) . . ?
C174 C169 P1 122.4(11) . . ?
C171 C170 C169 120.0 . . ?
C171 C170 H17A 120.0 . . ?
C169 C170 H17A 120.0 . . ?
C170 C171 C172 120.0 . . ?
C170 C171 H17B 120.0 . . ?
C172 C171 H17B 120.0 . . ?
C171 C172 C173 120.0 . . ?
C171 C172 H17C 120.0 . . ?
C173 C172 H17C 120.0 . . ?
C174 C173 C172 120.0 . . ?
C174 C173 H17D 120.0 . . ?
C172 C173 H17D 120.0 . . ?
C173 C174 C169 120.0 . . ?
C173 C174 H17E 120.0 . . ?
C169 C174 H17E 120.0 . . ?
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 C73 1.966(16) . ?
Au1 C25 1.986(13) . ?
Au1 Ag2 2.9414(12) . ?
Au1 Ag1 2.9579(10) . ?
Au1 Ag4 3.2494(16) . ?
Au2 C49 1.967(11) . ?
Au2 C86 2.044(16) . ?
Au2 Ag2 2.8966(10) 6_556 ?
Au2 Ag1 3.0237(9) 6_556 ?
Au2 Au2 3.0238(7) 6_556 ?
Au3 C24 1.979(14) . ?
Au3 C61 2.010(14) . ?
Au3 Ag2 2.8561(11) . ?
Au3 Ag3 2.9079(11) . ?
Au3 Ag1 2.9421(11) . ?
Au3 Au4 2.9863(7) . ?
Au4 C48 1.990(15) . ?
Au4 P3 2.285(4) . ?
Au4 Ag3 2.9470(12) . ?
Au5 C1 2.01(3) . ?
Au5 P1 2.287(5) . ?
Au5 Ag4 2.9134(17) . ?
Ag1 C49 2.326(9) 6_556 ?
Ag1 C25 2.343(10) . ?
Ag1 C61 2.409(12) . ?
Ag1 C50' 2.62(7) 6_556 ?
Ag1 C50 2.65(8) 6_556 ?
Ag1 C26 2.683(11) . ?
Ag2 C86 2.352(10) 6_556 ?
Ag2 C24 2.354(13) . ?
Ag2 C73 2.410(14) . ?
Ag3 P2 2.456(4) . ?
Ag3 C48 2.488(13) . ?
Ag3 C24 2.538(14) . ?
Ag4 P4 2.393(7) . ?
Ag4 C73 2.436(13) . ?
Ag4 C1 2.463(17) . ?
Ag4 C74 2.663(14) . ?
P4 C151 1.846(14) . ?
P4 C158 1.848(11) . ?
P4 C163 1.920(12) . ?
C1 C2 1.25(3) . ?
C2 C3 1.41(2) . ?
C3 C12 1.340(19) . ?
C3 C4 1.440(18) . ?
C4 C5 1.31(2) . ?
C4 H4A 0.9500 . ?
C5 C10 1.43(2) . ?
C5 C6 1.554(17) . ?
C6 C8 1.37(3) . ?
C6 C9 1.40(3) . ?
C6 C7 1.53(2) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C11 1.410(16) . ?
C10 H10A 0.9500 . ?
C11 C12 1.425(17) . ?
C11 C14 1.49(2) . ?
C12 N1 1.428(15) . ?
C13 C22 1.326(18) . ?
C13 C14 1.440(17) . ?
C13 N1 1.443(17) . ?
C14 C15 1.36(2) . ?
C15 C16 1.41(2) . ?
C15 H15A 0.9500 . ?
C16 C21 1.391(17) . ?
C16 C17 1.471(18) . ?
C17 C18 1.52(3) . ?
C17 C20 1.54(2) . ?
C17 C19 1.60(2) . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 C22 1.427(19) . ?
C21 H21A 0.9500 . ?
C22 C23 1.417(16) . ?
C23 C24 1.260(18) . ?
C25 C26 1.225(17) . ?
C26 C27 1.448(17) . ?
C27 C36 1.371(19) . ?
C27 C28 1.381(18) . ?
C28 C29 1.376(19) . ?
C28 H28A 0.9500 . ?
C29 C34 1.38(2) . ?
C29 C30 1.50(2) . ?
C30 C33 1.493(19) . ?
C30 C32 1.58(3) . ?
C30 C31 1.59(3) . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 C35 1.33(2) . ?
C34 H34A 0.9500 . ?
C35 C38 1.41(2) . ?
C35 C36 1.459(15) . ?
C36 N2 1.412(18) . ?
C37 N2 1.357(14) . ?
C37 C46 1.400(18) . ?
C37 C38 1.462(18) . ?
C38 C39 1.412(18) . ?
C39 C40 1.32(2) . ?
C39 H39A 0.9500 . ?
C40 C45 1.42(2) . ?
C40 C41 1.552(16) . ?
C41 C43 1.504(13) . ?
C41 C42' 1.511(13) . ?
C41 C44' 1.512(13) . ?
C41 C44 1.513(13) . ?
C41 C43' 1.513(13) . ?
C41 C42 1.523(13) . ?
C42 C42' 1.34(5) . ?
C42 C43 1.87(5) . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C42' C44' 1.48(5) . ?
C42' H42D 0.9800 . ?
C42' H42E 0.9800 . ?
C42' H42F 0.9800 . ?
C43 C43' 0.97(5) . ?
C43 H43A 0.9800 . ?
C43 H43B 0.9800 . ?
C43 H43C 0.9800 . ?
C43' C44 1.71(5) . ?
C43' H43D 0.9800 . ?
C43' H43E 0.9800 . ?
C43' H43F 0.9800 . ?
C44 C44' 1.15(5) . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C44' H44D 0.9800 . ?
C44' H44E 0.9800 . ?
C44' H44F 0.9800 . ?
C45 C46 1.388(17) . ?
C45 H45A 0.9500 . ?
C46 C47 1.497(19) . ?
C47 C48 1.193(19) . ?
C49 C50 1.24(7) . ?
C49 C50' 1.26(7) . ?
C50 C51 1.41(7) . ?
C50' C51 1.40(7) . ?
C51 C52 1.436(16) . ?
C51 C60 1.437(15) . ?
C52 C53 1.364(16) . ?
C52 H52A 0.9500 . ?
C53 C58 1.403(15) . ?
C53 C54 1.544(16) . ?
C54 C57 1.509(18) . ?
C54 C56 1.565(18) . ?
C54 C55 1.577(18) . ?
C55 H55A 0.9800 . ?
C55 H55B 0.9800 . ?
C55 H55C 0.9800 . ?
C56 H56A 0.9800 . ?
C56 H56B 0.9800 . ?
C56 H56C 0.9800 . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 C59 1.411(15) . ?
C58 H58A 0.9500 . ?
C59 C60 1.417(14) . ?
C59 C71 1.457(15) . ?
C60 N3 1.374(13) . ?
C61 C62 1.192(17) . ?
C62 C63 1.419(16) . ?
C63 C64 1.395(16) . ?
C63 C72 1.397(15) . ?
C64 C65 1.472(17) . ?
C64 H64A 0.9500 . ?
C65 C70 1.362(17) . ?
C65 C66 1.527(18) . ?
C66 C68 1.40(2) . ?
C66 C67 1.49(2) . ?
C66 C69 1.60(3) . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
C69 H69A 0.9800 . ?
C69 H69B 0.9800 . ?
C69 H69C 0.9800 . ?
C70 C71 1.378(16) . ?
C70 H70A 0.9500 . ?
C71 C72 1.446(16) . ?
C72 N3 1.356(14) . ?
C73 C74 1.32(2) . ?
C74 C75 1.346(19) . ?
C75 C76 1.407(18) . ?
C75 C84 1.459(17) . ?
C76 C77 1.31(2) . ?
C76 H76A 0.9500 . ?
C77 C82 1.45(2) . ?
C77 C78 1.58(2) . ?
C78 C81 1.470(12) . ?
C78 C79 1.496(12) . ?
C78 C80 1.549(13) . ?
C79 H79A 0.9800 . ?
C79 H79B 0.9800 . ?
C79 H79C 0.9800 . ?
C80 H80A 0.9800 . ?
C80 H80B 0.9800 . ?
C80 H80C 0.9800 . ?
C81 H81A 0.9800 . ?
C81 H81B 0.9800 . ?
C81 H81C 0.9800 . ?
C82 C83 1.422(18) . ?
C82 H82A 0.9500 . ?
C83 C84 1.407(17) . ?
C83 C85 1.467(17) . ?
C84 N4 1.367(15) . ?
C85 C96 1.304(16) . ?
C85 C89 1.387(17) . ?
C86 C87 1.181(17) . ?
C87 C88 1.428(16) . ?
C88 C89 1.340(17) . ?
C88 C90 1.408(17) . ?
C89 N4 1.419(14) . ?
C90 C91 1.402(19) . ?
C90 H90A 0.9500 . ?
C91 C96 1.440(19) . ?
C91 C92 1.580(19) . ?
C92 C93 1.46(2) . ?
C92 C95 1.55(2) . ?
C92 C94 1.60(2) . ?
C93 H93A 0.9800 . ?
C93 H93B 0.9800 . ?
C93 H93C 0.9800 . ?
C94 H94A 0.9800 . ?
C94 H94B 0.9800 . ?
C94 H94C 0.9800 . ?
C95 H95A 0.9800 . ?
C95 H95B 0.9800 . ?
C95 H95C 0.9800 . ?
C96 H96A 0.9500 . ?
C97 C102 1.36(2) . ?
C97 C98 1.42(2) . ?
C97 P1 1.744(16) . ?
C98 C99 1.41(3) . ?
C98 H98A 0.9500 . ?
C99 C100 1.45(3) . ?
C99 H99A 0.9500 . ?
C100 C101 1.39(2) . ?
C100 H10B 0.9500 . ?
C101 C102 1.34(3) . ?
C101 H10C 0.9500 . ?
C102 H10D 0.9500 . ?
C103 C104 1.388(13) . ?
C103 C108 1.53(3) . ?
C103 P1 1.79(2) . ?
C104 C105 1.410(12) . ?
C104 H10E 0.9500 . ?
C105 C106 1.396(12) . ?
C105 H10F 0.9500 . ?
C106 C107 1.369(12) . ?
C106 H10G 0.9500 . ?
C107 C108 1.382(13) . ?
C107 H10H 0.9500 . ?
C108 H10I 0.9500 . ?
C115 C116 1.3900 . ?
C115 C120 1.3900 . ?
C115 P2 1.848(8) . ?
C116 C117 1.3900 . ?
C116 H11A 0.9500 . ?
C117 C118 1.3900 . ?
C117 H11B 0.9500 . ?
C118 C119 1.3900 . ?
C118 H11C 0.9500 . ?
C119 C120 1.3900 . ?
C119 H11D 0.9500 . ?
C120 H12A 0.9500 . ?
P3 C145 1.811(10) . ?
P3 C133 1.841(13) . ?
P3 C139 1.871(10) . ?
C121 C122 1.3900 . ?
C121 C126 1.3900 . ?
C121 P2 1.920(10) . ?
C122 C123 1.3900 . ?
C122 H12B 0.9500 . ?
C123 C124 1.3900 . ?
C123 H12C 0.9500 . ?
C124 C125 1.3900 . ?
C124 H12D 0.9500 . ?
C125 C126 1.3900 . ?
C125 H12E 0.9500 . ?
C126 H12F 0.9500 . ?
N1 H1B 0.8800 . ?
C127 C128 1.3900 . ?
C127 C132 1.3900 . ?
C127 H12G 0.9500 . ?
C128 C129 1.3900 . ?
C128 H12H 0.9500 . ?
C129 C130 1.3900 . ?
C129 H12I 0.9500 . ?
C130 C131 1.3900 . ?
C130 H13A 0.9500 . ?
C131 C132 1.3900 . ?
C131 H13B 0.9500 . ?
C132 P2 1.842(8) . ?
C133 C138 1.38(2) . ?
C133 C134 1.431(12) . ?
C134 C135 1.383(11) . ?
C134 H13C 0.9500 . ?
C135 C136 1.389(12) . ?
C135 H13D 0.9500 . ?
C136 C137 1.385(12) . ?
C136 H13E 0.9500 . ?
C137 C138 1.396(11) . ?
C137 H13F 0.9500 . ?
C138 H13G 0.9500 . ?
C139 C140 1.3900 . ?
C139 C144 1.3900 . ?
C140 C141 1.3900 . ?
C140 H14A 0.9500 . ?
C141 C142 1.3900 . ?
C141 H14B 0.9500 . ?
C142 C143 1.3900 . ?
C142 H14C 0.9500 . ?
C143 C144 1.3900 . ?
C143 H14D 0.9500 . ?
C144 H14E 0.9500 . ?
P1 C169 1.781(12) . ?
C145 C146 1.3900 . ?
C145 C150 1.3900 . ?
C146 C147 1.3900 . ?
C146 H14F 0.9500 . ?
C147 C148 1.3900 . ?
C147 H14G 0.9500 . ?
C148 C149 1.3900 . ?
C148 H14H 0.9500 . ?
C149 C150 1.3900 . ?
C149 H14I 0.9500 . ?
C150 H15B 0.9500 . ?
N3 H3A 0.8800 . ?
C151 C152 1.3900 . ?
C151 C156 1.3900 . ?
C152 C153 1.3900 . ?
C152 H15C 0.9500 . ?
C153 C154 1.3900 . ?
C153 H15D 0.9500 . ?
C154 C155 1.3900 . ?
C154 H15E 0.9500 . ?
C155 C156 1.3900 . ?
C155 H15F 0.9500 . ?
C156 H15G 0.9500 . ?
N2 H2A 0.8800 . ?
C157 C158 1.3900 . ?
C157 C162 1.3900 . ?
C157 H15H 0.9500 . ?
C158 C159 1.3900 . ?
C159 C160 1.3900 . ?
C159 H15I 0.9500 . ?
C160 C161 1.3900 . ?
C160 H16A 0.9500 . ?
C161 C162 1.3900 . ?
C161 H16B 0.9500 . ?
C162 H16C 0.9500 . ?
C163 C164 1.3900 . ?
C163 C168 1.3900 . ?
C164 C165 1.3900 . ?
C164 H16D 0.9500 . ?
C165 C166 1.3900 . ?
C165 H16E 0.9500 . ?
C166 C167 1.3900 . ?
C166 H16F 0.9500 . ?
C167 C168 1.3900 . ?
C167 H16G 0.9500 . ?
C168 H16H 0.9500 . ?
N4 H4B 0.8800 . ?
C169 C170 1.3900 . ?
C169 C174 1.3900 . ?
C170 C171 1.3900 . ?
C170 H17A 0.9500 . ?
C171 C172 1.3900 . ?
C171 H17B 0.9500 . ?
C172 C173 1.3900 . ?
C172 H17C 0.9500 . ?
C173 C174 1.3900 . ?
C173 H17D 0.9500 . ?
C174 H17E 0.9500 . ?
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
C12 C3 C4 C5 3(3) . . . . ?
C2 C3 C4 C5 -177.0(16) . . . . ?
C3 C4 C5 C10 1(3) . . . . ?
C3 C4 C5 C6 173.2(14) . . . . ?
C4 C5 C6 C8 -77(2) . . . . ?
C10 C5 C6 C8 95(2) . . . . ?
C4 C5 C6 C9 167(2) . . . . ?
C10 C5 C6 C9 -21(2) . . . . ?
C4 C5 C6 C7 48(2) . . . . ?
C10 C5 C6 C7 -139.7(17) . . . . ?
C4 C5 C10 C11 -4(2) . . . . ?
C6 C5 C10 C11 -176.4(13) . . . . ?
C5 C10 C11 C12 4(2) . . . . ?
C5 C10 C11 C14 -179.3(14) . . . . ?
C2 C3 C12 C11 176.5(14) . . . . ?
C4 C3 C12 C11 -3(2) . . . . ?
C2 C3 C12 N1 0(3) . . . . ?
C4 C3 C12 N1 180.0(14) . . . . ?
C10 C11 C12 C3 0(2) . . . . ?
C14 C11 C12 C3 -177.6(14) . . . . ?
C10 C11 C12 N1 177.4(12) . . . . ?
C14 C11 C12 N1 -0.1(16) . . . . ?
C22 C13 C14 C15 -2(2) . . . . ?
N1 C13 C14 C15 176.1(13) . . . . ?
C22 C13 C14 C11 -177.3(14) . . . . ?
N1 C13 C14 C11 1.1(15) . . . . ?
C10 C11 C14 C15 9(3) . . . . ?
C12 C11 C14 C15 -174.4(17) . . . . ?
C10 C11 C14 C13 -177.7(14) . . . . ?
C12 C11 C14 C13 -0.6(16) . . . . ?
C13 C14 C15 C16 3(2) . . . . ?
C11 C14 C15 C16 175.7(15) . . . . ?
C14 C15 C16 C21 0.5(19) . . . . ?
C14 C15 C16 C17 177.3(14) . . . . ?
C21 C16 C17 C18 -138.3(15) . . . . ?
C15 C16 C17 C18 45.2(18) . . . . ?
C21 C16 C17 C20 107.8(17) . . . . ?
C15 C16 C17 C20 -69(2) . . . . ?
C21 C16 C17 C19 -11(2) . . . . ?
C15 C16 C17 C19 172.8(14) . . . . ?
C15 C16 C21 C22 -4(2) . . . . ?
C17 C16 C21 C22 179.1(14) . . . . ?
C14 C13 C22 C23 -168.1(13) . . . . ?
N1 C13 C22 C23 14(2) . . . . ?
C14 C13 C22 C21 -1(2) . . . . ?
N1 C13 C22 C21 -179.3(13) . . . . ?
C16 C21 C22 C13 5(2) . . . . ?
C16 C21 C22 C23 171.7(13) . . . . ?
Ag1 C26 C27 C36 -53.9(15) . . . . ?
Ag1 C26 C27 C28 125.9(11) . . . . ?
C36 C27 C28 C29 -2.8(18) . . . . ?
C26 C27 C28 C29 177.4(11) . . . . ?
C27 C28 C29 C34 0.4(19) . . . . ?
C27 C28 C29 C30 -175.2(13) . . . . ?
C28 C29 C30 C33 115(2) . . . . ?
C34 C29 C30 C33 -61(2) . . . . ?
C28 C29 C30 C32 -130.2(17) . . . . ?
C34 C29 C30 C32 54.3(18) . . . . ?
C28 C29 C30 C31 -11(2) . . . . ?
C34 C29 C30 C31 173.9(13) . . . . ?
C28 C29 C34 C35 0.5(19) . . . . ?
C30 C29 C34 C35 176.5(13) . . . . ?
C29 C34 C35 C38 -177.0(13) . . . . ?
C29 C34 C35 C36 1.0(19) . . . . ?
C28 C27 C36 N2 178.4(12) . . . . ?
C26 C27 C36 N2 -2(2) . . . . ?
C28 C27 C36 C35 4.3(17) . . . . ?
C26 C27 C36 C35 -175.9(10) . . . . ?
C34 C35 C36 C27 -3.5(17) . . . . ?
C38 C35 C36 C27 175.0(11) . . . . ?
C34 C35 C36 N2 -178.8(11) . . . . ?
C38 C35 C36 N2 -0.3(13) . . . . ?
C34 C35 C38 C39 -4(3) . . . . ?
C36 C35 C38 C39 177.6(15) . . . . ?
C34 C35 C38 C37 179.6(14) . . . . ?
C36 C35 C38 C37 1.4(13) . . . . ?
N2 C37 C38 C39 -179.2(11) . . . . ?
C46 C37 C38 C39 4.4(17) . . . . ?
N2 C37 C38 C35 -2.1(13) . . . . ?
C46 C37 C38 C35 -178.5(11) . . . . ?
C35 C38 C39 C40 177.6(15) . . . . ?
C37 C38 C39 C40 -6.5(19) . . . . ?
C38 C39 C40 C45 6(2) . . . . ?
C38 C39 C40 C41 -175.9(11) . . . . ?
C39 C40 C41 C43 -119(3) . . . . ?
C45 C40 C41 C43 59(3) . . . . ?
C39 C40 C41 C42' 104(3) . . . . ?
C45 C40 C41 C42' -78(3) . . . . ?
C39 C40 C41 C44' 41(2) . . . . ?
C45 C40 C41 C44' -140(2) . . . . ?
C39 C40 C41 C44 -6(2) . . . . ?
C45 C40 C41 C44 172(2) . . . . ?
C39 C40 C41 C43' -79(3) . . . . ?
C45 C40 C41 C43' 99(3) . . . . ?
C39 C40 C41 C42 159(2) . . . . ?
C45 C40 C41 C42 -22(2) . . . . ?
C43 C41 C42 C42' 153(2) . . . . ?
C44' C41 C42 C42' 17(2) . . . . ?
C44 C41 C42 C42' 58(4) . . . . ?
C43' C41 C42 C42' 140(2) . . . . ?
C40 C41 C42 C42' -100.9(15) . . . . ?
C42' C41 C42 C43 -153(2) . . . . ?
C44' C41 C42 C43 -136(2) . . . . ?
C44 C41 C42 C43 -95(4) . . . . ?
C43' C41 C42 C43 -13.2(18) . . . . ?
C40 C41 C42 C43 105.9(13) . . . . ?
C41 C42 C42' C44' -20(2) . . . . ?
C43 C42 C42' C44' 2(3) . . . . ?
C43 C42 C42' C41 22.0(14) . . . . ?
C43 C41 C42' C42 -31(3) . . . . ?
C44' C41 C42' C42 -161(2) . . . . ?
C44 C41 C42' C42 -146(2) . . . . ?
C43' C41 C42' C42 -77(5) . . . . ?
C40 C41 C42' C42 98.9(16) . . . . ?
C43 C41 C42' C44' 129(3) . . . . ?
C44 C41 C42' C44' 15.3(18) . . . . ?
C43' C41 C42' C44' 84(5) . . . . ?
C42 C41 C42' C44' 161(2) . . . . ?
C40 C41 C42' C44' -100.3(15) . . . . ?
C42' C41 C43 C43' -135(3) . . . . ?
C44' C41 C43 C43' -57(4) . . . . ?
C44 C41 C43 C43' -22(3) . . . . ?
C42 C41 C43 C43' -160(3) . . . . ?
C40 C41 C43 C43' 95(2) . . . . ?
C42' C41 C43 C42 25(2) . . . . ?
C44' C41 C43 C42 103(4) . . . . ?
C44 C41 C43 C42 137.9(19) . . . . ?
C43' C41 C43 C42 160(3) . . . . ?
C40 C41 C43 C42 -105.5(14) . . . . ?
C42' C42 C43 C43' -3(3) . . . . ?
C41 C42 C43 C43' 22(2) . . . . ?
C42' C42 C43 C41 -25.4(16) . . . . ?
C42 C43 C43' C41 -18.6(19) . . . . ?
C41 C43 C43' C44 22(2) . . . . ?
C42 C43 C43' C44 4(4) . . . . ?
C42' C41 C43' C43 77(5) . . . . ?
C44' C41 C43' C43 143(3) . . . . ?
C44 C41 C43' C43 157(3) . . . . ?
C42 C41 C43' C43 21(3) . . . . ?
C40 C41 C43' C43 -98(2) . . . . ?
C43 C41 C43' C44 -157(3) . . . . ?
C42' C41 C43' C44 -80(5) . . . . ?
C44' C41 C43' C44 -14.5(19) . . . . ?
C42 C41 C43' C44 -136(2) . . . . ?
C40 C41 C43' C44 104.6(13) . . . . ?
C43 C41 C44 C44' -146(2) . . . . ?
C42' C41 C44 C44' -19(2) . . . . ?
C43' C41 C44 C44' -161(2) . . . . ?
C42 C41 C44 C44' -62(4) . . . . ?
C40 C41 C44 C44' 97.2(17) . . . . ?
C43 C41 C44 C43' 14.2(17) . . . . ?
C42' C41 C44 C43' 142(2) . . . . ?
C44' C41 C44 C43' 161(2) . . . . ?
C42 C41 C44 C43' 99(4) . . . . ?
C40 C41 C44 C43' -102.2(14) . . . . ?
C43 C43' C44 C44' -5(4) . . . . ?
C41 C43' C44 C44' 21(2) . . . . ?
C43 C43' C44 C41 -26(2) . . . . ?
C41 C44 C44' C42' 23(2) . . . . ?
C43' C44 C44' C42' 4(3) . . . . ?
C43' C44 C44' C41 -18.5(18) . . . . ?
C42 C42' C44' C44 -4(4) . . . . ?
C41 C42' C44' C44 -24(2) . . . . ?
C42 C42' C44' C41 20(2) . . . . ?
C43 C41 C44' C44 53(4) . . . . ?
C42' C41 C44' C44 158(2) . . . . ?
C43' C41 C44' C44 19(3) . . . . ?
C42 C41 C44' C44 143(2) . . . . ?
C40 C41 C44' C44 -99.3(17) . . . . ?
C43 C41 C44' C42' -106(4) . . . . ?
C44 C41 C44' C42' -158(2) . . . . ?
C43' C41 C44' C42' -139(2) . . . . ?
C42 C41 C44' C42' -16(2) . . . . ?
C40 C41 C44' C42' 102.2(14) . . . . ?
C39 C40 C45 C46 -3(2) . . . . ?
C41 C40 C45 C46 178.8(11) . . . . ?
C40 C45 C46 C37 1.0(18) . . . . ?
C40 C45 C46 C47 177.0(12) . . . . ?
N2 C37 C46 C45 -177.5(11) . . . . ?
C38 C37 C46 C45 -1.9(17) . . . . ?
N2 C37 C46 C47 6.6(18) . . . . ?
C38 C37 C46 C47 -177.8(11) . . . . ?
C50' C49 C50 C51 55(32) . . . . ?
Ag1 C49 C50 C51 134(26) 6_556 . . . ?
C50' C49 C50 Ag1 -78(43) . . . 6_556 ?
C50 C49 C50' C51 -44(30) . . . . ?
Au2 C49 C50' C51 134(13) . . . . ?
Ag1 C49 C50' C51 -146(21) 6_556 . . . ?
C50 C49 C50' Ag1 102(43) . . . 6_556 ?
Au2 C49 C50' Ag1 -80(17) . . . 6_556 ?
C49 C50' C51 C50 43(29) . . . . ?
Ag1 C50' C51 C50 -97(44) 6_556 . . . ?
C49 C50' C51 C52 160(20) . . . . ?
Ag1 C50' C51 C52 20(4) 6_556 . . . ?
C49 C50' C51 C60 -26(23) . . . . ?
Ag1 C50' C51 C60 -165(2) 6_556 . . . ?
C49 C50 C51 C50' -56(33) . . . . ?
Ag1 C50 C51 C50' 72(42) 6_556 . . . ?
C49 C50 C51 C52 -124(25) . . . . ?
Ag1 C50 C51 C52 3(5) 6_556 . . . ?
C49 C50 C51 C60 60(26) . . . . ?
Ag1 C50 C51 C60 -173(2) 6_556 . . . ?
C50' C51 C52 C53 174(3) . . . . ?
C50 C51 C52 C53 -177(3) . . . . ?
C60 C51 C52 C53 -1.0(16) . . . . ?
C51 C52 C53 C58 2.2(18) . . . . ?
C51 C52 C53 C54 -178.9(10) . . . . ?
C52 C53 C54 C57 -117.5(14) . . . . ?
C58 C53 C54 C57 61.4(14) . . . . ?
C52 C53 C54 C56 125.0(13) . . . . ?
C58 C53 C54 C56 -56.1(15) . . . . ?
C52 C53 C54 C55 7.3(16) . . . . ?
C58 C53 C54 C55 -173.8(10) . . . . ?
C52 C53 C58 C59 -1.9(17) . . . . ?
C54 C53 C58 C59 179.1(10) . . . . ?
C53 C58 C59 C60 0.6(16) . . . . ?
C53 C58 C59 C71 -172.3(12) . . . . ?
C58 C59 C60 N3 -175.8(10) . . . . ?
C71 C59 C60 N3 -1.1(13) . . . . ?
C58 C59 C60 C51 0.7(16) . . . . ?
C71 C59 C60 C51 175.4(10) . . . . ?
C50' C51 C60 N3 1(3) . . . . ?
C50 C51 C60 N3 -8(3) . . . . ?
C52 C51 C60 N3 175.3(11) . . . . ?
C50' C51 C60 C59 -175(3) . . . . ?
C50 C51 C60 C59 176(3) . . . . ?
C52 C51 C60 C59 -0.5(16) . . . . ?
C72 C63 C64 C65 -0.1(19) . . . . ?
C62 C63 C64 C65 -177.1(12) . . . . ?
C63 C64 C65 C70 0(2) . . . . ?
C63 C64 C65 C66 -173.8(13) . . . . ?
C70 C65 C66 C68 -60(2) . . . . ?
C64 C65 C66 C68 113.8(18) . . . . ?
C70 C65 C66 C67 162.1(16) . . . . ?
C64 C65 C66 C67 -24(2) . . . . ?
C70 C65 C66 C69 49.6(19) . . . . ?
C64 C65 C66 C69 -136.2(15) . . . . ?
C64 C65 C70 C71 2(2) . . . . ?
C66 C65 C70 C71 175.8(13) . . . . ?
C65 C70 C71 C72 -4.2(19) . . . . ?
C65 C70 C71 C59 175.5(13) . . . . ?
C58 C59 C71 C70 -7(2) . . . . ?
C60 C59 C71 C70 179.6(13) . . . . ?
C58 C59 C71 C72 172.9(12) . . . . ?
C60 C59 C71 C72 -0.7(12) . . . . ?
C64 C63 C72 N3 -179.1(13) . . . . ?
C62 C63 C72 N3 -2(2) . . . . ?
C64 C63 C72 C71 -2.3(19) . . . . ?
C62 C63 C72 C71 174.8(11) . . . . ?
C70 C71 C72 N3 -178.0(11) . . . . ?
C59 C71 C72 N3 2.2(13) . . . . ?
C70 C71 C72 C63 4.6(19) . . . . ?
C59 C71 C72 C63 -175.2(11) . . . . ?
Ag2 C73 C74 Ag4 178.5(6) . . . . ?
Ag4 C74 C75 C76 -63.1(18) . . . . ?
Ag4 C74 C75 C84 117.3(12) . . . . ?
C74 C75 C76 C77 175(2) . . . . ?
C84 C75 C76 C77 -5(3) . . . . ?
C75 C76 C77 C82 5(4) . . . . ?
C75 C76 C77 C78 -157.6(19) . . . . ?
C76 C77 C78 C81 179(2) . . . . ?
C82 C77 C78 C81 17(3) . . . . ?
C76 C77 C78 C79 -62(3) . . . . ?
C82 C77 C78 C79 136(2) . . . . ?
C76 C77 C78 C80 58(3) . . . . ?
C82 C77 C78 C80 -104(3) . . . . ?
C76 C77 C82 C83 0(3) . . . . ?
C78 C77 C82 C83 162(2) . . . . ?
C77 C82 C83 C84 -5(3) . . . . ?
C77 C82 C83 C85 177.5(19) . . . . ?
C82 C83 C84 N4 -175.8(12) . . . . ?
C85 C83 C84 N4 2.2(14) . . . . ?
C82 C83 C84 C75 5(2) . . . . ?
C85 C83 C84 C75 -176.6(12) . . . . ?
C74 C75 C84 N4 0(2) . . . . ?
C76 C75 C84 N4 -179.2(14) . . . . ?
C74 C75 C84 C83 179.0(13) . . . . ?
C76 C75 C84 C83 -1(2) . . . . ?
C84 C83 C85 C96 176.7(14) . . . . ?
C82 C83 C85 C96 -6(3) . . . . ?
C84 C83 C85 C89 -2.2(14) . . . . ?
C82 C83 C85 C89 175.2(16) . . . . ?
Ag2 C86 C87 C88 174(4) 6_556 . . . ?
C86 C87 C88 C89 11(5) . . . . ?
C86 C87 C88 C90 -170(4) . . . . ?
C90 C88 C89 C85 3.4(18) . . . . ?
C87 C88 C89 C85 -177.4(11) . . . . ?
C90 C88 C89 N4 178.4(12) . . . . ?
C87 C88 C89 N4 -2(2) . . . . ?
C96 C85 C89 C88 -2(2) . . . . ?
C83 C85 C89 C88 177.3(11) . . . . ?
C96 C85 C89 N4 -177.5(12) . . . . ?
C83 C85 C89 N4 1.5(13) . . . . ?
C89 C88 C90 C91 -4(2) . . . . ?
C87 C88 C90 C91 177.0(12) . . . . ?
C88 C90 C91 C96 2(2) . . . . ?
C88 C90 C91 C92 -174.1(13) . . . . ?
C90 C91 C92 C93 4(2) . . . . ?
C96 C91 C92 C93 -171.9(13) . . . . ?
C90 C91 C92 C95 122.4(15) . . . . ?
C96 C91 C92 C95 -53.9(19) . . . . ?
C90 C91 C92 C94 -112.2(15) . . . . ?
C96 C91 C92 C94 71.4(18) . . . . ?
C89 C85 C96 C91 0(2) . . . . ?
C83 C85 C96 C91 -178.6(13) . . . . ?
C90 C91 C96 C85 -1(2) . . . . ?
C92 C91 C96 C85 175.8(13) . . . . ?
C102 C97 C98 C99 6(3) . . . . ?
P1 C97 C98 C99 -177.3(16) . . . . ?
C97 C98 C99 C100 -7(3) . . . . ?
C98 C99 C100 C101 6(3) . . . . ?
C99 C100 C101 C102 -5(3) . . . . ?
C100 C101 C102 C97 4(4) . . . . ?
C98 C97 C102 C101 -5(3) . . . . ?
P1 C97 C102 C101 178.7(18) . . . . ?
C108 C103 C104 C105 13(5) . . . . ?
P1 C103 C104 C105 -174(3) . . . . ?
C103 C104 C105 C106 -2(5) . . . . ?
C104 C105 C106 C107 -9(5) . . . . ?
C105 C106 C107 C108 8(5) . . . . ?
C106 C107 C108 C103 3(5) . . . . ?
C104 C103 C108 C107 -14(4) . . . . ?
P1 C103 C108 C107 173(2) . . . . ?
C120 C115 C116 C117 0.0 . . . . ?
P2 C115 C116 C117 -178.8(10) . . . . ?
C115 C116 C117 C118 0.0 . . . . ?
C116 C117 C118 C119 0.0 . . . . ?
C117 C118 C119 C120 0.0 . . . . ?
C118 C119 C120 C115 0.0 . . . . ?
C116 C115 C120 C119 0.0 . . . . ?
P2 C115 C120 C119 178.9(10) . . . . ?
C126 C121 C122 C123 0.0 . . . . ?
P2 C121 C122 C123 -174.0(9) . . . . ?
C121 C122 C123 C124 0.0 . . . . ?
C122 C123 C124 C125 0.0 . . . . ?
C123 C124 C125 C126 0.0 . . . . ?
C124 C125 C126 C121 0.0 . . . . ?
C122 C121 C126 C125 0.0 . . . . ?
P2 C121 C126 C125 174.0(9) . . . . ?
C3 C12 N1 C13 178.0(15) . . . . ?
C11 C12 N1 C13 0.8(15) . . . . ?
C22 C13 N1 C12 177.2(14) . . . . ?
C14 C13 N1 C12 -1.2(15) . . . . ?
C132 C127 C128 C129 0.0 . . . . ?
C127 C128 C129 C130 0.0 . . . . ?
C128 C129 C130 C131 0.0 . . . . ?
C129 C130 C131 C132 0.0 . . . . ?
C130 C131 C132 C127 0.0 . . . . ?
C130 C131 C132 P2 177.1(13) . . . . ?
C128 C127 C132 C131 0.0 . . . . ?
C128 C127 C132 P2 -177.1(13) . . . . ?
C145 P3 C133 C138 -85.5(15) . . . . ?
C139 P3 C133 C138 159.0(13) . . . . ?
Au4 P3 C133 C138 31.6(15) . . . . ?
C145 P3 C133 C134 90.9(15) . . . . ?
C139 P3 C133 C134 -24.6(15) . . . . ?
Au4 P3 C133 C134 -152.0(12) . . . . ?
C138 C133 C134 C135 -2(3) . . . . ?
P3 C133 C134 C135 -178.3(13) . . . . ?
C133 C134 C135 C136 4(3) . . . . ?
C134 C135 C136 C137 -3(3) . . . . ?
C135 C136 C137 C138 -1(3) . . . . ?
C134 C133 C138 C137 -2(2) . . . . ?
P3 C133 C138 C137 174.3(13) . . . . ?
C136 C137 C138 C133 4(3) . . . . ?
C145 P3 C139 C140 -176.5(7) . . . . ?
C133 P3 C139 C140 -61.6(9) . . . . ?
Au4 P3 C139 C140 64.7(8) . . . . ?
C145 P3 C139 C144 -2.4(9) . . . . ?
C133 P3 C139 C144 112.4(8) . . . . ?
Au4 P3 C139 C144 -121.3(6) . . . . ?
C144 C139 C140 C141 0.0 . . . . ?
P3 C139 C140 C141 174.2(10) . . . . ?
C139 C140 C141 C142 0.0 . . . . ?
C140 C141 C142 C143 0.0 . . . . ?
C141 C142 C143 C144 0.0 . . . . ?
C142 C143 C144 C139 0.0 . . . . ?
C140 C139 C144 C143 0.0 . . . . ?
P3 C139 C144 C143 -173.9(10) . . . . ?
C102 C97 P1 C169 137.6(18) . . . . ?
C98 C97 P1 C169 -38.9(17) . . . . ?
C102 C97 P1 C103 -103.1(19) . . . . ?
C98 C97 P1 C103 80.3(18) . . . . ?
C102 C97 P1 Au5 22.8(18) . . . . ?
C98 C97 P1 Au5 -153.7(13) . . . . ?
C104 C103 P1 C97 -24(3) . . . . ?
C108 C103 P1 C97 149(2) . . . . ?
C104 C103 P1 C169 93(3) . . . . ?
C108 C103 P1 C169 -95(2) . . . . ?
C104 C103 P1 Au5 -152(2) . . . . ?
C108 C103 P1 Au5 21(2) . . . . ?
C133 P3 C145 C146 -16.2(11) . . . . ?
C139 P3 C145 C146 98.6(10) . . . . ?
Au4 P3 C145 C146 -137.4(8) . . . . ?
C133 P3 C145 C150 169.8(9) . . . . ?
C139 P3 C145 C150 -75.5(10) . . . . ?
Au4 P3 C145 C150 48.5(10) . . . . ?
C150 C145 C146 C147 0.0 . . . . ?
P3 C145 C146 C147 -174.0(13) . . . . ?
C145 C146 C147 C148 0.0 . . . . ?
C146 C147 C148 C149 0.0 . . . . ?
C147 C148 C149 C150 0.0 . . . . ?
C148 C149 C150 C145 0.0 . . . . ?
C146 C145 C150 C149 0.0 . . . . ?
P3 C145 C150 C149 174.2(12) . . . . ?
C63 C72 N3 C60 174.1(13) . . . . ?
C71 C72 N3 C60 -3.0(14) . . . . ?
C59 C60 N3 C72 2.6(13) . . . . ?
C51 C60 N3 C72 -173.7(11) . . . . ?
C158 P4 C151 C152 82.5(11) . . . . ?
C163 P4 C151 C152 -29.9(10) . . . . ?
Ag4 P4 C151 C152 -151.1(7) . . . . ?
C158 P4 C151 C156 -90.4(10) . . . . ?
C163 P4 C151 C156 157.1(9) . . . . ?
Ag4 P4 C151 C156 36.0(9) . . . . ?
C156 C151 C152 C153 0.0 . . . . ?
P4 C151 C152 C153 -172.7(11) . . . . ?
C151 C152 C153 C154 0.0 . . . . ?
C152 C153 C154 C155 0.0 . . . . ?
C153 C154 C155 C156 0.0 . . . . ?
C154 C155 C156 C151 0.0 . . . . ?
C152 C151 C156 C155 0.0 . . . . ?
P4 C151 C156 C155 173.1(10) . . . . ?
C46 C37 N2 C36 178.0(11) . . . . ?
C38 C37 N2 C36 2.0(12) . . . . ?
C27 C36 N2 C37 -175.7(12) . . . . ?
C35 C36 N2 C37 -1.1(13) . . . . ?
C162 C157 C158 C159 0.0 . . . . ?
C162 C157 C158 P4 -179.4(16) . . . . ?
C151 P4 C158 C159 156.4(12) . . . . ?
C163 P4 C158 C159 -93.5(13) . . . . ?
Ag4 P4 C158 C159 34.7(15) . . . . ?
C151 P4 C158 C157 -24.3(13) . . . . ?
C163 P4 C158 C157 85.9(12) . . . . ?
Ag4 P4 C158 C157 -145.9(9) . . . . ?
C157 C158 C159 C160 0.0 . . . . ?
P4 C158 C159 C160 179.4(16) . . . . ?
C158 C159 C160 C161 0.0 . . . . ?
C159 C160 C161 C162 0.0 . . . . ?
C160 C161 C162 C157 0.0 . . . . ?
C158 C157 C162 C161 0.0 . . . . ?
C131 C132 P2 C115 -174.2(9) . . . . ?
C127 C132 P2 C115 2.9(11) . . . . ?
C131 C132 P2 C121 -62.6(10) . . . . ?
C127 C132 P2 C121 114.6(10) . . . . ?
C131 C132 P2 Ag3 59.1(10) . . . . ?
C127 C132 P2 Ag3 -123.8(9) . . . . ?
C116 C115 P2 C132 81.3(9) . . . . ?
C120 C115 P2 C132 -97.5(9) . . . . ?
C116 C115 P2 C121 -33.5(9) . . . . ?
C120 C115 P2 C121 147.7(8) . . . . ?
C116 C115 P2 Ag3 -160.6(6) . . . . ?
C120 C115 P2 Ag3 20.6(9) . . . . ?
C168 C163 C164 C165 0.0 . . . . ?
P4 C163 C164 C165 -179.2(12) . . . . ?
C163 C164 C165 C166 0.0 . . . . ?
C164 C165 C166 C167 0.0 . . . . ?
C165 C166 C167 C168 0.0 . . . . ?
C166 C167 C168 C163 0.0 . . . . ?
C164 C163 C168 C167 0.0 . . . . ?
P4 C163 C168 C167 179.2(13) . . . . ?
C83 C84 N4 C89 -1.3(14) . . . . ?
C75 C84 N4 C89 177.3(13) . . . . ?
C88 C89 N4 C84 -175.8(12) . . . . ?
C85 C89 N4 C84 -0.2(13) . . . . ?
C97 P1 C169 C170 107.8(11) . . . . ?
C103 P1 C169 C170 -10.0(14) . . . . ?
Au5 P1 C169 C170 -130.2(10) . . . . ?
C97 P1 C169 C174 -84.9(13) . . . . ?
C103 P1 C169 C174 157.4(12) . . . . ?
Au5 P1 C169 C174 37.2(13) . . . . ?
C174 C169 C170 C171 0.0 . . . . ?
P1 C169 C170 C171 167.7(15) . . . . ?
C169 C170 C171 C172 0.0 . . . . ?
C170 C171 C172 C173 0.0 . . . . ?
C171 C172 C173 C174 0.0 . . . . ?
C172 C173 C174 C169 0.0 . . . . ?
C170 C169 C174 C173 0.0 . . . . ?
P1 C169 C174 C173 -166.9(16) . . . . ?
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.000 0.000 -0.006 2891 1217 ' '
2 -0.062 0.366 -0.011 12070 4077 ' '
