#------------------------------------------------------------------------------
#$Date: 2022-08-06 14:38:43 +0300 (Sat, 06 Aug 2022) $
#$Revision: 277094 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/71/1567145.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_1567145
loop_
_publ_author_name
'Das, Anish Kumar'
'Biswas, Sourav'
'Manna, Surya Sekhar'
'Pathak, Biswarup'
'Mandal, Sukhendu'
_publ_section_title
;
 An atomically precise silver nanocluster for artificial light-harvesting
 system through supramolecular functionalization.
;
_journal_issue                   28
_journal_name_full               'Chemical science'
_journal_page_first              8355
_journal_page_last               8364
_journal_paper_doi               10.1039/d2sc02786k
_journal_volume                  13
_journal_year                    2022
_chemical_formula_sum            'C102 H148 Ag16 Cl F15 N4 O16 S9'
_chemical_formula_weight         4021.15
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2022-04-29 deposited with the CCDC.	2022-06-20 downloaded from the CCDC.
;
_cell_angle_alpha                94.002(2)
_cell_angle_beta                 97.603(3)
_cell_angle_gamma                119.287(2)
_cell_formula_units_Z            2
_cell_length_a                   17.2901(12)
_cell_length_b                   17.3047(11)
_cell_length_c                   29.001(2)
_cell_measurement_reflns_used    241695
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.633
_cell_measurement_theta_min      2.152
_cell_volume                     7410.1(9)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SAINT'
_computing_data_reduction        'Bruker APEX2'
_computing_molecular_graphics    'Mercury (Macrae et al. , 2008)'
_computing_publication_material  'WINZX (Farrugia, 2014) and PLATON(Spek, 2009)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.977
_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  0.1401
_diffrn_reflns_av_unetI/netI     0.1108
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.977
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       38
_diffrn_reflns_limit_l_min       -38
_diffrn_reflns_number            241695
_diffrn_reflns_point_group_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.977
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.633
_diffrn_reflns_theta_min         2.152
_exptl_absorpt_coefficient_mu    2.274
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.802
_exptl_crystal_description       block
_exptl_crystal_F_000             3928
_exptl_crystal_size_max          0.096
_exptl_crystal_size_mid          0.075
_exptl_crystal_size_min          0.045
_refine_diff_density_max         3.157
_refine_diff_density_min         -1.913
_refine_diff_density_rms         0.262
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.018
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1485
_refine_ls_number_reflns         37175
_refine_ls_number_restraints     127
_refine_ls_restrained_S_all      1.018
_refine_ls_R_factor_all          0.2174
_refine_ls_R_factor_gt           0.1059
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1456P)²+105.2460P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2692
_refine_ls_wR_factor_ref         0.3334
_reflns_Friedel_coverage         0.000
_reflns_number_gt                16862
_reflns_number_total             37175
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2sc02786k2.cif
_cod_data_source_block           shelx
_cod_depositor_comments          'Adding full bibliography for 1567145.cif.'
_cod_original_cell_volume        7410.2(9)
_cod_database_code               1567145
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.811
_shelx_estimated_absorpt_t_max   0.905
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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
Ag01 Ag 0.24067(8) 0.24234(8) 0.68737(4) 0.0372(3) Uani 1 1 d . . . . .
Ag02 Ag 0.39150(8) 0.41007(8) 0.74987(4) 0.0382(3) Uani 1 1 d . . . . .
Ag03 Ag 0.18776(8) 0.35123(8) 0.75140(4) 0.0373(3) Uani 1 1 d . . . . .
Ag04 Ag 0.34902(8) 0.14738(8) 0.66816(4) 0.0398(3) Uani 1 1 d . . . . .
Ag05 Ag 0.16877(8) -0.03234(9) 0.69188(4) 0.0431(3) Uani 1 1 d . . . . .
Ag06 Ag 0.29061(9) -0.07947(8) 0.75697(4) 0.0425(3) Uani 1 1 d . . . . .
Ag07 Ag 0.46664(8) 0.09310(8) 0.74587(4) 0.0412(3) Uani 1 1 d . . . . .
Ag08 Ag 0.01167(9) 0.17541(9) 0.76044(5) 0.0470(3) Uani 1 1 d . . . . .
Ag09 Ag 1.34138(9) 1.08868(9) 0.81801(5) 0.0476(3) Uani 1 1 d . . . . .
Ag0A Ag 1.39918(10) 1.29142(9) 0.82078(6) 0.0557(4) Uani 1 1 d . . . . .
Ag0B Ag 1.18151(9) 1.21358(9) 0.82422(6) 0.0560(4) Uani 1 1 d . . . . .
Ag0C Ag 0.04751(10) 0.05574(8) 0.68678(5) 0.0556(4) Uani 1 1 d . . . . .
Ag0D Ag 1.07186(11) 0.84256(10) 0.76165(5) 0.0593(4) Uani 1 1 d . . . . .
Ag0E Ag 0.52163(10) 0.29455(11) 0.73769(5) 0.0624(4) Uani 1 1 d . . . . .
Ag0F Ag 1.13469(11) 1.02281(11) 0.83595(6) 0.0605(4) Uani 1 1 d . . . . .
S0I S 0.3208(2) 0.0006(2) 0.68635(12) 0.0296(7) Uani 1 1 d . . . . .
Cl0J Cl 1.2310(2) 1.1287(2) 0.75462(11) 0.0305(7) Uani 1 1 d . . . . .
S0K S 0.4013(2) 0.3077(2) 0.68629(12) 0.0292(7) Uani 1 1 d . . . . .
S0L S 1.0313(2) 1.0797(2) 0.81871(13) 0.0322(8) Uani 1 1 d D . . . .
S0M S 0.0882(2) 0.2102(2) 0.69048(12) 0.0291(7) Uani 1 1 d . . . . .
S0N S 0.0111(2) -0.0936(2) 0.70010(12) 0.0292(7) Uani 1 1 d . . . . .
S0O S 1.3056(2) 1.3594(2) 0.81640(12) 0.0281(7) Uani 1 1 d . . . . .
S0P S 1.2137(3) 0.9421(3) 0.82207(14) 0.0395(9) Uani 1 1 d . . . . .
S0Q S 1.4820(3) 1.2161(3) 0.80704(13) 0.0351(8) Uani 1 1 d . . . . .
F00R F 0.4874(9) -0.1716(9) 0.8431(6) 0.098(5) Uani 1 1 d . . . . .
O00S O 0.5198(8) 0.0115(8) 0.7892(4) 0.053(3) Uani 1 1 d . . . . .
O00T O 0.2340(9) 0.4722(7) 0.7088(5) 0.056(3) Uani 1 1 d . . . . .
O00U O 0.3951(10) -0.1144(9) 0.7933(5) 0.060(3) Uani 1 1 d . . . . .
F00V F 0.6085(10) -0.0688(10) 0.8259(6) 0.105(5) Uani 1 1 d . . . . .
O00W O 0.7902(8) 0.8302(10) 0.7556(6) 0.087(5) Uani 1 1 d D . . . .
O00X O 0.3819(8) 0.5250(7) 0.7172(4) 0.051(3) Uani 1 1 d . . . . .
O00Y O 0.1026(9) 0.4006(8) 0.7899(5) 0.057(3) Uani 1 1 d . . . . .
O00Z O 0.2720(8) 0.1070(8) 0.5840(4) 0.053(3) Uani 1 1 d . . . . .
N010 N -0.2783(11) 0.0192(13) 0.7213(6) 0.068(5) Uani 1 1 d . . . . .
O011 O 0.5770(10) 0.1397(10) 0.6976(5) 0.072(4) Uani 1 1 d . . . . .
N012 N 0.6429(10) 0.7509(10) 0.7561(6) 0.059(4) Uani 1 1 d . . . . .
C013 C 0.4340(10) 0.3632(9) 0.6339(5) 0.030(3) Uani 1 1 d . . . . .
O014 O -0.1371(9) 0.0464(12) 0.7164(6) 0.091(5) Uani 1 1 d . . . . .
C015 C 0.9805(9) 1.0852(11) 0.8691(5) 0.034(3) Uani 1 1 d . . . . .
C016 C 0.3277(11) -0.0672(11) 0.6372(5) 0.037(4) Uani 1 1 d . . . . .
O017 O 0.1618(10) 0.0755(11) 0.6245(4) 0.074(4) Uani 1 1 d . . . . .
C018 C 0.5309(13) 0.5083(11) 0.6082(6) 0.050(5) Uani 1 1 d . . . . .
H018 H 0.576734 0.571525 0.618911 0.060 Uiso 1 1 calc R U . . .
F019 F 0.5460(13) -0.0385(12) 0.8821(5) 0.119(6) Uani 1 1 d . . . . .
C01B C 0.5684(11) 0.4633(11) 0.5786(6) 0.049(4) Uani 1 1 d . . . . .
H01A H 0.622098 0.468219 0.597114 0.059 Uiso 1 1 calc R U . . .
H01B H 0.585314 0.493231 0.551509 0.059 Uiso 1 1 calc R U . . .
C01C C 0.8864(10) 1.0707(12) 0.8509(5) 0.042(4) Uani 1 1 d . . . . .
H01N H 0.849059 1.011713 0.832028 0.050 Uiso 1 1 calc R U . . .
H01O H 0.891378 1.114952 0.830861 0.050 Uiso 1 1 calc R U . . .
C01D C 0.9717(14) 1.0131(13) 0.8979(6) 0.053(5) Uani 1 1 d . . . . .
H01P H 1.030841 1.020676 0.908831 0.064 Uiso 1 1 calc R U . . .
H01Q H 0.934173 0.954622 0.878650 0.064 Uiso 1 1 calc R U . . .
C01E C -0.0401(10) 0.1504(9) 0.6098(5) 0.035(3) Uani 1 1 d . . . . .
H01C H -0.084701 0.114928 0.627999 0.042 Uiso 1 1 calc R U . . .
H01D H -0.014182 0.115751 0.598516 0.042 Uiso 1 1 calc R U . . .
C01F C 0.0337(9) 0.2380(9) 0.6402(5) 0.028(3) Uani 1 1 d . . . . .
O01G O 0.6141(13) 0.2808(13) 0.6925(7) 0.101(6) Uani 1 1 d . . . . .
C01H C 0.3102(12) 0.5225(10) 0.7032(6) 0.039(4) Uani 1 1 d . . . . .
C01I C -0.0043(10) 0.2931(11) 0.6589(5) 0.035(3) Uani 1 1 d . . . . .
H01E H 0.043801 0.348257 0.678149 0.042 Uiso 1 1 calc R U . . .
H01F H -0.047760 0.259896 0.678140 0.042 Uiso 1 1 calc R U . . .
O01J O -0.0203(10) 0.2757(10) 0.7966(6) 0.079(4) Uani 1 1 d . . . . .
C01K C 0.3668(14) -0.1243(13) 0.6586(6) 0.050(4) Uani 1 1 d . . . . .
H01G H 0.328310 -0.162224 0.678616 0.060 Uiso 1 1 calc R U . . .
H01H H 0.426846 -0.085390 0.677243 0.060 Uiso 1 1 calc R U . . .
C01L C -0.0692(9) -0.1759(9) 0.6494(5) 0.028(3) Uani 1 1 d . . . . .
C01M C 0.0576(12) 0.3112(11) 0.5702(6) 0.046(4) Uani 1 1 d . . . . .
H01M H 0.102584 0.345529 0.551382 0.055 Uiso 1 1 calc R U . . .
C01N C 0.3856(13) -0.0053(13) 0.6057(6) 0.054(5) Uani 1 1 d . . . . .
H01I H 0.445642 0.036591 0.623520 0.065 Uiso 1 1 calc R U . . .
H01J H 0.358821 0.028643 0.593205 0.065 Uiso 1 1 calc R U . . .
C01O C 1.0414(12) 1.1778(11) 0.9011(6) 0.044(4) Uani 1 1 d . . . . .
H01R H 1.099580 1.184500 0.913738 0.053 Uiso 1 1 calc R U . . .
H01S H 1.051417 1.225703 0.882920 0.053 Uiso 1 1 calc R U . . .
N01P N 0.6254(13) 0.8757(12) 0.5515(7) 0.074(5) Uani 1 1 d . . . . .
C01Q C 1.2359(14) 0.8986(13) 0.8752(6) 0.052(5) Uani 1 1 d . . . . .
F01R F 0.3946(11) 0.6398(11) 0.6602(8) 0.139(8) Uani 1 1 d . . . . .
C01S C 1.5781(10) 1.2492(11) 0.8554(5) 0.039(4) Uani 1 1 d . . . . .
C01T C 0.4976(11) 0.3642(10) 0.5620(5) 0.041(4) Uani 1 1 d . . . . .
H01T H 0.522333 0.335409 0.543268 0.049 Uiso 1 1 calc R U . . .
C01U C -0.2063(13) -0.3279(12) 0.6232(6) 0.057(5) Uani 1 1 d . . . . .
H01U H -0.251382 -0.381434 0.633940 0.068 Uiso 1 1 calc R U . . .
C01V C -0.1414(12) -0.2592(10) 0.6673(5) 0.044(4) Uani 1 1 d . . . . .
H01K H -0.112572 -0.285110 0.686516 0.053 Uiso 1 1 calc R U . . .
H01L H -0.174526 -0.242094 0.686126 0.053 Uiso 1 1 calc R U . . .
C01W C 0.3705(17) -0.1835(14) 0.6158(7) 0.065(6) Uani 1 1 d . . . . .
H01W H 0.395416 -0.220052 0.627617 0.079 Uiso 1 1 calc R U . . .
C01X C 0.3910(15) -0.0639(14) 0.5650(6) 0.058(5) Uani 1 1 d . . . . .
H01X H 0.428696 -0.024841 0.544607 0.070 Uiso 1 1 calc R U . . .
C01Y C 0.9008(14) 1.1699(15) 0.9228(6) 0.058(5) Uani 1 1 d . . . . .
H01V H 0.873209 1.174470 0.949173 0.070 Uiso 1 1 calc R U . . .
H01Y H 0.906823 1.216666 0.904486 0.070 Uiso 1 1 calc R U . . .
C020 C 0.5046(11) 0.4596(10) 0.6513(5) 0.036(3) Uani 1 1 d . . . . .
H02A H 0.557364 0.463230 0.670133 0.044 Uiso 1 1 calc R U . . .
H02B H 0.481157 0.487869 0.670869 0.044 Uiso 1 1 calc R U . . .
C021 C 1.5507(12) 1.1815(13) 0.8896(5) 0.045(4) Uani 1 1 d . . . . .
H1 H 1.500386 1.178566 0.902277 0.055 Uiso 1 1 calc R U . . .
H H 1.531451 1.122423 0.873041 0.055 Uiso 1 1 calc R U . . .
O022 O 0.1639(11) -0.2302(8) 0.7166(6) 0.090(5) Uani 1 1 d . . . . .
C023 C 0.8407(14) 1.0787(16) 0.8924(7) 0.064(6) Uani 1 1 d . . . . .
H023 H 0.780961 1.070312 0.880433 0.077 Uiso 1 1 calc R U . . .
C024 C 0.1053(10) 0.2906(10) 0.6116(6) 0.039(4) Uani 1 1 d . . . . .
H02C H 0.130551 0.255316 0.600346 0.046 Uiso 1 1 calc R U . . .
H02D H 0.153832 0.345772 0.630683 0.046 Uiso 1 1 calc R U . . .
C025 C 1.2200(13) 0.8049(12) 0.8604(7) 0.060(5) Uani 1 1 d . . . . .
H2 H 1.259261 0.808374 0.838644 0.073 Uiso 1 1 calc R U . . .
HA H 1.158078 0.766797 0.843883 0.073 Uiso 1 1 calc R U . . .
C026 C -0.0508(11) 0.3147(12) 0.6164(6) 0.045(4) Uani 1 1 d . . . . .
H026 H -0.075795 0.350838 0.627805 0.054 Uiso 1 1 calc R U . . .
C027 C 0.4746(13) -0.0623(13) 0.8007(7) 0.054(5) Uani 1 1 d . . . . .
C028 C 0.4137(12) 0.3570(13) 0.5323(6) 0.053(5) Uani 1 1 d . . . . .
H02E H 0.429445 0.386892 0.505082 0.063 Uiso 1 1 calc R U . . .
H02F H 0.368530 0.294502 0.521304 0.063 Uiso 1 1 calc R U . . .
C02A C 0.4717(11) 0.3179(11) 0.6056(5) 0.039(4) Uani 1 1 d . . . . .
H02G H 0.426877 0.254937 0.595714 0.046 Uiso 1 1 calc R U . . .
H02H H 0.524496 0.322105 0.624622 0.046 Uiso 1 1 calc R U . . .
C02B C 0.9945(12) 1.1831(13) 0.9413(6) 0.056(5) Uani 1 1 d . . . . .
H3 H 1.031943 1.241592 0.961487 0.067 Uiso 1 1 calc R U . . .
C02C C 0.7261(14) 0.8071(14) 0.7738(7) 0.068(6) Uani 1 1 d . . . . .
H4 H 0.737956 0.833198 0.804926 0.082 Uiso 1 1 calc R U . . .
O02D O 0.6232(16) 0.8136(15) 0.6180(8) 0.118(7) Uani 1 1 d . . . . .
C02E C 0.2345(13) -0.1297(12) 0.6087(6) 0.052(4) Uani 1 1 d . . . . .
H02I H 0.208943 -0.094842 0.596171 0.062 Uiso 1 1 calc R U . . .
H02J H 0.196048 -0.166829 0.629058 0.062 Uiso 1 1 calc R U . . .
C02F C 0.3780(13) 0.3991(14) 0.5613(6) 0.059(5) Uani 1 1 d . . . . .
H02K H 0.324428 0.393572 0.541649 0.071 Uiso 1 1 calc R U . . .
F02G F 0.318(2) 0.6606(14) 0.7008(9) 0.187(12) Uani 1 1 d . . . . .
C02H C 1.2711(13) 1.4211(13) 0.8967(6) 0.056(5) Uani 1 1 d . . . . .
H5 H 1.265851 1.368895 0.909636 0.067 Uiso 1 1 calc R U . . .
HB H 1.212502 1.405774 0.879011 0.067 Uiso 1 1 calc R U . . .
C02I C 1.6542(11) 1.2466(15) 0.8346(6) 0.059(5) Uani 1 1 d . . . . .
H6 H 1.672642 1.287316 0.811724 0.070 Uiso 1 1 calc R U . . .
HC H 1.633106 1.186508 0.818823 0.070 Uiso 1 1 calc R U . . .
C02J C 0.1923(11) 0.0798(11) 0.5880(5) 0.042(4) Uani 1 1 d . . . . .
C02K C 1.7061(12) 1.2105(14) 0.9078(7) 0.055(5) Uani 1 1 d . . . . .
H7 H 1.757272 1.226477 0.932616 0.066 Uiso 1 1 calc R U . . .
HD H 1.686157 1.151128 0.891505 0.066 Uiso 1 1 calc R U . . .
C02L C 0.0208(13) 0.3685(12) 0.5872(7) 0.058(5) Uani 1 1 d . . . . .
H02L H -0.006206 0.384012 0.560648 0.069 Uiso 1 1 calc R U . . .
H02M H 0.069109 0.423524 0.606516 0.069 Uiso 1 1 calc R U . . .
C02M C -0.2537(13) -0.2899(13) 0.5959(6) 0.060(5) Uani 1 1 d . . . . .
H02N H -0.285857 -0.273012 0.615641 0.072 Uiso 1 1 calc R U . . .
H02O H -0.297421 -0.334305 0.569602 0.072 Uiso 1 1 calc R U . . .
C02N C 0.4460(14) 0.5014(13) 0.5773(7) 0.065(6) Uani 1 1 d . . . . .
H02P H 0.419729 0.528594 0.595374 0.078 Uiso 1 1 calc R U . . .
H02Q H 0.462060 0.531529 0.550148 0.078 Uiso 1 1 calc R U . . .
C02O C 1.334(2) 0.8267(18) 0.9289(8) 0.083(8) Uani 1 1 d . . . . .
H8 H 1.347447 0.802379 0.956027 0.100 Uiso 1 1 calc R U . . .
HE H 1.376205 0.832944 0.908422 0.100 Uiso 1 1 calc R U . . .
C02P C 0.3478(10) 0.3548(11) 0.6043(6) 0.041(4) Uani 1 1 d . . . . .
H02R H 0.301306 0.292251 0.594889 0.049 Uiso 1 1 calc R U . . .
H02S H 0.324234 0.385205 0.622231 0.049 Uiso 1 1 calc R U . . .
C02Q C 0.2747(19) -0.2432(15) 0.5900(9) 0.086(8) Uani 1 1 d . . . . .
H02T H 0.237792 -0.276924 0.611777 0.104 Uiso 1 1 calc R U . . .
H02U H 0.272979 -0.285715 0.565639 0.104 Uiso 1 1 calc R U . . .
C02S C 1.7347(14) 1.2744(18) 0.8748(7) 0.070(6) Uani 1 1 d . . . . .
H9 H 1.784252 1.274249 0.861905 0.084 Uiso 1 1 calc R U . . .
C02T C 0.2969(15) -0.1265(15) 0.5364(6) 0.067(6) Uani 1 1 d . . . . .
H02V H 0.300202 -0.161448 0.509943 0.080 Uiso 1 1 calc R U . . .
H02W H 0.270969 -0.091649 0.524241 0.080 Uiso 1 1 calc R U . . .
C02U C -0.0822(14) -0.2739(14) 0.5777(7) 0.065(6) Uani 1 1 d . . . . .
H02X H -0.049561 -0.292293 0.558667 0.077 Uiso 1 1 calc R U . . .
C02V C -0.1833(11) -0.2056(13) 0.5773(6) 0.054(5) Uani 1 1 d . . . . .
H02Y H -0.214382 -0.180374 0.558600 0.064 Uiso 1 1 calc R U . . .
C02W C -0.1235(11) 0.2323(13) 0.5861(6) 0.049(4) Uani 1 1 d . . . . .
H02Z H -0.151277 0.247685 0.559729 0.059 Uiso 1 1 calc R U . . .
HF H -0.169622 0.198143 0.603865 0.059 Uiso 1 1 calc R U . . .
C02X C 0.8321(13) 1.0022(17) 0.9202(7) 0.073(7) Uani 1 1 d . . . . .
H10 H 0.798006 0.945057 0.899417 0.088 Uiso 1 1 calc R U . . .
HG H 0.799942 0.999892 0.945526 0.088 Uiso 1 1 calc R U . . .
C02Y C -0.3706(15) -0.036(2) 0.7069(10) 0.101(9) Uani 1 1 d . . . . .
H02 H -0.384661 -0.054145 0.673469 0.151 Uiso 1 1 calc R U . . .
HH H -0.400329 -0.003561 0.714942 0.151 Uiso 1 1 calc R U . . .
HI H -0.390897 -0.087643 0.722423 0.151 Uiso 1 1 calc R U . . .
C030 C -0.2204(14) -0.0026(18) 0.7081(7) 0.075(7) Uani 1 1 d . . . . .
H030 H -0.244078 -0.059515 0.691079 0.090 Uiso 1 1 calc R U . . .
C032 C -0.0849(11) 0.1748(12) 0.5675(6) 0.049(4) Uani 1 1 d . . . . .
H032 H -0.133863 0.119630 0.547817 0.059 Uiso 1 1 calc R U . . .
C033 C 0.9284(17) 1.0193(17) 0.9410(7) 0.073(7) Uani 1 1 d . . . . .
H033 H 0.923083 0.972765 0.959941 0.088 Uiso 1 1 calc R U . . .
C034 C 1.3346(18) 0.9582(15) 0.9005(7) 0.077(7) Uani 1 1 d . . . . .
H03Q H 1.347712 1.019180 0.909191 0.092 Uiso 1 1 calc R U . . .
H03R H 1.375002 0.959174 0.880016 0.092 Uiso 1 1 calc R U . . .
C035 C -0.1176(12) -0.1361(12) 0.6202(5) 0.045(4) Uani 1 1 d . . . . .
H03A H -0.073604 -0.082583 0.609740 0.053 Uiso 1 1 calc R U . . .
H03B H -0.150663 -0.119536 0.639393 0.053 Uiso 1 1 calc R U . . .
C036 C 1.6299(13) 1.2085(15) 0.9296(6) 0.062(5) Uani 1 1 d . . . . .
H036 H 1.612117 1.164914 0.951546 0.074 Uiso 1 1 calc R U . . .
C037 C 0.9845(16) 1.1083(16) 0.9701(6) 0.070(6) Uani 1 1 d . . . . .
H03S H 1.043730 1.117216 0.982245 0.084 Uiso 1 1 calc R U . . .
H03T H 0.956935 1.111460 0.996706 0.084 Uiso 1 1 calc R U . . .
F038 F 0.2548(13) 0.5786(15) 0.6451(11) 0.207(15) Uani 1 1 d . . . . .
C039 C 1.3477(19) 0.9182(17) 0.9453(7) 0.078(7) Uani 1 1 d . . . . .
H039 H 1.409750 0.956740 0.962758 0.094 Uiso 1 1 calc R U . . .
C03A C -0.2502(17) 0.1021(17) 0.7506(10) 0.097(9) Uani 1 1 d . . . . .
H03C H -0.282271 0.129813 0.737110 0.146 Uiso 1 1 calc R U . . .
H03D H -0.186437 0.141393 0.752947 0.146 Uiso 1 1 calc R U . . .
H03E H -0.262897 0.090563 0.781449 0.146 Uiso 1 1 calc R U . . .
C03B C 1.6599(15) 1.2991(15) 0.9546(6) 0.067(6) Uani 1 1 d . . . . .
H03U H 1.610818 1.298474 0.967757 0.081 Uiso 1 1 calc R U . . .
H03V H 1.710035 1.316381 0.980310 0.081 Uiso 1 1 calc R U . . .
C03C C 0.4335(16) -0.1178(16) 0.5844(7) 0.075(7) Uani 1 1 d . . . . .
H03F H 0.493165 -0.077407 0.603184 0.090 Uiso 1 1 calc R U . . .
H03G H 0.439654 -0.152000 0.558633 0.090 Uiso 1 1 calc R U . . .
C03D C 0.2360(15) -0.1903(13) 0.5679(7) 0.069(6) Uani 1 1 d . . . . .
H03H H 0.174798 -0.230514 0.549854 0.083 Uiso 1 1 calc R U . . .
C03F C -0.1543(14) -0.3549(12) 0.5947(7) 0.061(5) Uani 1 1 d . . . . .
H03I H -0.195449 -0.399452 0.567795 0.074 Uiso 1 1 calc R U . . .
H03J H -0.126149 -0.381564 0.613777 0.074 Uiso 1 1 calc R U . . .
C03G C 1.1729(17) 0.8939(19) 0.9079(8) 0.082(8) Uani 1 1 d . . . . .
H03W H 1.110804 0.859608 0.891160 0.098 Uiso 1 1 calc R U . . .
H03X H 1.185855 0.953830 0.919293 0.098 Uiso 1 1 calc R U . . .
F03J F 0.1534(11) 0.0586(15) 0.5052(5) 0.144(8) Uani 1 1 d . . . . .
C03K C 0.5300(16) -0.0854(14) 0.8378(9) 0.070(6) Uani 1 1 d . . . . .
C03L C 0.597(2) 0.8106(19) 0.5767(10) 0.087(8) Uani 1 1 d . . . . .
H13 H 0.550107 0.755050 0.560922 0.105 Uiso 1 1 calc R U . . .
C03M C -0.1320(15) -0.2334(14) 0.5468(7) 0.068(6) Uani 1 1 d . . . . .
H03K H -0.088154 -0.181606 0.534973 0.082 Uiso 1 1 calc R U . . .
H03L H -0.174006 -0.277770 0.520025 0.082 Uiso 1 1 calc R U . . .
C03N C 1.4360(12) 1.4785(11) 0.8914(6) 0.052(5) Uani 1 1 d . . . . .
H03Y H 1.478791 1.497864 0.870246 0.063 Uiso 1 1 calc R U . . .
HJ H 1.434959 1.427752 0.904191 0.063 Uiso 1 1 calc R U . . .
C03P C -0.0152(11) 0.2266(13) 0.5389(6) 0.050(4) Uani 1 1 d . . . . .
H03M H -0.042462 0.240944 0.511939 0.060 Uiso 1 1 calc R U . . .
H03N H 0.010033 0.191309 0.527693 0.060 Uiso 1 1 calc R U . . .
C03Q C 1.283(2) 0.915(2) 0.9763(8) 0.100(10) Uani 1 1 d . . . . .
H03Z H 1.289995 0.974311 0.982930 0.121 Uiso 1 1 calc R U . . .
HK H 1.295756 0.897142 1.005922 0.121 Uiso 1 1 calc R U . . .
C03R C 1.7664(15) 1.3642(16) 0.9008(9) 0.090(8) Uani 1 1 d . . . . .
H03 H 1.786370 1.408402 0.879668 0.108 Uiso 1 1 calc R U . . .
HL H 1.817090 1.380271 0.925885 0.108 Uiso 1 1 calc R U . . .
C03S C 1.3075(19) 1.5806(14) 0.9140(7) 0.078(7) Uani 1 1 d . . . . .
H11 H 1.247733 1.561258 0.896291 0.094 Uiso 1 1 calc R U . . .
HM H 1.323827 1.630826 0.937936 0.094 Uiso 1 1 calc R U . . .
C03U C -0.0192(11) -0.2045(11) 0.6165(6) 0.045(4) Uani 1 1 d . . . . .
H03O H 0.022816 -0.152519 0.604046 0.053 Uiso 1 1 calc R U . . .
H03P H 0.015257 -0.226155 0.634781 0.053 Uiso 1 1 calc R U . . .
C03V C 1.3417(11) 1.4521(9) 0.8649(5) 0.038(4) Uani 1 1 d . . . . .
C03W C 1.6063(15) 1.3398(13) 0.8826(7) 0.068(6) Uani 1 1 d . . . . .
H12 H 1.556895 1.337013 0.896210 0.081 Uiso 1 1 calc R U . . .
HN H 1.623349 1.384778 0.861917 0.081 Uiso 1 1 calc R U . . .
C03X C 0.6140(16) 0.211(2) 0.6817(8) 0.078(7) Uani 1 1 d D . . . .
F03Z F 0.0599(14) 0.0554(19) 0.5431(6) 0.187(12) Uani 1 1 d . . . . .
C040 C 1.3466(14) 1.5351(11) 0.8425(6) 0.057(5) Uani 1 1 d . . . . .
H04A H 1.389323 1.553154 0.821321 0.068 Uiso 1 1 calc R U . . .
H04B H 1.287765 1.518497 0.824538 0.068 Uiso 1 1 calc R U . . .
C041 C 1.3756(19) 1.6106(12) 0.8808(7) 0.082(8) Uani 1 1 d . . . . .
H041 H 1.379117 1.662556 0.867568 0.099 Uiso 1 1 calc R U . . .
C042 C 0.6231(19) 0.7027(18) 0.7104(8) 0.112(11) Uani 1 1 d . . . . .
H04C H 0.676140 0.728433 0.696629 0.168 Uiso 1 1 calc R U . . .
H04D H 0.575542 0.705945 0.691079 0.168 Uiso 1 1 calc R U . . .
H04E H 0.604264 0.641128 0.712672 0.168 Uiso 1 1 calc R U . . .
C044 C 1.6877(18) 1.3636(15) 0.9218(8) 0.089(9) Uani 1 1 d . . . . .
H044 H 1.709314 1.423479 0.939015 0.107 Uiso 1 1 calc R U . . .
C04A C 1.3061(18) 1.5033(14) 0.9376(7) 0.071(6) Uani 1 1 d . . . . .
H04F H 1.264202 1.486637 0.959666 0.086 Uiso 1 1 calc R U . . .
C04B C 1.238(2) 0.761(2) 0.9026(11) 0.105(10) Uani 1 1 d . . . . .
H04G H 1.228620 0.701690 0.892455 0.126 Uiso 1 1 calc R U . . .
C04C C 1.4671(18) 1.6343(14) 0.9079(8) 0.087(8) Uani 1 1 d . . . . .
H04H H 1.488520 1.685695 0.932055 0.104 Uiso 1 1 calc R U . . .
H04I H 1.509674 1.650731 0.886717 0.104 Uiso 1 1 calc R U . . .
C04D C 0.586(2) 0.8690(16) 0.5037(9) 0.104(10) Uani 1 1 d . . . . .
H04N H 0.612103 0.846278 0.483007 0.157 Uiso 1 1 calc R U . . .
H04O H 0.598582 0.927277 0.497368 0.157 Uiso 1 1 calc R U . . .
H04Q H 0.522247 0.829060 0.498569 0.157 Uiso 1 1 calc R U . . .
C04H C 1.174(2) 0.759(2) 0.9362(10) 0.111(11) Uani 1 1 d . . . . .
H04J H 1.111696 0.718479 0.920606 0.133 Uiso 1 1 calc R U . . .
H04K H 1.185307 0.735071 0.964088 0.133 Uiso 1 1 calc R U . . .
C04J C 1.3978(18) 1.5288(14) 0.9632(8) 0.077(7) Uani 1 1 d . . . . .
H04L H 1.418005 1.578358 0.988330 0.093 Uiso 1 1 calc R U . . .
H04M H 1.395016 1.478518 0.977265 0.093 Uiso 1 1 calc R U . . .
C04N C 0.1280(15) 0.0442(14) 0.5427(6) 0.055(5) Uani 1 1 d . . . . .
C04O C 0.705(2) 0.955(2) 0.5739(13) 0.136(13) Uani 1 1 d . . . . .
H04S H 0.692593 1.003116 0.577339 0.204 Uiso 1 1 calc R U . . .
H04T H 0.750609 0.969176 0.555199 0.204 Uiso 1 1 calc R U . . .
H04U H 0.725503 0.945970 0.604384 0.204 Uiso 1 1 calc R U . . .
C04P C 1.186(2) 0.848(2) 0.9505(8) 0.094(9) Uani 1 1 d . . . . .
H04P H 1.144093 0.842744 0.971118 0.113 Uiso 1 1 calc R U . . .
C04R C 1.4634(17) 1.5553(15) 0.9312(8) 0.085(8) Uani 1 1 d . . . . .
H04R H 1.523425 1.573599 0.949207 0.103 Uiso 1 1 calc R U . . .
C13 C 0.3221(14) 0.6008(14) 0.6781(10) 0.070(6) Uani 1 1 d . . . . .
Ag2 Ag 0.93600(18) 0.95521(18) 0.75502(10) 0.0413(6) Uani 0.5 1 d D U P . .
F34 F 0.0978(19) -0.0410(13) 0.5312(8) 0.199(12) Uani 1 1 d . . . . .
C196 C 0.083(2) -0.4662(16) 0.7145(14) 0.132(13) Uani 1 1 d . . . . .
H19A H 0.126396 -0.473072 0.735044 0.197 Uiso 1 1 calc R U . . .
H19B H 0.073163 -0.495701 0.683232 0.197 Uiso 1 1 calc R U . . .
H19C H 0.026637 -0.492516 0.725629 0.197 Uiso 1 1 calc R U . . .
C14 C 0.0354(16) 0.3605(14) 0.8042(9) 0.078(6) Uani 1 1 d D . . . .
C121 C 0.137(3) -0.3112(18) 0.7233(15) 0.148(10) Uani 1 1 d . U . . .
H121 H 0.140688 -0.306554 0.755735 0.177 Uiso 1 1 calc R U . . .
C8 C 0.5732(18) 0.7288(16) 0.7813(12) 0.119(12) Uani 1 1 d . . . . .
H8A H 0.545847 0.666508 0.784601 0.178 Uiso 1 1 calc R U . . .
H8B H 0.528657 0.739902 0.764786 0.178 Uiso 1 1 calc R U . . .
H8C H 0.597414 0.764777 0.811968 0.178 Uiso 1 1 calc R U . . .
O2 O 0.5484(11) 0.5091(13) 0.7849(6) 0.110(7) Uani 1 1 d . . . . .
C17 C 0.662(2) 0.2104(16) 0.6451(13) 0.158(10) Uani 1 1 d D . . . .
F2A F 0.6662(16) 0.1330(17) 0.6327(9) 0.187(10) Uani 1 1 d D . . A 2
F4A F 0.7513(19) 0.2814(18) 0.6548(13) 0.251(14) Uani 1 1 d D . . B 2
F8A F 0.640(3) 0.226(3) 0.6056(11) 0.274(15) Uani 1 1 d . . . C 2
C27 C 0.0226(16) 0.4065(13) 0.8383(9) 0.162(7) Uani 1 1 d D U . . .
F39 F -0.0537(15) 0.3795(11) 0.8533(8) 0.161(6) Uani 1 1 d D U . D 1
F41 F 0.0429(14) 0.4900(11) 0.8358(7) 0.159(6) Uani 1 1 d D U . E 1
F10 F 0.0648(17) 0.4218(15) 0.8837(9) 0.195(7) Uani 1 1 d D U . F 1
Ag1 Ag 0.9473(2) 0.9150(3) 0.77526(14) 0.0706(10) Uani 0.5 1 d . U P . .
C45 C 0.065(3) -0.393(2) 0.6570(16) 0.164(12) Uani 1 1 d . U . . .
H45A H 0.097214 -0.407552 0.636992 0.246 Uiso 1 1 calc R U . . .
H45B H 0.066677 -0.338454 0.649968 0.246 Uiso 1 1 calc R U . . .
H45C H 0.003289 -0.440527 0.651753 0.246 Uiso 1 1 calc R U . . .
N65 N 0.113(2) -0.3773(15) 0.7137(12) 0.139(9) Uani 1 1 d . U . . .
O7 O 0.641(2) 0.4376(16) 0.7685(11) 0.25(2) Uani 1 1 d . . . . .
S1 S 0.9418(15) 0.814(2) 0.8247(10) 0.343(14) Uani 1 1 d . . . . .
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'
Cl Cl 0.1484 0.1585 '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'
S S 0.1246 0.1234 '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
S0M Ag01 S0K 167.78(13) . . ?
S0M Ag01 Cl0J 90.85(12) . 1_445 ?
S0K Ag01 Cl0J 97.18(11) . 1_445 ?
S0M Ag01 Ag02 116.03(9) . . ?
S0K Ag01 Ag02 54.36(9) . . ?
Cl0J Ag01 Ag02 94.31(8) 1_445 . ?
S0M Ag01 Ag03 53.68(9) . . ?
S0K Ag01 Ag03 116.48(9) . . ?
Cl0J Ag01 Ag03 92.52(8) 1_445 . ?
Ag02 Ag01 Ag03 62.40(4) . . ?
S0M Ag01 Ag04 141.47(10) . . ?
S0K Ag01 Ag04 50.67(9) . . ?
Cl0J Ag01 Ag04 69.01(8) 1_445 . ?
Ag02 Ag01 Ag04 98.53(5) . . ?
Ag03 Ag01 Ag04 153.15(5) . . ?
S0M Ag01 Ag0C 46.21(9) . . ?
S0K Ag01 Ag0C 145.97(10) . . ?
Cl0J Ag01 Ag0C 59.96(8) 1_445 . ?
Ag02 Ag01 Ag0C 143.30(5) . . ?
Ag03 Ag01 Ag0C 91.06(5) . . ?
Ag04 Ag01 Ag0C 95.76(5) . . ?
O00X Ag02 O2 91.7(6) . . ?
O00X Ag02 S0O 114.2(3) . 1_445 ?
O2 Ag02 S0O 107.4(5) . 1_445 ?
O00X Ag02 S0K 109.6(3) . . ?
O2 Ag02 S0K 101.8(4) . . ?
S0O Ag02 S0K 125.53(12) 1_445 . ?
O00X Ag02 Ag01 103.4(3) . . ?
O2 Ag02 Ag01 152.0(4) . . ?
S0O Ag02 Ag01 87.86(9) 1_445 . ?
S0K Ag02 Ag01 51.10(9) . . ?
O00X Ag02 Ag0A 161.3(3) . 1_445 ?
O2 Ag02 Ag0A 84.6(5) . 1_445 ?
S0O Ag02 Ag0A 50.41(8) 1_445 1_445 ?
S0K Ag02 Ag0A 89.06(9) . 1_445 ?
Ag01 Ag02 Ag0A 87.80(5) . 1_445 ?
O00X Ag02 Ag03 79.5(3) . . ?
O2 Ag02 Ag03 147.6(4) . . ?
S0O Ag02 Ag03 51.28(9) 1_445 . ?
S0K Ag02 Ag03 110.57(9) . . ?
Ag01 Ag02 Ag03 59.72(4) . . ?
Ag0A Ag02 Ag03 93.87(5) 1_445 . ?
O00T Ag03 O00Y 90.4(5) . . ?
O00T Ag03 S0O 116.8(3) . 1_445 ?
O00Y Ag03 S0O 105.2(3) . 1_445 ?
O00T Ag03 S0M 105.8(3) . . ?
O00Y Ag03 S0M 112.8(3) . . ?
S0O Ag03 S0M 121.63(11) 1_445 . ?
O00T Ag03 Ag01 95.3(3) . . ?
O00Y Ag03 Ag01 162.8(3) . . ?
S0O Ag03 Ag01 86.68(8) 1_445 . ?
S0M Ag03 Ag01 50.03(8) . . ?
O00T Ag03 Ag08 139.9(3) . . ?
O00Y Ag03 Ag08 74.7(3) . . ?
S0O Ag03 Ag08 103.17(9) 1_445 . ?
S0M Ag03 Ag08 51.21(9) . . ?
Ag01 Ag03 Ag08 90.73(4) . . ?
O00T Ag03 Ag02 77.0(3) . . ?
O00Y Ag03 Ag02 139.3(3) . . ?
S0O Ag03 Ag02 51.45(9) 1_445 . ?
S0M Ag03 Ag02 107.86(9) . . ?
Ag01 Ag03 Ag02 57.88(4) . . ?
Ag08 Ag03 Ag02 136.90(5) . . ?
O00T Ag03 Ag0B 164.4(3) . 1_445 ?
O00Y Ag03 Ag0B 95.2(3) . 1_445 ?
S0O Ag03 Ag0B 47.66(9) 1_445 1_445 ?
S0M Ag03 Ag0B 85.50(9) . 1_445 ?
Ag01 Ag03 Ag0B 83.59(4) . 1_445 ?
Ag08 Ag03 Ag0B 55.75(4) . 1_445 ?
Ag02 Ag03 Ag0B 89.35(4) . 1_445 ?
S0I Ag04 S0K 155.39(13) . . ?
S0I Ag04 O00Z 100.9(3) . . ?
S0K Ag04 O00Z 103.5(3) . . ?
S0I Ag04 Ag01 128.01(10) . . ?
S0K Ag04 Ag01 50.30(9) . . ?
O00Z Ag04 Ag01 88.4(3) . . ?
S0I Ag04 Ag0E 107.98(10) . . ?
S0K Ag04 Ag0E 51.90(9) . . ?
O00Z Ag04 Ag0E 142.3(3) . . ?
Ag01 Ag04 Ag0E 92.35(5) . . ?
S0I Ag04 Ag07 49.21(9) . . ?
S0K Ag04 Ag07 109.67(9) . . ?
O00Z Ag04 Ag07 141.3(3) . . ?
Ag01 Ag04 Ag07 128.28(5) . . ?
Ag0E Ag04 Ag07 58.85(4) . . ?
S0I Ag04 Ag05 46.43(9) . . ?
S0K Ag04 Ag05 130.73(10) . . ?
O00Z Ag04 Ag05 88.8(3) . . ?
Ag01 Ag04 Ag05 83.35(4) . . ?
Ag0E Ag04 Ag05 128.72(5) . . ?
Ag07 Ag04 Ag05 84.47(4) . . ?
S0I Ag05 S0N 169.05(13) . . ?
S0I Ag05 Cl0J 93.39(11) . 1_445 ?
S0N Ag05 Cl0J 93.88(11) . 1_445 ?
S0I Ag05 Ag06 52.81(9) . . ?
S0N Ag05 Ag06 118.95(10) . . ?
Cl0J Ag05 Ag06 90.34(8) 1_445 . ?
S0I Ag05 Ag0D 118.24(10) . 1_445 ?
S0N Ag05 Ag0D 52.93(9) . 1_445 ?
Cl0J Ag05 Ag0D 94.79(8) 1_445 1_445 ?
Ag06 Ag05 Ag0D 66.02(4) . 1_445 ?
S0I Ag05 Ag0C 141.47(10) . . ?
S0N Ag05 Ag0C 49.47(9) . . ?
Cl0J Ag05 Ag0C 62.29(8) 1_445 . ?
Ag06 Ag05 Ag0C 145.78(6) . . ?
Ag0D Ag05 Ag0C 94.54(5) 1_445 . ?
S0I Ag05 Ag04 46.87(9) . . ?
S0N Ag05 Ag04 144.06(10) . . ?
Cl0J Ag05 Ag04 65.38(8) 1_445 . ?
Ag06 Ag05 Ag04 91.48(4) . . ?
Ag0D Ag05 Ag04 150.61(5) 1_445 . ?
Ag0C Ag05 Ag04 94.65(5) . . ?
O00U Ag06 O022 102.2(5) . . ?
O00U Ag06 S0I 119.6(3) . . ?
O022 Ag06 S0I 99.0(4) . . ?
O00U Ag06 S0P 105.4(3) . 1_445 ?
O022 Ag06 S0P 97.7(4) . 1_445 ?
S0I Ag06 S0P 126.78(13) . 1_445 ?
O00U Ag06 Ag09 101.0(4) . 1_445 ?
O022 Ag06 Ag09 146.0(4) . 1_445 ?
S0I Ag06 Ag09 90.86(9) . 1_445 ?
S0P Ag06 Ag09 51.93(10) 1_445 1_445 ?
O00U Ag06 Ag05 168.8(3) . . ?
O022 Ag06 Ag05 77.1(4) . . ?
S0I Ag06 Ag05 50.23(9) . . ?
S0P Ag06 Ag05 85.67(10) 1_445 . ?
Ag09 Ag06 Ag05 84.80(5) 1_445 . ?
O00U Ag06 Ag07 81.8(3) . . ?
O022 Ag06 Ag07 145.1(4) . . ?
S0I Ag06 Ag07 51.90(9) . . ?
S0P Ag06 Ag07 114.83(11) 1_445 . ?
Ag09 Ag06 Ag07 63.01(4) 1_445 . ?
Ag05 Ag06 Ag07 92.51(5) . . ?
O00U Ag06 Ag0D 131.7(3) . 1_445 ?
O022 Ag06 Ag0D 55.8(4) . 1_445 ?
S0I Ag06 Ag0D 106.83(10) . 1_445 ?
S0P Ag06 Ag0D 48.09(10) 1_445 1_445 ?
Ag09 Ag06 Ag0D 90.19(5) 1_445 1_445 ?
Ag05 Ag06 Ag0D 57.08(4) . 1_445 ?
Ag07 Ag06 Ag0D 142.30(5) . 1_445 ?
O011 Ag07 O00S 95.5(5) . . ?
O011 Ag07 S0I 102.4(4) . . ?
O00S Ag07 S0I 116.2(3) . . ?
O011 Ag07 S0Q 115.8(4) . 1_445 ?
O00S Ag07 S0Q 105.1(3) . 1_445 ?
S0I Ag07 S0Q 119.58(12) . 1_445 ?
O011 Ag07 Ag06 139.5(4) . . ?
O00S Ag07 Ag06 75.8(3) . . ?
S0I Ag07 Ag06 51.62(9) . . ?
S0Q Ag07 Ag06 104.56(10) 1_445 . ?
O011 Ag07 Ag0E 75.2(4) . . ?
O00S Ag07 Ag0E 139.5(3) . . ?
S0I Ag07 Ag0E 104.36(9) . . ?
S0Q Ag07 Ag0E 50.12(10) 1_445 . ?
Ag06 Ag07 Ag0E 135.45(5) . . ?
O011 Ag07 Ag09 164.1(4) . 1_445 ?
O00S Ag07 Ag09 93.0(3) . 1_445 ?
S0I Ag07 Ag09 85.67(9) . 1_445 ?
S0Q Ag07 Ag09 48.72(10) 1_445 1_445 ?
Ag06 Ag07 Ag09 55.86(4) . 1_445 ?
Ag0E Ag07 Ag09 89.63(5) . 1_445 ?
O011 Ag07 Ag04 87.3(4) . . ?
O00S Ag07 Ag04 163.1(3) . . ?
S0I Ag07 Ag04 47.13(9) . . ?
S0Q Ag07 Ag04 88.44(9) 1_445 . ?
Ag06 Ag07 Ag04 91.24(4) . . ?
Ag0E Ag07 Ag04 57.31(4) . . ?
Ag09 Ag07 Ag04 88.35(4) 1_445 . ?
O01J Ag08 S0M 120.2(4) . . ?
O01J Ag08 O014 106.4(5) . . ?
S0M Ag08 O014 96.2(4) . . ?
O01J Ag08 S0L 110.4(4) . 1_445 ?
S0M Ag08 S0L 123.21(12) . 1_445 ?
O014 Ag08 S0L 92.6(4) . 1_445 ?
O01J Ag08 Ag0B 101.7(4) . 1_445 ?
S0M Ag08 Ag0B 92.13(9) . 1_445 ?
O014 Ag08 Ag0B 141.1(4) . 1_445 ?
S0L Ag08 Ag0B 52.08(9) 1_445 1_445 ?
O01J Ag08 Ag03 82.6(4) . . ?
S0M Ag08 Ag03 52.28(9) . . ?
O014 Ag08 Ag03 145.1(5) . . ?
S0L Ag08 Ag03 116.28(10) 1_445 . ?
Ag0B Ag08 Ag03 64.24(4) 1_445 . ?
O01J Ag08 Ag0C 165.4(4) . . ?
S0M Ag08 Ag0C 47.83(8) . . ?
O014 Ag08 Ag0C 70.5(4) . . ?
S0L Ag08 Ag0C 84.14(9) 1_445 . ?
Ag0B Ag08 Ag0C 88.09(5) 1_445 . ?
Ag03 Ag08 Ag0C 92.25(5) . . ?
O01J Ag08 Ag2 135.8(4) . 1_445 ?
S0M Ag08 Ag2 101.71(10) . 1_445 ?
O014 Ag08 Ag2 51.9(4) . 1_445 ?
S0L Ag08 Ag2 46.31(10) 1_445 1_445 ?
Ag0B Ag08 Ag2 89.27(6) 1_445 1_445 ?
Ag03 Ag08 Ag2 138.90(7) . 1_445 ?
Ag0C Ag08 Ag2 54.02(6) . 1_445 ?
S0Q Ag09 S0P 167.67(14) . . ?
S0Q Ag09 Cl0J 94.02(12) . . ?
S0P Ag09 Cl0J 91.79(12) . . ?
S0Q Ag09 Ag06 113.23(10) . 1_665 ?
S0P Ag09 Ag06 55.52(10) . 1_665 ?
Cl0J Ag09 Ag06 93.09(8) . 1_665 ?
S0Q Ag09 Ag0A 49.36(10) . . ?
S0P Ag09 Ag0A 142.56(11) . . ?
Cl0J Ag09 Ag0A 63.11(8) . . ?
Ag06 Ag09 Ag0A 145.17(6) 1_665 . ?
S0Q Ag09 Ag07 52.13(9) . 1_665 ?
S0P Ag09 Ag07 116.53(11) . 1_665 ?
Cl0J Ag09 Ag07 95.00(8) . 1_665 ?
Ag06 Ag09 Ag07 61.13(4) 1_665 1_665 ?
Ag0A Ag09 Ag07 94.17(5) . 1_665 ?
S0Q Ag09 Ag0F 144.79(10) . . ?
S0P Ag09 Ag0F 47.14(10) . . ?
Cl0J Ag09 Ag0F 62.62(8) . . ?
Ag06 Ag09 Ag0F 95.02(5) 1_665 . ?
Ag0A Ag09 Ag0F 95.48(5) . . ?
Ag07 Ag09 Ag0F 147.56(6) 1_665 . ?
S0Q Ag0A S0O 167.67(14) . . ?
S0Q Ag0A Ag02 116.90(11) . 1_665 ?
S0O Ag0A Ag02 53.86(9) . 1_665 ?
S0Q Ag0A Ag09 50.05(10) . . ?
S0O Ag0A Ag09 128.90(10) . . ?
Ag02 Ag0A Ag09 136.34(6) 1_665 . ?
S0Q Ag0A Ag0B 131.90(11) . . ?
S0O Ag0A Ag0B 46.75(9) . . ?
Ag02 Ag0A Ag0B 90.05(5) 1_665 . ?
Ag09 Ag0A Ag0B 82.58(5) . . ?
S0O Ag0B S0L 164.27(14) . . ?
S0O Ag0B Cl0J 89.97(11) . . ?
S0L Ag0B Cl0J 93.32(12) . . ?
S0O Ag0B Ag08 109.85(10) . 1_665 ?
S0L Ag0B Ag08 54.63(9) . 1_665 ?
Cl0J Ag0B Ag08 93.33(8) . 1_665 ?
S0O Ag0B Ag0F 142.81(10) . . ?
S0L Ag0B Ag0F 51.27(9) . . ?
Cl0J Ag0B Ag0F 65.79(8) . . ?
Ag08 Ag0B Ag0F 99.79(6) 1_665 . ?
S0O Ag0B Ag03 50.10(9) . 1_665 ?
S0L Ag0B Ag03 114.60(10) . 1_665 ?
Cl0J Ag0B Ag03 88.03(8) . 1_665 ?
Ag08 Ag0B Ag03 60.01(4) 1_665 1_665 ?
Ag0F Ag0B Ag03 146.83(7) . 1_665 ?
S0O Ag0B Ag0A 46.32(9) . . ?
S0L Ag0B Ag0A 146.33(10) . . ?
Cl0J Ag0B Ag0A 60.08(8) . . ?
Ag08 Ag0B Ag0A 139.05(6) 1_665 . ?
Ag0F Ag0B Ag0A 96.50(5) . . ?
Ag03 Ag0B Ag0A 86.65(5) 1_665 . ?
S0M Ag0C S0N 168.47(14) . . ?
S0M Ag0C Ag2 116.51(12) . 1_445 ?
S0N Ag0C Ag2 54.62(10) . 1_445 ?
S0M Ag0C Ag05 130.29(10) . . ?
S0N Ag0C Ag05 50.32(9) . . ?
Ag2 Ag0C Ag05 96.37(7) 1_445 . ?
S0M Ag0C Ag08 51.04(9) . . ?
S0N Ag0C Ag08 119.00(10) . . ?
Ag2 Ag0C Ag08 65.65(6) 1_445 . ?
Ag05 Ag0C Ag08 135.14(6) . . ?
S0M Ag0C Ag01 46.97(9) . . ?
S0N Ag0C Ag01 133.09(10) . . ?
Ag2 Ag0C Ag01 138.93(7) 1_445 . ?
Ag05 Ag0C Ag01 83.60(5) . . ?
Ag08 Ag0C Ag01 85.55(4) . . ?
S0P Ag0D S0N 121.49(13) . 1_665 ?
S0P Ag0D S1 96.9(5) . . ?
S0N Ag0D S1 97.3(6) 1_665 . ?
S0P Ag0D Ag1 104.78(12) . . ?
S0N Ag0D Ag1 54.82(12) 1_665 . ?
S1 Ag0D Ag1 45.3(6) . . ?
S0P Ag0D Ag05 86.10(10) . 1_665 ?
S0N Ag0D Ag05 50.41(9) 1_665 1_665 ?
S1 Ag0D Ag05 140.8(6) . 1_665 ?
Ag1 Ag0D Ag05 96.06(10) . 1_665 ?
S0P Ag0D Ag0F 47.53(10) . . ?
S0N Ag0D Ag0F 88.27(9) 1_665 . ?
S1 Ag0D Ag0F 67.4(6) . . ?
Ag1 Ag0D Ag0F 57.44(7) . . ?
Ag05 Ag0D Ag0F 87.54(5) 1_665 . ?
S0P Ag0D Ag06 48.92(10) . 1_665 ?
S0N Ag0D Ag06 107.31(10) 1_665 1_665 ?
S1 Ag0D Ag06 144.9(5) . 1_665 ?
Ag1 Ag0D Ag06 138.86(9) . 1_665 ?
Ag05 Ag0D Ag06 56.90(4) 1_665 1_665 ?
Ag0F Ag0D Ag06 88.41(5) . 1_665 ?
O01G Ag0E O7 87.1(13) . . ?
O01G Ag0E S0Q 122.6(4) . 1_445 ?
O7 Ag0E S0Q 105.1(7) . 1_445 ?
O01G Ag0E S0K 109.3(5) . . ?
O7 Ag0E S0K 108.9(8) . . ?
S0Q Ag0E S0K 118.11(13) 1_445 . ?
O01G Ag0E Ag04 91.9(6) . . ?
O7 Ag0E Ag04 157.3(6) . . ?
S0Q Ag0E Ag04 94.52(10) 1_445 . ?
S0K Ag0E Ag04 50.26(9) . . ?
O01G Ag0E Ag07 81.4(4) . . ?
O7 Ag0E Ag07 138.1(7) . . ?
S0Q Ag0E Ag07 52.08(9) 1_445 . ?
S0K Ag0E Ag07 112.95(10) . . ?
Ag04 Ag0E Ag07 63.84(5) . . ?
S0P Ag0F S0L 158.33(15) . . ?
S0P Ag0F Ag1 107.01(14) . . ?
S0L Ag0F Ag1 55.57(12) . . ?
S0P Ag0F Ag0B 130.96(12) . . ?
S0L Ag0F Ag0B 52.02(10) . . ?
Ag1 Ag0F Ag0B 101.29(11) . . ?
S0P Ag0F Ag0D 49.92(11) . . ?
S0L Ag0F Ag0D 110.52(11) . . ?
Ag1 Ag0F Ag0D 57.28(8) . . ?
Ag0B Ag0F Ag0D 133.46(7) . . ?
S0P Ag0F Ag09 47.37(11) . . ?
S0L Ag0F Ag09 133.32(11) . . ?
Ag1 Ag0F Ag09 134.60(8) . . ?
Ag0B Ag0F Ag09 84.45(5) . . ?
Ag0D Ag0F Ag09 86.05(5) . . ?
C016 S0I Ag05 115.0(5) . . ?
C016 S0I Ag04 112.6(5) . . ?
Ag05 S0I Ag04 86.69(12) . . ?
C016 S0I Ag06 111.2(5) . . ?
Ag05 S0I Ag06 76.95(11) . . ?
Ag04 S0I Ag06 136.15(15) . . ?
C016 S0I Ag07 114.6(5) . . ?
Ag05 S0I Ag07 129.33(14) . . ?
Ag04 S0I Ag07 83.66(11) . . ?
Ag06 S0I Ag07 76.48(11) . . ?
Ag01 Cl0J Ag09 141.78(14) 1_665 . ?
Ag01 Cl0J Ag05 98.70(11) 1_665 1_665 ?
Ag09 Cl0J Ag05 91.72(10) . 1_665 ?
Ag01 Cl0J Ag0B 95.86(10) 1_665 . ?
Ag09 Cl0J Ag0B 97.01(11) . . ?
Ag05 Cl0J Ag0B 143.77(14) 1_665 . ?
C013 S0K Ag01 113.0(5) . . ?
C013 S0K Ag04 110.4(5) . . ?
Ag01 S0K Ag04 79.03(11) . . ?
C013 S0K Ag0E 116.0(5) . . ?
Ag01 S0K Ag0E 130.51(15) . . ?
Ag04 S0K Ag0E 77.84(11) . . ?
C013 S0K Ag02 111.2(5) . . ?
Ag01 S0K Ag02 74.54(11) . . ?
Ag04 S0K Ag02 136.74(15) . . ?
Ag0E S0K Ag02 94.10(13) . . ?
C015 S0L Ag2 116.3(5) . . ?
C015 S0L Ag0F 111.5(5) . . ?
Ag2 S0L Ag0F 91.59(15) . . ?
C015 S0L Ag0B 111.9(5) . . ?
Ag2 S0L Ag0B 131.32(17) . . ?
Ag0F S0L Ag0B 76.71(12) . . ?
C015 S0L Ag08 109.8(5) . 1_665 ?
Ag2 S0L Ag08 84.47(14) . 1_665 ?
Ag0F S0L Ag08 135.53(16) . 1_665 ?
Ag0B S0L Ag08 73.29(11) . 1_665 ?
C015 S0L Ag1 109.2(5) . . ?
Ag2 S0L Ag1 22.88(11) . . ?
Ag0F S0L Ag1 73.77(15) . . ?
Ag0B S0L Ag1 135.84(17) . . ?
Ag08 S0L Ag1 107.22(17) 1_665 . ?
C01F S0M Ag0C 116.1(5) . . ?
C01F S0M Ag01 114.9(4) . . ?
Ag0C S0M Ag01 86.82(12) . . ?
C01F S0M Ag08 116.8(5) . . ?
Ag0C S0M Ag08 81.13(12) . . ?
Ag01 S0M Ag08 126.97(15) . . ?
C01F S0M Ag03 109.3(5) . . ?
Ag0C S0M Ag03 134.54(15) . . ?
Ag01 S0M Ag03 76.29(11) . . ?
Ag08 S0M Ag03 76.51(11) . . ?
C01L S0N Ag0C 110.0(5) . . ?
C01L S0N Ag05 113.1(4) . . ?
Ag0C S0N Ag05 80.20(12) . . ?
C01L S0N Ag2 112.7(4) . 1_445 ?
Ag0C S0N Ag2 74.09(12) . 1_445 ?
Ag05 S0N Ag2 132.78(16) . 1_445 ?
C01L S0N Ag0D 114.7(5) . 1_445 ?
Ag0C S0N Ag0D 134.84(15) . 1_445 ?
Ag05 S0N Ag0D 76.67(11) . 1_445 ?
Ag2 S0N Ag0D 94.37(14) 1_445 1_445 ?
C01L S0N Ag1 116.6(5) . 1_445 ?
Ag0C S0N Ag1 93.90(16) . 1_445 ?
Ag05 S0N Ag1 128.72(16) . 1_445 ?
Ag2 S0N Ag1 22.77(10) 1_445 1_445 ?
Ag0D S0N Ag1 72.29(15) 1_445 1_445 ?
C03V S0O Ag0A 114.0(5) . . ?
C03V S0O Ag0B 116.5(5) . . ?
Ag0A S0O Ag0B 86.94(12) . . ?
C03V S0O Ag03 112.0(5) . 1_665 ?
Ag0A S0O Ag03 132.73(14) . 1_665 ?
Ag0B S0O Ag03 82.24(12) . 1_665 ?
C03V S0O Ag02 112.6(5) . 1_665 ?
Ag0A S0O Ag02 75.73(11) . 1_665 ?
Ag0B S0O Ag02 130.78(14) . 1_665 ?
Ag03 S0O Ag02 77.27(10) 1_665 1_665 ?
C01Q S0P Ag0F 110.9(6) . . ?
C01Q S0P Ag09 111.3(7) . . ?
Ag0F S0P Ag09 85.49(14) . . ?
C01Q S0P Ag0D 118.9(7) . . ?
Ag0F S0P Ag0D 82.55(14) . . ?
Ag09 S0P Ag0D 129.38(16) . . ?
C01Q S0P Ag06 112.4(6) . 1_665 ?
Ag0F S0P Ag06 136.08(16) . 1_665 ?
Ag09 S0P Ag06 72.55(12) . 1_665 ?
Ag0D S0P Ag06 82.99(13) . 1_665 ?
C01S S0Q Ag0A 112.5(5) . . ?
C01S S0Q Ag09 113.6(6) . . ?
Ag0A S0Q Ag09 80.59(13) . . ?
C01S S0Q Ag0E 115.0(6) . 1_665 ?
Ag0A S0Q Ag0E 87.82(13) . 1_665 ?
Ag09 S0Q Ag0E 130.80(16) . 1_665 ?
C01S S0Q Ag07 110.1(5) . 1_665 ?
Ag0A S0Q Ag07 137.19(16) . 1_665 ?
Ag09 S0Q Ag07 79.15(12) . 1_665 ?
Ag0E S0Q Ag07 77.79(12) 1_665 1_665 ?
C027 O00S Ag07 127.5(12) . . ?
C01H O00T Ag03 126.9(11) . . ?
C027 O00U Ag06 122.0(13) . . ?
C02C O00W Ag1 139.6(15) . . ?
C02C O00W Ag2 142.6(14) . . ?
Ag1 O00W Ag2 24.75(16) . . ?
C01H O00X Ag02 123.8(10) . . ?
C14 O00Y Ag03 131.3(13) . . ?
C02J O00Z Ag04 101.2(10) . . ?
C030 N010 C02Y 122(2) . . ?
C030 N010 C03A 122.6(19) . . ?
C02Y N010 C03A 115(2) . . ?
C03X O011 Ag07 129.0(14) . . ?
C02C N012 C8 123(2) . . ?
C02C N012 C042 117.4(19) . . ?
C8 N012 C042 119(2) . . ?
C020 C013 C02A 110.1(12) . . ?
C020 C013 C02P 111.4(12) . . ?
C02A C013 C02P 110.5(12) . . ?
C020 C013 S0K 107.6(10) . . ?
C02A C013 S0K 109.6(10) . . ?
C02P C013 S0K 107.5(9) . . ?
C030 O014 Ag08 154.9(15) . . ?
C01D C015 C01C 109.1(13) . . ?
C01D C015 C01O 108.1(13) . . ?
C01C C015 C01O 111.0(13) . . ?
C01D C015 S0L 110.3(11) . . ?
C01C C015 S0L 108.5(10) . . ?
C01O C015 S0L 109.7(10) . . ?
C02E C016 C01N 108.8(13) . . ?
C02E C016 C01K 108.8(14) . . ?
C01N C016 C01K 113.0(14) . . ?
C02E C016 S0I 109.5(11) . . ?
C01N C016 S0I 109.1(11) . . ?
C01K C016 S0I 107.6(10) . . ?
C01B C018 C020 108.7(14) . . ?
C01B C018 C02N 108.6(15) . . ?
C020 C018 C02N 110.3(14) . . ?
C01B C018 H018 109.7 . . ?
C020 C018 H018 109.7 . . ?
C02N C018 H018 109.7 . . ?
C018 C01B C01T 110.2(13) . . ?
C018 C01B H01A 109.6 . . ?
C01T C01B H01A 109.6 . . ?
C018 C01B H01B 109.6 . . ?
C01T C01B H01B 109.6 . . ?
H01A C01B H01B 108.1 . . ?
C015 C01C C023 111.0(13) . . ?
C015 C01C H01N 109.4 . . ?
C023 C01C H01N 109.4 . . ?
C015 C01C H01O 109.4 . . ?
C023 C01C H01O 109.5 . . ?
H01N C01C H01O 108.0 . . ?
C015 C01D C033 109.6(14) . . ?
C015 C01D H01P 109.8 . . ?
C033 C01D H01P 109.8 . . ?
C015 C01D H01Q 109.8 . . ?
C033 C01D H01Q 109.8 . . ?
H01P C01D H01Q 108.2 . . ?
C01F C01E C032 107.6(12) . . ?
C01F C01E H01C 110.2 . . ?
C032 C01E H01C 110.2 . . ?
C01F C01E H01D 110.2 . . ?
C032 C01E H01D 110.2 . . ?
H01C C01E H01D 108.5 . . ?
C01I C01F C024 110.9(12) . . ?
C01I C01F C01E 111.7(12) . . ?
C024 C01F C01E 109.3(12) . . ?
C01I C01F S0M 108.9(10) . . ?
C024 C01F S0M 107.8(9) . . ?
C01E C01F S0M 108.1(9) . . ?
C03X O01G Ag0E 124.6(15) . . ?
O00T C01H O00X 131.1(15) . . ?
O00T C01H C13 115.6(15) . . ?
O00X C01H C13 113.1(15) . . ?
C01F C01I C026 108.2(12) . . ?
C01F C01I H01E 110.1 . . ?
C026 C01I H01E 110.0 . . ?
C01F C01I H01F 110.1 . . ?
C026 C01I H01F 110.1 . . ?
H01E C01I H01F 108.4 . . ?
C14 O01J Ag08 122.3(13) . . ?
C016 C01K C01W 107.0(13) . . ?
C016 C01K H01G 110.3 . . ?
C01W C01K H01G 110.4 . . ?
C016 C01K H01H 110.3 . . ?
C01W C01K H01H 110.3 . . ?
H01G C01K H01H 108.6 . . ?
C035 C01L C01V 108.3(12) . . ?
C035 C01L C03U 107.9(12) . . ?
C01V C01L C03U 110.3(12) . . ?
C035 C01L S0N 110.5(10) . . ?
C01V C01L S0N 109.1(10) . . ?
C03U C01L S0N 110.7(10) . . ?
C03P C01M C02L 111.4(15) . . ?
C03P C01M C024 111.3(13) . . ?
C02L C01M C024 110.9(14) . . ?
C03P C01M H01M 107.7 . . ?
C02L C01M H01M 107.7 . . ?
C024 C01M H01M 107.7 . . ?
C016 C01N C01X 107.9(15) . . ?
C016 C01N H01I 110.1 . . ?
C01X C01N H01I 110.1 . . ?
C016 C01N H01J 110.1 . . ?
C01X C01N H01J 110.1 . . ?
H01I C01N H01J 108.4 . . ?
C02B C01O C015 108.8(14) . . ?
C02B C01O H01R 109.9 . . ?
C015 C01O H01R 109.9 . . ?
C02B C01O H01S 109.9 . . ?
C015 C01O H01S 109.9 . . ?
H01R C01O H01S 108.3 . . ?
C03L N01P C04O 115(3) . . ?
C03L N01P C04D 125(2) . . ?
C04O N01P C04D 120(2) . . ?
C03G C01Q C025 109.6(18) . . ?
C03G C01Q C034 110.2(18) . . ?
C025 C01Q C034 108.2(15) . . ?
C03G C01Q S0P 110.0(13) . . ?
C025 C01Q S0P 108.4(12) . . ?
C034 C01Q S0P 110.4(13) . . ?
C03W C01S C021 107.6(14) . . ?
C03W C01S C02I 113.6(16) . . ?
C021 C01S C02I 106.9(14) . . ?
C03W C01S S0Q 110.0(12) . . ?
C021 C01S S0Q 110.1(11) . . ?
C02I C01S S0Q 108.6(10) . . ?
C028 C01T C01B 109.3(15) . . ?
C028 C01T C02A 109.4(13) . . ?
C01B C01T C02A 108.8(13) . . ?
C028 C01T H01T 109.8 . . ?
C01B C01T H01T 109.8 . . ?
C02A C01T H01T 109.8 . . ?
C02M C01U C03F 112.6(16) . . ?
C02M C01U C01V 109.8(15) . . ?
C03F C01U C01V 109.8(16) . . ?
C02M C01U H01U 108.2 . . ?
C03F C01U H01U 108.2 . . ?
C01V C01U H01U 108.2 . . ?
C01U C01V C01L 107.3(12) . . ?
C01U C01V H01K 110.3 . . ?
C01L C01V H01K 110.3 . . ?
C01U C01V H01L 110.2 . . ?
C01L C01V H01L 110.2 . . ?
H01K C01V H01L 108.5 . . ?
C02Q C01W C01K 106.5(17) . . ?
C02Q C01W C03C 112.8(19) . . ?
C01K C01W C03C 107.8(15) . . ?
C02Q C01W H01W 109.8 . . ?
C01K C01W H01W 109.9 . . ?
C03C C01W H01W 109.9 . . ?
C02T C01X C03C 110.5(18) . . ?
C02T C01X C01N 109.3(15) . . ?
C03C C01X C01N 110.5(15) . . ?
C02T C01X H01X 108.8 . . ?
C03C C01X H01X 108.8 . . ?
C01N C01X H01X 108.8 . . ?
C023 C01Y C02B 110.4(14) . . ?
C023 C01Y H01V 109.6 . . ?
C02B C01Y H01V 109.6 . . ?
C023 C01Y H01Y 109.6 . . ?
C02B C01Y H01Y 109.6 . . ?
H01V C01Y H01Y 108.1 . . ?
C013 C020 C018 108.6(12) . . ?
C013 C020 H02A 110.0 . . ?
C018 C020 H02A 110.0 . . ?
C013 C020 H02B 110.0 . . ?
C018 C020 H02B 110.0 . . ?
H02A C020 H02B 108.3 . . ?
C036 C021 C01S 110.3(15) . . ?
C036 C021 H1 109.6 . . ?
C01S C021 H1 109.6 . . ?
C036 C021 H 109.6 . . ?
C01S C021 H 109.6 . . ?
H1 C021 H 108.1 . . ?
C121 O022 Ag06 135(2) . . ?
C01Y C023 C02X 111.0(16) . . ?
C01Y C023 C01C 109.4(16) . . ?
C02X C023 C01C 104.7(15) . . ?
C01Y C023 H023 110.5 . . ?
C02X C023 H023 110.5 . . ?
C01C C023 H023 110.5 . . ?
C01F C024 C01M 106.3(12) . . ?
C01F C024 H02C 110.5 . . ?
C01M C024 H02C 110.5 . . ?
C01F C024 H02D 110.5 . . ?
C01M C024 H02D 110.5 . . ?
H02C C024 H02D 108.7 . . ?
C01Q C025 C04B 113.2(19) . . ?
C01Q C025 H2 108.9 . . ?
C04B C025 H2 109.0 . . ?
C01Q C025 HA 108.9 . . ?
C04B C025 HA 108.9 . . ?
H2 C025 HA 107.8 . . ?
C02W C026 C02L 108.8(14) . . ?
C02W C026 C01I 111.4(14) . . ?
C02L C026 C01I 108.2(13) . . ?
C02W C026 H026 109.5 . . ?
C02L C026 H026 109.5 . . ?
C01I C026 H026 109.5 . . ?
O00U C027 O00S 132.5(19) . . ?
O00U C027 C03K 113.8(19) . . ?
O00S C027 C03K 113.0(17) . . ?
C02F C028 C01T 108.3(15) . . ?
C02F C028 H02E 110.0 . . ?
C01T C028 H02E 110.0 . . ?
C02F C028 H02F 110.0 . . ?
C01T C028 H02F 110.0 . . ?
H02E C028 H02F 108.4 . . ?
C013 C02A C01T 108.9(13) . . ?
C013 C02A H02G 109.9 . . ?
C01T C02A H02G 109.9 . . ?
C013 C02A H02H 109.9 . . ?
C01T C02A H02H 109.9 . . ?
H02G C02A H02H 108.3 . . ?
C01O C02B C01Y 111.6(15) . . ?
C01O C02B C037 107.4(14) . . ?
C01Y C02B C037 109.4(17) . . ?
C01O C02B H3 109.5 . . ?
C01Y C02B H3 109.4 . . ?
C037 C02B H3 109.5 . . ?
O00W C02C N012 129(2) . . ?
O00W C02C H4 115.7 . . ?
N012 C02C H4 115.7 . . ?
C016 C02E C03D 111.7(15) . . ?
C016 C02E H02I 109.3 . . ?
C03D C02E H02I 109.3 . . ?
C016 C02E H02J 109.3 . . ?
C03D C02E H02J 109.3 . . ?
H02I C02E H02J 107.9 . . ?
C028 C02F C02P 114.3(16) . . ?
C028 C02F C02N 112.0(16) . . ?
C02P C02F C02N 109.5(15) . . ?
C028 C02F H02K 106.9 . . ?
C02P C02F H02K 106.9 . . ?
C02N C02F H02K 106.9 . . ?
C03V C02H C04A 106.0(15) . . ?
C03V C02H H5 110.6 . . ?
C04A C02H H5 110.6 . . ?
C03V C02H HB 110.5 . . ?
C04A C02H HB 110.5 . . ?
H5 C02H HB 108.7 . . ?
C01S C02I C02S 108.8(14) . . ?
C01S C02I H6 109.9 . . ?
C02S C02I H6 110.0 . . ?
C01S C02I HC 109.9 . . ?
C02S C02I HC 109.9 . . ?
H6 C02I HC 108.3 . . ?
O017 C02J O00Z 128.1(16) . . ?
O017 C02J C04N 118.1(16) . . ?
O00Z C02J C04N 113.7(15) . . ?
C02S C02K C036 112.1(16) . . ?
C02S C02K H7 109.2 . . ?
C036 C02K H7 109.2 . . ?
C02S C02K HD 109.2 . . ?
C036 C02K HD 109.2 . . ?
H7 C02K HD 107.9 . . ?
C01M C02L C026 108.1(14) . . ?
C01M C02L H02L 110.1 . . ?
C026 C02L H02L 110.1 . . ?
C01M C02L H02M 110.1 . . ?
C026 C02L H02M 110.1 . . ?
H02L C02L H02M 108.4 . . ?
C01U C02M C02V 109.2(16) . . ?
C01U C02M H02N 109.8 . . ?
C02V C02M H02N 109.8 . . ?
C01U C02M H02O 109.9 . . ?
C02V C02M H02O 109.9 . . ?
H02N C02M H02O 108.3 . . ?
C02F C02N C018 105.9(15) . . ?
C02F C02N H02P 110.6 . . ?
C018 C02N H02P 110.6 . . ?
C02F C02N H02Q 110.6 . . ?
C018 C02N H02Q 110.6 . . ?
H02P C02N H02Q 108.7 . . ?
C039 C02O C04B 112(2) . . ?
C039 C02O H8 109.2 . . ?
C04B C02O H8 109.2 . . ?
C039 C02O HE 109.1 . . ?
C04B C02O HE 109.1 . . ?
H8 C02O HE 107.9 . . ?
C02F C02P C013 105.2(13) . . ?
C02F C02P H02R 110.7 . . ?
C013 C02P H02R 110.7 . . ?
C02F C02P H02S 110.7 . . ?
C013 C02P H02S 110.7 . . ?
H02R C02P H02S 108.8 . . ?
C01W C02Q C03D 111.8(18) . . ?
C01W C02Q H02T 109.3 . . ?
C03D C02Q H02T 109.3 . . ?
C01W C02Q H02U 109.2 . . ?
C03D C02Q H02U 109.3 . . ?
H02T C02Q H02U 107.9 . . ?
C02K C02S C03R 107.9(18) . . ?
C02K C02S C02I 108.8(19) . . ?
C03R C02S C02I 111.4(18) . . ?
C02K C02S H9 109.6 . . ?
C03R C02S H9 109.5 . . ?
C02I C02S H9 109.6 . . ?
C01X C02T C03D 109.8(15) . . ?
C01X C02T H02V 109.7 . . ?
C03D C02T H02V 109.7 . . ?
C01X C02T H02W 109.7 . . ?
C03D C02T H02W 109.7 . . ?
H02V C02T H02W 108.2 . . ?
C03U C02U C03F 112.1(17) . . ?
C03U C02U C03M 107.6(16) . . ?
C03F C02U C03M 107.3(17) . . ?
C03U C02U H02X 109.9 . . ?
C03F C02U H02X 109.9 . . ?
C03M C02U H02X 109.9 . . ?
C035 C02V C03M 110.4(15) . . ?
C035 C02V C02M 107.9(14) . . ?
C03M C02V C02M 109.1(17) . . ?
C035 C02V H02Y 109.8 . . ?
C03M C02V H02Y 109.8 . . ?
C02M C02V H02Y 109.8 . . ?
C026 C02W C032 110.0(13) . . ?
C026 C02W H02Z 109.6 . . ?
C032 C02W H02Z 109.7 . . ?
C026 C02W HF 109.7 . . ?
C032 C02W HF 109.7 . . ?
H02Z C02W HF 108.2 . . ?
C023 C02X C033 109.7(17) . . ?
C023 C02X H10 109.7 . . ?
C033 C02X H10 109.7 . . ?
C023 C02X HG 109.8 . . ?
C033 C02X HG 109.8 . . ?
H10 C02X HG 108.2 . . ?
N010 C02Y H02 109.5 . . ?
N010 C02Y HH 109.5 . . ?
H02 C02Y HH 109.5 . . ?
N010 C02Y HI 109.5 . . ?
H02 C02Y HI 109.5 . . ?
HH C02Y HI 109.5 . . ?
O014 C030 N010 125(2) . . ?
O014 C030 H030 117.3 . . ?
N010 C030 H030 117.3 . . ?
C03P C032 C02W 109.8(16) . . ?
C03P C032 C01E 109.1(13) . . ?
C02W C032 C01E 109.6(13) . . ?
C03P C032 H032 109.4 . . ?
C02W C032 H032 109.4 . . ?
C01E C032 H032 109.4 . . ?
C037 C033 C01D 110.1(19) . . ?
C037 C033 C02X 111.3(17) . . ?
C01D C033 C02X 106.3(17) . . ?
C037 C033 H033 109.7 . . ?
C01D C033 H033 109.7 . . ?
C02X C033 H033 109.7 . . ?
C01Q C034 C039 107(2) . . ?
C01Q C034 H03Q 110.2 . . ?
C039 C034 H03Q 110.2 . . ?
C01Q C034 H03R 110.2 . . ?
C039 C034 H03R 110.2 . . ?
H03Q C034 H03R 108.5 . . ?
C01L C035 C02V 109.6(14) . . ?
C01L C035 H03A 109.7 . . ?
C02V C035 H03A 109.7 . . ?
C01L C035 H03B 109.7 . . ?
C02V C035 H03B 109.7 . . ?
H03A C035 H03B 108.2 . . ?
C03B C036 C021 109.6(16) . . ?
C03B C036 C02K 109.6(18) . . ?
C021 C036 C02K 107.3(14) . . ?
C03B C036 H036 110.1 . . ?
C021 C036 H036 110.1 . . ?
C02K C036 H036 110.1 . . ?
C033 C037 C02B 111.1(15) . . ?
C033 C037 H03S 109.4 . . ?
C02B C037 H03S 109.4 . . ?
C033 C037 H03T 109.5 . . ?
C02B C037 H03T 109.4 . . ?
H03S C037 H03T 108.0 . . ?
C03Q C039 C02O 113(2) . . ?
C03Q C039 C034 109.6(17) . . ?
C02O C039 C034 107.3(17) . . ?
C03Q C039 H039 108.9 . . ?
C02O C039 H039 108.9 . . ?
C034 C039 H039 108.9 . . ?
N010 C03A H03C 109.5 . . ?
N010 C03A H03D 109.5 . . ?
H03C C03A H03D 109.5 . . ?
N010 C03A H03E 109.5 . . ?
H03C C03A H03E 109.5 . . ?
H03D C03A H03E 109.5 . . ?
C044 C03B C036 109.6(16) . . ?
C044 C03B H03U 109.8 . . ?
C036 C03B H03U 109.8 . . ?
C044 C03B H03V 109.7 . . ?
C036 C03B H03V 109.8 . . ?
H03U C03B H03V 108.2 . . ?
C01X C03C C01W 108.7(17) . . ?
C01X C03C H03F 110.0 . . ?
C01W C03C H03F 110.0 . . ?
C01X C03C H03G 110.0 . . ?
C01W C03C H03G 109.9 . . ?
H03F C03C H03G 108.3 . . ?
C02Q C03D C02E 106.3(18) . . ?
C02Q C03D C02T 112.5(19) . . ?
C02E C03D C02T 106.3(15) . . ?
C02Q C03D H03H 110.5 . . ?
C02E C03D H03H 110.5 . . ?
C02T C03D H03H 110.5 . . ?
C01U C03F C02U 110.5(15) . . ?
C01U C03F H03I 109.6 . . ?
C02U C03F H03I 109.6 . . ?
C01U C03F H03J 109.6 . . ?
C02U C03F H03J 109.5 . . ?
H03I C03F H03J 108.1 . . ?
C01Q C03G C04P 109.1(16) . . ?
C01Q C03G H03W 109.9 . . ?
C04P C03G H03W 109.8 . . ?
C01Q C03G H03X 109.9 . . ?
C04P C03G H03X 109.9 . . ?
H03W C03G H03X 108.3 . . ?
F00R C03K F00V 105.7(17) . . ?
F00R C03K F019 104.9(19) . . ?
F00V C03K F019 110(2) . . ?
F00R C03K C027 113.2(19) . . ?
F00V C03K C027 111.6(18) . . ?
F019 C03K C027 111.0(17) . . ?
O02D C03L N01P 128(3) . . ?
O02D C03L H13 116.0 . . ?
N01P C03L H13 115.9 . . ?
C02V C03M C02U 108.9(15) . . ?
C02V C03M H03K 109.9 . . ?
C02U C03M H03K 109.9 . . ?
C02V C03M H03L 109.9 . . ?
C02U C03M H03L 109.9 . . ?
H03K C03M H03L 108.3 . . ?
C03V C03N C04R 107.2(17) . . ?
C03V C03N H03Y 110.3 . . ?
C04R C03N H03Y 110.3 . . ?
C03V C03N HJ 110.3 . . ?
C04R C03N HJ 110.3 . . ?
H03Y C03N HJ 108.5 . . ?
C032 C03P C01M 107.7(14) . . ?
C032 C03P H03M 110.2 . . ?
C01M C03P H03M 110.1 . . ?
C032 C03P H03N 110.2 . . ?
C01M C03P H03N 110.2 . . ?
H03M C03P H03N 108.5 . . ?
C039 C03Q C04P 109(2) . . ?
C039 C03Q H03Z 110.0 . . ?
C04P C03Q H03Z 110.0 . . ?
C039 C03Q HK 110.0 . . ?
C04P C03Q HK 110.0 . . ?
H03Z C03Q HK 108.4 . . ?
C02S C03R C044 109.3(18) . . ?
C02S C03R H03 109.8 . . ?
C044 C03R H03 109.8 . . ?
C02S C03R HL 109.8 . . ?
C044 C03R HL 109.8 . . ?
H03 C03R HL 108.3 . . ?
C041 C03S C04A 110.6(18) . . ?
C041 C03S H11 109.5 . . ?
C04A C03S H11 109.5 . . ?
C041 C03S HM 109.5 . . ?
C04A C03S HM 109.5 . . ?
H11 C03S HM 108.1 . . ?
C02U C03U C01L 111.7(14) . . ?
C02U C03U H03O 109.3 . . ?
C01L C03U H03O 109.3 . . ?
C02U C03U H03P 109.3 . . ?
C01L C03U H03P 109.3 . . ?
H03O C03U H03P 107.9 . . ?
C03N C03V C02H 112.7(14) . . ?
C03N C03V C040 109.1(14) . . ?
C02H C03V C040 109.8(15) . . ?
C03N C03V S0O 108.8(11) . . ?
C02H C03V S0O 108.4(11) . . ?
C040 C03V S0O 108.0(10) . . ?
C01S C03W C044 107.1(15) . . ?
C01S C03W H12 110.3 . . ?
C044 C03W H12 110.3 . . ?
C01S C03W HN 110.3 . . ?
C044 C03W HN 110.3 . . ?
H12 C03W HN 108.6 . . ?
O01G C03X O011 129(2) . . ?
O01G C03X C17 116(2) . . ?
O011 C03X C17 115(2) . . ?
C041 C040 C03V 109.0(14) . . ?
C041 C040 H04A 109.9 . . ?
C03V C040 H04A 109.9 . . ?
C041 C040 H04B 109.9 . . ?
C03V C040 H04B 109.9 . . ?
H04A C040 H04B 108.3 . . ?
C040 C041 C04C 108(2) . . ?
C040 C041 C03S 109.1(18) . . ?
C04C C041 C03S 109.1(19) . . ?
C040 C041 H041 110.1 . . ?
C04C C041 H041 110.1 . . ?
C03S C041 H041 110.1 . . ?
N012 C042 H04C 109.5 . . ?
N012 C042 H04D 109.5 . . ?
H04C C042 H04D 109.5 . . ?
N012 C042 H04E 109.4 . . ?
H04C C042 H04E 109.5 . . ?
H04D C042 H04E 109.5 . . ?
C03B C044 C03W 110(2) . . ?
C03B C044 C03R 109.5(18) . . ?
C03W C044 C03R 111(2) . . ?
C03B C044 H044 108.8 . . ?
C03W C044 H044 108.8 . . ?
C03R C044 H044 108.8 . . ?
C04J C04A C03S 111(2) . . ?
C04J C04A C02H 110.1(17) . . ?
C03S C04A C02H 106.6(16) . . ?
C04J C04A H04F 109.6 . . ?
C03S C04A H04F 109.6 . . ?
C02H C04A H04F 109.6 . . ?
C02O C04B C025 107(2) . . ?
C02O C04B C04H 106(3) . . ?
C025 C04B C04H 106.4(19) . . ?
C02O C04B H04G 112.3 . . ?
C025 C04B H04G 112.3 . . ?
C04H C04B H04G 112.3 . . ?
C041 C04C C04R 111.7(19) . . ?
C041 C04C H04H 109.3 . . ?
C04R C04C H04H 109.3 . . ?
C041 C04C H04I 109.3 . . ?
C04R C04C H04I 109.3 . . ?
H04H C04C H04I 107.9 . . ?
N01P C04D H04N 109.5 . . ?
N01P C04D H04O 109.4 . . ?
H04N C04D H04O 109.5 . . ?
N01P C04D H04Q 109.5 . . ?
H04N C04D H04Q 109.5 . . ?
H04O C04D H04Q 109.5 . . ?
C04P C04H C04B 112(2) . . ?
C04P C04H H04J 109.2 . . ?
C04B C04H H04J 109.1 . . ?
C04P C04H H04K 109.2 . . ?
C04B C04H H04K 109.2 . . ?
H04J C04H H04K 107.9 . . ?
C04R C04J C04A 111.4(19) . . ?
C04R C04J H04L 109.4 . . ?
C04A C04J H04L 109.3 . . ?
C04R C04J H04M 109.3 . . ?
C04A C04J H04M 109.4 . . ?
H04L C04J H04M 108.0 . . ?
F03J C04N F03Z 110(2) . . ?
F03J C04N F34 90.5(19) . . ?
F03Z C04N F34 108(2) . . ?
F03J C04N C02J 122(2) . . ?
F03Z C04N C02J 113.0(16) . . ?
F34 C04N C02J 110.9(17) . . ?
N01P C04O H04S 109.5 . . ?
N01P C04O H04T 109.5 . . ?
H04S C04O H04T 109.5 . . ?
N01P C04O H04U 109.5 . . ?
H04S C04O H04U 109.5 . . ?
H04T C04O H04U 109.5 . . ?
C04H C04P C03Q 112(2) . . ?
C04H C04P C03G 113(2) . . ?
C03Q C04P C03G 103(2) . . ?
C04H C04P H04P 109.2 . . ?
C03Q C04P H04P 109.2 . . ?
C03G C04P H04P 109.2 . . ?
C04J C04R C03N 111.6(18) . . ?
C04J C04R C04C 110(2) . . ?
C03N C04R C04C 107.0(18) . . ?
C04J C04R H04R 109.5 . . ?
C03N C04R H04R 109.5 . . ?
C04C C04R H04R 109.5 . . ?
F02G C13 F038 97(2) . . ?
F02G C13 F01R 106(2) . . ?
F038 C13 F01R 107(2) . . ?
F02G C13 C01H 116(2) . . ?
F038 C13 C01H 112.1(18) . . ?
F01R C13 C01H 116.1(17) . . ?
Ag1 Ag2 O00W 74.3(5) . . ?
Ag1 Ag2 S0L 88.0(3) . . ?
O00W Ag2 S0L 126.9(4) . . ?
Ag1 Ag2 S0N 82.6(3) . 1_665 ?
O00W Ag2 S0N 108.5(4) . 1_665 ?
S0L Ag2 S0N 118.46(16) . 1_665 ?
Ag1 Ag2 Ag0C 125.9(3) . 1_665 ?
O00W Ag2 Ag0C 139.8(4) . 1_665 ?
S0L Ag2 Ag0C 91.03(12) . 1_665 ?
S0N Ag2 Ag0C 51.30(10) 1_665 1_665 ?
Ag1 Ag2 Ag08 136.8(3) . 1_665 ?
O00W Ag2 Ag08 132.2(4) . 1_665 ?
S0L Ag2 Ag08 49.22(10) . 1_665 ?
S0N Ag2 Ag08 110.55(13) 1_665 1_665 ?
Ag0C Ag2 Ag08 60.32(6) 1_665 1_665 ?
N65 C196 H19A 109.5 . . ?
N65 C196 H19B 109.4 . . ?
H19A C196 H19B 109.5 . . ?
N65 C196 H19C 109.5 . . ?
H19A C196 H19C 109.5 . . ?
H19B C196 H19C 109.5 . . ?
O00Y C14 O01J 128(2) . . ?
O00Y C14 C27 116(2) . . ?
O01J C14 C27 115.0(19) . . ?
N65 C121 O022 156(5) . . ?
N65 C121 H121 102.2 . . ?
O022 C121 H121 102.1 . . ?
N012 C8 H8A 109.5 . . ?
N012 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N012 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
F8A C17 F4A 97(3) . . ?
F8A C17 F2A 102(3) . . ?
F4A C17 F2A 106(3) . . ?
F8A C17 C03X 119(3) . . ?
F4A C17 C03X 112(2) . . ?
F2A C17 C03X 118(2) . . ?
F39 C27 F41 97.8(16) . . ?
F39 C27 C14 125(2) . . ?
F41 C27 C14 119.9(19) . . ?
F39 C27 F10 88.5(17) . . ?
F41 C27 F10 96.5(18) . . ?
C14 C27 F10 122(2) . . ?
Ag2 Ag1 S1 167.3(6) . . ?
Ag2 Ag1 O00W 81.0(5) . . ?
S1 Ag1 O00W 87.9(7) . . ?
Ag2 Ag1 S0N 74.6(3) . 1_665 ?
S1 Ag1 S0N 114.9(6) . 1_665 ?
O00W Ag1 S0N 108.0(4) . 1_665 ?
Ag2 Ag1 S0L 69.2(3) . . ?
S1 Ag1 S0L 112.7(7) . . ?
O00W Ag1 S0L 121.9(4) . . ?
S0N Ag1 S0L 110.06(18) 1_665 . ?
Ag2 Ag1 Ag0D 125.7(3) . . ?
S1 Ag1 Ag0D 65.9(6) . . ?
O00W Ag1 Ag0D 124.3(4) . . ?
S0N Ag1 Ag0D 52.89(10) 1_665 . ?
S0L Ag1 Ag0D 113.53(14) . . ?
Ag2 Ag1 Ag0F 109.1(3) . . ?
S1 Ag1 Ag0F 79.7(7) . . ?
O00W Ag1 Ag0F 159.2(4) . . ?
S0N Ag1 Ag0F 92.40(13) 1_665 . ?
S0L Ag1 Ag0F 50.66(10) . . ?
Ag0D Ag1 Ag0F 65.28(9) . . ?
N65 C45 H45A 109.5 . . ?
N65 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
N65 C45 H45C 109.4 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
C121 N65 C196 163(4) . . ?
C121 N65 C45 101(4) . . ?
C196 N65 C45 94(3) . . ?
Ag1 S1 Ag0D 68.9(7) . . ?
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
Ag01 S0M 2.429(4) . ?
Ag01 S0K 2.439(4) . ?
Ag01 Cl0J 2.828(3) 1_445 ?
Ag01 Ag02 3.0199(17) . ?
Ag01 Ag03 3.0794(17) . ?
Ag01 Ag04 3.1115(17) . ?
Ag01 Ag0C 3.3177(18) . ?
Ag02 O00X 2.330(11) . ?
Ag02 O2 2.410(16) . ?
Ag02 S0O 2.534(4) 1_445 ?
Ag02 S0K 2.547(4) . ?
Ag02 Ag0A 3.0407(19) 1_445 ?
Ag02 Ag03 3.1601(17) . ?
Ag03 O00T 2.352(11) . ?
Ag03 O00Y 2.383(12) . ?
Ag03 S0O 2.528(4) 1_445 ?
Ag03 S0M 2.554(4) . ?
Ag03 Ag08 3.1394(18) . ?
Ag03 Ag0B 3.264(2) 1_445 ?
Ag04 S0I 2.451(4) . ?
Ag04 S0K 2.451(4) . ?
Ag04 O00Z 2.492(12) . ?
Ag04 Ag0E 3.117(2) . ?
Ag04 Ag07 3.3239(18) . ?
Ag04 Ag05 3.3528(18) . ?
Ag05 S0I 2.433(4) . ?
Ag05 S0N 2.447(4) . ?
Ag05 Cl0J 2.842(3) 1_445 ?
Ag05 Ag06 3.0839(18) . ?
Ag05 Ag0D 3.090(2) 1_445 ?
Ag05 Ag0C 3.1331(19) . ?
Ag06 O00U 2.322(13) . ?
Ag06 O022 2.506(13) . ?
Ag06 S0I 2.522(4) . ?
Ag06 S0P 2.555(4) 1_445 ?
Ag06 Ag09 2.9565(18) 1_445 ?
Ag06 Ag07 3.1282(18) . ?
Ag06 Ag0D 3.363(2) 1_445 ?
Ag07 O011 2.368(12) . ?
Ag07 O00S 2.373(11) . ?
Ag07 S0I 2.532(4) . ?
Ag07 S0Q 2.558(4) 1_445 ?
Ag07 Ag0E 3.169(2) . ?
Ag07 Ag09 3.1831(19) 1_445 ?
Ag08 O01J 2.292(14) . ?
Ag08 S0M 2.516(4) . ?
Ag08 O014 2.519(15) . ?
Ag08 S0L 2.551(4) 1_445 ?
Ag08 Ag0B 2.996(2) 1_445 ?
Ag08 Ag0C 3.197(2) . ?
Ag08 Ag2 3.353(3) 1_445 ?
Ag09 S0Q 2.436(4) . ?
Ag09 S0P 2.440(5) . ?
Ag09 Cl0J 2.836(4) . ?
Ag09 Ag0A 3.1342(19) . ?
Ag09 Ag0F 3.306(2) . ?
Ag0A S0Q 2.411(4) . ?
Ag0A S0O 2.418(4) . ?
Ag0A Ag0B 3.339(2) . ?
Ag0B S0O 2.435(4) . ?
Ag0B S0L 2.468(4) . ?
Ag0B Cl0J 2.870(4) . ?
Ag0B Ag0F 3.047(2) . ?
Ag0C S0M 2.399(4) . ?
Ag0C S0N 2.417(4) . ?
Ag0C Ag2 2.978(3) 1_445 ?
Ag0D S0P 2.522(5) . ?
Ag0D S0N 2.534(4) 1_665 ?
Ag0D S1 2.96(2) . ?
Ag0D Ag1 3.027(4) . ?
Ag0D Ag0F 3.268(2) . ?
Ag0E O01G 2.283(18) . ?
Ag0E O7 2.32(2) . ?
Ag0E S0Q 2.488(4) 1_445 ?
Ag0E S0K 2.509(4) . ?
Ag0F S0P 2.431(4) . ?
Ag0F S0L 2.442(4) . ?
Ag0F Ag1 3.032(4) . ?
S0I C016 1.838(14) . ?
S0K C013 1.856(13) . ?
S0L C015 1.822(15) . ?
S0L Ag2 2.436(4) . ?
S0L Ag1 2.605(5) . ?
S0M C01F 1.851(14) . ?
S0N C01L 1.830(14) . ?
S0N Ag2 2.525(4) 1_445 ?
S0N Ag1 2.597(5) 1_445 ?
S0O C03V 1.849(14) . ?
S0P C01Q 1.839(17) . ?
S0Q C01S 1.842(14) . ?
F00R C03K 1.33(2) . ?
O00S C027 1.23(2) . ?
O00T C01H 1.21(2) . ?
O00U C027 1.20(2) . ?
F00V C03K 1.34(3) . ?
O00W C02C 1.19(2) . ?
O00W Ag1 2.330(13) . ?
O00W Ag2 2.390(11) . ?
O00X C01H 1.231(19) . ?
O00Y C14 1.18(2) . ?
O00Z C02J 1.246(19) . ?
N010 C030 1.32(3) . ?
N010 C02Y 1.38(3) . ?
N010 C03A 1.43(3) . ?
O011 C03X 1.23(3) . ?
N012 C02C 1.28(2) . ?
N012 C8 1.40(3) . ?
N012 C042 1.42(3) . ?
C013 C020 1.50(2) . ?
C013 C02A 1.51(2) . ?
C013 C02P 1.55(2) . ?
O014 C030 1.24(2) . ?
C015 C01D 1.51(2) . ?
C015 C01C 1.53(2) . ?
C015 C01O 1.56(2) . ?
C016 C02E 1.51(2) . ?
C016 C01N 1.52(2) . ?
C016 C01K 1.56(2) . ?
O017 C02J 1.234(19) . ?
C018 C01B 1.52(2) . ?
C018 C020 1.55(2) . ?
C018 C02N 1.56(3) . ?
C018 H018 0.9800 . ?
F019 C03K 1.39(3) . ?
C01B C01T 1.53(2) . ?
C01B H01A 0.9700 . ?
C01B H01B 0.9700 . ?
C01C C023 1.56(2) . ?
C01C H01N 0.9700 . ?
C01C H01O 0.9700 . ?
C01D C033 1.56(2) . ?
C01D H01P 0.9700 . ?
C01D H01Q 0.9700 . ?
C01E C01F 1.525(18) . ?
C01E C032 1.56(2) . ?
C01E H01C 0.9700 . ?
C01E H01D 0.9700 . ?
C01F C01I 1.505(19) . ?
C01F C024 1.53(2) . ?
O01G C03X 1.23(3) . ?
C01H C13 1.52(2) . ?
C01I C026 1.55(2) . ?
C01I H01E 0.9700 . ?
C01I H01F 0.9700 . ?
O01J C14 1.28(2) . ?
C01K C01W 1.58(2) . ?
C01K H01G 0.9700 . ?
C01K H01H 0.9700 . ?
C01L C035 1.53(2) . ?
C01L C01V 1.55(2) . ?
C01L C03U 1.574(19) . ?
C01M C03P 1.50(2) . ?
C01M C02L 1.50(3) . ?
C01M C024 1.53(2) . ?
C01M H01M 0.9800 . ?
C01N C01X 1.54(2) . ?
C01N H01I 0.9700 . ?
C01N H01J 0.9700 . ?
C01O C02B 1.53(2) . ?
C01O H01R 0.9700 . ?
C01O H01S 0.9700 . ?
N01P C03L 1.31(3) . ?
N01P C04O 1.41(3) . ?
N01P C04D 1.43(3) . ?
C01Q C03G 1.51(2) . ?
C01Q C025 1.52(3) . ?
C01Q C034 1.53(3) . ?
F01R C13 1.30(3) . ?
C01S C03W 1.52(2) . ?
C01S C021 1.52(2) . ?
C01S C02I 1.54(2) . ?
C01T C028 1.53(2) . ?
C01T C02A 1.54(2) . ?
C01T H01T 0.9800 . ?
C01U C02M 1.47(3) . ?
C01U C03F 1.50(3) . ?
C01U C01V 1.55(2) . ?
C01U H01U 0.9800 . ?
C01V H01K 0.9700 . ?
C01V H01L 0.9700 . ?
C01W C02Q 1.50(3) . ?
C01W C03C 1.58(3) . ?
C01W H01W 0.9800 . ?
C01X C02T 1.52(3) . ?
C01X C03C 1.54(3) . ?
C01X H01X 0.9800 . ?
C01Y C023 1.52(3) . ?
C01Y C02B 1.54(3) . ?
C01Y H01V 0.9700 . ?
C01Y H01Y 0.9700 . ?
C020 H02A 0.9700 . ?
C020 H02B 0.9700 . ?
C021 C036 1.52(2) . ?
C021 H1 0.9700 . ?
C021 H 0.9700 . ?
O022 C121 1.28(3) . ?
C023 C02X 1.55(3) . ?
C023 H023 0.9800 . ?
C024 H02C 0.9700 . ?
C024 H02D 0.9700 . ?
C025 C04B 1.55(3) . ?
C025 H2 0.9700 . ?
C025 HA 0.9700 . ?
C026 C02W 1.47(2) . ?
C026 C02L 1.54(3) . ?
C026 H026 0.9800 . ?
C027 C03K 1.55(3) . ?
C028 C02F 1.45(3) . ?
C028 H02E 0.9700 . ?
C028 H02F 0.9700 . ?
C02A H02G 0.9700 . ?
C02A H02H 0.9700 . ?
C02B C037 1.54(3) . ?
C02B H3 0.9800 . ?
C02C H4 0.9300 . ?
O02D C03L 1.21(3) . ?
C02E C03D 1.54(2) . ?
C02E H02I 0.9700 . ?
C02E H02J 0.9700 . ?
C02F C02P 1.53(2) . ?
C02F C02N 1.56(3) . ?
C02F H02K 0.9800 . ?
F02G C13 1.22(3) . ?
C02H C03V 1.53(2) . ?
C02H C04A 1.59(3) . ?
C02H H5 0.9700 . ?
C02H HB 0.9700 . ?
C02I C02S 1.54(2) . ?
C02I H6 0.9700 . ?
C02I HC 0.9700 . ?
C02J C04N 1.47(2) . ?
C02K C02S 1.46(3) . ?
C02K C036 1.52(3) . ?
C02K H7 0.9700 . ?
C02K HD 0.9700 . ?
C02L H02L 0.9700 . ?
C02L H02M 0.9700 . ?
C02M C02V 1.56(3) . ?
C02M H02N 0.9700 . ?
C02M H02O 0.9700 . ?
C02N H02P 0.9700 . ?
C02N H02Q 0.9700 . ?
C02O C039 1.51(3) . ?
C02O C04B 1.53(4) . ?
C02O H8 0.9700 . ?
C02O HE 0.9700 . ?
C02P H02R 0.9700 . ?
C02P H02S 0.9700 . ?
C02Q C03D 1.51(3) . ?
C02Q H02T 0.9700 . ?
C02Q H02U 0.9700 . ?
C02S C03R 1.48(3) . ?
C02S H9 0.9800 . ?
C02T C03D 1.55(3) . ?
C02T H02V 0.9700 . ?
C02T H02W 0.9700 . ?
C02U C03U 1.45(2) . ?
C02U C03F 1.52(3) . ?
C02U C03M 1.59(3) . ?
C02U H02X 0.9800 . ?
C02V C035 1.54(2) . ?
C02V C03M 1.54(3) . ?
C02V H02Y 0.9800 . ?
C02W C032 1.55(2) . ?
C02W H02Z 0.9700 . ?
C02W HF 0.9700 . ?
C02X C033 1.57(3) . ?
C02X H10 0.9700 . ?
C02X HG 0.9700 . ?
C02Y H02 0.9600 . ?
C02Y HH 0.9600 . ?
C02Y HI 0.9600 . ?
C030 H030 0.9300 . ?
C032 C03P 1.50(2) . ?
C032 H032 0.9800 . ?
C033 C037 1.47(3) . ?
C033 H033 0.9800 . ?
C034 C039 1.56(3) . ?
C034 H03Q 0.9700 . ?
C034 H03R 0.9700 . ?
C035 H03A 0.9700 . ?
C035 H03B 0.9700 . ?
C036 C03B 1.48(3) . ?
C036 H036 0.9800 . ?
C037 H03S 0.9700 . ?
C037 H03T 0.9700 . ?
F038 C13 1.28(3) . ?
C039 C03Q 1.51(3) . ?
C039 H039 0.9800 . ?
C03A H03C 0.9600 . ?
C03A H03D 0.9600 . ?
C03A H03E 0.9600 . ?
C03B C044 1.46(3) . ?
C03B H03U 0.9700 . ?
C03B H03V 0.9700 . ?
C03C H03F 0.9700 . ?
C03C H03G 0.9700 . ?
C03D H03H 0.9800 . ?
C03F H03I 0.9700 . ?
C03F H03J 0.9700 . ?
C03G C04P 1.57(3) . ?
C03G H03W 0.9700 . ?
C03G H03X 0.9700 . ?
F03J C04N 1.22(2) . ?
C03L H13 0.9300 . ?
C03M H03K 0.9700 . ?
C03M H03L 0.9700 . ?
C03N C03V 1.53(2) . ?
C03N C04R 1.53(3) . ?
C03N H03Y 0.9700 . ?
C03N HJ 0.9700 . ?
C03P H03M 0.9700 . ?
C03P H03N 0.9700 . ?
C03Q C04P 1.53(4) . ?
C03Q H03Z 0.9700 . ?
C03Q HK 0.9700 . ?
C03R C044 1.56(4) . ?
C03R H03 0.9700 . ?
C03R HL 0.9700 . ?
C03S C041 1.53(3) . ?
C03S C04A 1.54(3) . ?
C03S H11 0.9700 . ?
C03S HM 0.9700 . ?
C03U H03O 0.9700 . ?
C03U H03P 0.9700 . ?
C03V C040 1.59(2) . ?
C03W C044 1.54(2) . ?
C03W H12 0.9700 . ?
C03W HN 0.9700 . ?
C03X C17 1.43(2) . ?
F03Z C04N 1.28(2) . ?
C040 C041 1.48(2) . ?
C040 H04A 0.9700 . ?
C040 H04B 0.9700 . ?
C041 C04C 1.51(4) . ?
C041 H041 0.9800 . ?
C042 H04C 0.9600 . ?
C042 H04D 0.9600 . ?
C042 H04E 0.9600 . ?
C044 H044 0.9800 . ?
C04A C04J 1.49(3) . ?
C04A H04F 0.9800 . ?
C04B C04H 1.56(4) . ?
C04B H04G 0.9800 . ?
C04C C04R 1.54(3) . ?
C04C H04H 0.9700 . ?
C04C H04I 0.9700 . ?
C04D H04N 0.9600 . ?
C04D H04O 0.9600 . ?
C04D H04Q 0.9600 . ?
C04H C04P 1.47(4) . ?
C04H H04J 0.9700 . ?
C04H H04K 0.9700 . ?
C04J C04R 1.48(3) . ?
C04J H04L 0.9700 . ?
C04J H04M 0.9700 . ?
C04N F34 1.30(2) . ?
C04O H04S 0.9600 . ?
C04O H04T 0.9600 . ?
C04O H04U 0.9600 . ?
C04P H04P 0.9800 . ?
C04R H04R 0.9800 . ?
Ag2 Ag1 1.013(5) . ?
C196 N65 1.36(3) . ?
C196 H19A 0.9600 . ?
C196 H19B 0.9600 . ?
C196 H19C 0.9600 . ?
C14 C27 1.334(15) . ?
C121 N65 1.01(3) . ?
C121 H121 0.9300 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C17 F8A 1.25(5) . ?
C17 F4A 1.40(2) . ?
C17 F2A 1.40(2) . ?
C27 F39 1.314(16) . ?
C27 F41 1.319(16) . ?
C27 F10 1.360(16) . ?
Ag1 S1 2.31(3) . ?
C45 N65 1.68(5) . ?
C45 H45A 0.9600 . ?
C45 H45B 0.9600 . ?
C45 H45C 0.9600 . ?
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
Ag01 S0K C013 C020 121.4(9) . . . . ?
Ag04 S0K C013 C020 -152.2(9) . . . . ?
Ag0E S0K C013 C020 -66.2(11) . . . . ?
Ag02 S0K C013 C020 39.8(11) . . . . ?
Ag01 S0K C013 C02A -118.9(9) . . . . ?
Ag04 S0K C013 C02A -32.5(11) . . . . ?
Ag0E S0K C013 C02A 53.5(11) . . . . ?
Ag02 S0K C013 C02A 159.5(9) . . . . ?
Ag01 S0K C013 C02P 1.3(11) . . . . ?
Ag04 S0K C013 C02P 87.7(10) . . . . ?
Ag0E S0K C013 C02P 173.7(8) . . . . ?
Ag02 S0K C013 C02P -80.3(10) . . . . ?
Ag2 S0L C015 C01D 73.0(12) . . . . ?
Ag0F S0L C015 C01D -30.2(13) . . . . ?
Ag0B S0L C015 C01D -114.0(12) . . . . ?
Ag08 S0L C015 C01D 166.6(11) 1_665 . . . ?
Ag1 S0L C015 C01D 49.4(13) . . . . ?
Ag2 S0L C015 C01C -46.5(12) . . . . ?
Ag0F S0L C015 C01C -149.7(9) . . . . ?
Ag0B S0L C015 C01C 126.5(10) . . . . ?
Ag08 S0L C015 C01C 47.1(12) 1_665 . . . ?
Ag1 S0L C015 C01C -70.1(11) . . . . ?
Ag2 S0L C015 C01O -168.0(9) . . . . ?
Ag0F S0L C015 C01O 88.8(11) . . . . ?
Ag0B S0L C015 C01O 5.0(12) . . . . ?
Ag08 S0L C015 C01O -74.3(11) 1_665 . . . ?
Ag1 S0L C015 C01O 168.4(9) . . . . ?
Ag05 S0I C016 C02E 1.5(13) . . . . ?
Ag04 S0I C016 C02E -95.7(12) . . . . ?
Ag06 S0I C016 C02E 86.6(11) . . . . ?
Ag07 S0I C016 C02E 171.0(10) . . . . ?
Ag05 S0I C016 C01N 120.5(11) . . . . ?
Ag04 S0I C016 C01N 23.3(12) . . . . ?
Ag06 S0I C016 C01N -154.5(10) . . . . ?
Ag07 S0I C016 C01N -70.1(11) . . . . ?
Ag05 S0I C016 C01K -116.6(11) . . . . ?
Ag04 S0I C016 C01K 146.2(10) . . . . ?
Ag06 S0I C016 C01K -31.5(13) . . . . ?
Ag07 S0I C016 C01K 52.9(13) . . . . ?
C020 C018 C01B C01T 59.4(19) . . . . ?
C02N C018 C01B C01T -60.6(17) . . . . ?
C01D C015 C01C C023 62.2(19) . . . . ?
C01O C015 C01C C023 -56.9(18) . . . . ?
S0L C015 C01C C023 -177.6(13) . . . . ?
C01C C015 C01D C033 -61(2) . . . . ?
C01O C015 C01D C033 60(2) . . . . ?
S0L C015 C01D C033 179.7(15) . . . . ?
C032 C01E C01F C01I 60.6(16) . . . . ?
C032 C01E C01F C024 -62.5(15) . . . . ?
C032 C01E C01F S0M -179.6(10) . . . . ?
Ag0C S0M C01F C01I 130.9(9) . . . . ?
Ag01 S0M C01F C01I -129.9(9) . . . . ?
Ag08 S0M C01F C01I 37.8(11) . . . . ?
Ag03 S0M C01F C01I -46.4(10) . . . . ?
Ag0C S0M C01F C024 -108.6(9) . . . . ?
Ag01 S0M C01F C024 -9.4(11) . . . . ?
Ag08 S0M C01F C024 158.3(8) . . . . ?
Ag03 S0M C01F C024 74.0(10) . . . . ?
Ag0C S0M C01F C01E 9.4(11) . . . . ?
Ag01 S0M C01F C01E 108.6(9) . . . . ?
Ag08 S0M C01F C01E -83.7(10) . . . . ?
Ag03 S0M C01F C01E -168.0(9) . . . . ?
Ag03 O00T C01H O00X 0(3) . . . . ?
Ag03 O00T C01H C13 -174.2(14) . . . . ?
Ag02 O00X C01H O00T 13(3) . . . . ?
Ag02 O00X C01H C13 -173.0(13) . . . . ?
C024 C01F C01I C026 62.3(16) . . . . ?
C01E C01F C01I C026 -59.9(16) . . . . ?
S0M C01F C01I C026 -179.3(10) . . . . ?
C02E C016 C01K C01W 60.3(18) . . . . ?
C01N C016 C01K C01W -60.6(19) . . . . ?
S0I C016 C01K C01W 178.9(13) . . . . ?
Ag0C S0N C01L C035 -19.7(11) . . . . ?
Ag05 S0N C01L C035 -107.3(10) . . . . ?
Ag2 S0N C01L C035 60.8(11) 1_445 . . . ?
Ag0D S0N C01L C035 167.2(9) 1_445 . . . ?
Ag1 S0N C01L C035 85.5(11) 1_445 . . . ?
Ag0C S0N C01L C01V -138.7(9) . . . . ?
Ag05 S0N C01L C01V 133.7(9) . . . . ?
Ag2 S0N C01L C01V -58.2(11) 1_445 . . . ?
Ag0D S0N C01L C01V 48.3(11) 1_445 . . . ?
Ag1 S0N C01L C01V -33.5(11) 1_445 . . . ?
Ag0C S0N C01L C03U 99.7(10) . . . . ?
Ag05 S0N C01L C03U 12.1(12) . . . . ?
Ag2 S0N C01L C03U -179.7(9) 1_445 . . . ?
Ag0D S0N C01L C03U -73.3(11) 1_445 . . . ?
Ag1 S0N C01L C03U -155.0(9) 1_445 . . . ?
C02E C016 C01N C01X -61.2(18) . . . . ?
C01K C016 C01N C01X 59.8(19) . . . . ?
S0I C016 C01N C01X 179.4(12) . . . . ?
C01D C015 C01O C02B -63.2(17) . . . . ?
C01C C015 C01O C02B 56.5(17) . . . . ?
S0L C015 C01O C02B 176.4(12) . . . . ?
Ag0F S0P C01Q C03G 20.1(18) . . . . ?
Ag09 S0P C01Q C03G 113.5(16) . . . . ?
Ag0D S0P C01Q C03G -72.9(17) . . . . ?
Ag06 S0P C01Q C03G -167.3(15) 1_665 . . . ?
Ag0F S0P C01Q C025 139.9(12) . . . . ?
Ag09 S0P C01Q C025 -126.7(12) . . . . ?
Ag0D S0P C01Q C025 46.9(15) . . . . ?
Ag06 S0P C01Q C025 -47.5(15) 1_665 . . . ?
Ag0F S0P C01Q C034 -101.7(13) . . . . ?
Ag09 S0P C01Q C034 -8.3(14) . . . . ?
Ag0D S0P C01Q C034 165.3(11) . . . . ?
Ag06 S0P C01Q C034 70.9(14) 1_665 . . . ?
Ag0A S0Q C01S C03W -22.4(15) . . . . ?
Ag09 S0Q C01S C03W -111.7(14) . . . . ?
Ag0E S0Q C01S C03W 76.1(14) 1_665 . . . ?
Ag07 S0Q C01S C03W 161.6(13) 1_665 . . . ?
Ag0A S0Q C01S C021 96.0(11) . . . . ?
Ag09 S0Q C01S C021 6.7(12) . . . . ?
Ag0E S0Q C01S C021 -165.5(9) 1_665 . . . ?
Ag07 S0Q C01S C021 -79.9(11) 1_665 . . . ?
Ag0A S0Q C01S C02I -147.3(11) . . . . ?
Ag09 S0Q C01S C02I 123.4(12) . . . . ?
Ag0E S0Q C01S C02I -48.8(14) 1_665 . . . ?
Ag07 S0Q C01S C02I 36.7(14) 1_665 . . . ?
C018 C01B C01T C028 60.1(18) . . . . ?
C018 C01B C01T C02A -59.3(19) . . . . ?
C02M C01U C01V C01L -63.4(19) . . . . ?
C03F C01U C01V C01L 60.8(18) . . . . ?
C035 C01L C01V C01U 61.1(17) . . . . ?
C03U C01L C01V C01U -56.7(17) . . . . ?
S0N C01L C01V C01U -178.5(12) . . . . ?
C016 C01K C01W C02Q -61.7(19) . . . . ?
C016 C01K C01W C03C 60(2) . . . . ?
C016 C01N C01X C02T 62(2) . . . . ?
C016 C01N C01X C03C -60(2) . . . . ?
C02A C013 C020 C018 62.4(16) . . . . ?
C02P C013 C020 C018 -60.5(16) . . . . ?
S0K C013 C020 C018 -178.2(11) . . . . ?
C01B C018 C020 C013 -60.3(18) . . . . ?
C02N C018 C020 C013 58.7(18) . . . . ?
C03W C01S C021 C036 -60.0(18) . . . . ?
C02I C01S C021 C036 62.3(17) . . . . ?
S0Q C01S C021 C036 -179.9(12) . . . . ?
C02B C01Y C023 C02X 57(2) . . . . ?
C02B C01Y C023 C01C -58(2) . . . . ?
C015 C01C C023 C01Y 57.2(19) . . . . ?
C015 C01C C023 C02X -62(2) . . . . ?
C01I C01F C024 C01M -61.6(16) . . . . ?
C01E C01F C024 C01M 62.0(15) . . . . ?
S0M C01F C024 C01M 179.3(10) . . . . ?
C03P C01M C024 C01F -62.6(17) . . . . ?
C02L C01M C024 C01F 61.9(16) . . . . ?
C03G C01Q C025 C04B -61(2) . . . . ?
C034 C01Q C025 C04B 60(2) . . . . ?
S0P C01Q C025 C04B 179.4(17) . . . . ?
C01F C01I C026 C02W 59.0(17) . . . . ?
C01F C01I C026 C02L -60.5(17) . . . . ?
Ag06 O00U C027 O00S -7(3) . . . . ?
Ag06 O00U C027 C03K 162.3(13) . . . . ?
Ag07 O00S C027 O00U 2(3) . . . . ?
Ag07 O00S C027 C03K -167.2(13) . . . . ?
C01B C01T C028 C02F -60.3(17) . . . . ?
C02A C01T C028 C02F 58.7(18) . . . . ?
C020 C013 C02A C01T -62.4(16) . . . . ?
C02P C013 C02A C01T 61.1(15) . . . . ?
S0K C013 C02A C01T 179.5(10) . . . . ?
C028 C01T C02A C013 -59.6(17) . . . . ?
C01B C01T C02A C013 59.7(17) . . . . ?
C015 C01O C02B C01Y -58(2) . . . . ?
C015 C01O C02B C037 62.1(18) . . . . ?
C023 C01Y C02B C01O 60(2) . . . . ?
C023 C01Y C02B C037 -58.8(19) . . . . ?
Ag1 O00W C02C N012 -172.2(17) . . . . ?
Ag2 O00W C02C N012 148(2) . . . . ?
C8 N012 C02C O00W 180(3) . . . . ?
C042 N012 C02C O00W 6(4) . . . . ?
C01N C016 C02E C03D 62.6(19) . . . . ?
C01K C016 C02E C03D -60.9(19) . . . . ?
S0I C016 C02E C03D -178.2(13) . . . . ?
C01T C028 C02F C02P -61.8(19) . . . . ?
C01T C028 C02F C02N 63.4(18) . . . . ?
C03W C01S C02I C02S 57(2) . . . . ?
C021 C01S C02I C02S -61(2) . . . . ?
S0Q C01S C02I C02S 179.8(15) . . . . ?
Ag04 O00Z C02J O017 0(2) . . . . ?
Ag04 O00Z C02J C04N -175.7(12) . . . . ?
C03P C01M C02L C026 61.5(18) . . . . ?
C024 C01M C02L C026 -63.1(18) . . . . ?
C02W C026 C02L C01M -60.3(18) . . . . ?
C01I C026 C02L C01M 60.8(18) . . . . ?
C03F C01U C02M C02V -59.1(19) . . . . ?
C01V C01U C02M C02V 64(2) . . . . ?
C028 C02F C02N C018 -62.8(18) . . . . ?
C02P C02F C02N C018 65.0(19) . . . . ?
C01B C018 C02N C02F 59.1(17) . . . . ?
C020 C018 C02N C02F -59.9(19) . . . . ?
C028 C02F C02P C013 60.8(19) . . . . ?
C02N C02F C02P C013 -65.7(19) . . . . ?
C020 C013 C02P C02F 63.8(17) . . . . ?
C02A C013 C02P C02F -58.9(17) . . . . ?
S0K C013 C02P C02F -178.5(12) . . . . ?
C01K C01W C02Q C03D 66(2) . . . . ?
C03C C01W C02Q C03D -52(2) . . . . ?
C036 C02K C02S C03R 60(2) . . . . ?
C036 C02K C02S C02I -61(2) . . . . ?
C01S C02I C02S C02K 61(2) . . . . ?
C01S C02I C02S C03R -57(2) . . . . ?
C03C C01X C02T C03D 59.7(19) . . . . ?
C01N C01X C02T C03D -62(2) . . . . ?
C01U C02M C02V C035 -61(2) . . . . ?
C01U C02M C02V C03M 58.6(19) . . . . ?
C02L C026 C02W C032 60.1(18) . . . . ?
C01I C026 C02W C032 -59.1(18) . . . . ?
C01Y C023 C02X C033 -54(2) . . . . ?
C01C C023 C02X C033 64(2) . . . . ?
Ag08 O014 C030 N010 21(6) . . . . ?
C02Y N010 C030 O014 174(3) . . . . ?
C03A N010 C030 O014 -5(4) . . . . ?
C026 C02W C032 C03P -60.8(17) . . . . ?
C026 C02W C032 C01E 59.1(18) . . . . ?
C01F C01E C032 C03P 62.0(17) . . . . ?
C01F C01E C032 C02W -58.3(17) . . . . ?
C015 C01D C033 C037 -59(2) . . . . ?
C015 C01D C033 C02X 62(2) . . . . ?
C023 C02X C033 C037 55(2) . . . . ?
C023 C02X C033 C01D -64(2) . . . . ?
C03G C01Q C034 C039 57(2) . . . . ?
C025 C01Q C034 C039 -62(2) . . . . ?
S0P C01Q C034 C039 179.1(13) . . . . ?
C01V C01L C035 C02V -61.7(16) . . . . ?
C03U C01L C035 C02V 57.7(17) . . . . ?
S0N C01L C035 C02V 178.9(11) . . . . ?
C03M C02V C035 C01L -58.9(19) . . . . ?
C02M C02V C035 C01L 60.3(19) . . . . ?
C01S C021 C036 C03B 59(2) . . . . ?
C01S C021 C036 C02K -60(2) . . . . ?
C02S C02K C036 C03B -59(2) . . . . ?
C02S C02K C036 C021 60(2) . . . . ?
C01D C033 C037 C02B 59(2) . . . . ?
C02X C033 C037 C02B -59(2) . . . . ?
C01O C02B C037 C033 -61(2) . . . . ?
C01Y C02B C037 C033 60(2) . . . . ?
C04B C02O C039 C03Q 57(2) . . . . ?
C04B C02O C039 C034 -64(3) . . . . ?
C01Q C034 C039 C03Q -59(3) . . . . ?
C01Q C034 C039 C02O 65(2) . . . . ?
C021 C036 C03B C044 -60(2) . . . . ?
C02K C036 C03B C044 58(2) . . . . ?
C02T C01X C03C C01W -58(2) . . . . ?
C01N C01X C03C C01W 63(2) . . . . ?
C02Q C01W C03C C01X 55(2) . . . . ?
C01K C01W C03C C01X -62(2) . . . . ?
C01W C02Q C03D C02E -63(2) . . . . ?
C01W C02Q C03D C02T 53(2) . . . . ?
C016 C02E C03D C02Q 60(2) . . . . ?
C016 C02E C03D C02T -60(2) . . . . ?
C01X C02T C03D C02Q -57(2) . . . . ?
C01X C02T C03D C02E 59(2) . . . . ?
C02M C01U C03F C02U 61(2) . . . . ?
C01V C01U C03F C02U -61(2) . . . . ?
C03U C02U C03F C01U 59(2) . . . . ?
C03M C02U C03F C01U -59(2) . . . . ?
C025 C01Q C03G C04P 55(3) . . . . ?
C034 C01Q C03G C04P -64(3) . . . . ?
S0P C01Q C03G C04P 174(2) . . . . ?
O00U C027 C03K F00R 22(3) . . . . ?
O00S C027 C03K F00R -166.6(18) . . . . ?
O00U C027 C03K F00V 141.1(19) . . . . ?
O00S C027 C03K F00V -47(2) . . . . ?
O00U C027 C03K F019 -96(2) . . . . ?
O00S C027 C03K F019 76(2) . . . . ?
C04O N01P C03L O02D 10(4) . . . . ?
C04D N01P C03L O02D -175(3) . . . . ?
C035 C02V C03M C02U 59(2) . . . . ?
C02M C02V C03M C02U -59.7(19) . . . . ?
C03U C02U C03M C02V -61(2) . . . . ?
C03F C02U C03M C02V 60.1(19) . . . . ?
C02W C032 C03P C01M 58.8(17) . . . . ?
C01E C032 C03P C01M -61.4(18) . . . . ?
C02L C01M C03P C032 -61.2(18) . . . . ?
C024 C01M C03P C032 63.0(19) . . . . ?
C02O C039 C03Q C04P -53(2) . . . . ?
C034 C039 C03Q C04P 66(3) . . . . ?
C02K C02S C03R C044 -60(2) . . . . ?
C02I C02S C03R C044 59(2) . . . . ?
C03F C02U C03U C01L -55(2) . . . . ?
C03M C02U C03U C01L 63(2) . . . . ?
C035 C01L C03U C02U -62.7(19) . . . . ?
C01V C01L C03U C02U 55.4(19) . . . . ?
S0N C01L C03U C02U 176.2(14) . . . . ?
C04R C03N C03V C02H -59.7(19) . . . . ?
C04R C03N C03V C040 62.4(19) . . . . ?
C04R C03N C03V S0O -180.0(14) . . . . ?
C04A C02H C03V C03N 59.3(19) . . . . ?
C04A C02H C03V C040 -62.4(18) . . . . ?
C04A C02H C03V S0O 179.8(13) . . . . ?
Ag0A S0O C03V C03N 12.3(13) . . . . ?
Ag0B S0O C03V C03N 111.3(11) . . . . ?
Ag03 S0O C03V C03N -156.4(10) 1_665 . . . ?
Ag02 S0O C03V C03N -71.5(11) 1_665 . . . ?
Ag0A S0O C03V C02H -110.5(11) . . . . ?
Ag0B S0O C03V C02H -11.5(13) . . . . ?
Ag03 S0O C03V C02H 80.7(11) 1_665 . . . ?
Ag02 S0O C03V C02H 165.6(10) 1_665 . . . ?
Ag0A S0O C03V C040 130.6(11) . . . . ?
Ag0B S0O C03V C040 -130.4(11) . . . . ?
Ag03 S0O C03V C040 -38.2(13) 1_665 . . . ?
Ag02 S0O C03V C040 46.7(13) 1_665 . . . ?
C021 C01S C03W C044 61(2) . . . . ?
C02I C01S C03W C044 -57(2) . . . . ?
S0Q C01S C03W C044 -179.1(17) . . . . ?
Ag0E O01G C03X O011 -12(4) . . . . ?
Ag0E O01G C03X C17 167(2) . . . . ?
Ag07 O011 C03X O01G 13(4) . . . . ?
Ag07 O011 C03X C17 -166(2) . . . . ?
C03N C03V C040 C041 -62(2) . . . . ?
C02H C03V C040 C041 62(2) . . . . ?
S0O C03V C040 C041 -180.0(16) . . . . ?
C03V C040 C041 C04C 59(2) . . . . ?
C03V C040 C041 C03S -59(2) . . . . ?
C04A C03S C041 C040 63(3) . . . . ?
C04A C03S C041 C04C -55(2) . . . . ?
C036 C03B C044 C03W 63(2) . . . . ?
C036 C03B C044 C03R -59(2) . . . . ?
C01S C03W C044 C03B -64(2) . . . . ?
C01S C03W C044 C03R 57(3) . . . . ?
C02S C03R C044 C03B 61(2) . . . . ?
C02S C03R C044 C03W -60(2) . . . . ?
C041 C03S C04A C04J 56(2) . . . . ?
C041 C03S C04A C02H -64(2) . . . . ?
C03V C02H C04A C04J -58(2) . . . . ?
C03V C02H C04A C03S 63(2) . . . . ?
C039 C02O C04B C025 58(3) . . . . ?
C039 C02O C04B C04H -56(2) . . . . ?
C01Q C025 C04B C02O -55(3) . . . . ?
C01Q C025 C04B C04H 58(3) . . . . ?
C040 C041 C04C C04R -62(3) . . . . ?
C03S C041 C04C C04R 56(2) . . . . ?
C02O C04B C04H C04P 58(3) . . . . ?
C025 C04B C04H C04P -56(3) . . . . ?
C03S C04A C04J C04R -58(2) . . . . ?
C02H C04A C04J C04R 60(2) . . . . ?
O017 C02J C04N F03J 168(2) . . . . ?
O00Z C02J C04N F03J -15(3) . . . . ?
O017 C02J C04N F03Z 34(3) . . . . ?
O00Z C02J C04N F03Z -149(2) . . . . ?
O017 C02J C04N F34 -88(3) . . . . ?
O00Z C02J C04N F34 89(2) . . . . ?
C04B C04H C04P C03Q -60(3) . . . . ?
C04B C04H C04P C03G 57(3) . . . . ?
C039 C03Q C04P C04H 55(2) . . . . ?
C039 C03Q C04P C03G -67(2) . . . . ?
C01Q C03G C04P C04H -56(3) . . . . ?
C01Q C03G C04P C03Q 66(3) . . . . ?
C04A C04J C04R C03N -60(3) . . . . ?
C04A C04J C04R C04C 58(2) . . . . ?
C03V C03N C04R C04J 58(2) . . . . ?
C03V C03N C04R C04C -62(2) . . . . ?
C041 C04C C04R C04J -58(2) . . . . ?
C041 C04C C04R C03N 63(3) . . . . ?
O00T C01H C13 F02G 73(3) . . . . ?
O00X C01H C13 F02G -103(3) . . . . ?
O00T C01H C13 F038 -38(3) . . . . ?
O00X C01H C13 F038 147(2) . . . . ?
O00T C01H C13 F01R -161(2) . . . . ?
O00X C01H C13 F01R 23(3) . . . . ?
Ag03 O00Y C14 O01J -12(4) . . . . ?
Ag03 O00Y C14 C27 156.2(17) . . . . ?
Ag08 O01J C14 O00Y 10(4) . . . . ?
Ag08 O01J C14 C27 -158.3(18) . . . . ?
Ag06 O022 C121 N65 -137(10) . . . . ?
O01G C03X C17 F8A -58(4) . . . . ?
O011 C03X C17 F8A 121(3) . . . . ?
O01G C03X C17 F4A 54(4) . . . . ?
O011 C03X C17 F4A -127(3) . . . . ?
O01G C03X C17 F2A 178(3) . . . . ?
O011 C03X C17 F2A -3(5) . . . . ?
O00Y C14 C27 F39 168(2) . . . . ?
O01J C14 C27 F39 -22(4) . . . . ?
O00Y C14 C27 F41 41(4) . . . . ?
O01J C14 C27 F41 -149(2) . . . . ?
O00Y C14 C27 F10 -79(3) . . . . ?
O01J C14 C27 F10 91(3) . . . . ?
O00W Ag2 Ag1 S1 -28(4) . . . . ?
S0L Ag2 Ag1 S1 101(4) . . . . ?
S0N Ag2 Ag1 S1 -140(4) 1_665 . . . ?
Ag0C Ag2 Ag1 S1 -169(3) 1_665 . . . ?
Ag08 Ag2 Ag1 S1 108(3) 1_665 . . . ?
S0L Ag2 Ag1 O00W 129.3(4) . . . . ?
S0N Ag2 Ag1 O00W -111.6(4) 1_665 . . . ?
Ag0C Ag2 Ag1 O00W -140.9(4) 1_665 . . . ?
Ag08 Ag2 Ag1 O00W 136.1(5) 1_665 . . . ?
O00W Ag2 Ag1 S0N 111.6(4) . . . 1_665 ?
S0L Ag2 Ag1 S0N -119.04(15) . . . 1_665 ?
Ag0C Ag2 Ag1 S0N -29.3(2) 1_665 . . 1_665 ?
Ag08 Ag2 Ag1 S0N -112.3(4) 1_665 . . 1_665 ?
O00W Ag2 Ag1 S0L -129.3(4) . . . . ?
S0N Ag2 Ag1 S0L 119.04(14) 1_665 . . . ?
Ag0C Ag2 Ag1 S0L 89.8(3) 1_665 . . . ?
Ag08 Ag2 Ag1 S0L 6.8(3) 1_665 . . . ?
O00W Ag2 Ag1 Ag0D 126.0(5) . . . . ?
S0L Ag2 Ag1 Ag0D -104.6(3) . . . . ?
S0N Ag2 Ag1 Ag0D 14.4(3) 1_665 . . . ?
Ag0C Ag2 Ag1 Ag0D -14.8(5) 1_665 . . . ?
Ag08 Ag2 Ag1 Ag0D -97.9(4) 1_665 . . . ?
O00W Ag2 Ag1 Ag0F -161.2(4) . . . . ?
S0L Ag2 Ag1 Ag0F -31.9(2) . . . . ?
S0N Ag2 Ag1 Ag0F 87.18(17) 1_665 . . . ?
Ag0C Ag2 Ag1 Ag0F 57.9(3) 1_665 . . . ?
Ag08 Ag2 Ag1 Ag0F -25.1(5) 1_665 . . . ?
O022 C121 N65 C196 -179(9) . . . . ?
O022 C121 N65 C45 -24(11) . . . . ?
