# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_a
_database_code_depnum_ccdc_archive 'CCDC 2056644'
loop_
_audit_author_name
_audit_author_address
'ZhiGang Ren'
;Soochow University
China
;
_audit_update_record             
;
2021-01-17 deposited with the CCDC.	2021-05-03 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C52 H40 Ag Au2  N8 P2, P F6 , 2(C H4 O)'
_chemical_formula_sum            'C54 H48 Ag Au2 F6 N8 O2 P3'
_chemical_formula_weight         1549.71

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'
F F 0.0171 0.0103 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_H-M_alt        'P 2/c'
_space_group_name_Hall           '-P 2yc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'

_cell_length_a                   13.393(4)
_cell_length_b                   11.321(4)
_cell_length_c                   19.152(5)
_cell_angle_alpha                90
_cell_angle_beta                 110.223(9)
_cell_angle_gamma                90
_cell_volume                     2724.7(14)
_cell_formula_units_Z            2
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    9888
_cell_measurement_theta_min      2.4249
_cell_measurement_theta_max      27.5022

_exptl_crystal_description       block
_exptl_crystal_colour            light-yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.889
_exptl_crystal_F_000             1496
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.150
_exptl_absorpt_coefficient_mu    5.885
_shelx_estimated_absorpt_T_min   0.386
_shelx_estimated_absorpt_T_max   0.472
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.4325
_exptl_absorpt_correction_T_max  0.7586
_exptl_absorpt_process_details   
;
 SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction 
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker ApexII'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            36206
_diffrn_reflns_av_unetI/netI     0.0483
_diffrn_reflns_av_R_equivalents  0.1156
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         2.902
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measured_fraction_theta_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_point_group_measured_fraction_full 0.991
_reflns_number_total             4767
_reflns_number_gt                4389
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0363P)²+6.0680P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4767
_refine_ls_number_parameters     346
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0330
_refine_ls_R_factor_gt           0.0305
_refine_ls_wR_factor_ref         0.0846
_refine_ls_wR_factor_gt          0.0832
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_restrained_S_all      1.073
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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 0.500000 0.16101(2) 0.750000 0.01573(9) Uani 1 2 d S T P . .
Au2 Au 0.500000 -0.11609(2) 0.750000 0.02688(10) Uani 1 2 d S T P . .
Ag1 Ag 0.500000 0.41436(5) 0.750000 0.02249(13) Uani 1 2 d S T P . .
P1 P 0.68117(8) 0.17837(10) 0.77359(6) 0.0144(2) Uani 1 1 d . . . . .
P2 P 1.000000 0.50866(15) 0.750000 0.0207(4) Uani 1 2 d S T P . .
F1 F 0.8746(2) 0.5088(3) 0.73496(17) 0.0380(7) Uani 1 1 d . . . . .
F2 F 1.0181(3) 0.4111(4) 0.8121(3) 0.0852(16) Uani 1 1 d . . . . .
F3 F 1.0174(3) 0.6087(4) 0.8113(2) 0.0564(10) Uani 1 1 d . . . . .
N1 N 0.3656(3) 0.5147(3) 0.6680(2) 0.0216(8) Uani 1 1 d . . . . .
N2 N 0.4993(3) 0.3761(3) 0.61696(18) 0.0163(7) Uani 1 1 d . . . . .
N3 N 0.6493(3) 0.2578(3) 0.63424(18) 0.0205(8) Uani 1 1 d . . . . .
H3N H 0.682416 0.220339 0.612118 0.025 Uiso 1 1 d R U . . .
N4 N 0.3459(4) -0.1131(5) 0.5845(3) 0.0504(14) Uani 1 1 d . . . . .
C1 C 0.3035(4) 0.5838(5) 0.6919(3) 0.0304(11) Uani 1 1 d . . . . .
H1 H 0.318444 0.590084 0.744005 0.036 Uiso 1 1 calc R U . . .
C2 C 0.2174(4) 0.6477(5) 0.6441(3) 0.0364(13) Uani 1 1 d . . . . .
H2 H 0.175098 0.696082 0.663424 0.044 Uiso 1 1 calc R U . . .
C3 C 0.1957(4) 0.6392(5) 0.5699(3) 0.0357(12) Uani 1 1 d . . . . .
H3 H 0.137908 0.682379 0.536581 0.043 Uiso 1 1 calc R U . . .
C4 C 0.2578(4) 0.5672(4) 0.5419(3) 0.0271(11) Uani 1 1 d . . . . .
C5 C 0.2346(4) 0.5516(5) 0.4637(3) 0.0329(12) Uani 1 1 d . . . . .
H5 H 0.177495 0.593989 0.429154 0.039 Uiso 1 1 calc R U . . .
C6 C 0.2928(4) 0.4777(4) 0.4392(3) 0.0300(12) Uani 1 1 d . . . . .
H6 H 0.274085 0.465527 0.387132 0.036 Uiso 1 1 calc R U . . .
C7 C 0.3828(3) 0.4161(4) 0.4891(2) 0.0219(9) Uani 1 1 d . . . . .
C8 C 0.4450(4) 0.3391(4) 0.4631(2) 0.0261(11) Uani 1 1 d . . . . .
H8 H 0.426826 0.326125 0.411148 0.031 Uiso 1 1 calc R U . . .
C9 C 0.5302(4) 0.2838(4) 0.5116(2) 0.0235(10) Uani 1 1 d . . . . .
H9 H 0.571126 0.229862 0.494618 0.028 Uiso 1 1 calc R U . . .
C10 C 0.5572(3) 0.3084(4) 0.5892(2) 0.0195(9) Uani 1 1 d . . . . .
C11 C 0.4106(3) 0.4306(4) 0.5668(2) 0.0187(9) Uani 1 1 d . . . . .
C12 C 0.3453(4) 0.5048(4) 0.5939(2) 0.0205(9) Uani 1 1 d . . . . .
C13 C 0.7051(3) 0.2895(4) 0.7105(2) 0.0184(9) Uani 1 1 d . . . . .
H13A H 0.680587 0.367940 0.720830 0.022 Uiso 1 1 calc R U . . .
H13B H 0.782344 0.294767 0.719404 0.022 Uiso 1 1 calc R U . . .
C14 C 0.7615(3) 0.2247(4) 0.8667(2) 0.0197(9) Uani 1 1 d . . . . .
C15 C 0.8433(4) 0.3072(4) 0.8777(3) 0.0291(11) Uani 1 1 d . . . . .
H15 H 0.856405 0.340876 0.836285 0.035 Uiso 1 1 calc R U . . .
C16 C 0.9050(4) 0.3394(5) 0.9494(3) 0.0414(14) Uani 1 1 d . . . . .
H16 H 0.959890 0.396253 0.956905 0.050 Uiso 1 1 calc R U . . .
C17 C 0.8880(5) 0.2906(6) 1.0091(3) 0.0468(17) Uani 1 1 d . . . . .
H17 H 0.931170 0.313146 1.058001 0.056 Uiso 1 1 calc R U . . .
C18 C 0.8077(5) 0.2079(7) 0.9988(3) 0.0528(18) Uani 1 1 d . . . . .
H18 H 0.796803 0.173154 1.040776 0.063 Uiso 1 1 calc R U . . .
C19 C 0.7432(4) 0.1755(5) 0.9275(3) 0.0343(12) Uani 1 1 d . . . . .
H19 H 0.687110 0.120336 0.920428 0.041 Uiso 1 1 calc R U . . .
C21 C 0.7422(3) 0.0464(4) 0.7534(2) 0.0176(8) Uani 1 1 d . . . . .
C22 C 0.8414(4) 0.0058(4) 0.7995(3) 0.0258(10) Uani 1 1 d . . . . .
H22 H 0.878549 0.046548 0.844325 0.031 Uiso 1 1 calc R U . . .
C23 C 0.8859(4) -0.0941(5) 0.7801(3) 0.0347(12) Uani 1 1 d . . . . .
H23 H 0.953859 -0.120936 0.811406 0.042 Uiso 1 1 calc R U . . .
C24 C 0.8319(5) -0.1549(5) 0.7153(3) 0.0386(13) Uani 1 1 d . . . . .
H24 H 0.862482 -0.223448 0.702408 0.046 Uiso 1 1 calc R U . . .
C25 C 0.7331(4) -0.1155(4) 0.6694(3) 0.0335(12) Uani 1 1 d . . . . .
H25 H 0.696151 -0.157186 0.624829 0.040 Uiso 1 1 calc R U . . .
C26 C 0.6883(4) -0.0166(4) 0.6878(3) 0.0252(11) Uani 1 1 d . . . . .
H26 H 0.620326 0.009491 0.656112 0.030 Uiso 1 1 calc R U . . .
C27 C 0.4020(4) -0.1164(5) 0.6445(3) 0.0375(13) Uani 1 1 d . . . . .
C28 C 0.8858(4) 0.1108(6) 0.5939(4) 0.0504(16) Uani 1 1 d . . . . .
H28A H 0.922611 0.169159 0.631808 0.076 Uiso 1 1 calc R U . . .
H28B H 0.915303 0.112461 0.553647 0.076 Uiso 1 1 calc R U . . .
H28C H 0.895488 0.031880 0.616270 0.076 Uiso 1 1 calc R U . . .
O1 O 0.7770(3) 0.1377(4) 0.5651(2) 0.0553(13) Uani 1 1 d . . . . .
H1A H 0.750671 0.110664 0.521685 0.083 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Au1 P1 2.3177(12) 2_656 ?
Au1 P1 2.3178(12) . ?
Au1 Ag1 2.8681(10) . ?
Au1 Au2 3.1370(10) . ?
Au2 C27 1.994(6) . ?
Au2 C27 1.994(6) 2_656 ?
Ag1 N1 2.246(4) . ?
Ag1 N1 2.246(4) 2_656 ?
Ag1 N2 2.582(3) . ?
Ag1 N2 2.582(3) 2_656 ?
P1 C21 1.808(5) . ?
P1 C14 1.812(4) . ?
P1 C13 1.848(4) . ?
P2 F2 1.579(4) 2_756 ?
P2 F2 1.579(4) . ?
P2 F3 1.589(3) . ?
P2 F3 1.589(3) 2_756 ?
P2 F1 1.602(3) 2_756 ?
P2 F1 1.602(3) . ?
N1 C1 1.333(6) . ?
N1 C12 1.355(6) . ?
N2 C10 1.325(6) . ?
N2 C11 1.387(5) . ?
N3 C10 1.364(5) . ?
N3 C13 1.437(5) . ?
N4 C27 1.135(7) . ?
C1 C2 1.401(7) . ?
C2 C3 1.353(8) . ?
C3 C4 1.397(8) . ?
C4 C5 1.431(7) . ?
C4 C12 1.434(6) . ?
C5 C6 1.335(8) . ?
C6 C7 1.434(6) . ?
C7 C8 1.410(7) . ?
C7 C11 1.414(6) . ?
C8 C9 1.351(7) . ?
C9 C10 1.429(6) . ?
C11 C12 1.433(7) . ?
C14 C19 1.387(7) . ?
C14 C15 1.399(7) . ?
C15 C16 1.384(7) . ?
C16 C17 1.358(9) . ?
C17 C18 1.388(10) . ?
C18 C19 1.390(8) . ?
C21 C22 1.394(6) . ?
C21 C26 1.407(6) . ?
C22 C23 1.388(7) . ?
C23 C24 1.383(8) . ?
C24 C25 1.385(8) . ?
C25 C26 1.374(7) . ?
C28 O1 1.402(6) . ?

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
P1 Au1 P1 170.27(6) 2_656 . ?
P1 Au1 Ag1 85.14(3) 2_656 . ?
P1 Au1 Ag1 85.14(3) . . ?
P1 Au1 Au2 94.86(3) 2_656 . ?
P1 Au1 Au2 94.86(3) . . ?
Ag1 Au1 Au2 180.0 . . ?
C27 Au2 C27 179.8(3) . 2_656 ?
C27 Au2 Au1 90.12(16) . . ?
C27 Au2 Au1 90.12(16) 2_656 . ?
N1 Ag1 N1 119.2(2) . 2_656 ?
N1 Ag1 N2 70.51(13) . . ?
N1 Ag1 N2 120.23(13) 2_656 . ?
N1 Ag1 N2 120.23(13) . 2_656 ?
N1 Ag1 N2 70.51(13) 2_656 2_656 ?
N2 Ag1 N2 160.67(16) . 2_656 ?
N1 Ag1 Au1 120.38(10) . . ?
N1 Ag1 Au1 120.38(10) 2_656 . ?
N2 Ag1 Au1 80.33(8) . . ?
N2 Ag1 Au1 80.33(8) 2_656 . ?
C21 P1 C14 106.91(19) . . ?
C21 P1 C13 103.3(2) . . ?
C14 P1 C13 105.5(2) . . ?
C21 P1 Au1 114.11(14) . . ?
C14 P1 Au1 116.22(14) . . ?
C13 P1 Au1 109.69(14) . . ?
F2 P2 F2 91.2(4) 2_756 . ?
F2 P2 F3 178.9(2) 2_756 . ?
F2 P2 F3 89.9(3) . . ?
F2 P2 F3 89.9(3) 2_756 2_756 ?
F2 P2 F3 178.9(2) . 2_756 ?
F3 P2 F3 89.1(3) . 2_756 ?
F2 P2 F1 90.8(2) 2_756 2_756 ?
F2 P2 F1 89.3(2) . 2_756 ?
F3 P2 F1 89.39(17) . 2_756 ?
F3 P2 F1 90.50(18) 2_756 2_756 ?
F2 P2 F1 89.3(2) 2_756 . ?
F2 P2 F1 90.8(2) . . ?
F3 P2 F1 90.50(18) . . ?
F3 P2 F1 89.40(17) 2_756 . ?
F1 P2 F1 179.8(3) 2_756 . ?
C1 N1 C12 119.1(4) . . ?
C1 N1 Ag1 120.1(3) . . ?
C12 N1 Ag1 120.9(3) . . ?
C10 N2 C11 117.3(4) . . ?
C10 N2 Ag1 133.7(3) . . ?
C11 N2 Ag1 108.5(3) . . ?
C10 N3 C13 125.3(4) . . ?
N1 C1 C2 123.3(5) . . ?
C3 C2 C1 118.7(5) . . ?
C2 C3 C4 120.3(5) . . ?
C3 C4 C5 122.0(4) . . ?
C3 C4 C12 118.2(5) . . ?
C5 C4 C12 119.7(5) . . ?
C6 C5 C4 120.2(4) . . ?
C5 C6 C7 121.9(5) . . ?
C8 C7 C11 118.1(4) . . ?
C8 C7 C6 121.8(4) . . ?
C11 C7 C6 120.1(4) . . ?
C9 C8 C7 120.3(4) . . ?
C8 C9 C10 118.3(4) . . ?
N2 C10 N3 121.0(4) . . ?
N2 C10 C9 123.9(4) . . ?
N3 C10 C9 115.1(4) . . ?
N2 C11 C7 121.9(4) . . ?
N2 C11 C12 119.7(4) . . ?
C7 C11 C12 118.5(4) . . ?
N1 C12 C11 120.0(4) . . ?
N1 C12 C4 120.4(4) . . ?
C11 C12 C4 119.5(4) . . ?
N3 C13 P1 110.3(3) . . ?
C19 C14 C15 119.8(4) . . ?
C19 C14 P1 119.5(4) . . ?
C15 C14 P1 120.6(3) . . ?
C16 C15 C14 119.6(5) . . ?
C17 C16 C15 120.8(6) . . ?
C16 C17 C18 120.2(5) . . ?
C17 C18 C19 120.3(5) . . ?
C14 C19 C18 119.3(6) . . ?
C22 C21 C26 118.7(4) . . ?
C22 C21 P1 122.7(3) . . ?
C26 C21 P1 118.6(3) . . ?
C23 C22 C21 120.2(5) . . ?
C24 C23 C22 120.3(5) . . ?
C23 C24 C25 119.9(5) . . ?
C26 C25 C24 120.3(5) . . ?
C25 C26 C21 120.5(5) . . ?
N4 C27 Au2 178.0(5) . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O1 H1A N4 0.84 2.00 2.780(6) 154.7 3_656
N3 H3N O1 0.83 2.02 2.845(5) 174.0 .

_refine_diff_density_max         1.368
_refine_diff_density_min         -1.610
_refine_diff_density_rms         0.147



####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_a_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 2056645'
loop_
_audit_author_name
_audit_author_address
'ZhiGang Ren'
;Soochow University
China
;
_audit_update_record             
;
2021-01-17 deposited with the CCDC.	2021-05-03 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C52 H40 Ag Au2 N8 P2, F6 P, 2(C2 H6 O)'
_chemical_formula_sum            'C56 H52 Ag Au2 F6 N8 O2 P3'
_chemical_formula_weight         1577.77

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'
F F 0.0171 0.0103 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_H-M_alt        'P 2/c'
_space_group_name_Hall           '-P 2yc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'

_cell_length_a                   13.4700(7)
_cell_length_b                   11.4324(6)
_cell_length_c                   19.0084(11)
_cell_angle_alpha                90
_cell_angle_beta                 109.0308(15)
_cell_angle_gamma                90
_cell_volume                     2767.2(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    9945
_cell_measurement_theta_min      3.5643
_cell_measurement_theta_max      27.5164

_exptl_crystal_description       block
_exptl_crystal_colour            light-yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.894
_exptl_crystal_F_000             1528
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.100
_exptl_absorpt_coefficient_mu    5.796
_shelx_estimated_absorpt_T_min   0.390
_shelx_estimated_absorpt_T_max   0.595
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5150
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_process_details   
;
 SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction 
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker ApexII'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            40293
_diffrn_reflns_av_unetI/netI     0.0304
_diffrn_reflns_av_R_equivalents  0.0500
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         3.512
_diffrn_reflns_theta_max         27.516
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measured_fraction_theta_full 0.975
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_Laue_measured_fraction_full 0.975
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_point_group_measured_fraction_full 0.975
_reflns_number_total             6241
_reflns_number_gt                6046
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0242P)²+4.8996P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6241
_refine_ls_number_parameters     357
_refine_ls_number_restraints     6
_refine_ls_R_factor_all          0.0251
_refine_ls_R_factor_gt           0.0243
_refine_ls_wR_factor_ref         0.0634
_refine_ls_wR_factor_gt          0.0630
_refine_ls_goodness_of_fit_ref   1.058
_refine_ls_restrained_S_all      1.059
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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 0.500000 0.16902(2) 0.750000 0.01839(5) Uani 1 2 d S T P . .
Au2 Au 0.500000 -0.10544(2) 0.750000 0.03594(6) Uani 1 2 d S T P . .
Ag1 Ag 0.500000 0.41934(3) 0.750000 0.02199(7) Uani 1 2 d S T P . .
P1 P 0.67865(5) 0.18412(6) 0.77085(4) 0.01693(13) Uani 1 1 d . . . . .
P2 P 1.000000 0.52682(9) 0.750000 0.0239(2) Uani 1 2 d S T P . .
F1 F 1.12466(15) 0.5274(2) 0.76784(12) 0.0440(5) Uani 1 1 d . . . . .
F2 F 0.9899(3) 0.6403(4) 0.6947(2) 0.0326(8) Uiso 0.5 1 d . . P A 1
F3 F 0.9915(4) 0.4485(5) 0.6783(3) 0.0442(10) Uiso 0.5 1 d . . P B 1
F2A F 0.9946(9) 0.5115(12) 0.6636(7) 0.047(3) Uiso 0.2 1 d . . P B 2
F3A F 1.000000 0.381(2) 0.750000 0.072(6) Uiso 0.2 2 d S . P C 2
F3B F 1.000000 0.656(2) 0.750000 0.075(6) Uiso 0.2 2 d S . P B 2
F2C F 0.9829(5) 0.5946(7) 0.6772(4) 0.0317(14) Uiso 0.3 1 d . . P B 3
F3C F 0.9807(5) 0.4104(6) 0.7042(4) 0.0314(13) Uiso 0.3 1 d . . P B 3
N1 N 0.36689(18) 0.5139(2) 0.66727(13) 0.0212(4) Uani 1 1 d . . . . .
N2 N 0.50053(17) 0.37751(19) 0.61471(12) 0.0178(4) Uani 1 1 d . . . . .
N3 N 0.65035(19) 0.2619(2) 0.63089(12) 0.0236(5) Uani 1 1 d . . . . .
H3 H 0.679184 0.206963 0.611510 0.028 Uiso 1 1 calc R U . . .
N4 N 0.3491(3) -0.1028(4) 0.5857(2) 0.0606(10) Uani 1 1 d . . . . .
C1 C 0.3055(2) 0.5822(3) 0.69156(18) 0.0287(6) Uani 1 1 d . . . . .
H1 H 0.321020 0.590421 0.743772 0.034 Uiso 1 1 calc R U . . .
C2 C 0.2191(3) 0.6427(3) 0.6444(2) 0.0362(7) Uani 1 1 d . . . . .
H2 H 0.176484 0.689921 0.664156 0.043 Uiso 1 1 calc R U . . .
C3 C 0.1976(2) 0.6324(3) 0.56938(19) 0.0340(7) Uani 1 1 d . . . . .
H3A H 0.139998 0.673659 0.536280 0.041 Uiso 1 1 calc R U . . .
C4 C 0.2604(2) 0.5610(3) 0.54093(16) 0.0258(6) Uani 1 1 d . . . . .
C5 C 0.2371(2) 0.5434(3) 0.46289(17) 0.0311(7) Uani 1 1 d . . . . .
H5 H 0.179045 0.582534 0.428677 0.037 Uiso 1 1 calc R U . . .
C6 C 0.2969(2) 0.4716(3) 0.43770(16) 0.0289(6) Uani 1 1 d . . . . .
H6 H 0.279755 0.459542 0.385647 0.035 Uiso 1 1 calc R U . . .
C7 C 0.3854(2) 0.4132(2) 0.48747(15) 0.0233(5) Uani 1 1 d . . . . .
C8 C 0.4484(3) 0.3374(2) 0.46066(15) 0.0268(6) Uani 1 1 d . . . . .
H8 H 0.431272 0.323792 0.408753 0.032 Uiso 1 1 calc R U . . .
C9 C 0.5325(2) 0.2848(2) 0.50898(15) 0.0262(6) Uani 1 1 d . . . . .
H9 H 0.573774 0.231745 0.491728 0.031 Uiso 1 1 calc R U . . .
C10 C 0.5590(2) 0.3097(2) 0.58642(14) 0.0208(5) Uani 1 1 d . . . . .
C11 C 0.4130(2) 0.4285(2) 0.56504(14) 0.0190(5) Uani 1 1 d . . . . .
C12 C 0.3464(2) 0.5021(2) 0.59254(15) 0.0204(5) Uani 1 1 d . . . . .
C13 C 0.7034(2) 0.2939(2) 0.70681(15) 0.0198(5) Uani 1 1 d . . . . .
H13A H 0.678381 0.371496 0.716910 0.024 Uiso 1 1 calc R U . . .
H13B H 0.779808 0.299486 0.715503 0.024 Uiso 1 1 calc R U . . .
C14 C 0.7592(2) 0.2301(2) 0.86271(14) 0.0207(5) Uani 1 1 d . . . . .
C15 C 0.8421(2) 0.3075(3) 0.87220(17) 0.0283(6) Uani 1 1 d . . . . .
H15 H 0.856523 0.337839 0.830011 0.034 Uiso 1 1 calc R U . . .
C16 C 0.9040(3) 0.3406(3) 0.9434(2) 0.0387(8) Uani 1 1 d . . . . .
H16 H 0.960194 0.394122 0.949633 0.046 Uiso 1 1 calc R U . . .
C17 C 0.8843(3) 0.2962(3) 1.00449(19) 0.0423(9) Uani 1 1 d . . . . .
H17 H 0.927420 0.318123 1.053063 0.051 Uiso 1 1 calc R U . . .
C18 C 0.8029(3) 0.2207(4) 0.99547(19) 0.0443(9) Uani 1 1 d . . . . .
H18 H 0.789779 0.190646 1.038197 0.053 Uiso 1 1 calc R U . . .
C19 C 0.7382(3) 0.1864(3) 0.92480(18) 0.0338(7) Uani 1 1 d . . . . .
H19 H 0.681072 0.134406 0.919239 0.041 Uiso 1 1 calc R U . . .
C21 C 0.7354(2) 0.0509(2) 0.74910(16) 0.0219(5) Uani 1 1 d . . . . .
C22 C 0.8292(3) 0.0058(3) 0.7960(2) 0.0336(7) Uani 1 1 d . . . . .
H22 H 0.864865 0.043620 0.841823 0.040 Uiso 1 1 calc R U . . .
C23 C 0.8710(3) -0.0955(3) 0.7756(2) 0.0439(9) Uani 1 1 d . . . . .
H23 H 0.935996 -0.125624 0.807230 0.053 Uiso 1 1 calc R U . . .
C24 C 0.8187(3) -0.1520(3) 0.7100(2) 0.0434(9) Uani 1 1 d . . . . .
H24 H 0.847540 -0.220893 0.696514 0.052 Uiso 1 1 calc R U . . .
C25 C 0.7247(3) -0.1085(3) 0.6640(2) 0.0381(8) Uani 1 1 d . . . . .
H25 H 0.688572 -0.147857 0.618919 0.046 Uiso 1 1 calc R U . . .
C26 C 0.6822(2) -0.0073(3) 0.68312(18) 0.0277(6) Uani 1 1 d . . . . .
H26 H 0.617135 0.022176 0.651273 0.033 Uiso 1 1 calc R U . . .
C27 C 0.4047(3) -0.1059(3) 0.6460(3) 0.0456(9) Uani 1 1 d . . . . .
C28 C 0.8858(6) 0.1101(8) 0.5862(4) 0.048(2) Uiso 0.7 1 d D . P D 1
H28A H 0.879938 0.045352 0.619213 0.057 Uiso 0.7 1 calc R U P D 1
H28B H 0.935799 0.167730 0.617539 0.057 Uiso 0.7 1 calc R U P D 1
C29 C 0.9347(6) 0.0597(7) 0.5284(4) 0.0672(18) Uiso 0.7 1 d D . P D 1
H29A H 1.003057 0.024411 0.554689 0.101 Uiso 0.7 1 calc R U P D 1
H29B H 0.887770 0.000036 0.497907 0.101 Uiso 0.7 1 calc R U P D 1
H29C H 0.943860 0.122916 0.496226 0.101 Uiso 0.7 1 calc R U P D 1
O1 O 0.7896(3) 0.1630(4) 0.5591(2) 0.0438(10) Uiso 0.7 1 d D . P D 1
H1A H 0.740135 0.134391 0.525043 0.053 Uiso 0.7 1 d DR U P D 1
C28A C 0.8702(11) 0.0914(15) 0.5767(8) 0.040(5) Uiso 0.3 1 d D . P E 2
H28C H 0.901260 0.116477 0.538547 0.048 Uiso 0.3 1 calc R U P E 2
H28D H 0.878946 0.005754 0.583672 0.048 Uiso 0.3 1 calc R U P E 2
C29A C 0.9220(6) 0.1572(7) 0.6514(4) 0.0158(15) Uiso 0.3 1 d D . P E 2
H29D H 0.997314 0.139820 0.669928 0.024 Uiso 0.3 1 calc R U P E 2
H29E H 0.911686 0.241634 0.643218 0.024 Uiso 0.3 1 calc R U P E 2
H29F H 0.889525 0.131670 0.688033 0.024 Uiso 0.3 1 calc R U P E 2
O1A O 0.7636(6) 0.1229(7) 0.5559(4) 0.0276(15) Uiso 0.3 1 d D . P E 2
H1B H 0.732581 0.091809 0.515187 0.033 Uiso 0.3 1 d DR U P E 2


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Au1 P1 2.3143(7) 2_656 ?
Au1 P1 2.3143(7) . ?
Au1 Ag1 2.8617(3) . ?
Au1 Au2 3.1377(3) . ?
Au2 C27 1.975(5) 2_656 ?
Au2 C27 1.975(5) . ?
Ag1 N1 2.240(2) 2_656 ?
Ag1 N1 2.240(2) . ?
Ag1 N2 2.618(2) 2_656 ?
Ag1 N2 2.618(2) . ?
P1 C14 1.808(3) . ?
P1 C21 1.811(3) . ?
P1 C13 1.852(3) . ?
P2 F3B 1.48(2) . ?
P2 F2C 1.536(6) 2_756 ?
P2 F2C 1.536(6) . ?
P2 F3C 1.565(6) 2_756 ?
P2 F3C 1.565(6) . ?
P2 F1 1.601(2) 2_756 ?
P2 F1 1.601(2) . ?
P2 F3 1.602(5) . ?
P2 F3 1.602(5) 2_756 ?
P2 F2A 1.629(12) . ?
P2 F2A 1.629(12) 2_756 ?
P2 F2 1.647(4) 2_756 ?
F3C F3C 1.647(14) 2_756 ?
N1 C1 1.324(4) . ?
N1 C12 1.363(3) . ?
N2 C10 1.336(3) . ?
N2 C11 1.377(3) . ?
N3 C10 1.360(3) . ?
N3 C13 1.433(3) . ?
N4 C27 1.147(6) . ?
C1 C2 1.399(4) . ?
C2 C3 1.365(5) . ?
C3 C4 1.405(5) . ?
C4 C12 1.420(4) . ?
C4 C5 1.427(4) . ?
C5 C6 1.343(5) . ?
C6 C7 1.424(4) . ?
C7 C11 1.409(4) . ?
C7 C8 1.419(4) . ?
C8 C9 1.345(4) . ?
C9 C10 1.426(4) . ?
C11 C12 1.445(4) . ?
C14 C15 1.390(4) . ?
C14 C19 1.394(4) . ?
C15 C16 1.390(4) . ?
C16 C17 1.371(6) . ?
C17 C18 1.362(6) . ?
C18 C19 1.398(5) . ?
C21 C22 1.387(4) . ?
C21 C26 1.394(4) . ?
C22 C23 1.397(5) . ?
C23 C24 1.377(6) . ?
C24 C25 1.376(6) . ?
C25 C26 1.390(4) . ?
C28 O1 1.368(8) . ?
C28 C29 1.565(10) . ?
C28A O1A 1.406(14) . ?
C28A C29A 1.557(14) . ?

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
P1 Au1 P1 171.45(3) 2_656 . ?
P1 Au1 Ag1 85.725(17) 2_656 . ?
P1 Au1 Ag1 85.724(17) . . ?
P1 Au1 Au2 94.275(17) 2_656 . ?
P1 Au1 Au2 94.276(17) . . ?
Ag1 Au1 Au2 180.0 . . ?
C27 Au2 C27 179.7(2) 2_656 . ?
C27 Au2 Au1 90.15(11) 2_656 . ?
C27 Au2 Au1 90.15(11) . . ?
N1 Ag1 N1 122.30(12) 2_656 . ?
N1 Ag1 N2 69.91(8) 2_656 2_656 ?
N1 Ag1 N2 121.32(8) . 2_656 ?
N1 Ag1 N2 121.32(8) 2_656 . ?
N1 Ag1 N2 69.91(8) . . ?
N2 Ag1 N2 158.95(9) 2_656 . ?
N1 Ag1 Au1 118.85(6) 2_656 . ?
N1 Ag1 Au1 118.85(6) . . ?
N2 Ag1 Au1 79.47(5) 2_656 . ?
N2 Ag1 Au1 79.47(5) . . ?
C14 P1 C21 107.45(13) . . ?
C14 P1 C13 104.93(13) . . ?
C21 P1 C13 103.86(12) . . ?
C14 P1 Au1 116.76(9) . . ?
C21 P1 Au1 113.03(9) . . ?
C13 P1 Au1 109.74(9) . . ?
F2C P2 F2C 119.4(6) 2_756 . ?
F2C P2 F3C 151.5(4) 2_756 . ?
F2C P2 F3C 88.8(4) . . ?
F3C P2 F3C 63.5(5) 2_756 . ?
F3B P2 F1 89.75(9) . . ?
F2C P2 F1 88.2(3) 2_756 . ?
F2C P2 F1 91.6(3) . . ?
F3C P2 F1 85.1(2) 2_756 . ?
F3C P2 F1 95.4(3) . . ?
F1 P2 F1 179.50(18) 2_756 . ?
F1 P2 F3 92.47(19) 2_756 . ?
F1 P2 F3 87.81(19) . . ?
F1 P2 F3 87.81(19) 2_756 2_756 ?
F1 P2 F3 92.47(19) . 2_756 ?
F3 P2 F3 112.1(4) . 2_756 ?
F3B P2 F2A 96.2(5) . . ?
F1 P2 F2A 95.0(4) 2_756 . ?
F1 P2 F2A 85.0(4) . . ?
F1 P2 F2A 85.0(4) 2_756 2_756 ?
F1 P2 F2A 95.0(4) . 2_756 ?
F3 P2 F2A 139.8(6) . 2_756 ?
F3 P2 F2A 27.8(4) 2_756 2_756 ?
F1 P2 F2 89.68(16) 2_756 2_756 ?
F1 P2 F2 89.93(16) . 2_756 ?
F3 P2 F2 161.9(3) . 2_756 ?
F3 P2 F2 85.9(3) 2_756 2_756 ?
P2 F3C F3C 58.3(3) . 2_756 ?
C1 N1 C12 119.0(2) . . ?
C1 N1 Ag1 119.16(19) . . ?
C12 N1 Ag1 121.83(18) . . ?
C10 N2 C11 117.1(2) . . ?
C10 N2 Ag1 133.79(17) . . ?
C11 N2 Ag1 108.67(16) . . ?
C10 N3 C13 125.2(2) . . ?
N1 C1 C2 123.5(3) . . ?
C3 C2 C1 118.4(3) . . ?
C2 C3 C4 120.2(3) . . ?
C3 C4 C12 117.9(3) . . ?
C3 C4 C5 121.7(3) . . ?
C12 C4 C5 120.3(3) . . ?
C6 C5 C4 120.1(3) . . ?
C5 C6 C7 121.3(3) . . ?
C11 C7 C8 117.8(2) . . ?
C11 C7 C6 121.0(3) . . ?
C8 C7 C6 121.2(3) . . ?
C9 C8 C7 119.8(3) . . ?
C8 C9 C10 119.1(3) . . ?
N2 C10 N3 121.0(2) . . ?
N2 C10 C9 123.4(3) . . ?
N3 C10 C9 115.6(2) . . ?
N2 C11 C7 122.7(2) . . ?
N2 C11 C12 119.5(2) . . ?
C7 C11 C12 117.9(2) . . ?
N1 C12 C4 121.0(3) . . ?
N1 C12 C11 119.8(2) . . ?
C4 C12 C11 119.2(2) . . ?
N3 C13 P1 110.58(18) . . ?
C15 C14 C19 119.7(3) . . ?
C15 C14 P1 121.0(2) . . ?
C19 C14 P1 119.3(2) . . ?
C14 C15 C16 120.1(3) . . ?
C17 C16 C15 120.3(4) . . ?
C18 C17 C16 119.9(3) . . ?
C17 C18 C19 121.5(3) . . ?
C14 C19 C18 118.5(3) . . ?
C22 C21 C26 119.6(3) . . ?
C22 C21 P1 122.0(2) . . ?
C26 C21 P1 118.4(2) . . ?
C21 C22 C23 119.7(3) . . ?
C24 C23 C22 120.4(3) . . ?
C25 C24 C23 120.0(3) . . ?
C24 C25 C26 120.4(3) . . ?
C25 C26 C21 119.8(3) . . ?
N4 C27 Au2 178.1(4) . . ?
O1 C28 C29 117.5(6) . . ?
O1A C28A C29A 104.2(10) . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
N3 H3 O1 0.88 2.10 2.886(5) 147.7 .
N3 H3 O1A 0.88 2.03 2.882(8) 162.7 .
O1 H1A N4 0.83 2.09 2.861(6) 155.1 3_656

_refine_diff_density_max         1.054
_refine_diff_density_min         -1.464
_refine_diff_density_rms         0.102



