#------------------------------------------------------------------------------
#$Date: 2019-11-02 07:49:09 +0200 (Sat, 02 Nov 2019) $
#$Revision: 221007 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/12/78/4127835.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_4127835
loop_
_publ_author_name
'Chiu, Tzu-Hao'
'Liao, Jian-Hong'
'Gam, Franck'
'Chantrenne, Isaac'
'Kahlal, Samia'
'Saillard, Jean-Yves'
'Liu, C. W.'
_publ_section_title
;
 Homoleptic Platinum/Silver Superatoms Protected by Dithiolates: Linear
 Assemblies of Two and Three Centered Icosahedra Isolobal to
 Ne₂ and I₃<sup/>.
;
_journal_issue                   33
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              12957
_journal_page_last               12961
_journal_paper_doi               10.1021/jacs.9b05000
_journal_volume                  141
_journal_year                    2019
_chemical_formula_sum            'C132 H308 Ag44 O44 P22 Pt3 S44'
_chemical_formula_weight         10023.29
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_cell_angle_alpha                90
_cell_angle_beta                 96.5225(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.7461(4)
_cell_length_b                   42.9207(9)
_cell_length_c                   32.3401(6)
_cell_measurement_reflns_used    9859
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.83
_cell_measurement_theta_min      2.27
_cell_volume                     27231.4(9)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_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  0.0340
_diffrn_reflns_av_unetI/netI     0.0327
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       51
_diffrn_reflns_limit_k_min       -50
_diffrn_reflns_limit_l_max       38
_diffrn_reflns_limit_l_min       -38
_diffrn_reflns_number            177285
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_theta_full        25.000
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_min         0.792
_exptl_absorpt_coefficient_mu    5.132
_exptl_absorpt_correction_T_max  0.7458
_exptl_absorpt_correction_T_min  0.5748
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    2.445
_exptl_crystal_description       block
_exptl_crystal_F_000             19152
_exptl_crystal_size_max          0.170
_exptl_crystal_size_mid          0.090
_exptl_crystal_size_min          0.040
_refine_diff_density_max         1.998
_refine_diff_density_min         -1.173
_refine_diff_density_rms         0.131
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2679
_refine_ls_number_reflns         47951
_refine_ls_number_restraints     719
_refine_ls_restrained_S_all      1.033
_refine_ls_R_factor_all          0.0447
_refine_ls_R_factor_gt           0.0282
_refine_ls_shift/su_max          0.006
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0176P)²+91.0888P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0540
_refine_ls_wR_factor_ref         0.0599
_reflns_Friedel_coverage         0.000
_reflns_number_gt                38448
_reflns_number_total             47951
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ja9b05000_si_004.cif
_cod_data_source_block           3
_cod_database_code               4127835
_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   0.476
_shelx_estimated_absorpt_t_max   0.821
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.01463(2) 0.89264(2) 0.41781(2) 0.01488(4) Uani 1 1 d . . . . .
Pt2 Pt 0.000000 1.000000 0.500000 0.01480(6) Uani 1 2 d S . P . .
Ag1 Ag 0.02647(2) 0.83822(2) 0.37573(2) 0.02415(10) Uani 1 1 d . . . . .
Ag2 Ag 0.02002(2) 0.83932(2) 0.46509(2) 0.02354(9) Uani 1 1 d . . . . .
Ag3 Ag -0.09896(2) 0.85535(2) 0.40836(2) 0.02434(10) Uani 1 1 d . . . . .
Ag4 Ag -0.05365(2) 0.88946(2) 0.33790(2) 0.02332(9) Uani 1 1 d . . . . .
Ag5 Ag 0.09461(2) 0.89484(2) 0.35330(2) 0.02124(9) Uani 1 1 d . . . . .
Ag6 Ag 0.14022(2) 0.86406(2) 0.43077(2) 0.02091(9) Uani 1 1 d . . . . .
Ag7 Ag -0.06463(2) 0.89150(2) 0.48477(2) 0.02250(9) Uani 1 1 d . . . . .
Ag8 Ag -0.10993(2) 0.92192(2) 0.40371(2) 0.02020(9) Uani 1 1 d . . . . .
Ag9 Ag 0.00828(2) 0.94722(2) 0.37186(2) 0.01915(9) Uani 1 1 d . . . . .
Ag10 Ag 0.12750(2) 0.93021(2) 0.42818(2) 0.02011(9) Uani 1 1 d . . . . .
Ag11 Ag 0.08335(2) 0.89670(2) 0.49842(2) 0.02230(9) Uani 1 1 d . . . . .
Ag12 Ag 0.00185(2) 0.94559(2) 0.46012(2) 0.01815(9) Uani 1 1 d . . . . .
Ag13 Ag -0.09658(2) 0.99129(2) 0.43108(2) 0.02074(9) Uani 1 1 d . . . . .
Ag14 Ag 0.05587(2) 1.00233(2) 0.42337(2) 0.02217(9) Uani 1 1 d . . . . .
Ag15 Ag 0.11170(2) 1.04140(2) 0.49343(2) 0.02271(9) Uani 1 1 d . . . . .
Ag16 Ag -0.03268(2) 1.05047(2) 0.45004(2) 0.02063(9) Uani 1 1 d . . . . .
Ag17 Ag -0.12736(2) 1.02513(2) 0.50302(2) 0.02057(9) Uani 1 1 d . . . . .
Ag18 Ag 0.12685(2) 0.79493(2) 0.42738(2) 0.03042(11) Uani 1 1 d . . . . .
Ag19 Ag 0.15028(2) 0.95964(2) 0.34818(2) 0.02844(10) Uani 1 1 d . . . . .
Ag20 Ag 0.02430(2) 0.93164(2) 0.28405(2) 0.02774(10) Uani 1 1 d . . . . .
Ag21 Ag -0.20997(2) 0.88531(2) 0.44716(2) 0.02609(10) Uani 1 1 d . . . . .
Ag22 Ag 0.14933(2) 0.83636(2) 0.51924(2) 0.02930(10) Uani 1 1 d . . . . .
C1 C 0.0450(4) 0.7971(2) 0.2383(2) 0.066(2) Uani 1 1 d . . . . .
H1A H 0.024065 0.776087 0.236121 0.080 Uiso 1 1 calc R U . . .
H1B H 0.008614 0.812418 0.241657 0.080 Uiso 1 1 calc R U . . .
C2 C 0.0746(6) 0.8037(3) 0.2020(3) 0.125(5) Uani 1 1 d . . . . .
H2A H 0.112224 0.788787 0.199350 0.150 Uiso 1 1 calc R U . . .
H2B H 0.094197 0.824917 0.203915 0.150 Uiso 1 1 calc R U . . .
C3 C 0.0222(7) 0.8014(4) 0.1632(3) 0.164(7) Uani 1 1 d . . . . .
H3A H 0.010036 0.779515 0.157825 0.247 Uiso 1 1 calc R U . . .
H3B H 0.041762 0.810053 0.139152 0.247 Uiso 1 1 calc R U . . .
H3C H -0.018790 0.813199 0.167847 0.247 Uiso 1 1 calc R U . . .
C4 C 0.0597(4) 0.72331(14) 0.3308(2) 0.0400(16) Uani 1 1 d . . . . .
H4A H 0.014061 0.728794 0.338511 0.048 Uiso 1 1 calc R U . . .
H4B H 0.091443 0.721676 0.356746 0.048 Uiso 1 1 calc R U . . .
C5 C 0.0563(4) 0.69308(17) 0.3088(3) 0.066(2) Uani 1 1 d . . . . .
H5A H 0.102545 0.687345 0.302466 0.079 Uiso 1 1 calc R U . . .
H5B H 0.040843 0.676857 0.327361 0.079 Uiso 1 1 calc R U . . .
C6 C 0.0108(6) 0.6935(2) 0.2706(3) 0.108(4) Uani 1 1 d . . . . .
H6A H -0.034309 0.700650 0.276239 0.162 Uiso 1 1 calc R U . . .
H6B H 0.007188 0.672451 0.258759 0.162 Uiso 1 1 calc R U . . .
H6C H 0.028816 0.707673 0.250693 0.162 Uiso 1 1 calc R U . . .
C7 C 0.3407(4) 0.78501(19) 0.4189(2) 0.058(2) Uani 1 1 d . . . . .
H7A H 0.343168 0.763100 0.428510 0.069 Uiso 1 1 calc R U . . .
H7B H 0.293778 0.788675 0.405437 0.069 Uiso 1 1 calc R U . . .
C8 C 0.3832(8) 0.7886(3) 0.3907(4) 0.159(7) Uani 1 1 d . . . . .
H8A H 0.353057 0.789773 0.364138 0.191 Uiso 1 1 calc R U . . .
H8B H 0.406394 0.768173 0.390274 0.191 Uiso 1 1 calc R U . . .
C9 C 0.4326(5) 0.8093(3) 0.3860(3) 0.102(4) Uani 1 1 d . . . . .
H9A H 0.414767 0.825586 0.366511 0.154 Uiso 1 1 calc R U . . .
H9B H 0.470686 0.798654 0.374913 0.154 Uiso 1 1 calc R U . . .
H9C H 0.448559 0.818639 0.412940 0.154 Uiso 1 1 calc R U . . .
C10 C 0.3674(4) 0.8695(2) 0.5118(2) 0.062(2) Uani 1 1 d . . . . .
H10A H 0.371119 0.878333 0.540212 0.075 Uiso 1 1 calc R U . . .
H10B H 0.342820 0.884628 0.492468 0.075 Uiso 1 1 calc R U . . .
C11 C 0.4391(5) 0.8636(3) 0.4990(4) 0.141(6) Uani 1 1 d . . . . .
H11A H 0.458851 0.845430 0.514908 0.169 Uiso 1 1 calc R U . . .
H11B H 0.434143 0.857836 0.469206 0.169 Uiso 1 1 calc R U . . .
C12 C 0.4826(6) 0.8865(4) 0.5044(4) 0.161(7) Uani 1 1 d . . . . .
H12A H 0.467845 0.903548 0.485319 0.241 Uiso 1 1 calc R U . . .
H12B H 0.527707 0.879218 0.498817 0.241 Uiso 1 1 calc R U . . .
H12C H 0.485007 0.893981 0.533190 0.241 Uiso 1 1 calc R U . . .
C13 C -0.0968(4) 0.7579(2) 0.5160(3) 0.072(2) Uani 1 1 d . . . . .
H13A H -0.101313 0.779323 0.504689 0.086 Uiso 1 1 calc R U . . .
H13B H -0.114403 0.743470 0.493400 0.086 Uiso 1 1 calc R U . . .
C14 C -0.1387(6) 0.7552(3) 0.5487(4) 0.132(5) Uani 1 1 d . . . . .
H14A H -0.133466 0.774857 0.564851 0.159 Uiso 1 1 calc R U . . .
H14B H -0.186431 0.754557 0.535608 0.159 Uiso 1 1 calc R U . . .
C15 C -0.1313(7) 0.7320(3) 0.5761(4) 0.143(6) Uani 1 1 d . . . . .
H15A H -0.145249 0.712428 0.562112 0.215 Uiso 1 1 calc R U . . .
H15B H -0.159894 0.735991 0.598404 0.215 Uiso 1 1 calc R U . . .
H15C H -0.083494 0.730627 0.587889 0.215 Uiso 1 1 calc R U . . .
C16 C 0.1254(5) 0.7465(2) 0.5660(2) 0.076(3) Uani 1 1 d . . . . .
H16A H 0.090546 0.736495 0.581320 0.091 Uiso 1 1 calc R U . . .
H16B H 0.136626 0.767025 0.578898 0.091 Uiso 1 1 calc R U . . .
C17 C 0.1861(5) 0.7272(2) 0.5692(3) 0.099(4) Uani 1 1 d . . . . .
H17A H 0.219635 0.736871 0.552617 0.119 Uiso 1 1 calc R U . . .
H17B H 0.173974 0.706561 0.557009 0.119 Uiso 1 1 calc R U . . .
C18 C 0.2192(6) 0.7227(3) 0.6134(3) 0.125(5) Uani 1 1 d . . . . .
H18A H 0.235414 0.742865 0.624948 0.187 Uiso 1 1 calc R U . . .
H18B H 0.257869 0.708400 0.613432 0.187 Uiso 1 1 calc R U . . .
H18C H 0.185877 0.714023 0.630478 0.187 Uiso 1 1 calc R U . . .
C19 C 0.1721(3) 0.93442(16) 0.65787(19) 0.0396(16) Uani 1 1 d . . . . .
H19A H 0.165473 0.917244 0.677433 0.048 Uiso 1 1 calc R U . . .
H19B H 0.128645 0.945967 0.652207 0.048 Uiso 1 1 calc R U . . .
C20 C 0.2265(3) 0.95551(14) 0.67619(17) 0.0319(14) Uani 1 1 d . . . . .
H20A H 0.235677 0.971438 0.655399 0.038 Uiso 1 1 calc R U . . .
H20B H 0.268875 0.943437 0.683523 0.038 Uiso 1 1 calc R U . . .
C21 C 0.2065(3) 0.97154(15) 0.71489(19) 0.0390(16) Uani 1 1 d . . . . .
H21A H 0.163955 0.983114 0.707810 0.059 Uiso 1 1 calc R U . . .
H21B H 0.242657 0.985979 0.725715 0.059 Uiso 1 1 calc R U . . .
H21C H 0.199892 0.955863 0.736100 0.059 Uiso 1 1 calc R U . . .
C22 C 0.2250(4) 0.8507(2) 0.6389(3) 0.074(3) Uani 1 1 d . . . . .
H22A H 0.250639 0.849575 0.614397 0.089 Uiso 1 1 calc R U . . .
H22B H 0.250543 0.864691 0.659394 0.089 Uiso 1 1 calc R U . . .
C23 C 0.2250(7) 0.8210(3) 0.6565(6) 0.192(9) Uani 1 1 d D . . . .
H23A H 0.260610 0.821104 0.680659 0.230 Uiso 1 1 calc R U . . .
H23B H 0.240956 0.806495 0.635828 0.230 Uiso 1 1 calc R U . . .
C24 C 0.1655(8) 0.8070(5) 0.6705(7) 0.268(13) Uani 1 1 d D . . . .
H24A H 0.159696 0.814843 0.698372 0.402 Uiso 1 1 calc R U . . .
H24B H 0.170988 0.784351 0.671514 0.402 Uiso 1 1 calc R U . . .
H24C H 0.125302 0.812420 0.651232 0.402 Uiso 1 1 calc R U . . .
C25 C 0.3169(8) 1.0405(4) 0.4490(7) 0.026(4) Uani 0.5 1 d D . P A 1
H25A H 0.279734 1.055509 0.451938 0.031 Uiso 0.5 1 calc R U P A 1
H25B H 0.325541 1.040050 0.419449 0.031 Uiso 0.5 1 calc R U P A 1
C26 C 0.3793(6) 1.0500(3) 0.4755(5) 0.048(3) Uani 0.5 1 d D . P A 1
H26A H 0.365765 1.054380 0.503494 0.057 Uiso 0.5 1 calc R U P A 1
H26B H 0.393874 1.070135 0.464407 0.057 Uiso 0.5 1 calc R U P A 1
C27 C 0.4415(7) 1.0295(4) 0.4816(6) 0.067(3) Uani 0.5 1 d D . P A 1
H27A H 0.477125 1.039917 0.500284 0.100 Uiso 0.5 1 calc R U P A 1
H27B H 0.458197 1.025670 0.454707 0.100 Uiso 0.5 1 calc R U P A 1
H27C H 0.429689 1.009671 0.493946 0.100 Uiso 0.5 1 calc R U P A 1
C25B C 0.3275(8) 1.0356(4) 0.4415(7) 0.026(4) Uani 0.5 1 d D . P A 2
H25C H 0.305004 1.055126 0.448764 0.031 Uiso 0.5 1 calc R U P A 2
H25D H 0.318824 1.032789 0.411017 0.031 Uiso 0.5 1 calc R U P A 2
C26B C 0.4014(7) 1.0384(3) 0.4535(4) 0.048(3) Uani 0.5 1 d D . P A 2
H26C H 0.418420 1.056621 0.438890 0.057 Uiso 0.5 1 calc R U P A 2
H26D H 0.424132 1.019637 0.443903 0.057 Uiso 0.5 1 calc R U P A 2
C27B C 0.4213(9) 1.0423(5) 0.5000(5) 0.067(3) Uani 0.5 1 d D . P A 2
H27D H 0.470278 1.038346 0.506514 0.100 Uiso 0.5 1 calc R U P A 2
H27E H 0.395667 1.027422 0.515121 0.100 Uiso 0.5 1 calc R U P A 2
H27F H 0.410965 1.063558 0.508273 0.100 Uiso 0.5 1 calc R U P A 2
C28 C 0.3663(3) 0.95307(16) 0.4192(2) 0.0387(16) Uani 1 1 d . . . . .
H28A H 0.352178 0.930970 0.420139 0.046 Uiso 1 1 calc R U . . .
H28B H 0.382608 0.959801 0.447850 0.046 Uiso 1 1 calc R U . . .
C29 C 0.4219(3) 0.95631(17) 0.3923(2) 0.0459(18) Uani 1 1 d . . . . .
H29A H 0.462761 0.945275 0.405503 0.055 Uiso 1 1 calc R U . . .
H29B H 0.433718 0.978640 0.390347 0.055 Uiso 1 1 calc R U . . .
C30 C 0.4041(4) 0.9437(2) 0.3491(2) 0.060(2) Uani 1 1 d . . . . .
H30A H 0.390879 0.921749 0.350661 0.089 Uiso 1 1 calc R U . . .
H30B H 0.443719 0.945437 0.333518 0.089 Uiso 1 1 calc R U . . .
H30C H 0.366049 0.955644 0.334858 0.089 Uiso 1 1 calc R U . . .
C31 C -0.0038(6) 1.0365(3) 0.2267(3) 0.040(2) Uani 0.5 1 d D . P B 1
H31A H 0.040397 1.027704 0.220798 0.048 Uiso 0.5 1 calc R U P B 1
H31B H 0.001081 1.059500 0.226818 0.048 Uiso 0.5 1 calc R U P B 1
C32 C -0.0568(8) 1.0279(3) 0.1909(4) 0.053(3) Uani 0.5 1 d D . P B 1
H32A H -0.102969 1.031633 0.199046 0.064 Uiso 0.5 1 calc R U P B 1
H32B H -0.051063 1.041221 0.166581 0.064 Uiso 0.5 1 calc R U P B 1
C33 C -0.0504(11) 0.9941(4) 0.1789(5) 0.075(4) Uani 0.5 1 d D . P B 1
H33A H -0.003256 0.989757 0.173890 0.113 Uiso 0.5 1 calc R U P B 1
H33B H -0.081047 0.989742 0.153600 0.113 Uiso 0.5 1 calc R U P B 1
H33C H -0.062566 0.980758 0.201582 0.113 Uiso 0.5 1 calc R U P B 1
C31B C -0.0484(6) 1.0175(3) 0.2333(3) 0.040(2) Uani 0.5 1 d D . P B 2
H31C H -0.092262 1.028892 0.230047 0.048 Uiso 0.5 1 calc R U P B 2
H31D H -0.059127 0.995418 0.238639 0.048 Uiso 0.5 1 calc R U P B 2
C32B C -0.0208(7) 1.0186(4) 0.1925(4) 0.053(3) Uani 0.5 1 d D . P B 2
H32C H -0.009833 1.040506 0.186121 0.064 Uiso 0.5 1 calc R U P B 2
H32D H 0.022099 1.006501 0.194318 0.064 Uiso 0.5 1 calc R U P B 2
C33B C -0.0689(10) 1.0061(5) 0.1582(5) 0.075(4) Uani 0.5 1 d D . P B 2
H33D H -0.065611 1.018363 0.132918 0.113 Uiso 0.5 1 calc R U P B 2
H33E H -0.115420 1.007331 0.165814 0.113 Uiso 0.5 1 calc R U P B 2
H33F H -0.057458 0.984330 0.153084 0.113 Uiso 0.5 1 calc R U P B 2
C34 C 0.0756(19) 1.0685(3) 0.3393(7) 0.052(6) Uani 0.5 1 d D . P C 1
H34A H 0.118746 1.074635 0.355965 0.062 Uiso 0.5 1 calc R U P C 1
H34B H 0.041940 1.063263 0.358691 0.062 Uiso 0.5 1 calc R U P C 1
C35 C 0.0495(9) 1.0948(3) 0.3114(5) 0.061(3) Uani 0.5 1 d D . P C 1
H35A H 0.004837 1.088462 0.296895 0.073 Uiso 0.5 1 calc R U P C 1
H35B H 0.041190 1.112804 0.329338 0.073 Uiso 0.5 1 calc R U P C 1
C36 C 0.091(3) 1.106(2) 0.2804(15) 0.078(9) Uani 0.5 1 d D . P C 1
H36A H 0.095433 1.088881 0.260165 0.117 Uiso 0.5 1 calc R U P C 1
H36B H 0.136271 1.111271 0.293851 0.117 Uiso 0.5 1 calc R U P C 1
H36C H 0.069506 1.123748 0.266109 0.117 Uiso 0.5 1 calc R U P C 1
C34B C 0.0591(18) 1.0698(3) 0.3303(8) 0.052(6) Uani 0.5 1 d D . P C 2
H34C H 0.054805 1.067422 0.360341 0.062 Uiso 0.5 1 calc R U P C 2
H34D H 0.013713 1.074631 0.315461 0.062 Uiso 0.5 1 calc R U P C 2
C35B C 0.1096(9) 1.0951(3) 0.3233(5) 0.061(3) Uani 0.5 1 d D . P C 2
H35C H 0.098581 1.113848 0.338961 0.073 Uiso 0.5 1 calc R U P C 2
H35D H 0.155726 1.088044 0.334690 0.073 Uiso 0.5 1 calc R U P C 2
C36B C 0.111(3) 1.103(2) 0.2801(13) 0.078(9) Uani 0.5 1 d D . P C 2
H36D H 0.123065 1.085119 0.264438 0.117 Uiso 0.5 1 calc R U P C 2
H36E H 0.144307 1.119956 0.277956 0.117 Uiso 0.5 1 calc R U P C 2
H36F H 0.065487 1.110800 0.268633 0.117 Uiso 0.5 1 calc R U P C 2
C37 C 0.2526(4) 0.84540(14) 0.2908(2) 0.0422(17) Uani 1 1 d . . . . .
H37A H 0.211277 0.832412 0.284494 0.051 Uiso 1 1 calc R U . . .
H37B H 0.259122 0.849458 0.321092 0.051 Uiso 1 1 calc R U . . .
C38 C 0.3123(4) 0.82886(18) 0.2783(3) 0.059(2) Uani 1 1 d . . . . .
H38A H 0.318809 0.809256 0.294331 0.071 Uiso 1 1 calc R U . . .
H38B H 0.353364 0.841889 0.285221 0.071 Uiso 1 1 calc R U . . .
C39 C 0.3053(6) 0.8214(2) 0.2325(3) 0.110(4) Uani 1 1 d . . . . .
H39A H 0.261086 0.811367 0.224516 0.166 Uiso 1 1 calc R U . . .
H39B H 0.341956 0.807207 0.226723 0.166 Uiso 1 1 calc R U . . .
H39C H 0.308148 0.840622 0.216547 0.166 Uiso 1 1 calc R U . . .
C40 C 0.2675(4) 0.94405(19) 0.2521(2) 0.057(2) Uani 1 1 d . . . . .
H40A H 0.305927 0.929105 0.254709 0.069 Uiso 1 1 calc R U . . .
H40B H 0.271946 0.957456 0.277177 0.069 Uiso 1 1 calc R U . . .
C41 C 0.2704(4) 0.9634(2) 0.2148(3) 0.077(3) Uani 1 1 d . . . . .
H41A H 0.314539 0.974588 0.217763 0.093 Uiso 1 1 calc R U . . .
H41B H 0.270057 0.949391 0.190489 0.093 Uiso 1 1 calc R U . . .
C42 C 0.2165(4) 0.98621(18) 0.2057(2) 0.066(2) Uani 1 1 d . . . . .
H42A H 0.172739 0.975449 0.199480 0.100 Uiso 1 1 calc R U . . .
H42B H 0.225674 0.998760 0.181695 0.100 Uiso 1 1 calc R U . . .
H42C H 0.214608 0.999801 0.229935 0.100 Uiso 1 1 calc R U . . .
C43 C -0.2529(4) 0.9000(2) 0.2703(2) 0.055(2) Uani 1 1 d . . . . .
H43A H -0.243866 0.918728 0.287948 0.066 Uiso 1 1 calc R U . . .
H43B H -0.240779 0.881337 0.287556 0.066 Uiso 1 1 calc R U . . .
C44 C -0.3271(4) 0.8988(2) 0.2530(2) 0.070(3) Uani 1 1 d . . . . .
H44A H -0.354688 0.898598 0.276740 0.084 Uiso 1 1 calc R U . . .
H44B H -0.338168 0.918300 0.237290 0.084 Uiso 1 1 calc R U . . .
C45 C -0.3481(4) 0.8728(2) 0.2262(3) 0.083(3) Uani 1 1 d . . . . .
H45A H -0.327297 0.874641 0.200162 0.124 Uiso 1 1 calc R U . . .
H45B H -0.397816 0.872806 0.220025 0.124 Uiso 1 1 calc R U . . .
H45C H -0.333285 0.853277 0.240140 0.124 Uiso 1 1 calc R U . . .
C46 C -0.0514(4) 0.9013(2) 0.1852(2) 0.060(2) Uani 1 1 d . . . . .
H46A H -0.026150 0.919537 0.197743 0.072 Uiso 1 1 calc R U . . .
H46B H -0.027704 0.882294 0.196706 0.072 Uiso 1 1 calc R U . . .
C47 C -0.0496(5) 0.9019(3) 0.1421(3) 0.090(3) Uani 1 1 d . . . . .
H47A H -0.079374 0.918908 0.130073 0.108 Uiso 1 1 calc R U . . .
H47B H -0.068212 0.882005 0.130121 0.108 Uiso 1 1 calc R U . . .
C48 C 0.0200(6) 0.9065(4) 0.1299(4) 0.152(6) Uani 1 1 d . . . . .
H48A H 0.042203 0.923770 0.145870 0.228 Uiso 1 1 calc R U . . .
H48B H 0.016889 0.911231 0.100114 0.228 Uiso 1 1 calc R U . . .
H48C H 0.046686 0.887394 0.135664 0.228 Uiso 1 1 calc R U . . .
C49 C -0.2015(3) 0.79889(17) 0.3138(2) 0.0439(17) Uani 1 1 d . . . . .
H49A H -0.162157 0.788137 0.329288 0.053 Uiso 1 1 calc R U . . .
H49B H -0.185812 0.819448 0.304727 0.053 Uiso 1 1 calc R U . . .
C50 C -0.2275(4) 0.7802(2) 0.2768(2) 0.060(2) Uani 1 1 d . . . . .
H50A H -0.264899 0.791664 0.260437 0.072 Uiso 1 1 calc R U . . .
H50B H -0.246254 0.760305 0.286058 0.072 Uiso 1 1 calc R U . . .
C51 C -0.1720(4) 0.7734(2) 0.2495(2) 0.066(2) Uani 1 1 d . . . . .
H51A H -0.153704 0.792993 0.240050 0.099 Uiso 1 1 calc R U . . .
H51B H -0.191005 0.761117 0.225340 0.099 Uiso 1 1 calc R U . . .
H51C H -0.135456 0.761520 0.265427 0.099 Uiso 1 1 calc R U . . .
C52 C -0.3181(4) 0.78485(16) 0.4248(3) 0.057(2) Uani 1 1 d . . . . .
H52A H -0.347031 0.771234 0.405356 0.068 Uiso 1 1 calc R U . . .
H52B H -0.274012 0.774107 0.432096 0.068 Uiso 1 1 calc R U . . .
C53 C -0.3483(9) 0.7889(2) 0.4592(5) 0.194(9) Uani 1 1 d . . . . .
H53A H -0.310390 0.787687 0.481937 0.233 Uiso 1 1 calc R U . . .
H53B H -0.374890 0.769488 0.461348 0.233 Uiso 1 1 calc R U . . .
C54 C -0.3905(5) 0.8122(2) 0.4719(3) 0.075(3) Uani 1 1 d . . . . .
H54A H -0.377825 0.832246 0.460548 0.113 Uiso 1 1 calc R U . . .
H54B H -0.385186 0.813276 0.502405 0.113 Uiso 1 1 calc R U . . .
H54C H -0.438020 0.807422 0.461847 0.113 Uiso 1 1 calc R U . . .
C55 C -0.3683(3) 0.92055(14) 0.39846(18) 0.0301(14) Uani 1 1 d . . . . .
H55A H -0.396191 0.936489 0.410758 0.036 Uiso 1 1 calc R U . . .
H55B H -0.350989 0.905735 0.420647 0.036 Uiso 1 1 calc R U . . .
C56 C -0.4110(3) 0.90350(15) 0.36411(19) 0.0348(15) Uani 1 1 d . . . . .
H56A H -0.381116 0.890845 0.348149 0.042 Uiso 1 1 calc R U . . .
H56B H -0.435288 0.918782 0.344834 0.042 Uiso 1 1 calc R U . . .
C57 C -0.4626(3) 0.88242(16) 0.3817(2) 0.0455(17) Uani 1 1 d . . . . .
H57A H -0.438597 0.865772 0.398098 0.068 Uiso 1 1 calc R U . . .
H57B H -0.492890 0.873266 0.358765 0.068 Uiso 1 1 calc R U . . .
H57C H -0.489585 0.894638 0.399493 0.068 Uiso 1 1 calc R U . . .
C58 C -0.2830(3) 1.01574(13) 0.43272(19) 0.0296(14) Uani 1 1 d . . . . .
H58A H -0.237431 1.021426 0.425063 0.036 Uiso 1 1 calc R U . . .
H58B H -0.278876 1.011852 0.463077 0.036 Uiso 1 1 calc R U . . .
C59 C -0.3326(3) 1.04176(14) 0.42148(19) 0.0345(15) Uani 1 1 d . . . . .
H59A H -0.339926 1.043779 0.390805 0.041 Uiso 1 1 calc R U . . .
H59B H -0.312554 1.061529 0.432885 0.041 Uiso 1 1 calc R U . . .
C60 C -0.4011(4) 1.03688(18) 0.4377(2) 0.0531(19) Uani 1 1 d . . . . .
H60A H -0.421450 1.017371 0.426486 0.080 Uiso 1 1 calc R U . . .
H60B H -0.431456 1.054301 0.428909 0.080 Uiso 1 1 calc R U . . .
H60C H -0.394616 1.035805 0.468162 0.080 Uiso 1 1 calc R U . . .
C61 C -0.0974(3) 0.83859(15) 0.60195(19) 0.0387(16) Uani 1 1 d . . . . .
H61A H -0.059984 0.854053 0.605677 0.046 Uiso 1 1 calc R U . . .
H61B H -0.090720 0.825387 0.577638 0.046 Uiso 1 1 calc R U . . .
C62 C -0.0969(4) 0.81883(17) 0.6403(2) 0.052(2) Uani 1 1 d . . . . .
H62A H -0.133138 0.802854 0.635714 0.063 Uiso 1 1 calc R U . . .
H62B H -0.106843 0.832045 0.663944 0.063 Uiso 1 1 calc R U . . .
C63 C -0.0291(5) 0.8030(2) 0.6509(3) 0.094(3) Uani 1 1 d . . . . .
H63A H -0.019507 0.789660 0.627727 0.141 Uiso 1 1 calc R U . . .
H63B H -0.030471 0.790307 0.675994 0.141 Uiso 1 1 calc R U . . .
H63C H 0.006721 0.818801 0.656000 0.141 Uiso 1 1 calc R U . . .
C64 C -0.3109(4) 0.8682(2) 0.5607(3) 0.070(2) Uani 1 1 d . . . . .
H64A H -0.296104 0.846184 0.560878 0.084 Uiso 1 1 calc R U . . .
H64B H -0.340703 0.872011 0.534467 0.084 Uiso 1 1 calc R U . . .
C65 C -0.3495(5) 0.8737(3) 0.5958(3) 0.107(4) Uani 1 1 d . . . . .
H65A H -0.363609 0.895796 0.595250 0.128 Uiso 1 1 calc R U . . .
H65B H -0.391547 0.860928 0.591623 0.128 Uiso 1 1 calc R U . . .
C66 C -0.3169(6) 0.8672(3) 0.6349(3) 0.108(4) Uani 1 1 d . . . . .
H66A H -0.301008 0.845535 0.635800 0.163 Uiso 1 1 calc R U . . .
H66B H -0.348709 0.870224 0.655682 0.163 Uiso 1 1 calc R U . . .
H66C H -0.277832 0.881188 0.640891 0.163 Uiso 1 1 calc R U . . .
O1 O 0.0963(2) 0.79823(10) 0.27469(12) 0.0359(10) Uani 1 1 d . . . . .
O2 O 0.0828(2) 0.74727(9) 0.30461(13) 0.0334(10) Uani 1 1 d . . . . .
O3 O 0.3524(2) 0.80520(9) 0.45519(12) 0.0334(10) Uani 1 1 d . . . . .
O4 O 0.3300(2) 0.84039(10) 0.51065(13) 0.0409(11) Uani 1 1 d . . . . .
O5 O -0.0248(2) 0.75141(11) 0.52705(14) 0.0488(13) Uani 1 1 d . . . . .
O6 O 0.0981(2) 0.75078(10) 0.52300(13) 0.0398(11) Uani 1 1 d . . . . .
O7 O 0.1926(2) 0.92184(9) 0.61897(12) 0.0319(10) Uani 1 1 d . . . . .
O8 O 0.1615(2) 0.86453(10) 0.62627(13) 0.0439(12) Uani 1 1 d . . . . .
O9 O 0.2973(2) 1.00935(9) 0.46214(12) 0.0304(9) Uani 1 1 d D . . . .
O10 O 0.30862(19) 0.97204(9) 0.40275(11) 0.0274(9) Uani 1 1 d . . . . .
O11 O -0.0144(3) 1.02768(12) 0.26523(13) 0.0586(15) Uani 1 1 d D . . . .
O12 O 0.0873(2) 1.04134(9) 0.31353(13) 0.0393(11) Uani 1 1 d D . . . .
O13 O 0.2441(2) 0.87480(9) 0.26814(12) 0.0328(10) Uani 1 1 d . . . . .
O14 O 0.2031(2) 0.92704(9) 0.24941(12) 0.0320(10) Uani 1 1 d . . . . .
O15 O -0.2122(2) 0.90105(10) 0.23529(12) 0.0342(10) Uani 1 1 d . . . . .
O16 O -0.1181(2) 0.90162(10) 0.19693(11) 0.0322(10) Uani 1 1 d . . . . .
O17 O -0.2544(2) 0.80317(9) 0.34047(12) 0.0332(10) Uani 1 1 d . . . . .
O18 O -0.3061(2) 0.81372(10) 0.40400(13) 0.0403(11) Uani 1 1 d . . . . .
O19 O -0.31100(18) 0.93548(8) 0.38112(11) 0.0241(9) Uani 1 1 d . . . . .
O20 O -0.30805(18) 0.98775(8) 0.41008(11) 0.0238(9) Uani 1 1 d . . . . .
O21 O -0.1627(2) 0.85440(9) 0.59515(11) 0.0304(9) Uani 1 1 d . . . . .
O22 O -0.2514(2) 0.88830(10) 0.56212(13) 0.0377(10) Uani 1 1 d . . . . .
P1 P 0.08138(8) 0.78288(3) 0.31733(5) 0.0252(3) Uani 1 1 d . . . . .
P2 P 0.29308(8) 0.82586(4) 0.46928(5) 0.0282(4) Uani 1 1 d . . . . .
P3 P 0.03328(9) 0.77135(4) 0.50989(5) 0.0341(4) Uani 1 1 d . . . . .
P4 P 0.15262(8) 0.89379(3) 0.59620(4) 0.0252(3) Uani 1 1 d . . . . .
P5 P 0.25646(7) 0.98481(3) 0.43248(4) 0.0209(3) Uani 1 1 d . . . . .
P6 P 0.03680(8) 1.01388(3) 0.30104(4) 0.0257(3) Uani 1 1 d . . . . .
P7 P 0.19354(8) 0.90038(3) 0.28139(5) 0.0255(3) Uani 1 1 d . . . . .
P8 P -0.13152(8) 0.90041(4) 0.24441(4) 0.0269(3) Uani 1 1 d . . . . .
P9 P -0.23897(8) 0.82047(3) 0.38384(5) 0.0272(3) Uani 1 1 d . . . . .
P10 P -0.26139(7) 0.95806(3) 0.40855(4) 0.0210(3) Uani 1 1 d . . . . .
P11 P -0.18016(8) 0.87471(4) 0.55425(5) 0.0275(3) Uani 1 1 d . . . . .
S1 S -0.01042(8) 0.79287(4) 0.33295(5) 0.0319(4) Uani 1 1 d . . . . .
S2 S 0.16203(8) 0.79505(4) 0.35660(5) 0.0389(4) Uani 1 1 d . . . . .
S3 S 0.22195(8) 0.79689(3) 0.48825(5) 0.0296(3) Uani 1 1 d . . . . .
S4 S 0.26400(8) 0.85756(4) 0.42653(5) 0.0356(4) Uani 1 1 d . . . . .
S5 S 0.03946(9) 0.81262(4) 0.53964(5) 0.0356(4) Uani 1 1 d . . . . .
S6 S 0.01744(8) 0.77352(4) 0.44823(5) 0.0349(4) Uani 1 1 d . . . . .
S7 S 0.20054(8) 0.88769(4) 0.54541(4) 0.0290(3) Uani 1 1 d . . . . .
S8 S -0.05195(8) 1.10061(3) 0.41237(4) 0.0272(3) Uani 1 1 d . . . . .
S9 S 0.23350(7) 0.95080(3) 0.47102(4) 0.0213(3) Uani 1 1 d . . . . .
S10 S 0.18243(7) 1.00559(3) 0.39498(4) 0.0241(3) Uani 1 1 d . . . . .
S11 S 0.09482(8) 0.98108(3) 0.27890(4) 0.0272(3) Uani 1 1 d . . . . .
S12 S -0.01912(7) 1.00301(3) 0.34698(4) 0.0253(3) Uani 1 1 d . . . . .
S13 S 0.22459(8) 0.91290(4) 0.34023(5) 0.0287(3) Uani 1 1 d . . . . .
S14 S 0.09750(8) 0.88482(3) 0.27098(4) 0.0266(3) Uani 1 1 d . . . . .
S15 S -0.10104(8) 0.93952(4) 0.27490(5) 0.0319(4) Uani 1 1 d . . . . .
S16 S -0.09574(8) 0.86141(3) 0.27109(4) 0.0314(4) Uani 1 1 d . . . . .
S17 S -0.23961(8) 0.86652(3) 0.37370(4) 0.0278(3) Uani 1 1 d . . . . .
S18 S -0.15546(9) 0.80310(3) 0.41523(5) 0.0345(4) Uani 1 1 d . . . . .
S19 S -0.23569(7) 0.94085(3) 0.46598(4) 0.0237(3) Uani 1 1 d . . . . .
S20 S -0.18441(7) 0.96711(3) 0.37487(4) 0.0221(3) Uani 1 1 d . . . . .
S21 S -0.18515(11) 0.84676(4) 0.50466(5) 0.0504(5) Uani 1 1 d . . . . .
S22 S 0.11435(9) 1.09048(4) 0.44530(5) 0.0402(4) Uani 1 1 d . . . . .
Pt3 Pt 0.50195(2) 0.10881(2) 0.08078(2) 0.01534(5) Uani 1 1 d . . . . .
Pt4 Pt 0.500000 0.000000 0.000000 0.01479(6) Uani 1 2 d S . P . .
Ag23 Ag 0.49739(2) 0.16467(2) 0.12090(2) 0.02575(10) Uani 1 1 d . . . . .
Ag24 Ag 0.48673(2) 0.16026(2) 0.03031(2) 0.02383(10) Uani 1 1 d . . . . .
Ag25 Ag 0.37578(2) 0.13725(2) 0.07466(2) 0.02178(9) Uani 1 1 d . . . . .
Ag26 Ag 0.43484(2) 0.10925(2) 0.15117(2) 0.02190(9) Uani 1 1 d . . . . .
Ag27 Ag 0.58331(2) 0.11411(2) 0.15652(2) 0.02370(10) Uani 1 1 d . . . . .
Ag28 Ag 0.61444(2) 0.14601(2) 0.08093(2) 0.02477(10) Uani 1 1 d . . . . .
Ag29 Ag 0.56670(2) 0.10813(2) 0.00815(2) 0.02143(9) Uani 1 1 d . . . . .
Ag30 Ag 0.41914(2) 0.10235(2) 0.00465(2) 0.02163(9) Uani 1 1 d . . . . .
Ag31 Ag 0.39033(2) 0.07136(2) 0.08041(2) 0.01986(9) Uani 1 1 d . . . . .
Ag32 Ag 0.51701(2) 0.05587(2) 0.12922(2) 0.01868(9) Uani 1 1 d . . . . .
Ag33 Ag 0.62748(2) 0.08007(2) 0.08794(2) 0.02053(9) Uani 1 1 d . . . . .
Ag34 Ag 0.50767(2) 0.05479(2) 0.03947(2) 0.01760(9) Uani 1 1 d . . . . .
Ag35 Ag 0.37689(2) 0.02585(2) 0.01227(2) 0.02058(9) Uani 1 1 d . . . . .
Ag36 Ag 0.46307(2) -0.00037(2) 0.08196(2) 0.02202(9) Uani 1 1 d . . . . .
Ag37 Ag 0.60930(2) 0.00949(2) 0.06127(2) 0.02083(9) Uani 1 1 d . . . . .
Ag38 Ag 0.39262(2) -0.04086(2) 0.01735(2) 0.02306(9) Uani 1 1 d . . . . .
Ag39 Ag 0.54164(2) -0.04965(2) 0.04944(2) 0.02035(9) Uani 1 1 d . . . . .
Ag40 Ag 0.39157(3) 0.20558(2) 0.07003(2) 0.03172(11) Uani 1 1 d . . . . .
Ag41 Ag 0.34761(2) 0.16157(2) -0.01600(2) 0.02783(10) Uani 1 1 d . . . . .
Ag42 Ag 0.38163(2) 0.04518(2) 0.16370(2) 0.02695(10) Uani 1 1 d . . . . .
Ag43 Ag 0.51430(2) 0.07386(2) 0.21804(2) 0.02655(10) Uani 1 1 d . . . . .
Ag44 Ag 0.71660(2) 0.11573(2) 0.03508(2) 0.02874(10) Uani 1 1 d . . . . .
C67 C 0.4044(3) 0.27886(15) 0.1923(2) 0.0485(18) Uani 1 1 d . . . . .
H67A H 0.400460 0.271916 0.221106 0.058 Uiso 1 1 calc R U . . .
H67B H 0.360552 0.274681 0.175141 0.058 Uiso 1 1 calc R U . . .
C68 C 0.4201(4) 0.31249(15) 0.1918(2) 0.0503(19) Uani 1 1 d . . . . .
H68A H 0.380888 0.324124 0.200708 0.060 Uiso 1 1 calc R U . . .
H68B H 0.425040 0.318770 0.162884 0.060 Uiso 1 1 calc R U . . .
C69 C 0.4829(4) 0.32184(18) 0.2190(2) 0.061(2) Uani 1 1 d . . . . .
H69A H 0.476558 0.318042 0.248219 0.092 Uiso 1 1 calc R U . . .
H69B H 0.491844 0.344038 0.215039 0.092 Uiso 1 1 calc R U . . .
H69C H 0.521705 0.309581 0.211695 0.092 Uiso 1 1 calc R U . . .
C70 C 0.5139(4) 0.2187(2) 0.2504(2) 0.075(3) Uani 1 1 d . . . . .
H70A H 0.555611 0.211485 0.238879 0.090 Uiso 1 1 calc R U . . .
H70B H 0.518884 0.241279 0.255965 0.090 Uiso 1 1 calc R U . . .
C71 C 0.5087(7) 0.2029(3) 0.2884(3) 0.108(4) Uani 1 1 d . . . . .
H71A H 0.548533 0.208748 0.308290 0.129 Uiso 1 1 calc R U . . .
H71B H 0.511570 0.180269 0.283316 0.129 Uiso 1 1 calc R U . . .
C72 C 0.4488(8) 0.2088(5) 0.3076(4) 0.203(9) Uani 1 1 d . . . . .
H72A H 0.445218 0.231132 0.313087 0.304 Uiso 1 1 calc R U . . .
H72B H 0.450927 0.197239 0.333815 0.304 Uiso 1 1 calc R U . . .
H72C H 0.408825 0.201992 0.288983 0.304 Uiso 1 1 calc R U . . .
C73 C 0.1766(3) 0.21509(16) 0.0972(2) 0.0436(17) Uani 1 1 d . . . . .
H73A H 0.184256 0.236973 0.089280 0.052 Uiso 1 1 calc R U . . .
H73B H 0.218504 0.207426 0.113811 0.052 Uiso 1 1 calc R U . . .
C74 C 0.1184(4) 0.21347(18) 0.1225(3) 0.060(2) Uani 1 1 d . . . . .
H74A H 0.076808 0.221443 0.105855 0.072 Uiso 1 1 calc R U . . .
H74B H 0.127921 0.226989 0.147290 0.072 Uiso 1 1 calc R U . . .
C75 C 0.1057(5) 0.1806(2) 0.1364(3) 0.085(3) Uani 1 1 d . . . . .
H75A H 0.095534 0.167234 0.111908 0.128 Uiso 1 1 calc R U . . .
H75B H 0.067009 0.180458 0.152839 0.128 Uiso 1 1 calc R U . . .
H75C H 0.146431 0.172814 0.153393 0.128 Uiso 1 1 calc R U . . .
C76 C 0.1279(4) 0.13504(18) 0.0088(2) 0.054(2) Uani 1 1 d . . . . .
H76A H 0.098658 0.140288 0.030722 0.065 Uiso 1 1 calc R U . . .
H76B H 0.153688 0.115859 0.017233 0.065 Uiso 1 1 calc R U . . .
C77 C 0.0855(4) 0.1300(2) -0.0312(2) 0.066(2) Uani 1 1 d . . . . .
H77A H 0.058635 0.110673 -0.029265 0.079 Uiso 1 1 calc R U . . .
H77B H 0.115716 0.126909 -0.053260 0.079 Uiso 1 1 calc R U . . .
C78 C 0.0380(5) 0.1562(3) -0.0433(3) 0.107(4) Uani 1 1 d . . . . .
H78A H 0.011022 0.160818 -0.020414 0.160 Uiso 1 1 calc R U . . .
H78B H 0.007512 0.150422 -0.068132 0.160 Uiso 1 1 calc R U . . .
H78C H 0.064304 0.174730 -0.049323 0.160 Uiso 1 1 calc R U . . .
C79 C 0.3752(6) 0.2475(2) -0.0778(3) 0.094(4) Uani 1 1 d . . . . .
H79A H 0.410063 0.248421 -0.097493 0.113 Uiso 1 1 calc R U . . .
H79B H 0.347867 0.228442 -0.084155 0.113 Uiso 1 1 calc R U . . .
C80 C 0.3339(8) 0.2724(3) -0.0846(4) 0.189(8) Uani 1 1 d . . . . .
H80A H 0.362123 0.291480 -0.080300 0.227 Uiso 1 1 calc R U . . .
H80B H 0.301732 0.272449 -0.063230 0.227 Uiso 1 1 calc R U . . .
C81 C 0.2933(7) 0.2746(3) -0.1264(4) 0.177(7) Uani 1 1 d . . . . .
H81A H 0.302541 0.294582 -0.139318 0.266 Uiso 1 1 calc R U . . .
H81B H 0.244655 0.273095 -0.123272 0.266 Uiso 1 1 calc R U . . .
H81C H 0.306192 0.257525 -0.144067 0.266 Uiso 1 1 calc R U . . .
C82 C 0.5851(6) 0.2529(3) -0.0315(3) 0.107(4) Uani 1 1 d . . . . .
H82A H 0.615823 0.240945 -0.010965 0.128 Uiso 1 1 calc R U . . .
H82B H 0.566763 0.270745 -0.016774 0.128 Uiso 1 1 calc R U . . .
C83 C 0.6242(7) 0.2647(4) -0.0647(3) 0.162(8) Uani 1 1 d . . . . .
H83A H 0.664375 0.276448 -0.051867 0.194 Uiso 1 1 calc R U . . .
H83B H 0.640956 0.246818 -0.079951 0.194 Uiso 1 1 calc R U . . .
C84 C 0.5862(10) 0.2836(4) -0.0923(5) 0.247(11) Uani 1 1 d . . . . .
H84A H 0.537615 0.279963 -0.090419 0.371 Uiso 1 1 calc R U . . .
H84B H 0.596462 0.279075 -0.120587 0.371 Uiso 1 1 calc R U . . .
H84C H 0.597094 0.305474 -0.085599 0.371 Uiso 1 1 calc R U . . .
C85 C 0.7055(3) -0.05579(14) 0.14285(18) 0.0317(14) Uani 1 1 d . . . . .
H85A H 0.696429 -0.071904 0.163410 0.038 Uiso 1 1 calc R U . . .
H85B H 0.666410 -0.041237 0.139430 0.038 Uiso 1 1 calc R U . . .
C86 C 0.7697(3) -0.03852(14) 0.15753(17) 0.0293(13) Uani 1 1 d . . . . .
H86A H 0.780887 -0.023966 0.135557 0.035 Uiso 1 1 calc R U . . .
H86B H 0.807815 -0.053480 0.163024 0.035 Uiso 1 1 calc R U . . .
C87 C 0.7612(3) -0.02031(14) 0.19721(18) 0.0357(15) Uani 1 1 d . . . . .
H87A H 0.723813 -0.005348 0.191660 0.054 Uiso 1 1 calc R U . . .
H87B H 0.803557 -0.009106 0.206341 0.054 Uiso 1 1 calc R U . . .
H87C H 0.750933 -0.034777 0.219087 0.054 Uiso 1 1 calc R U . . .
C88 C 0.7678(3) -0.13712(17) 0.1264(2) 0.0485(18) Uani 1 1 d . . . . .
H88A H 0.785670 -0.138819 0.099104 0.058 Uiso 1 1 calc R U . . .
H88B H 0.794953 -0.121113 0.142921 0.058 Uiso 1 1 calc R U . . .
C89 C 0.7761(6) -0.1662(2) 0.1473(5) 0.122(5) Uani 1 1 d . . . . .
H89A H 0.818476 -0.175246 0.138797 0.146 Uiso 1 1 calc R U . . .
H89B H 0.786118 -0.161027 0.177211 0.146 Uiso 1 1 calc R U . . .
C90 C 0.7339(8) -0.1881(3) 0.1455(6) 0.197(9) Uani 1 1 d . . . . .
H90A H 0.740996 -0.200357 0.171261 0.295 Uiso 1 1 calc R U . . .
H90B H 0.740206 -0.201535 0.121749 0.295 Uiso 1 1 calc R U . . .
H90C H 0.687506 -0.179650 0.142241 0.295 Uiso 1 1 calc R U . . .
C91 C 0.2911(4) 0.16173(15) 0.2200(2) 0.0516(19) Uani 1 1 d . . . . .
H91A H 0.335350 0.170336 0.213655 0.062 Uiso 1 1 calc R U . . .
H91B H 0.264689 0.155783 0.193278 0.062 Uiso 1 1 calc R U . . .
C92 C 0.2559(8) 0.1845(2) 0.2391(4) 0.170(8) Uani 1 1 d D . . . .
H92A H 0.227593 0.194926 0.215892 0.204 Uiso 1 1 calc R U . . .
H92B H 0.291200 0.199853 0.249414 0.204 Uiso 1 1 calc R U . . .
C93 C 0.2135(8) 0.1826(3) 0.2708(4) 0.171(8) Uani 1 1 d D . . . .
H93A H 0.165848 0.184917 0.258896 0.257 Uiso 1 1 calc R U . . .
H93B H 0.225246 0.199205 0.291137 0.257 Uiso 1 1 calc R U . . .
H93C H 0.219597 0.162296 0.284629 0.257 Uiso 1 1 calc R U . . .
C94 C 0.2848(4) 0.0657(2) 0.2712(3) 0.071(2) Uani 1 1 d . . . . .
H94A H 0.246883 0.080762 0.271766 0.085 Uiso 1 1 calc R U . . .
H94B H 0.274202 0.052079 0.246704 0.085 Uiso 1 1 calc R U . . .
C95 C 0.2899(6) 0.0472(3) 0.3083(4) 0.121(5) Uani 1 1 d . . . . .
H95A H 0.281099 0.061291 0.331295 0.145 Uiso 1 1 calc R U . . .
H95B H 0.251480 0.032213 0.304819 0.145 Uiso 1 1 calc R U . . .
C96 C 0.3470(7) 0.0303(3) 0.3221(4) 0.141(6) Uani 1 1 d . . . . .
H96A H 0.361225 0.017946 0.299114 0.212 Uiso 1 1 calc R U . . .
H96B H 0.336863 0.016355 0.344603 0.212 Uiso 1 1 calc R U . . .
H96C H 0.383874 0.044548 0.332520 0.212 Uiso 1 1 calc R U . . .
C97 C 0.5971(4) 0.1098(3) 0.3106(2) 0.087(3) Uani 1 1 d . . . . .
H97A H 0.567461 0.125188 0.294532 0.104 Uiso 1 1 calc R U . . .
H97B H 0.576442 0.088996 0.305032 0.104 Uiso 1 1 calc R U . . .
C98 C 0.5970(5) 0.1163(3) 0.3526(3) 0.111(4) Uani 1 1 d . . . . .
H98A H 0.612812 0.137919 0.358426 0.133 Uiso 1 1 calc R U . . .
H98B H 0.628462 0.101980 0.369326 0.133 Uiso 1 1 calc R U . . .
C99 C 0.5234(6) 0.1123(4) 0.3648(4) 0.161(7) Uani 1 1 d . . . . .
H99A H 0.493532 0.128158 0.350597 0.242 Uiso 1 1 calc R U . . .
H99B H 0.524017 0.114658 0.394969 0.242 Uiso 1 1 calc R U . . .
H99C H 0.506276 0.091521 0.356455 0.242 Uiso 1 1 calc R U . . .
C100 C 0.7858(3) 0.11205(17) 0.21637(19) 0.0401(16) Uani 1 1 d . . . . .
H10C H 0.772989 0.130831 0.199496 0.048 Uiso 1 1 calc R U . . .
H10D H 0.773604 0.093414 0.199082 0.048 Uiso 1 1 calc R U . . .
C101 C 0.8615(4) 0.1123(2) 0.2304(2) 0.058(2) Uani 1 1 d . . . . .
H10E H 0.872777 0.094817 0.250047 0.069 Uiso 1 1 calc R U . . .
H10F H 0.873833 0.131961 0.245308 0.069 Uiso 1 1 calc R U . . .
C102 C 0.9024(4) 0.1091(2) 0.1938(3) 0.080(3) Uani 1 1 d . . . . .
H10G H 0.889986 0.089656 0.178982 0.121 Uiso 1 1 calc R U . . .
H10H H 0.951103 0.108842 0.203855 0.121 Uiso 1 1 calc R U . . .
H10I H 0.892526 0.126786 0.174914 0.121 Uiso 1 1 calc R U . . .
C103 C 0.7452(4) 0.21595(15) 0.1713(2) 0.0431(17) Uani 1 1 d . . . . .
H10J H 0.696434 0.220221 0.162510 0.052 Uiso 1 1 calc R U . . .
H10K H 0.772613 0.232712 0.160389 0.052 Uiso 1 1 calc R U . . .
C104 C 0.7580(4) 0.21502(16) 0.2180(2) 0.0499(19) Uani 1 1 d . . . . .
H10L H 0.807060 0.211228 0.226545 0.060 Uiso 1 1 calc R U . . .
H10M H 0.731966 0.197612 0.228589 0.060 Uiso 1 1 calc R U . . .
C105 C 0.7371(5) 0.2452(2) 0.2367(3) 0.074(3) Uani 1 1 d . . . . .
H10N H 0.765109 0.262212 0.227780 0.111 Uiso 1 1 calc R U . . .
H10O H 0.743748 0.243587 0.267162 0.111 Uiso 1 1 calc R U . . .
H10P H 0.689009 0.249318 0.227473 0.111 Uiso 1 1 calc R U . . .
C106 C 0.8332(4) 0.20253(18) 0.0516(2) 0.0519(19) Uani 1 1 d . . . . .
H10Q H 0.854151 0.223348 0.049565 0.062 Uiso 1 1 calc R U . . .
H10R H 0.788899 0.202625 0.033853 0.062 Uiso 1 1 calc R U . . .
C107 C 0.8777(5) 0.1790(2) 0.0358(3) 0.073(2) Uani 1 1 d . . . . .
H10S H 0.852985 0.158909 0.033241 0.088 Uiso 1 1 calc R U . . .
H10T H 0.887382 0.185233 0.007623 0.088 Uiso 1 1 calc R U . . .
C108 C 0.9421(5) 0.1743(3) 0.0616(3) 0.103(4) Uani 1 1 d . . . . .
H10U H 0.966470 0.194177 0.065231 0.154 Uiso 1 1 calc R U . . .
H10V H 0.969878 0.159289 0.048131 0.154 Uiso 1 1 calc R U . . .
H10W H 0.933374 0.166260 0.088875 0.154 Uiso 1 1 calc R U . . .
C109 C 0.8813(3) 0.08057(15) 0.0732(2) 0.0399(16) Uani 1 1 d . . . . .
H101 H 0.899138 0.098186 0.090928 0.048 Uiso 1 1 calc R U . . .
H102 H 0.859277 0.089384 0.046686 0.048 Uiso 1 1 calc R U . . .
C110 C 0.9391(4) 0.06085(19) 0.0641(3) 0.062(2) Uani 1 1 d . . . . .
H11C H 0.921887 0.042791 0.046962 0.075 Uiso 1 1 calc R U . . .
H11D H 0.963259 0.052840 0.090454 0.075 Uiso 1 1 calc R U . . .
C111 C 0.9882(4) 0.0796(2) 0.0409(3) 0.075(3) Uani 1 1 d . . . . .
H11E H 0.963639 0.088389 0.015541 0.112 Uiso 1 1 calc R U . . .
H11F H 1.024796 0.065988 0.033514 0.112 Uiso 1 1 calc R U . . .
H11G H 1.007819 0.096537 0.058773 0.112 Uiso 1 1 calc R U . . .
C112 C 0.7898(3) -0.01521(14) 0.0441(2) 0.0359(15) Uani 1 1 d . . . . .
H11H H 0.776960 -0.010202 0.014314 0.043 Uiso 1 1 calc R U . . .
H11I H 0.748497 -0.022403 0.056001 0.043 Uiso 1 1 calc R U . . .
C113 C 0.8434(4) -0.04027(18) 0.0483(3) 0.065(2) Uani 1 1 d . . . . .
H11J H 0.860336 -0.042921 0.078111 0.078 Uiso 1 1 calc R U . . .
H11K H 0.822667 -0.060228 0.038096 0.078 Uiso 1 1 calc R U . . .
C114 C 0.8981(5) -0.0334(2) 0.0263(4) 0.102(4) Uani 1 1 d . . . . .
H11L H 0.883335 -0.034770 -0.003643 0.153 Uiso 1 1 calc R U . . .
H11M H 0.934909 -0.048399 0.033738 0.153 Uiso 1 1 calc R U . . .
H11N H 0.914448 -0.012311 0.033215 0.153 Uiso 1 1 calc R U . . .
C115 C 0.5828(4) 0.16348(16) -0.11245(19) 0.0424(17) Uani 1 1 d . . . . .
H11O H 0.584049 0.178174 -0.088784 0.051 Uiso 1 1 calc R U . . .
H11P H 0.543621 0.149242 -0.111158 0.051 Uiso 1 1 calc R U . . .
C116 C 0.5741(4) 0.18112(17) -0.1524(2) 0.054(2) Uani 1 1 d . . . . .
H11Q H 0.574252 0.166317 -0.175865 0.065 Uiso 1 1 calc R U . . .
H11R H 0.613143 0.195479 -0.153290 0.065 Uiso 1 1 calc R U . . .
C117 C 0.5087(5) 0.1996(2) -0.1576(2) 0.078(3) Uani 1 1 d . . . . .
H11S H 0.469738 0.185347 -0.159215 0.118 Uiso 1 1 calc R U . . .
H11T H 0.506477 0.211901 -0.183316 0.118 Uiso 1 1 calc R U . . .
H11U H 0.507354 0.213632 -0.133827 0.118 Uiso 1 1 calc R U . . .
C118 C 0.7961(4) 0.1276(2) -0.0833(3) 0.071(2) Uani 1 1 d . . . . .
H11V H 0.794883 0.146873 -0.066520 0.085 Uiso 1 1 calc R U . . .
H11W H 0.835575 0.115134 -0.071171 0.085 Uiso 1 1 calc R U . . .
C119 C 0.8064(6) 0.1359(3) -0.1240(4) 0.121(4) Uani 1 1 d . . . . .
H111 H 0.775454 0.153492 -0.132642 0.145 Uiso 1 1 calc R U . . .
H112 H 0.853631 0.143836 -0.123464 0.145 Uiso 1 1 calc R U . . .
C120 C 0.7973(6) 0.1141(3) -0.1533(3) 0.118(4) Uani 1 1 d . . . . .
H12D H 0.823768 0.095558 -0.144162 0.177 Uiso 1 1 calc R U . . .
H12E H 0.812432 0.122005 -0.179145 0.177 Uiso 1 1 calc R U . . .
H12F H 0.748797 0.108677 -0.158148 0.177 Uiso 1 1 calc R U . . .
C121 C 0.1724(3) 0.05802(14) 0.11344(18) 0.0317(14) Uani 1 1 d . . . . .
H12G H 0.139504 0.053267 0.088816 0.038 Uiso 1 1 calc R U . . .
H12H H 0.196259 0.077638 0.108065 0.038 Uiso 1 1 calc R U . . .
C122 C 0.1357(3) 0.06148(15) 0.1512(2) 0.0382(16) Uani 1 1 d . . . . .
H12I H 0.169325 0.061406 0.176374 0.046 Uiso 1 1 calc R U . . .
H12J H 0.104883 0.043471 0.153043 0.046 Uiso 1 1 calc R U . . .
C123 C 0.0946(4) 0.09125(19) 0.1502(2) 0.064(2) Uani 1 1 d . . . . .
H12K H 0.125322 0.109187 0.150149 0.096 Uiso 1 1 calc R U . . .
H12L H 0.069865 0.092206 0.174747 0.096 Uiso 1 1 calc R U . . .
H12M H 0.062030 0.091650 0.124953 0.096 Uiso 1 1 calc R U . . .
C124 C 0.1964(3) -0.03426(14) 0.0817(2) 0.0392(16) Uani 1 1 d . . . . .
H12N H 0.200528 -0.031443 0.112266 0.047 Uiso 1 1 calc R U . . .
H12O H 0.226027 -0.051851 0.075402 0.047 Uiso 1 1 calc R U . . .
C125 C 0.1238(4) -0.04104(18) 0.0653(3) 0.061(2) Uani 1 1 d . . . . .
H12P H 0.119659 -0.042032 0.034563 0.073 Uiso 1 1 calc R U . . .
H12Q H 0.110691 -0.061617 0.075728 0.073 Uiso 1 1 calc R U . . .
C126 C 0.0768(5) -0.0170(2) 0.0782(4) 0.110(4) Uani 1 1 d . . . . .
H12R H 0.083574 -0.014721 0.108525 0.165 Uiso 1 1 calc R U . . .
H12S H 0.029644 -0.023307 0.069449 0.165 Uiso 1 1 calc R U . . .
H12T H 0.086057 0.002897 0.065112 0.165 Uiso 1 1 calc R U . . .
C127 C 0.6102(3) -0.00941(16) 0.25906(19) 0.0417(16) Uani 1 1 d . . . . .
H12U H 0.604779 0.013375 0.255195 0.050 Uiso 1 1 calc R U . . .
H12V H 0.650951 -0.016067 0.246166 0.050 Uiso 1 1 calc R U . . .
C128 C 0.6192(4) -0.01702(17) 0.30451(19) 0.0465(17) Uani 1 1 d . . . . .
H12W H 0.620929 -0.039943 0.307868 0.056 Uiso 1 1 calc R U . . .
H121 H 0.663403 -0.008498 0.317071 0.056 Uiso 1 1 calc R U . . .
C129 C 0.5644(4) -0.0046(2) 0.3272(2) 0.072(3) Uani 1 1 d . . . . .
H122 H 0.565146 0.018269 0.326342 0.108 Uiso 1 1 calc R U . . .
H123 H 0.571441 -0.011545 0.356249 0.108 Uiso 1 1 calc R U . . .
H124 H 0.520205 -0.012096 0.314197 0.108 Uiso 1 1 calc R U . . .
C130 C 0.4654(4) -0.06457(15) 0.1726(2) 0.0473(19) Uani 1 1 d . . . . .
H13C H 0.452571 -0.062727 0.142159 0.057 Uiso 1 1 calc R U . . .
H13D H 0.515355 -0.067623 0.177626 0.057 Uiso 1 1 calc R U . . .
C131 C 0.4311(6) -0.09076(19) 0.1884(3) 0.090(3) Uani 1 1 d . . . . .
H13E H 0.445032 -0.109617 0.173882 0.108 Uiso 1 1 calc R U . . .
H13F H 0.381588 -0.087973 0.180332 0.108 Uiso 1 1 calc R U . . .
C132 C 0.4412(5) -0.09702(19) 0.2328(3) 0.089(3) Uani 1 1 d . . . . .
H13G H 0.489434 -0.101426 0.241272 0.134 Uiso 1 1 calc R U . . .
H13H H 0.413682 -0.115075 0.238998 0.134 Uiso 1 1 calc R U . . .
H13I H 0.427179 -0.078802 0.247951 0.134 Uiso 1 1 calc R U . . .
O23 O 0.4593(2) 0.26208(9) 0.17553(13) 0.0361(10) Uani 1 1 d . . . . .
O24 O 0.4556(3) 0.21366(11) 0.21959(13) 0.0486(12) Uani 1 1 d . . . . .
O25 O 0.1619(2) 0.19610(10) 0.05996(13) 0.0361(10) Uani 1 1 d . . . . .
O26 O 0.1742(2) 0.16018(11) 0.00371(13) 0.0419(11) Uani 1 1 d . . . . .
O27 O 0.4097(3) 0.24495(10) -0.03588(13) 0.0458(12) Uani 1 1 d . . . . .
O28 O 0.5307(3) 0.23362(11) -0.04839(13) 0.0521(14) Uani 1 1 d . . . . .
O29 O 0.7148(2) -0.07036(9) 0.10289(11) 0.0277(9) Uani 1 1 d . . . . .
O30 O 0.6970(2) -0.12715(9) 0.11989(12) 0.0301(9) Uani 1 1 d . . . . .
O31 O 0.3035(2) 0.13411(9) 0.24587(12) 0.0349(10) Uani 1 1 d . . . . .
O32 O 0.3476(2) 0.08272(9) 0.26720(12) 0.0363(10) Uani 1 1 d . . . . .
O33 O 0.6612(2) 0.11010(11) 0.29553(12) 0.0398(11) Uani 1 1 d . . . . .
O34 O 0.7502(2) 0.11166(10) 0.25287(12) 0.0344(10) Uani 1 1 d . . . . .
O35 O 0.7642(2) 0.18593(10) 0.15526(13) 0.0365(10) Uani 1 1 d . . . . .
O36 O 0.8215(2) 0.19688(10) 0.09434(14) 0.0415(11) Uani 1 1 d . . . . .
O37 O 0.8298(2) 0.06426(9) 0.09388(13) 0.0332(10) Uani 1 1 d . . . . .
O38 O 0.81759(19) 0.01204(9) 0.06607(12) 0.0301(9) Uani 1 1 d . . . . .
O39 O 0.6456(2) 0.14563(9) -0.10936(12) 0.0354(10) Uani 1 1 d . . . . .
O40 O 0.7344(2) 0.11006(10) -0.07985(13) 0.0392(11) Uani 1 1 d . . . . .
O41 O 0.2212(2) 0.03281(9) 0.12091(12) 0.0281(9) Uani 1 1 d . . . . .
O42 O 0.2173(2) -0.00597(9) 0.06191(12) 0.0294(9) Uani 1 1 d . . . . .
O43 O 0.5502(2) -0.02533(9) 0.23918(11) 0.0282(9) Uani 1 1 d . . . . .
O44 O 0.4462(2) -0.03600(8) 0.19338(11) 0.0266(9) Uani 1 1 d . . . . .
P12 P 0.45792(9) 0.22516(4) 0.17307(5) 0.0296(4) Uani 1 1 d . . . . .
P13 P 0.21799(8) 0.17556(4) 0.04238(5) 0.0294(4) Uani 1 1 d . . . . .
P14 P 0.46984(9) 0.22118(4) -0.02520(5) 0.0301(4) Uani 1 1 d . . . . .
P15 P 0.67359(8) -0.10047(3) 0.08774(4) 0.0236(3) Uani 1 1 d . . . . .
P16 P 0.35009(8) 0.10730(3) 0.23126(5) 0.0267(3) Uani 1 1 d . . . . .
P17 P 0.66945(8) 0.11055(4) 0.24704(4) 0.0272(3) Uani 1 1 d . . . . .
P18 P 0.75642(8) 0.17914(4) 0.10703(5) 0.0300(4) Uani 1 1 d . . . . .
P19 P 0.77401(8) 0.04240(3) 0.07032(5) 0.0261(3) Uani 1 1 d . . . . .
P20 P 0.66732(8) 0.12612(4) -0.06848(5) 0.0291(4) Uani 1 1 d . . . . .
P21 P 0.26420(7) 0.01891(3) 0.08676(4) 0.0214(3) Uani 1 1 d . . . . .
P22 P 0.49914(8) -0.00928(3) 0.20443(4) 0.0216(3) Uani 1 1 d . . . . .
S23 S 0.54375(9) 0.21399(4) 0.15099(5) 0.0370(4) Uani 1 1 d . . . . .
S24 S 0.37063(9) 0.20877(4) 0.14406(5) 0.0363(4) Uani 1 1 d . . . . .
S25 S 0.28399(8) 0.20357(3) 0.01691(5) 0.0296(3) Uani 1 1 d . . . . .
S26 S 0.25456(8) 0.14485(4) 0.08484(5) 0.0355(4) Uani 1 1 d . . . . .
S27 S 0.49525(9) 0.22299(4) 0.03620(5) 0.0351(4) Uani 1 1 d . . . . .
S28 S 0.44847(8) 0.17935(3) -0.05069(5) 0.0306(3) Uani 1 1 d . . . . .
S29 S 0.29360(8) 0.10871(3) -0.03222(4) 0.0262(3) Uani 1 1 d . . . . .
S30 S 0.57357(8) -0.09762(3) 0.08996(4) 0.0262(3) Uani 1 1 d . . . . .
S31 S 0.30769(8) 0.09155(4) 0.17615(5) 0.0314(4) Uani 1 1 d . . . . .
S32 S 0.44579(8) 0.12242(3) 0.23236(5) 0.0295(3) Uani 1 1 d . . . . .
S33 S 0.64034(8) 0.06974(3) 0.22009(5) 0.0298(3) Uani 1 1 d . . . . .
S34 S 0.62724(8) 0.14758(3) 0.21869(5) 0.0315(4) Uani 1 1 d . . . . .
S35 S 0.76844(8) 0.13282(4) 0.10498(5) 0.0326(4) Uani 1 1 d . . . . .
S36 S 0.67271(8) 0.19696(3) 0.07657(5) 0.0344(4) Uani 1 1 d . . . . .
S37 S 0.73842(8) 0.05969(3) 0.01429(5) 0.0280(3) Uani 1 1 d . . . . .
S38 S 0.70522(7) 0.03460(3) 0.11005(4) 0.0240(3) Uani 1 1 d . . . . .
S39 S 0.68307(10) 0.15500(4) -0.02029(5) 0.0424(4) Uani 1 1 d . . . . .
S40 S 0.59896(8) 0.09226(3) -0.06407(4) 0.0290(3) Uani 1 1 d . . . . .
S41 S 0.27830(7) 0.05160(3) 0.04451(4) 0.0210(3) Uani 1 1 d . . . . .
S42 S 0.34422(7) -0.00169(3) 0.11902(4) 0.0239(3) Uani 1 1 d . . . . .
S43 S 0.54942(7) 0.00153(3) 0.15567(4) 0.0235(3) Uani 1 1 d . . . . .
S44 S 0.44780(8) 0.02446(3) 0.23021(4) 0.0243(3) 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 '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
Ag12 Pt1 Ag1 179.011(16) . .
Ag12 Pt1 Ag10 63.954(13) . .
Ag1 Pt1 Ag10 116.773(15) . .
Ag12 Pt1 Ag3 115.362(15) . .
Ag1 Pt1 Ag3 63.907(14) . .
Ag10 Pt1 Ag3 179.241(15) . .
Ag12 Pt1 Ag2 114.970(14) . .
Ag1 Pt1 Ag2 64.166(13) . .
Ag10 Pt1 Ag2 116.256(14) . .
Ag3 Pt1 Ag2 63.624(13) . .
Ag12 Pt1 Ag8 64.103(13) . .
Ag1 Pt1 Ag8 115.720(14) . .
Ag10 Pt1 Ag8 116.770(14) . .
Ag3 Pt1 Ag8 62.893(13) . .
Ag2 Pt1 Ag8 116.727(15) . .
Ag12 Pt1 Ag6 115.798(14) . .
Ag1 Pt1 Ag6 64.399(13) . .
Ag10 Pt1 Ag6 62.482(13) . .
Ag3 Pt1 Ag6 117.867(14) . .
Ag2 Pt1 Ag6 64.363(13) . .
Ag8 Pt1 Ag6 178.887(15) . .
Ag12 Pt1 Ag5 116.906(14) . .
Ag1 Pt1 Ag5 64.075(13) . .
Ag10 Pt1 Ag5 62.915(13) . .
Ag3 Pt1 Ag5 117.833(14) . .
Ag2 Pt1 Ag5 117.405(14) . .
Ag8 Pt1 Ag5 115.889(14) . .
Ag6 Pt1 Ag5 63.093(13) . .
Ag12 Pt1 Ag9 63.606(13) . .
Ag1 Pt1 Ag9 117.255(14) . .
Ag10 Pt1 Ag9 63.548(13) . .
Ag3 Pt1 Ag9 116.551(14) . .
Ag2 Pt1 Ag9 178.554(15) . .
Ag8 Pt1 Ag9 62.608(13) . .
Ag6 Pt1 Ag9 116.307(14) . .
Ag5 Pt1 Ag9 63.889(13) . .
Ag12 Pt1 Ag4 116.911(14) . .
Ag1 Pt1 Ag4 63.506(13) . .
Ag10 Pt1 Ag4 116.398(14) . .
Ag3 Pt1 Ag4 64.134(13) . .
Ag2 Pt1 Ag4 117.432(14) . .
Ag8 Pt1 Ag4 62.518(13) . .
Ag6 Pt1 Ag4 116.920(14) . .
Ag5 Pt1 Ag4 63.720(13) . .
Ag9 Pt1 Ag4 63.570(13) . .
Ag12 Pt1 Ag11 62.363(12) . .
Ag1 Pt1 Ag11 117.224(14) . .
Ag10 Pt1 Ag11 63.172(13) . .
Ag3 Pt1 Ag11 116.290(15) . .
Ag2 Pt1 Ag11 63.284(13) . .
Ag8 Pt1 Ag11 117.019(14) . .
Ag6 Pt1 Ag11 63.532(13) . .
Ag5 Pt1 Ag11 116.292(14) . .
Ag9 Pt1 Ag11 115.709(14) . .
Ag4 Pt1 Ag11 179.240(15) . .
Ag12 Pt1 Ag7 61.870(13) . .
Ag1 Pt1 Ag7 117.146(15) . .
Ag10 Pt1 Ag7 115.584(14) . .
Ag3 Pt1 Ag7 63.668(13) . .
Ag2 Pt1 Ag7 63.057(13) . .
Ag8 Pt1 Ag7 64.579(13) . .
Ag6 Pt1 Ag7 116.426(14) . .
Ag5 Pt1 Ag7 178.499(15) . .
Ag9 Pt1 Ag7 115.630(14) . .
Ag4 Pt1 Ag7 117.484(14) . .
Ag11 Pt1 Ag7 62.491(13) . .
Ag12 Pt2 Ag12 180.0 3_576 .
Ag12 Pt2 Ag16 64.995(12) 3_576 .
Ag12 Pt2 Ag16 115.004(12) . .
Ag12 Pt2 Ag16 115.004(12) 3_576 3_576
Ag12 Pt2 Ag16 64.998(12) . 3_576
Ag16 Pt2 Ag16 179.998(17) . 3_576
Ag12 Pt2 Ag17 115.032(12) 3_576 3_576
Ag12 Pt2 Ag17 64.968(12) . 3_576
Ag16 Pt2 Ag17 116.435(13) . 3_576
Ag16 Pt2 Ag17 63.567(12) 3_576 3_576
Ag12 Pt2 Ag17 64.965(12) 3_576 .
Ag12 Pt2 Ag17 115.035(12) . .
Ag16 Pt2 Ag17 63.565(13) . .
Ag16 Pt2 Ag17 116.433(13) 3_576 .
Ag17 Pt2 Ag17 180.0 3_576 .
Ag12 Pt2 Ag13 62.773(12) 3_576 3_576
Ag12 Pt2 Ag13 117.228(12) . 3_576
Ag16 Pt2 Ag13 117.384(12) . 3_576
Ag16 Pt2 Ag13 62.617(12) 3_576 3_576
Ag17 Pt2 Ag13 62.327(12) 3_576 3_576
Ag17 Pt2 Ag13 117.670(12) . 3_576
Ag12 Pt2 Ag13 117.228(12) 3_576 .
Ag12 Pt2 Ag13 62.772(12) . .
Ag16 Pt2 Ag13 62.617(12) . .
Ag16 Pt2 Ag13 117.383(12) 3_576 .
Ag17 Pt2 Ag13 117.673(12) 3_576 .
Ag17 Pt2 Ag13 62.330(12) . .
Ag13 Pt2 Ag13 180.0 3_576 .
Ag12 Pt2 Ag14 114.872(12) 3_576 .
Ag12 Pt2 Ag14 65.127(12) . .
Ag16 Pt2 Ag14 62.842(12) . .
Ag16 Pt2 Ag14 117.160(12) 3_576 .
Ag17 Pt2 Ag14 62.150(12) 3_576 .
Ag17 Pt2 Ag14 117.852(12) . .
Ag13 Pt2 Ag14 113.352(12) 3_576 .
Ag13 Pt2 Ag14 66.648(12) . .
Ag12 Pt2 Ag14 65.127(12) 3_576 3_576
Ag12 Pt2 Ag14 114.874(12) . 3_576
Ag16 Pt2 Ag14 117.157(12) . 3_576
Ag16 Pt2 Ag14 62.841(12) 3_576 3_576
Ag17 Pt2 Ag14 117.851(12) 3_576 3_576
Ag17 Pt2 Ag14 62.148(12) . 3_576
Ag13 Pt2 Ag14 66.647(12) 3_576 3_576
Ag13 Pt2 Ag14 113.352(12) . 3_576
Ag14 Pt2 Ag14 180.0 . 3_576
Ag12 Pt2 Ag15 62.952(12) 3_576 .
Ag12 Pt2 Ag15 117.047(12) . .
Ag16 Pt2 Ag15 66.184(12) . .
Ag16 Pt2 Ag15 113.817(12) 3_576 .
Ag17 Pt2 Ag15 61.599(12) 3_576 .
Ag17 Pt2 Ag15 118.399(12) . .
Ag13 Pt2 Ag15 60.847(12) 3_576 .
Ag13 Pt2 Ag15 119.154(12) . .
Ag14 Pt2 Ag15 62.071(12) . .
Ag14 Pt2 Ag15 117.928(12) 3_576 .
Ag12 Pt2 Ag15 117.049(12) 3_576 3_576
Ag12 Pt2 Ag15 62.952(12) . 3_576
Ag16 Pt2 Ag15 113.817(12) . 3_576
Ag16 Pt2 Ag15 66.182(12) 3_576 3_576
Ag17 Pt2 Ag15 118.399(12) 3_576 3_576
Ag17 Pt2 Ag15 61.603(12) . 3_576
Ag13 Pt2 Ag15 119.152(12) 3_576 3_576
Ag13 Pt2 Ag15 60.847(12) . 3_576
Ag14 Pt2 Ag15 117.928(12) . 3_576
Ag14 Pt2 Ag15 62.073(12) 3_576 3_576
Ag15 Pt2 Ag15 179.999(16) . 3_576
S1 Ag1 Pt1 157.73(4) . .
S1 Ag1 Ag3 101.29(4) . .
Pt1 Ag1 Ag3 58.340(12) . .
S1 Ag1 Ag4 104.57(4) . .
Pt1 Ag1 Ag4 59.128(12) . .
Ag3 Ag1 Ag4 60.822(15) . .
S1 Ag1 Ag2 122.02(4) . .
Pt1 Ag1 Ag2 58.270(12) . .
Ag3 Ag1 Ag2 59.850(15) . .
Ag4 Ag1 Ag2 108.895(17) . .
S1 Ag1 Ag5 129.73(4) . .
Pt1 Ag1 Ag5 58.477(12) . .
Ag3 Ag1 Ag5 108.526(17) . .
Ag4 Ag1 Ag5 60.433(14) . .
Ag2 Ag1 Ag5 107.934(17) . .
S1 Ag1 Ag6 143.54(4) . .
Pt1 Ag1 Ag6 58.283(12) . .
Ag3 Ag1 Ag6 108.170(17) . .
Ag4 Ag1 Ag6 108.312(17) . .
Ag2 Ag1 Ag6 60.376(14) . .
Ag5 Ag1 Ag6 59.299(14) . .
S1 Ag1 Ag18 87.63(4) . .
Pt1 Ag1 Ag18 109.488(16) . .
Ag3 Ag1 Ag18 118.794(19) . .
Ag4 Ag1 Ag18 167.727(19) . .
Ag2 Ag1 Ag18 64.361(15) . .
Ag5 Ag1 Ag18 110.672(18) . .
Ag6 Ag1 Ag18 59.596(14) . .
S5 Ag2 Pt1 148.92(4) . .
S5 Ag2 S6 75.30(5) . .
Pt1 Ag2 S6 135.54(4) . .
S5 Ag2 Ag3 134.48(4) . .
Pt1 Ag2 Ag3 58.126(12) . .
S6 Ag2 Ag3 96.75(3) . .
S5 Ag2 Ag1 151.23(4) . .
Pt1 Ag2 Ag1 57.564(12) . .
S6 Ag2 Ag1 78.32(3) . .
Ag3 Ag2 Ag1 59.862(15) . .
S5 Ag2 Ag7 99.26(4) . .
Pt1 Ag2 Ag7 59.563(12) . .
S6 Ag2 Ag7 143.09(4) . .
Ag3 Ag2 Ag7 60.685(14) . .
Ag1 Ag2 Ag7 108.732(17) . .
S5 Ag2 Ag11 90.99(4) . .
Pt1 Ag2 Ag11 59.308(12) . .
S6 Ag2 Ag11 153.92(4) . .
Ag3 Ag2 Ag11 108.476(17) . .
Ag1 Ag2 Ag11 108.424(17) . .
Ag7 Ag2 Ag11 60.068(14) . .
S5 Ag2 Ag22 54.05(4) . .
Pt1 Ag2 Ag22 110.165(17) . .
S6 Ag2 Ag22 93.80(3) . .
Ag3 Ag2 Ag22 168.08(2) . .
Ag1 Ag2 Ag22 117.367(19) . .
Ag7 Ag2 Ag22 112.711(18) . .
Ag11 Ag2 Ag22 60.478(14) . .
S5 Ag2 Ag6 117.39(4) . .
Pt1 Ag2 Ag6 57.950(12) . .
S6 Ag2 Ag6 106.36(4) . .
Ag3 Ag2 Ag6 107.915(17) . .
Ag1 Ag2 Ag6 60.044(14) . .
Ag7 Ag2 Ag6 108.305(17) . .
Ag11 Ag2 Ag6 60.119(14) . .
Ag22 Ag2 Ag6 63.508(15) . .
S5 Ag2 Ag18 93.20(4) . .
Pt1 Ag2 Ag18 105.693(16) . .
S6 Ag2 Ag18 48.58(4) . .
Ag3 Ag2 Ag18 115.118(18) . .
Ag1 Ag2 Ag18 60.277(14) . .
Ag7 Ag2 Ag18 165.081(19) . .
Ag11 Ag2 Ag18 111.851(18) . .
Ag22 Ag2 Ag18 68.466(15) . .
Ag6 Ag2 Ag18 58.122(14) . .
S18 Ag3 Pt1 150.65(4) . .
S18 Ag3 Ag8 149.06(4) . .
Pt1 Ag3 Ag8 58.714(12) . .
S18 Ag3 Ag2 93.90(4) . .
Pt1 Ag3 Ag2 58.249(12) . .
Ag8 Ag3 Ag2 108.724(17) . .
S18 Ag3 Ag1 102.20(4) . .
Pt1 Ag3 Ag1 57.753(12) . .
Ag8 Ag3 Ag1 107.246(18) . .
Ag2 Ag3 Ag1 60.289(15) . .
S18 Ag3 S17 76.63(5) . .
Pt1 Ag3 S17 132.70(3) . .
Ag8 Ag3 S17 75.70(3) . .
Ag2 Ag3 S17 162.23(4) . .
Ag1 Ag3 S17 135.96(3) . .
S18 Ag3 Ag7 117.26(4) . .
Pt1 Ag3 Ag7 59.306(12) . .
Ag8 Ag3 Ag7 61.686(14) . .
Ag2 Ag3 Ag7 59.882(14) . .
Ag1 Ag3 Ag7 108.432(18) . .
S17 Ag3 Ag7 110.87(3) . .
S18 Ag3 Ag4 133.51(4) . .
Pt1 Ag3 Ag4 58.511(12) . .
Ag8 Ag3 Ag4 59.320(14) . .
Ag2 Ag3 Ag4 108.293(18) . .
Ag1 Ag3 Ag4 59.630(15) . .
S17 Ag3 Ag4 88.88(3) . .
Ag7 Ag3 Ag4 109.206(17) . .
S18 Ag3 Ag21 89.58(4) . .
Pt1 Ag3 Ag21 109.673(16) . .
Ag8 Ag3 Ag21 62.059(15) . .
Ag2 Ag3 Ag21 115.081(18) . .
Ag1 Ag3 Ag21 167.42(2) . .
S17 Ag3 Ag21 50.84(3) . .
Ag7 Ag3 Ag21 61.401(15) . .
Ag4 Ag3 Ag21 114.891(18) . .
S16 Ag4 Pt1 153.52(4) . .
S16 Ag4 Ag8 138.31(4) . .
Pt1 Ag4 Ag8 58.306(12) . .
S16 Ag4 Ag1 96.31(4) . .
Pt1 Ag4 Ag1 57.366(12) . .
Ag8 Ag4 Ag1 107.104(17) . .
S16 Ag4 Ag5 114.12(4) . .
Pt1 Ag4 Ag5 57.780(12) . .
Ag8 Ag4 Ag5 107.451(17) . .
Ag1 Ag4 Ag5 59.979(14) . .
S16 Ag4 Ag9 143.84(4) . .
Pt1 Ag4 Ag9 58.058(12) . .
Ag8 Ag4 Ag9 59.375(14) . .
Ag1 Ag4 Ag9 107.463(17) . .
Ag5 Ag4 Ag9 60.041(14) . .
S16 Ag4 Ag3 109.05(4) . .
Pt1 Ag4 Ag3 57.355(12) . .
Ag8 Ag4 Ag3 59.225(14) . .
Ag1 Ag4 Ag3 59.548(15) . .
Ag5 Ag4 Ag3 107.167(17) . .
Ag9 Ag4 Ag3 106.450(16) . .
S16 Ag4 Ag20 86.15(4) . .
Pt1 Ag4 Ag20 106.206(16) . .
Ag8 Ag4 Ag20 113.491(18) . .
Ag1 Ag4 Ag20 113.891(19) . .
Ag5 Ag4 Ag20 59.286(14) . .
Ag9 Ag4 Ag20 59.600(14) . .
Ag3 Ag4 Ag20 163.551(19) . .
S14 Ag5 Pt1 144.83(4) . .
S14 Ag5 S13 76.69(5) . .
Pt1 Ag5 S13 138.43(3) . .
S14 Ag5 Ag10 152.51(4) . .
Pt1 Ag5 Ag10 58.253(12) . .
S13 Ag5 Ag10 81.68(3) . .
S14 Ag5 Ag6 137.98(4) . .
Pt1 Ag5 Ag6 58.424(12) . .
S13 Ag5 Ag6 93.30(3) . .
Ag10 Ag5 Ag6 59.396(14) . .
S14 Ag5 Ag1 100.06(3) . .
Pt1 Ag5 Ag1 57.448(12) . .
S13 Ag5 Ag1 137.51(4) . .
Ag10 Ag5 Ag1 107.356(17) . .
Ag6 Ag5 Ag1 60.562(14) . .
S14 Ag5 Ag4 87.27(3) . .
Pt1 Ag5 Ag4 58.500(12) . .
S13 Ag5 Ag4 158.02(3) . .
Ag10 Ag5 Ag4 108.178(17) . .
Ag6 Ag5 Ag4 108.647(18) . .
Ag1 Ag5 Ag4 59.589(15) . .
S14 Ag5 Ag9 113.72(3) . .
Pt1 Ag5 Ag9 58.258(12) . .
S13 Ag5 Ag9 112.92(4) . .
Ag10 Ag5 Ag9 60.100(14) . .
Ag6 Ag5 Ag9 107.802(17) . .
Ag1 Ag5 Ag9 107.111(18) . .
Ag4 Ag5 Ag9 59.983(14) . .
S14 Ag5 Ag20 53.08(3) . .
Pt1 Ag5 Ag20 109.372(17) . .
S13 Ag5 Ag20 95.67(3) . .
Ag10 Ag5 Ag20 113.505(18) . .
Ag6 Ag5 Ag20 167.58(2) . .
Ag1 Ag5 Ag20 116.400(18) . .
Ag4 Ag5 Ag20 62.470(15) . .
Ag9 Ag5 Ag20 60.663(14) . .
S14 Ag5 Ag19 92.53(3) . .
Pt1 Ag5 Ag19 108.565(16) . .
S13 Ag5 Ag19 51.57(3) . .
Ag10 Ag5 Ag19 60.484(14) . .
Ag6 Ag5 Ag19 113.089(17) . .
Ag1 Ag5 Ag19 165.996(19) . .
Ag4 Ag5 Ag19 115.455(18) . .
Ag9 Ag5 Ag19 61.625(14) . .
Ag20 Ag5 Ag19 66.824(15) . .
S4 Ag6 Pt1 156.56(4) . .
S4 Ag6 Ag10 101.22(4) . .
Pt1 Ag6 Ag10 58.497(12) . .
S4 Ag6 Ag5 102.48(4) . .
Pt1 Ag6 Ag5 58.483(12) . .
Ag10 Ag6 Ag5 60.036(14) . .
S4 Ag6 Ag1 128.18(4) . .
Pt1 Ag6 Ag1 57.318(12) . .
Ag10 Ag6 Ag1 107.526(17) . .
Ag5 Ag6 Ag1 60.140(14) . .
S4 Ag6 Ag11 124.01(4) . .
Pt1 Ag6 Ag11 59.046(12) . .
Ag10 Ag6 Ag11 60.345(14) . .
Ag5 Ag6 Ag11 108.753(17) . .
Ag1 Ag6 Ag11 107.666(18) . .
S4 Ag6 Ag2 145.68(4) . .
Pt1 Ag6 Ag2 57.687(12) . .
Ag10 Ag6 Ag2 107.429(17) . .
Ag5 Ag6 Ag2 107.970(17) . .
Ag1 Ag6 Ag2 59.580(14) . .
Ag11 Ag6 Ag2 59.635(14) . .
S4 Ag6 Ag18 88.26(4) . .
Pt1 Ag6 Ag18 111.298(17) . .
Ag10 Ag6 Ag18 169.59(2) . .
Ag5 Ag6 Ag18 113.990(18) . .
Ag1 Ag6 Ag18 62.668(14) . .
Ag11 Ag6 Ag18 117.656(18) . .
Ag2 Ag6 Ag18 65.229(15) . .
S4 Ag6 Ag22 93.09(4) . .
Pt1 Ag6 Ag22 105.621(16) . .
Ag10 Ag6 Ag22 114.001(17) . .
Ag5 Ag6 Ag22 164.09(2) . .
Ag1 Ag6 Ag22 112.248(18) . .
Ag11 Ag6 Ag22 58.542(14) . .
Ag2 Ag6 Ag22 58.230(14) . .
Ag18 Ag6 Ag22 69.259(15) . .
S22 Ag7 Pt1 159.07(4) 3_576 .
S22 Ag7 Ag12 103.15(4) 3_576 .
Pt1 Ag7 Ag12 56.746(12) . .
S22 Ag7 Ag2 132.98(4) 3_576 .
Pt1 Ag7 Ag2 57.380(12) . .
Ag12 Ag7 Ag2 105.902(18) . .
S22 Ag7 Ag11 107.90(4) 3_576 .
Pt1 Ag7 Ag11 58.615(12) . .
Ag12 Ag7 Ag11 59.324(14) . .
Ag2 Ag7 Ag11 60.049(14) . .
S22 Ag7 Ag3 142.41(4) 3_576 .
Pt1 Ag7 Ag3 57.026(12) . .
Ag12 Ag7 Ag3 105.508(17) . .
Ag2 Ag7 Ag3 59.433(14) . .
Ag11 Ag7 Ag3 107.469(18) . .
S22 Ag7 Ag8 120.99(4) 3_576 .
Pt1 Ag7 Ag8 56.745(12) . .
Ag12 Ag7 Ag8 59.571(13) . .
Ag2 Ag7 Ag8 105.543(17) . .
Ag11 Ag7 Ag8 107.215(17) . .
Ag3 Ag7 Ag8 58.107(14) . .
S22 Ag7 Ag21 86.70(4) 3_576 .
Pt1 Ag7 Ag21 106.242(16) . .
Ag12 Ag7 Ag21 114.338(18) . .
Ag2 Ag7 Ag21 112.974(18) . .
Ag11 Ag7 Ag21 164.851(19) . .
Ag3 Ag7 Ag21 59.477(14) . .
Ag8 Ag7 Ag21 60.207(14) . .
S22 Ag7 Ag15 52.98(4) 3_576 3_576
Pt1 Ag7 Ag15 111.270(16) . 3_576
Ag12 Ag7 Ag15 57.805(13) . 3_576
Ag2 Ag7 Ag15 161.87(2) . 3_576
Ag11 Ag7 Ag15 102.337(17) . 3_576
Ag3 Ag7 Ag15 129.086(18) . 3_576
Ag8 Ag7 Ag15 74.181(14) . 3_576
Ag21 Ag7 Ag15 82.988(15) . 3_576
S20 Ag8 Pt1 151.19(4) . .
S20 Ag8 Ag3 144.60(4) . .
Pt1 Ag8 Ag3 58.393(12) . .
S20 Ag8 Ag9 92.28(4) . .
Pt1 Ag8 Ag9 58.971(12) . .
Ag3 Ag8 Ag9 109.644(18) . .
S20 Ag8 Ag4 110.74(3) . .
Pt1 Ag8 Ag4 59.177(12) . .
Ag3 Ag8 Ag4 61.456(15) . .
Ag9 Ag8 Ag4 61.210(14) . .
S20 Ag8 Ag12 109.40(3) . .
Pt1 Ag8 Ag12 56.702(12) . .
Ag3 Ag8 Ag12 105.662(17) . .
Ag9 Ag8 Ag12 59.905(14) . .
Ag4 Ag8 Ag12 107.881(17) . .
S20 Ag8 Ag7 139.52(4) . .
Pt1 Ag8 Ag7 58.675(12) . .
Ag3 Ag8 Ag7 60.208(14) . .
Ag9 Ag8 Ag7 107.886(17) . .
Ag4 Ag8 Ag7 109.724(17) . .
Ag12 Ag8 Ag7 57.658(13) . .
S20 Ag8 Ag21 100.78(4) . .
Pt1 Ag8 Ag21 107.886(16) . .
Ag3 Ag8 Ag21 60.188(15) . .
Ag9 Ag8 Ag21 166.746(19) . .
Ag4 Ag8 Ag21 115.121(18) . .
Ag12 Ag8 Ag21 112.711(17) . .
Ag7 Ag8 Ag21 60.311(14) . .
S20 Ag8 Ag13 53.24(3) . .
Pt1 Ag8 Ag13 110.166(15) . .
Ag3 Ag8 Ag13 159.348(19) . .
Ag9 Ag8 Ag13 72.160(14) . .
Ag4 Ag8 Ag13 130.416(18) . .
Ag12 Ag8 Ag13 56.530(13) . .
Ag7 Ag8 Ag13 99.333(16) . .
Ag21 Ag8 Ag13 114.071(17) . .
S12 Ag9 Pt1 162.43(4) . .
S12 Ag9 Ag8 108.35(4) . .
Pt1 Ag9 Ag8 58.421(12) . .
S12 Ag9 Ag12 107.64(3) . .
Pt1 Ag9 Ag12 56.669(11) . .
Ag8 Ag9 Ag12 60.292(14) . .
S12 Ag9 Ag10 124.00(4) . .
Pt1 Ag9 Ag10 57.736(12) . .
Ag8 Ag9 Ag10 108.321(17) . .
Ag12 Ag9 Ag10 59.622(14) . .
S12 Ag9 Ag4 127.58(4) . .
Pt1 Ag9 Ag4 58.371(12) . .
Ag8 Ag9 Ag4 59.415(14) . .
Ag12 Ag9 Ag4 106.783(17) . .
Ag10 Ag9 Ag4 107.301(17) . .
S12 Ag9 Ag5 139.53(4) . .
Pt1 Ag9 Ag5 57.852(12) . .
Ag8 Ag9 Ag5 107.431(17) . .
Ag12 Ag9 Ag5 106.122(16) . .
Ag10 Ag9 Ag5 59.007(14) . .
Ag4 Ag9 Ag5 59.976(14) . .
S12 Ag9 Ag20 87.25(3) . .
Pt1 Ag9 Ag20 108.626(16) . .
Ag8 Ag9 Ag20 115.944(18) . .
Ag12 Ag9 Ag20 165.115(19) . .
Ag10 Ag9 Ag20 112.132(18) . .
Ag4 Ag9 Ag20 62.295(14) . .
Ag5 Ag9 Ag20 60.176(14) . .
S12 Ag9 Ag14 58.44(3) . .
Pt1 Ag9 Ag14 112.262(15) . .
Ag8 Ag9 Ag14 108.483(17) . .
Ag12 Ag9 Ag14 60.727(13) . .
Ag10 Ag9 Ag14 70.566(14) . .
Ag4 Ag9 Ag14 166.971(19) . .
Ag5 Ag9 Ag14 124.763(18) . .
Ag20 Ag9 Ag14 130.679(18) . .
S12 Ag9 Ag19 85.69(4) . .
Pt1 Ag9 Ag19 107.282(16) . .
Ag8 Ag9 Ag19 165.698(19) . .
Ag12 Ag9 Ag19 113.656(17) . .
Ag10 Ag9 Ag19 59.734(14) . .
Ag4 Ag9 Ag19 114.404(18) . .
Ag5 Ag9 Ag19 60.450(14) . .
Ag20 Ag9 Ag19 66.208(15) . .
Ag14 Ag9 Ag19 76.131(15) . .
S9 Ag10 Pt1 151.86(4) . .
S9 Ag10 Ag6 105.47(3) . .
Pt1 Ag10 Ag6 59.021(12) . .
S9 Ag10 Ag5 137.69(4) . .
Pt1 Ag10 Ag5 58.832(12) . .
Ag6 Ag10 Ag5 60.568(14) . .
S9 Ag10 Ag12 114.65(4) . .
Pt1 Ag10 Ag12 56.991(12) . .
Ag6 Ag10 Ag12 107.179(17) . .
Ag5 Ag10 Ag12 107.657(17) . .
S9 Ag10 Ag9 144.71(4) . .
Pt1 Ag10 Ag9 58.716(12) . .
Ag6 Ag10 Ag9 109.366(17) . .
Ag5 Ag10 Ag9 60.894(14) . .
Ag12 Ag10 Ag9 59.689(14) . .
S9 Ag10 Ag11 92.73(3) . .
Pt1 Ag10 Ag11 59.490(12) . .
Ag6 Ag10 Ag11 61.139(14) . .
Ag5 Ag10 Ag11 109.809(17) . .
Ag12 Ag10 Ag11 58.935(14) . .
Ag9 Ag10 Ag11 108.748(17) . .
S9 Ag10 Ag17 55.26(3) . 3_576
Pt1 Ag10 Ag17 113.958(17) . 3_576
Ag6 Ag10 Ag17 129.463(18) . 3_576
Ag5 Ag10 Ag17 164.797(19) . 3_576
Ag12 Ag10 Ag17 60.140(14) . 3_576
Ag9 Ag10 Ag17 103.930(17) . 3_576
Ag11 Ag10 Ag17 72.817(15) . 3_576
S9 Ag10 Ag19 97.52(3) . .
Pt1 Ag10 Ag19 110.273(16) . .
Ag6 Ag10 Ag19 115.419(18) . .
Ag5 Ag10 Ag19 61.984(14) . .
Ag12 Ag10 Ag19 116.095(18) . .
Ag9 Ag10 Ag19 62.400(14) . .
Ag11 Ag10 Ag19 169.741(19) . .
Ag17 Ag10 Ag19 113.383(17) 3_576 .
S7 Ag11 Pt1 145.41(4) . .
S7 Ag11 Ag12 140.59(4) . .
Pt1 Ag11 Ag12 56.661(11) . .
S7 Ag11 Ag10 101.58(4) . .
Pt1 Ag11 Ag10 57.338(12) . .
Ag12 Ag11 Ag10 59.934(14) . .
S7 Ag11 Ag2 113.52(4) . .
Pt1 Ag11 Ag2 57.408(12) . .
Ag12 Ag11 Ag2 105.365(17) . .
Ag10 Ag11 Ag2 106.469(17) . .
S7 Ag11 Ag7 150.64(4) . .
Pt1 Ag11 Ag7 58.894(12) . .
Ag12 Ag11 Ag7 58.796(14) . .
Ag10 Ag11 Ag7 107.717(17) . .
Ag2 Ag11 Ag7 59.883(15) . .
S7 Ag11 Ag6 88.54(3) . .
Pt1 Ag11 Ag6 57.422(12) . .
Ag12 Ag11 Ag6 105.898(16) . .
Ag10 Ag11 Ag6 58.515(14) . .
Ag2 Ag11 Ag6 60.246(14) . .
Ag7 Ag11 Ag6 108.258(17) . .
S7 Ag11 Ag22 53.48(3) . .
Pt1 Ag11 Ag22 108.224(16) . .
Ag12 Ag11 Ag22 164.525(19) . .
Ag10 Ag11 Ag22 116.753(19) . .
Ag2 Ag11 Ag22 60.047(14) . .
Ag7 Ag11 Ag22 112.181(18) . .
Ag6 Ag11 Ag22 63.400(14) . .
S7 Ag11 Ag16 96.58(3) . 3_576
Pt1 Ag11 Ag16 113.590(16) . 3_576
Ag12 Ag11 Ag16 58.964(13) . 3_576
Ag10 Ag11 Ag16 101.864(16) . 3_576
Ag2 Ag11 Ag16 132.63(2) . 3_576
Ag7 Ag11 Ag16 75.765(15) . 3_576
Ag6 Ag11 Ag16 160.376(19) . 3_576
Ag22 Ag11 Ag16 133.923(18) . 3_576
Pt2 Ag12 Pt1 174.726(18) . .
Pt2 Ag12 Ag7 123.369(17) . .
Pt1 Ag12 Ag7 61.383(13) . .
Pt2 Ag12 Ag11 118.259(16) . .
Pt1 Ag12 Ag11 60.975(12) . .
Ag7 Ag12 Ag11 61.880(15) . .
Pt2 Ag12 Ag13 60.657(11) . .
Pt1 Ag12 Ag13 121.113(16) . .
Ag7 Ag12 Ag13 109.746(18) . .
Ag11 Ag12 Ag13 170.06(2) . .
Pt2 Ag12 Ag10 115.766(16) . .
Pt1 Ag12 Ag10 59.055(12) . .
Ag7 Ag12 Ag10 111.149(17) . .
Ag11 Ag12 Ag10 61.131(14) . .
Ag13 Ag12 Ag10 128.734(18) . .
Pt2 Ag12 Ag9 117.589(16) . .
Pt1 Ag12 Ag9 59.725(12) . .
Ag7 Ag12 Ag9 112.013(17) . .
Ag11 Ag12 Ag9 111.373(17) . .
Ag13 Ag12 Ag9 76.157(15) . .
Ag10 Ag12 Ag9 60.688(14) . .
Pt2 Ag12 Ag8 124.206(16) . .
Pt1 Ag12 Ag8 59.195(12) . .
Ag7 Ag12 Ag8 62.771(14) . .
Ag11 Ag12 Ag8 111.751(17) . .
Ag13 Ag12 Ag8 65.734(14) . .
Ag10 Ag12 Ag8 108.783(17) . .
Ag9 Ag12 Ag8 59.804(14) . .
Pt2 Ag12 Ag15 61.717(12) . 3_576
Pt1 Ag12 Ag15 123.558(17) . 3_576
Ag7 Ag12 Ag15 66.404(15) . 3_576
Ag11 Ag12 Ag15 110.516(18) . 3_576
Ag13 Ag12 Ag15 59.820(14) . 3_576
Ag10 Ag12 Ag15 169.818(19) . 3_576
Ag9 Ag12 Ag15 129.488(18) . 3_576
Ag8 Ag12 Ag15 79.268(16) . 3_576
Pt2 Ag12 Ag16 58.586(11) . 3_576
Pt1 Ag12 Ag16 122.619(16) . 3_576
Ag7 Ag12 Ag16 79.457(15) . 3_576
Ag11 Ag12 Ag16 64.092(14) . 3_576
Ag13 Ag12 Ag16 110.346(17) . 3_576
Ag10 Ag12 Ag16 106.368(17) . 3_576
Ag9 Ag12 Ag16 164.69(2) . 3_576
Ag8 Ag12 Ag16 135.367(19) . 3_576
Ag15 Ag12 Ag16 63.639(14) 3_576 3_576
Pt2 Ag12 Ag17 58.811(11) . 3_576
Pt1 Ag12 Ag17 116.760(17) . 3_576
Ag7 Ag12 Ag17 129.829(18) . 3_576
Ag11 Ag12 Ag17 74.137(15) . 3_576
Ag13 Ag12 Ag17 110.811(17) . 3_576
Ag10 Ag12 Ag17 61.064(14) . 3_576
Ag9 Ag12 Ag17 105.346(17) . 3_576
Ag8 Ag12 Ag17 165.025(19) . 3_576
Ag15 Ag12 Ag17 112.225(17) 3_576 3_576
Ag16 Ag12 Ag17 59.557(14) 3_576 3_576
Pt2 Ag12 Ag14 59.987(11) . .
Pt1 Ag12 Ag14 115.685(16) . .
Ag7 Ag12 Ag14 171.441(19) . .
Ag11 Ag12 Ag14 124.764(19) . .
Ag13 Ag12 Ag14 64.156(14) . .
Ag10 Ag12 Ag14 71.291(15) . .
Ag9 Ag12 Ag14 61.476(14) . .
Ag8 Ag12 Ag14 108.691(17) . .
Ag15 Ag12 Ag14 112.675(17) 3_576 .
Ag16 Ag12 Ag14 108.019(16) 3_576 .
Ag17 Ag12 Ag14 58.693(14) 3_576 .
S20 Ag13 Pt2 163.66(3) . .
S20 Ag13 Ag12 109.52(3) . .
Pt2 Ag13 Ag12 56.571(11) . .
S20 Ag13 Ag15 106.06(3) . 3_576
Pt2 Ag13 Ag15 60.786(12) . 3_576
Ag12 Ag13 Ag15 60.899(14) . 3_576
S20 Ag13 Ag17 125.98(4) . .
Pt2 Ag13 Ag17 58.138(11) . .
Ag12 Ag13 Ag17 106.340(17) . .
Ag15 Ag13 Ag17 60.222(14) 3_576 .
S20 Ag13 Ag16 138.54(3) . .
Pt2 Ag13 Ag16 57.777(11) . .
Ag12 Ag13 Ag16 105.806(17) . .
Ag15 Ag13 Ag16 109.730(17) 3_576 .
Ag17 Ag13 Ag16 60.457(14) . .
S20 Ag13 Ag14 126.02(4) . .
Pt2 Ag13 Ag14 57.259(11) . .
Ag12 Ag13 Ag14 59.756(14) . .
Ag15 Ag13 Ag14 109.979(17) 3_576 .
Ag17 Ag13 Ag14 106.661(16) . .
Ag16 Ag13 Ag14 58.152(14) . .
S20 Ag13 Ag8 52.15(3) . .
Pt2 Ag13 Ag8 112.582(15) . .
Ag12 Ag13 Ag8 57.737(13) . .
Ag15 Ag13 Ag8 76.083(15) 3_576 .
Ag17 Ag13 Ag8 134.225(18) . .
Ag16 Ag13 Ag8 158.29(2) . .
Ag14 Ag13 Ag8 100.135(16) . .
S12 Ag14 S10 96.70(4) . .
S12 Ag14 Pt2 124.59(3) . .
S10 Ag14 Pt2 138.70(3) . .
S12 Ag14 Ag17 156.45(3) . 3_576
S10 Ag14 Ag17 85.32(3) . 3_576
Pt2 Ag14 Ag17 57.589(11) . 3_576
S12 Ag14 Ag16 88.75(3) . .
S10 Ag14 Ag16 131.41(3) . .
Pt2 Ag14 Ag16 57.041(11) . .
Ag17 Ag14 Ag16 107.533(17) 3_576 .
S12 Ag14 Ag15 144.13(3) . .
S10 Ag14 Ag15 87.30(3) . .
Pt2 Ag14 Ag15 59.507(11) . .
Ag17 Ag14 Ag15 59.260(14) 3_576 .
Ag16 Ag14 Ag15 63.203(14) . .
S12 Ag14 Ag12 100.88(3) . .
S10 Ag14 Ag12 123.77(3) . .
Pt2 Ag14 Ag12 54.886(11) . .
Ag17 Ag14 Ag12 59.774(14) 3_576 .
Ag16 Ag14 Ag12 102.104(17) . .
Ag15 Ag14 Ag12 106.333(16) . .
S12 Ag14 Ag9 53.09(3) . .
S10 Ag14 Ag9 95.40(3) . .
Pt2 Ag14 Ag9 109.397(15) . .
Ag17 Ag14 Ag9 103.364(17) 3_576 .
Ag16 Ag14 Ag9 124.657(19) . .
Ag15 Ag14 Ag9 162.221(19) . .
Ag12 Ag14 Ag9 57.797(13) . .
S12 Ag14 Ag13 68.97(3) . .
S10 Ag14 Ag13 164.27(3) . .
Pt2 Ag14 Ag13 56.093(11) . .
Ag17 Ag14 Ag13 105.171(17) 3_576 .
Ag16 Ag14 Ag13 57.225(14) . .
Ag15 Ag14 Ag13 108.065(17) . .
Ag12 Ag14 Ag13 56.088(13) . .
Ag9 Ag14 Ag13 71.038(14) . .
S22 Ag15 S19 89.09(5) . 3_576
S22 Ag15 Pt2 127.64(4) . .
S19 Ag15 Pt2 142.09(3) 3_576 .
S22 Ag15 Ag13 155.68(5) . 3_576
S19 Ag15 Ag13 84.39(3) 3_576 3_576
Pt2 Ag15 Ag13 58.367(11) . 3_576
S22 Ag15 Ag17 144.34(5) . 3_576
S19 Ag15 Ag17 99.80(3) 3_576 3_576
Pt2 Ag15 Ag17 57.302(11) . 3_576
Ag13 Ag15 Ag17 59.975(14) 3_576 3_576
S22 Ag15 Ag12 102.82(4) . 3_576
S19 Ag15 Ag12 113.53(3) 3_576 3_576
Pt2 Ag15 Ag12 55.329(11) . 3_576
Ag13 Ag15 Ag12 59.282(14) 3_576 3_576
Ag17 Ag15 Ag12 104.926(17) 3_576 3_576
S22 Ag15 Ag14 91.82(4) . .
S19 Ag15 Ag14 139.77(4) 3_576 .
Pt2 Ag15 Ag14 58.422(11) . .
Ag13 Ag15 Ag14 108.207(17) 3_576 .
Ag17 Ag15 Ag14 59.448(14) 3_576 .
Ag12 Ag15 Ag14 105.441(17) 3_576 .
S22 Ag15 Ag16 72.88(4) . .
S19 Ag15 Ag16 156.50(3) 3_576 .
Pt2 Ag15 Ag16 54.966(11) . .
Ag13 Ag15 Ag16 105.777(17) 3_576 .
Ag17 Ag15 Ag16 103.622(16) 3_576 .
Ag12 Ag15 Ag16 58.389(13) 3_576 .
Ag14 Ag15 Ag16 57.906(14) . .
S22 Ag15 Ag7 54.65(4) . 3_576
S19 Ag15 Ag7 84.76(3) 3_576 3_576
Pt2 Ag15 Ag7 107.675(15) . 3_576
Ag13 Ag15 Ag7 101.336(16) 3_576 3_576
Ag17 Ag15 Ag7 159.803(19) 3_576 3_576
Ag12 Ag15 Ag7 55.790(13) 3_576 3_576
Ag14 Ag15 Ag7 127.224(18) . 3_576
Ag16 Ag15 Ag7 72.594(14) . 3_576
S8 Ag16 Pt2 171.78(4) . .
S8 Ag16 Ag13 128.56(4) . .
Pt2 Ag16 Ag13 59.606(11) . .
S8 Ag16 Ag17 123.00(4) . .
Pt2 Ag16 Ag17 58.435(11) . .
Ag13 Ag16 Ag17 59.680(14) . .
S8 Ag16 Ag14 122.40(4) . .
Pt2 Ag16 Ag14 60.117(11) . .
Ag13 Ag16 Ag14 64.624(14) . .
Ag17 Ag16 Ag14 111.150(17) . .
S8 Ag16 Ag12 116.34(4) . 3_576
Pt2 Ag16 Ag12 56.416(11) . 3_576
Ag13 Ag16 Ag12 107.595(17) . 3_576
Ag17 Ag16 Ag12 60.324(14) . 3_576
Ag14 Ag16 Ag12 105.902(17) . 3_576
S8 Ag16 Ag11 65.29(4) . 3_576
Pt2 Ag16 Ag11 109.641(15) . 3_576
Ag13 Ag16 Ag11 127.663(19) . 3_576
Ag17 Ag16 Ag11 71.407(15) . 3_576
Ag14 Ag16 Ag11 159.806(19) . 3_576
Ag12 Ag16 Ag11 56.947(13) 3_576 3_576
S8 Ag16 Ag15 114.77(4) . .
Pt2 Ag16 Ag15 58.850(11) . .
Ag13 Ag16 Ag15 110.472(17) . .
Ag17 Ag16 Ag15 108.216(17) . .
Ag14 Ag16 Ag15 58.891(14) . .
Ag12 Ag16 Ag15 57.968(13) 3_576 .
Ag11 Ag16 Ag15 100.997(16) 3_576 .
S9 Ag17 Pt2 162.90(3) 3_576 .
S9 Ag17 Ag13 136.65(3) 3_576 .
Pt2 Ag17 Ag13 59.532(11) . .
S9 Ag17 Ag15 118.43(4) 3_576 3_576
Pt2 Ag17 Ag15 61.097(12) . 3_576
Ag13 Ag17 Ag15 59.802(14) . 3_576
S9 Ag17 Ag14 103.70(3) 3_576 3_576
Pt2 Ag17 Ag14 60.264(12) . 3_576
Ag13 Ag17 Ag14 109.555(17) . 3_576
Ag15 Ag17 Ag14 61.293(14) 3_576 3_576
S9 Ag17 Ag16 130.63(4) 3_576 .
Pt2 Ag17 Ag16 58.000(11) . .
Ag13 Ag17 Ag16 59.863(14) . .
Ag15 Ag17 Ag16 108.907(18) 3_576 .
Ag14 Ag17 Ag16 110.802(18) 3_576 .
S9 Ag17 Ag12 112.45(3) 3_576 3_576
Pt2 Ag17 Ag12 56.219(11) . 3_576
Ag13 Ag17 Ag12 107.577(17) . 3_576
Ag15 Ag17 Ag12 109.278(17) 3_576 3_576
Ag14 Ag17 Ag12 61.536(14) 3_576 3_576
Ag16 Ag17 Ag12 60.118(14) . 3_576
S9 Ag17 Ag10 54.37(3) 3_576 3_576
Pt2 Ag17 Ag10 111.266(15) . 3_576
Ag13 Ag17 Ag10 164.63(2) . 3_576
Ag15 Ag17 Ag10 128.894(18) 3_576 3_576
Ag14 Ag17 Ag10 71.538(14) 3_576 3_576
Ag16 Ag17 Ag10 105.063(17) . 3_576
Ag12 Ag17 Ag10 58.800(13) 3_576 3_576
S2 Ag18 S6 126.30(6) . .
S2 Ag18 S3 116.99(5) . .
S6 Ag18 S3 112.56(5) . .
S2 Ag18 Ag6 89.94(5) . .
S6 Ag18 Ag6 115.47(4) . .
S3 Ag18 Ag6 83.39(4) . .
S2 Ag18 Ag1 74.10(4) . .
S6 Ag18 Ag1 81.11(4) . .
S3 Ag18 Ag1 140.33(4) . .
Ag6 Ag18 Ag1 57.737(14) . .
S2 Ag18 Ag2 128.50(5) . .
S6 Ag18 Ag2 59.23(4) . .
S3 Ag18 Ag2 98.36(4) . .
Ag6 Ag18 Ag2 56.650(14) . .
Ag1 Ag18 Ag2 55.362(13) . .
S13 Ag19 S10 125.07(5) . .
S13 Ag19 S11 113.27(5) . .
S10 Ag19 S11 107.38(5) . .
S13 Ag19 Ag10 84.09(4) . .
S10 Ag19 Ag10 82.07(3) . .
S11 Ag19 Ag10 146.01(4) . .
S13 Ag19 Ag5 59.23(4) . .
S10 Ag19 Ag5 139.44(4) . .
S11 Ag19 Ag5 105.03(4) . .
Ag10 Ag19 Ag5 57.532(13) . .
S13 Ag19 Ag9 116.85(4) . .
S10 Ag19 Ag9 99.36(4) . .
S11 Ag19 Ag9 88.18(4) . .
Ag10 Ag19 Ag9 57.866(14) . .
Ag5 Ag19 Ag9 57.926(14) . .
S13 Ag19 Ag20 93.00(4) . .
S10 Ag19 Ag20 141.89(4) . .
S11 Ag19 Ag20 50.05(4) . .
Ag10 Ag19 Ag20 102.510(17) . .
Ag5 Ag19 Ag20 55.897(13) . .
Ag9 Ag19 Ag20 55.910(13) . .
S15 Ag20 S14 131.83(5) . .
S15 Ag20 S11 114.99(5) . .
S14 Ag20 S11 108.78(5) . .
S15 Ag20 Ag5 122.65(4) . .
S14 Ag20 Ag5 58.39(3) . .
S11 Ag20 Ag5 106.31(4) . .
S15 Ag20 Ag9 82.54(4) . .
S14 Ag20 Ag9 117.52(4) . .
S11 Ag20 Ag9 89.62(4) . .
Ag5 Ag20 Ag9 59.160(14) . .
S15 Ag20 Ag4 65.65(4) . .
S14 Ag20 Ag4 87.66(4) . .
S11 Ag20 Ag4 147.70(4) . .
Ag5 Ag20 Ag4 58.244(14) . .
Ag9 Ag20 Ag4 58.104(14) . .
S15 Ag20 Ag19 134.39(4) . .
S14 Ag20 Ag19 89.43(4) . .
S11 Ag20 Ag19 49.97(3) . .
Ag5 Ag20 Ag19 57.279(13) . .
Ag9 Ag20 Ag19 57.881(14) . .
Ag4 Ag20 Ag19 104.613(16) . .
S21 Ag21 S17 119.75(5) . .
S21 Ag21 S19 118.29(5) . .
S17 Ag21 S19 119.93(5) . .
S21 Ag21 Ag3 86.29(5) . .
S17 Ag21 Ag3 64.00(4) . .
S19 Ag21 Ag3 134.04(4) . .
S21 Ag21 Ag8 127.81(6) . .
S17 Ag21 Ag8 79.65(4) . .
S19 Ag21 Ag8 77.26(4) . .
Ag3 Ag21 Ag8 57.753(14) . .
S21 Ag21 Ag7 70.04(5) . .
S17 Ag21 Ag7 121.40(4) . .
S19 Ag21 Ag7 91.60(4) . .
Ag3 Ag21 Ag7 59.123(14) . .
Ag8 Ag21 Ag7 59.482(14) . .
S3 Ag22 S7 119.89(5) . .
S3 Ag22 S5 112.11(5) . .
S7 Ag22 S5 125.51(5) . .
S3 Ag22 Ag2 106.88(4) . .
S7 Ag22 Ag2 116.76(4) . .
S5 Ag22 Ag2 57.51(4) . .
S3 Ag22 Ag11 139.78(4) . .
S7 Ag22 Ag11 57.30(4) . .
S5 Ag22 Ag11 92.48(4) . .
Ag2 Ag22 Ag11 59.474(14) . .
S3 Ag22 Ag6 82.25(4) . .
S7 Ag22 Ag6 87.34(4) . .
S5 Ag22 Ag6 115.61(4) . .
Ag2 Ag22 Ag6 58.262(14) . .
Ag11 Ag22 Ag6 58.058(13) . .
C2 C1 O1 110.5(7) . .
C1 C2 C3 111.4(10) . .
O2 C4 C5 110.0(6) . .
C6 C5 C4 113.1(8) . .
C8 C7 O3 115.7(7) . .
C7 C8 C9 133.4(9) . .
O4 C10 C11 109.5(8) . .
C12 C11 C10 117.0(12) . .
C14 C13 O5 115.9(8) . .
C15 C14 C13 121.9(13) . .
O6 C16 C17 110.9(7) . .
C16 C17 C18 114.0(10) . .
O7 C19 C20 108.1(5) . .
C19 C20 C21 111.3(5) . .
C23 C22 O8 117.7(9) . .
C22 C23 C24 123.1(14) . .
O9 C25 C26 108.4(12) . .
C25 C26 C27 121.9(15) . .
O9 C25B C26B 112.8(12) . .
C25B C26B C27B 114.0(15) . .
O10 C28 C29 109.6(5) . .
C28 C29 C30 113.6(6) . .
O11 C31 C32 118.2(11) . .
C33 C32 C31 111.1(13) . .
O11 C31B C32B 120.5(11) . .
C33B C32B C31B 112.6(14) . .
O12 C34 C35 108.8(16) . .
C36 C35 C34 118(3) . .
O12 C34B C35B 104.9(17) . .
C36B C35B C34B 114(4) . .
O13 C37 C38 109.2(6) . .
C37 C38 C39 112.7(7) . .
O14 C40 C41 110.4(6) . .
C42 C41 C40 116.8(7) . .
O15 C43 C44 108.1(5) . .
C45 C44 C43 116.6(8) . .
C47 C46 O16 113.4(7) . .
C46 C47 C48 113.3(9) . .
O17 C49 C50 110.1(5) . .
C49 C50 C51 111.6(6) . .
C53 C52 O18 113.0(7) . .
C52 C53 C54 132.8(11) . .
O19 C55 C56 108.8(5) . .
C55 C56 C57 110.9(5) . .
O20 C58 C59 108.3(4) . .
C58 C59 C60 113.3(6) . .
O21 C61 C62 108.1(5) . .
C61 C62 C63 111.5(7) . .
O22 C64 C65 112.0(8) . .
C66 C65 C64 116.8(10) . .
C1 O1 P1 120.3(4) . .
C4 O2 P1 121.3(4) . .
C7 O3 P2 120.8(4) . .
C10 O4 P2 123.2(4) . .
C13 O5 P3 122.6(4) . .
C16 O6 P3 122.3(5) . .
C19 O7 P4 120.6(4) . .
C22 O8 P4 123.2(5) . .
C25 O9 P5 124.3(9) . .
C25B O9 P5 116.1(9) . .
C28 O10 P5 120.6(4) . .
C31B O11 P6 136.3(8) . .
C31 O11 P6 129.7(6) . .
C34 O12 P6 127.4(14) . .
C34B O12 P6 117.6(14) . .
C37 O13 P7 120.4(4) . .
C40 O14 P7 119.6(4) . .
C43 O15 P8 118.9(4) . .
C46 O16 P8 121.5(4) . .
C49 O17 P9 120.6(4) . .
C52 O18 P9 122.9(4) . .
C55 O19 P10 120.7(3) . .
C58 O20 P10 120.9(3) . .
C61 O21 P11 119.1(4) . .
C64 O22 P11 120.7(5) . .
O2 P1 O1 99.5(2) . .
O2 P1 S1 108.60(18) . .
O1 P1 S1 113.39(18) . .
O2 P1 S2 112.47(18) . .
O1 P1 S2 103.39(18) . .
S1 P1 S2 117.97(10) . .
O3 P2 O4 100.4(2) . .
O3 P2 S4 110.55(18) . .
O4 P2 S4 113.0(2) . .
O3 P2 S3 107.81(18) . .
O4 P2 S3 104.80(19) . .
S4 P2 S3 118.59(10) . .
O6 P3 O5 101.7(2) . .
O6 P3 S6 109.11(19) . .
O5 P3 S6 109.9(2) . .
O6 P3 S5 111.21(19) . .
O5 P3 S5 108.4(2) . .
S6 P3 S5 115.66(10) . .
O7 P4 O8 107.7(2) . .
O7 P4 S8 114.34(18) . 3_576
O8 P4 S8 102.75(19) . 3_576
O7 P4 S7 102.99(17) . .
O8 P4 S7 111.66(19) . .
S8 P4 S7 117.31(9) 3_576 .
O9 P5 O10 106.0(2) . .
O9 P5 S10 110.97(17) . .
O10 P5 S10 105.50(16) . .
O9 P5 S9 104.08(16) . .
O10 P5 S9 109.49(16) . .
S10 P5 S9 120.03(9) . .
O11 P6 O12 104.2(3) . .
O11 P6 S11 110.48(19) . .
O12 P6 S11 104.37(18) . .
O11 P6 S12 105.8(2) . .
O12 P6 S12 111.84(18) . .
S11 P6 S12 119.22(9) . .
O14 P7 O13 101.6(2) . .
O14 P7 S14 108.34(17) . .
O13 P7 S14 109.83(18) . .
O14 P7 S13 112.57(18) . .
O13 P7 S13 108.05(18) . .
S14 P7 S13 115.50(9) . .
O15 P8 O16 95.4(2) . .
O15 P8 S16 113.42(18) . .
O16 P8 S16 111.04(18) . .
O15 P8 S15 108.40(18) . .
O16 P8 S15 111.96(18) . .
S16 P8 S15 114.96(9) . .
O18 P9 O17 101.2(2) . .
O18 P9 S18 114.28(19) . .
O17 P9 S18 110.01(18) . .
O18 P9 S17 105.08(18) . .
O17 P9 S17 108.68(18) . .
S18 P9 S17 116.40(9) . .
O20 P10 O19 100.7(2) . .
O20 P10 S20 110.01(16) . .
O19 P10 S20 105.91(16) . .
O20 P10 S19 110.81(16) . .
O19 P10 S19 111.67(16) . .
S20 P10 S19 116.47(9) . .
O22 P11 O21 100.5(2) . .
O22 P11 S22 108.53(18) . 3_576
O21 P11 S22 109.16(17) . 3_576
O22 P11 S21 112.97(19) . .
O21 P11 S21 108.98(17) . .
S22 P11 S21 115.60(11) 3_576 .
P1 S1 Ag1 95.38(7) . .
P1 S2 Ag18 107.59(8) . .
P2 S3 Ag22 98.90(7) . .
P2 S3 Ag18 105.10(7) . .
Ag22 S3 Ag18 85.79(5) . .
P2 S4 Ag6 104.39(8) . .
P3 S5 Ag22 103.59(8) . .
P3 S5 Ag2 87.20(7) . .
Ag22 S5 Ag2 68.43(4) . .
P3 S6 Ag18 104.18(8) . .
P3 S6 Ag2 81.85(7) . .
Ag18 S6 Ag2 72.19(4) . .
P4 S7 Ag22 100.38(8) . .
P4 S7 Ag11 89.32(7) . .
Ag22 S7 Ag11 69.22(4) . .
P4 S8 Ag16 105.56(7) 3_576 .
P5 S9 Ag10 98.34(7) . .
P5 S9 Ag17 99.27(7) . 3_576
Ag10 S9 Ag17 70.38(4) . 3_576
P5 S10 Ag19 97.59(7) . .
P5 S10 Ag14 113.73(7) . .
Ag19 S10 Ag14 89.10(5) . .
P6 S11 Ag19 98.38(7) . .
P6 S11 Ag20 102.88(8) . .
Ag19 S11 Ag20 79.97(4) . .
P6 S12 Ag9 109.61(7) . .
P6 S12 Ag14 112.65(8) . .
Ag9 S12 Ag14 68.47(4) . .
P7 S13 Ag19 101.04(7) . .
P7 S13 Ag5 83.14(7) . .
Ag19 S13 Ag5 69.20(4) . .
P7 S14 Ag20 104.74(7) . .
P7 S14 Ag5 84.66(6) . .
Ag20 S14 Ag5 68.54(4) . .
P8 S15 Ag20 100.60(8) . .
P8 S16 Ag4 92.08(7) . .
P9 S17 Ag21 99.51(7) . .
P9 S17 Ag3 77.68(6) . .
Ag21 S17 Ag3 65.16(4) . .
P9 S18 Ag3 88.34(7) . .
P10 S19 Ag21 99.25(7) . .
P10 S19 Ag15 117.18(7) . 3_576
Ag21 S19 Ag15 100.60(5) . 3_576
P10 S20 Ag8 95.48(7) . .
P10 S20 Ag13 100.67(7) . .
Ag8 S20 Ag13 74.61(4) . .
P11 S21 Ag21 100.83(8) . .
P11 S22 Ag15 131.23(9) 3_576 .
P11 S22 Ag7 94.53(8) 3_576 3_576
Ag15 S22 Ag7 72.37(4) . 3_576
Ag34 Pt3 Ag31 64.427(13) . .
Ag34 Pt3 Ag23 178.341(15) . .
Ag31 Pt3 Ag23 116.685(15) . .
Ag34 Pt3 Ag28 115.148(15) . .
Ag31 Pt3 Ag28 179.564(16) . .
Ag23 Pt3 Ag28 63.742(14) . .
Ag34 Pt3 Ag24 114.029(14) . .
Ag31 Pt3 Ag24 115.990(14) . .
Ag23 Pt3 Ag24 64.454(13) . .
Ag28 Pt3 Ag24 64.218(14) . .
Ag34 Pt3 Ag33 64.331(13) . .
Ag31 Pt3 Ag33 117.095(14) . .
Ag23 Pt3 Ag33 115.524(14) . .
Ag28 Pt3 Ag33 62.511(13) . .
Ag24 Pt3 Ag33 116.576(15) . .
Ag34 Pt3 Ag32 64.091(12) . .
Ag31 Pt3 Ag32 63.358(13) . .
Ag23 Pt3 Ag32 117.426(14) . .
Ag28 Pt3 Ag32 116.421(14) . .
Ag24 Pt3 Ag32 178.119(14) . .
Ag33 Pt3 Ag32 62.947(13) . .
Ag34 Pt3 Ag26 117.864(14) . .
Ag31 Pt3 Ag26 62.888(13) . .
Ag23 Pt3 Ag26 63.752(13) . .
Ag28 Pt3 Ag26 117.409(14) . .
Ag24 Pt3 Ag26 117.057(14) . .
Ag33 Pt3 Ag26 116.438(14) . .
Ag32 Pt3 Ag26 64.403(13) . .
Ag34 Pt3 Ag25 115.767(14) . .
Ag31 Pt3 Ag25 62.486(13) . .
Ag23 Pt3 Ag25 64.403(13) . .
Ag28 Pt3 Ag25 117.910(14) . .
Ag24 Pt3 Ag25 64.175(13) . .
Ag33 Pt3 Ag25 179.188(15) . .
Ag32 Pt3 Ag25 116.314(14) . .
Ag26 Pt3 Ag25 62.770(13) . .
Ag34 Pt3 Ag27 117.131(14) . .
Ag31 Pt3 Ag27 115.957(14) . .
Ag23 Pt3 Ag27 63.712(13) . .
Ag28 Pt3 Ag27 64.093(13) . .
Ag24 Pt3 Ag27 118.140(14) . .
Ag33 Pt3 Ag27 62.512(13) . .
Ag32 Pt3 Ag27 63.431(13) . .
Ag26 Pt3 Ag27 63.688(13) . .
Ag25 Pt3 Ag27 116.943(14) . .
Ag34 Pt3 Ag29 61.594(13) . .
Ag31 Pt3 Ag29 115.854(14) . .
Ag23 Pt3 Ag29 116.780(14) . .
Ag28 Pt3 Ag29 63.854(13) . .
Ag24 Pt3 Ag29 62.522(13) . .
Ag33 Pt3 Ag29 64.751(13) . .
Ag32 Pt3 Ag29 115.984(14) . .
Ag26 Pt3 Ag29 178.495(15) . .
Ag25 Pt3 Ag29 116.037(14) . .
Ag27 Pt3 Ag29 117.815(15) . .
Ag34 Pt3 Ag30 62.092(12) . .
Ag31 Pt3 Ag30 63.149(13) . .
Ag23 Pt3 Ag30 117.085(14) . .
Ag28 Pt3 Ag30 116.796(14) . .
Ag24 Pt3 Ag30 62.904(13) . .
Ag33 Pt3 Ag30 117.253(14) . .
Ag32 Pt3 Ag30 115.527(13) . .
Ag26 Pt3 Ag30 115.908(15) . .
Ag25 Pt3 Ag30 63.280(13) . .
Ag27 Pt3 Ag30 178.953(15) . .
Ag29 Pt3 Ag30 62.588(13) . .
Ag34 Pt4 Ag34 180.0 3_655 .
Ag34 Pt4 Ag39 65.813(12) 3_655 .
Ag34 Pt4 Ag39 114.186(12) . .
Ag34 Pt4 Ag39 114.190(12) 3_655 3_655
Ag34 Pt4 Ag39 65.811(12) . 3_655
Ag39 Pt4 Ag39 180.0 . 3_655
Ag34 Pt4 Ag35 65.025(12) 3_655 3_655
Ag34 Pt4 Ag35 114.975(12) . 3_655
Ag39 Pt4 Ag35 63.676(12) . 3_655
Ag39 Pt4 Ag35 116.326(12) 3_655 3_655
Ag34 Pt4 Ag35 114.979(12) 3_655 .
Ag34 Pt4 Ag35 65.021(12) . .
Ag39 Pt4 Ag35 116.325(12) . .
Ag39 Pt4 Ag35 63.673(12) 3_655 .
Ag35 Pt4 Ag35 180.0 3_655 .
Ag34 Pt4 Ag37 117.723(12) 3_655 .
Ag34 Pt4 Ag37 62.276(12) . .
Ag39 Pt4 Ag37 62.694(12) . .
Ag39 Pt4 Ag37 117.304(12) 3_655 .
Ag35 Pt4 Ag37 62.265(12) 3_655 .
Ag35 Pt4 Ag37 117.732(12) . .
Ag34 Pt4 Ag37 62.274(12) 3_655 3_655
Ag34 Pt4 Ag37 117.727(12) . 3_655
Ag39 Pt4 Ag37 117.303(12) . 3_655
Ag39 Pt4 Ag37 62.699(12) 3_655 3_655
Ag35 Pt4 Ag37 117.734(12) 3_655 3_655
Ag35 Pt4 Ag37 62.269(12) . 3_655
Ag37 Pt4 Ag37 180.0 . 3_655
Ag34 Pt4 Ag36 64.139(12) 3_655 3_655
Ag34 Pt4 Ag36 115.862(12) . 3_655
Ag39 Pt4 Ag36 117.390(12) . 3_655
Ag39 Pt4 Ag36 62.613(12) 3_655 3_655
Ag35 Pt4 Ag36 62.567(12) 3_655 3_655
Ag35 Pt4 Ag36 117.434(12) . 3_655
Ag37 Pt4 Ag36 113.827(12) . 3_655
Ag37 Pt4 Ag36 66.174(12) 3_655 3_655
Ag34 Pt4 Ag36 115.858(12) 3_655 .
Ag34 Pt4 Ag36 64.141(12) . .
Ag39 Pt4 Ag36 62.607(12) . .
Ag39 Pt4 Ag36 117.390(12) 3_655 .
Ag35 Pt4 Ag36 117.431(12) 3_655 .
Ag35 Pt4 Ag36 62.568(12) . .
Ag37 Pt4 Ag36 66.174(12) . .
Ag37 Pt4 Ag36 113.825(12) 3_655 .
Ag36 Pt4 Ag36 180.0 3_655 .
Ag34 Pt4 Ag38 116.726(12) 3_655 3_655
Ag34 Pt4 Ag38 63.275(12) . 3_655
Ag39 Pt4 Ag38 114.384(12) . 3_655
Ag39 Pt4 Ag38 65.615(12) 3_655 3_655
Ag35 Pt4 Ag38 61.952(12) 3_655 3_655
Ag35 Pt4 Ag38 118.045(12) . 3_655
Ag37 Pt4 Ag38 61.189(12) . 3_655
Ag37 Pt4 Ag38 118.814(12) 3_655 3_655
Ag36 Pt4 Ag38 62.365(12) 3_655 3_655
Ag36 Pt4 Ag38 117.637(12) . 3_655
Ag34 Pt4 Ag38 63.274(12) 3_655 .
Ag34 Pt4 Ag38 116.726(12) . .
Ag39 Pt4 Ag38 65.615(12) . .
Ag39 Pt4 Ag38 114.385(12) 3_655 .
Ag35 Pt4 Ag38 118.047(12) 3_655 .
Ag35 Pt4 Ag38 61.956(12) . .
Ag37 Pt4 Ag38 118.812(12) . .
Ag37 Pt4 Ag38 61.186(12) 3_655 .
Ag36 Pt4 Ag38 117.634(12) 3_655 .
Ag36 Pt4 Ag38 62.364(12) . .
Ag38 Pt4 Ag38 180.0 3_655 .
S23 Ag23 Pt3 155.65(4) . .
S23 Ag23 Ag28 97.75(4) . .
Pt3 Ag23 Ag28 58.172(12) . .
S23 Ag23 Ag26 136.47(5) . .
Pt3 Ag23 Ag26 58.605(12) . .
Ag28 Ag23 Ag26 108.467(17) . .
S23 Ag23 Ag27 108.11(4) . .
Pt3 Ag23 Ag27 58.967(12) . .
Ag28 Ag23 Ag27 60.655(15) . .
Ag26 Ag23 Ag27 60.424(14) . .
S23 Ag23 Ag24 115.68(5) . .
Pt3 Ag23 Ag24 57.935(12) . .
Ag28 Ag23 Ag24 60.182(15) . .
Ag26 Ag23 Ag24 107.491(17) . .
Ag27 Ag23 Ag24 108.731(17) . .
S23 Ag23 Ag25 142.55(4) . .
Pt3 Ag23 Ag25 58.275(12) . .
Ag28 Ag23 Ag25 108.162(17) . .
Ag26 Ag23 Ag25 59.127(14) . .
Ag27 Ag23 Ag25 108.048(17) . .
Ag24 Ag23 Ag25 59.998(14) . .
S23 Ag23 Ag40 85.39(4) . .
Pt3 Ag23 Ag40 107.777(16) . .
Ag28 Ag23 Ag40 116.791(19) . .
Ag26 Ag23 Ag40 111.152(19) . .
Ag27 Ag23 Ag40 166.360(19) . .
Ag24 Ag23 Ag40 62.027(15) . .
Ag25 Ag23 Ag40 59.069(14) . .
S27 Ag24 Pt3 139.33(4) . .
S27 Ag24 S28 77.28(4) . .
Pt3 Ag24 S28 143.29(3) . .
S27 Ag24 Ag29 139.55(4) . .
Pt3 Ag24 Ag29 59.709(12) . .
S28 Ag24 Ag29 95.34(4) . .
S27 Ag24 Ag30 153.84(4) . .
Pt3 Ag24 Ag30 59.697(12) . .
S28 Ag24 Ag30 85.15(3) . .
Ag29 Ag24 Ag30 60.615(14) . .
S27 Ag24 Ag28 97.28(4) . .
Pt3 Ag24 Ag28 57.770(12) . .
S28 Ag24 Ag28 136.10(4) . .
Ag29 Ag24 Ag28 60.763(14) . .
Ag30 Ag24 Ag28 108.792(17) . .
S27 Ag24 Ag23 82.41(3) . .
Pt3 Ag24 Ag23 57.611(12) . .
S28 Ag24 Ag23 155.75(4) . .
Ag29 Ag24 Ag23 108.752(17) . .
Ag30 Ag24 Ag23 108.740(17) . .
Ag28 Ag24 Ag23 59.353(15) . .
S27 Ag24 Ag25 110.25(4) . .
Pt3 Ag24 Ag25 58.228(12) . .
S28 Ag24 Ag25 115.17(4) . .
Ag29 Ag24 Ag25 108.825(17) . .
Ag30 Ag24 Ag25 60.279(14) . .
Ag28 Ag24 Ag25 107.616(17) . .
Ag23 Ag24 Ag25 60.139(15) . .
S27 Ag24 Ag41 93.62(4) . .
Pt3 Ag24 Ag41 110.316(17) . .
S28 Ag24 Ag41 51.74(4) . .
Ag29 Ag24 Ag41 113.003(18) . .
Ag30 Ag24 Ag41 60.217(14) . .
Ag28 Ag24 Ag41 167.95(2) . .
Ag23 Ag24 Ag41 117.45(2) . .
Ag25 Ag24 Ag41 63.447(15) . .
S27 Ag24 Ag40 51.57(4) . .
Pt3 Ag24 Ag40 106.901(16) . .
S28 Ag24 Ag40 95.38(4) . .
Ag29 Ag24 Ag40 166.455(19) . .
Ag30 Ag24 Ag40 112.185(19) . .
Ag28 Ag24 Ag40 115.350(18) . .
Ag23 Ag24 Ag40 61.253(14) . .
Ag25 Ag24 Ag40 58.850(14) . .
Ag41 Ag24 Ag40 68.068(15) . .
S26 Ag25 Pt3 158.02(4) . .
S26 Ag25 Ag31 102.37(4) . .
Pt3 Ag25 Ag31 58.171(12) . .
S26 Ag25 Ag26 104.15(4) . .
Pt3 Ag25 Ag26 58.614(12) . .
Ag31 Ag25 Ag26 60.040(14) . .
S26 Ag25 Ag30 122.92(4) . .
Pt3 Ag25 Ag30 59.180(12) . .
Ag31 Ag25 Ag30 60.338(14) . .
Ag26 Ag25 Ag30 109.049(17) . .
S26 Ag25 Ag24 144.18(4) . .
Pt3 Ag25 Ag24 57.597(12) . .
Ag31 Ag25 Ag24 106.977(17) . .
Ag26 Ag25 Ag24 108.062(18) . .
Ag30 Ag25 Ag24 59.425(14) . .
S26 Ag25 Ag23 128.96(4) . .
Pt3 Ag25 Ag23 57.322(12) . .
Ag31 Ag25 Ag23 107.171(17) . .
Ag26 Ag25 Ag23 59.977(14) . .
Ag30 Ag25 Ag23 107.833(18) . .
Ag24 Ag25 Ag23 59.862(15) . .
S26 Ag25 Ag40 89.15(4) . .
Pt3 Ag25 Ag40 110.051(18) . .
Ag31 Ag25 Ag40 168.22(2) . .
Ag26 Ag25 Ag40 115.065(18) . .
Ag30 Ag25 Ag40 115.309(18) . .
Ag24 Ag25 Ag40 63.291(15) . .
Ag23 Ag25 Ag40 62.730(15) . .
S26 Ag25 Ag41 90.52(4) . .
Pt3 Ag25 Ag41 106.254(16) . .
Ag31 Ag25 Ag41 113.692(17) . .
Ag26 Ag25 Ag41 164.87(2) . .
Ag30 Ag25 Ag41 58.480(14) . .
Ag24 Ag25 Ag41 59.107(14) . .
Ag23 Ag25 Ag41 113.334(18) . .
Ag40 Ag25 Ag41 68.086(14) . .
S32 Ag26 Pt3 145.01(4) . .
S32 Ag26 S31 75.60(5) . .
Pt3 Ag26 S31 139.34(3) . .
S32 Ag26 Ag31 152.79(4) . .
Pt3 Ag26 Ag31 57.976(12) . .
S31 Ag26 Ag31 82.75(3) . .
S32 Ag26 Ag25 137.48(4) . .
Pt3 Ag26 Ag25 58.616(12) . .
S31 Ag26 Ag25 94.11(3) . .
Ag31 Ag26 Ag25 59.474(14) . .
S32 Ag26 Ag23 99.68(4) . .
Pt3 Ag26 Ag23 57.643(12) . .
S31 Ag26 Ag23 137.95(4) . .
Ag31 Ag26 Ag23 107.450(17) . .
Ag25 Ag26 Ag23 60.896(14) . .
S32 Ag26 Ag27 87.60(4) . .
Pt3 Ag26 Ag27 58.498(12) . .
S31 Ag26 Ag27 156.78(4) . .
Ag31 Ag26 Ag27 107.606(17) . .
Ag25 Ag26 Ag27 109.080(18) . .
Ag23 Ag26 Ag27 59.947(15) . .
S32 Ag26 Ag32 114.65(4) . .
Pt3 Ag26 Ag32 57.726(12) . .
S31 Ag26 Ag32 113.07(3) . .
Ag31 Ag26 Ag32 59.486(14) . .
Ag25 Ag26 Ag32 107.390(17) . .
Ag23 Ag26 Ag32 106.836(18) . .
Ag27 Ag26 Ag32 59.529(14) . .
S32 Ag26 Ag43 53.87(3) . .
Pt3 Ag26 Ag43 109.657(17) . .
S31 Ag26 Ag43 93.89(3) . .
Ag31 Ag26 Ag43 112.554(17) . .
Ag25 Ag26 Ag43 167.79(2) . .
Ag23 Ag26 Ag43 117.318(19) . .
Ag27 Ag26 Ag43 63.036(15) . .
Ag32 Ag26 Ag43 60.856(14) . .
S32 Ag26 Ag42 92.97(4) . .
Pt3 Ag26 Ag42 108.346(16) . .
S31 Ag26 Ag42 51.43(3) . .
Ag31 Ag26 Ag42 60.322(14) . .
Ag25 Ag26 Ag42 112.759(18) . .
Ag23 Ag26 Ag42 165.972(19) . .
Ag27 Ag26 Ag42 115.041(18) . .
Ag32 Ag26 Ag42 61.832(14) . .
Ag43 Ag26 Ag42 65.920(15) . .
S34 Ag27 Pt3 148.61(4) . .
S34 Ag27 Ag33 142.34(4) . .
Pt3 Ag27 Ag33 58.287(12) . .
S34 Ag27 Ag23 91.31(4) . .
Pt3 Ag27 Ag23 57.321(12) . .
Ag33 Ag27 Ag23 106.746(17) . .
S34 Ag27 Ag32 145.71(4) . .
Pt3 Ag27 Ag32 57.867(12) . .
Ag33 Ag27 Ag32 59.662(14) . .
Ag23 Ag27 Ag32 107.356(17) . .
S34 Ag27 Ag26 109.68(4) . .
Pt3 Ag27 Ag26 57.814(12) . .
Ag33 Ag27 Ag26 107.959(17) . .
Ag23 Ag27 Ag26 59.629(15) . .
Ag32 Ag27 Ag26 60.509(14) . .
S34 Ag27 Ag28 108.12(4) . .
Pt3 Ag27 Ag28 57.179(12) . .
Ag33 Ag27 Ag28 58.817(14) . .
Ag23 Ag27 Ag28 59.272(15) . .
Ag32 Ag27 Ag28 106.151(16) . .
Ag26 Ag27 Ag28 106.748(17) . .
S34 Ag27 S33 75.11(5) . .
Pt3 Ag27 S33 134.58(3) . .
Ag33 Ag27 S33 94.87(3) . .
Ag23 Ag27 S33 157.23(4) . .
Ag32 Ag27 S33 77.22(3) . .
Ag26 Ag27 S33 107.33(3) . .
Ag28 Ag27 S33 142.09(4) . .
S34 Ag27 Ag43 86.68(4) . .
Pt3 Ag27 Ag43 105.689(16) . .
Ag33 Ag27 Ag43 114.235(18) . .
Ag23 Ag27 Ag43 113.237(19) . .
Ag32 Ag27 Ag43 59.728(14) . .
Ag26 Ag27 Ag43 58.815(14) . .
Ag28 Ag27 Ag43 162.868(19) . .
S33 Ag27 Ag43 48.94(3) . .
S36 Ag28 Pt3 153.60(4) . .
S36 Ag28 Ag33 147.29(4) . .
Pt3 Ag28 Ag33 59.086(12) . .
S36 Ag28 Ag23 100.42(4) . .
Pt3 Ag28 Ag23 58.086(13) . .
Ag33 Ag28 Ag23 108.046(18) . .
S36 Ag28 Ag24 99.23(4) . .
Pt3 Ag28 Ag24 58.011(12) . .
Ag33 Ag28 Ag24 108.558(17) . .
Ag23 Ag28 Ag24 60.465(15) . .
S36 Ag28 Ag29 123.55(4) . .
Pt3 Ag28 Ag29 59.139(12) . .
Ag33 Ag28 Ag29 61.972(14) . .
Ag23 Ag28 Ag29 108.246(18) . .
Ag24 Ag28 Ag29 59.023(14) . .
S36 Ag28 Ag27 127.02(4) . .
Pt3 Ag28 Ag27 58.728(12) . .
Ag33 Ag28 Ag27 59.634(14) . .
Ag23 Ag28 Ag27 60.073(15) . .
Ag24 Ag28 Ag27 108.494(18) . .
Ag29 Ag28 Ag27 109.431(17) . .
S36 Ag28 Ag44 90.67(4) . .
Pt3 Ag28 Ag44 110.171(16) . .
Ag33 Ag28 Ag44 62.596(15) . .
Ag23 Ag28 Ag44 168.24(2) . .
Ag24 Ag28 Ag44 114.177(18) . .
Ag29 Ag28 Ag44 61.668(15) . .
Ag27 Ag28 Ag44 115.834(19) . .
S40 Ag29 Pt3 160.95(4) . .
S40 Ag29 Ag34 105.44(4) . .
Pt3 Ag29 Ag34 57.198(12) . .
S40 Ag29 Ag24 129.03(4) . .
Pt3 Ag29 Ag24 57.769(12) . .
Ag34 Ag29 Ag24 106.384(18) . .
S40 Ag29 Ag30 106.91(4) . .
Pt3 Ag29 Ag30 58.893(12) . .
Ag34 Ag29 Ag30 59.375(14) . .
Ag24 Ag29 Ag30 60.062(14) . .
S40 Ag29 Ag28 141.64(4) . .
Pt3 Ag29 Ag28 57.007(12) . .
Ag34 Ag29 Ag28 105.759(17) . .
Ag24 Ag29 Ag28 60.214(14) . .
Ag30 Ag29 Ag28 107.925(17) . .
S40 Ag29 Ag33 124.16(4) . .
Pt3 Ag29 Ag33 56.903(12) . .
Ag34 Ag29 Ag33 60.025(14) . .
Ag24 Ag29 Ag33 106.122(17) . .
Ag30 Ag29 Ag33 107.602(17) . .
Ag28 Ag29 Ag33 57.715(14) . .
S40 Ag29 Ag44 87.40(4) . .
Pt3 Ag29 Ag44 106.517(16) . .
Ag34 Ag29 Ag44 114.777(18) . .
Ag24 Ag29 Ag44 113.188(18) . .
Ag30 Ag29 Ag44 165.399(19) . .
Ag28 Ag29 Ag44 59.360(14) . .
Ag33 Ag29 Ag44 60.375(14) . .
S40 Ag29 Ag38 54.65(3) . 3_655
Pt3 Ag29 Ag38 112.698(15) . 3_655
Ag34 Ag29 Ag38 58.212(13) . 3_655
Ag24 Ag29 Ag38 161.31(2) . 3_655
Ag30 Ag29 Ag38 101.337(16) . 3_655
Ag28 Ag29 Ag38 130.911(18) . 3_655
Ag33 Ag29 Ag38 76.407(14) . 3_655
Ag44 Ag29 Ag38 84.419(16) . 3_655
S29 Ag30 Pt3 143.96(4) . .
S29 Ag30 Ag34 139.34(4) . .
Pt3 Ag30 Ag34 56.780(11) . .
S29 Ag30 Ag24 114.77(4) . .
Pt3 Ag30 Ag24 57.399(12) . .
Ag34 Ag30 Ag24 105.105(17) . .
S29 Ag30 Ag31 99.49(4) . .
Pt3 Ag30 Ag31 57.026(12) . .
Ag34 Ag30 Ag31 60.380(14) . .
Ag24 Ag30 Ag31 106.245(17) . .
S29 Ag30 Ag29 153.16(4) . .
Pt3 Ag30 Ag29 58.518(12) . .
Ag34 Ag30 Ag29 58.482(14) . .
Ag24 Ag30 Ag29 59.323(14) . .
Ag31 Ag30 Ag29 107.309(16) . .
S29 Ag30 Ag25 87.38(3) . .
Pt3 Ag30 Ag25 57.541(12) . .
Ag34 Ag30 Ag25 106.434(16) . .
Ag24 Ag30 Ag25 60.297(14) . .
Ag31 Ag30 Ag25 58.529(14) . .
Ag29 Ag30 Ag25 107.814(17) . .
S29 Ag30 Ag41 53.65(3) . .
Pt3 Ag30 Ag41 109.245(16) . .
Ag34 Ag30 Ag41 165.594(19) . .
Ag24 Ag30 Ag41 61.213(14) . .
Ag31 Ag30 Ag41 116.875(18) . .
Ag29 Ag30 Ag41 112.753(18) . .
Ag25 Ag30 Ag41 63.808(14) . .
S29 Ag30 Ag39 96.05(3) . 3_655
Pt3 Ag30 Ag39 114.851(16) . 3_655
Ag34 Ag30 Ag39 60.189(13) . 3_655
Ag24 Ag30 Ag39 132.03(2) . 3_655
Ag31 Ag30 Ag39 103.537(16) . 3_655
Ag29 Ag30 Ag39 76.387(15) . 3_655
Ag25 Ag30 Ag39 162.063(19) . 3_655
Ag41 Ag30 Ag39 131.585(18) . 3_655
S41 Ag31 Pt3 149.92(4) . .
S41 Ag31 Ag25 103.12(3) . .
Pt3 Ag31 Ag25 59.343(13) . .
S41 Ag31 Ag26 137.02(4) . .
Pt3 Ag31 Ag26 59.136(12) . .
Ag25 Ag31 Ag26 60.486(14) . .
S41 Ag31 Ag32 146.67(4) . .
Pt3 Ag31 Ag32 58.822(12) . .
Ag25 Ag31 Ag32 109.871(17) . .
Ag26 Ag31 Ag32 61.592(14) . .
S41 Ag31 Ag34 114.43(3) . .
Pt3 Ag31 Ag34 57.074(12) . .
Ag25 Ag31 Ag34 107.168(17) . .
Ag26 Ag31 Ag34 108.486(17) . .
Ag32 Ag31 Ag34 60.120(14) . .
S41 Ag31 Ag30 90.65(3) . .
Pt3 Ag31 Ag30 59.825(12) . .
Ag25 Ag31 Ag30 61.133(14) . .
Ag26 Ag31 Ag30 110.044(17) . .
Ag32 Ag31 Ag30 109.105(18) . .
Ag34 Ag31 Ag30 58.705(14) . .
S41 Ag31 Ag35 55.35(3) . .
Pt3 Ag31 Ag35 113.570(17) . .
Ag25 Ag31 Ag35 127.773(18) . .
Ag26 Ag31 Ag35 166.36(2) . .
Ag32 Ag31 Ag35 104.886(17) . .
Ag34 Ag31 Ag35 60.010(14) . .
Ag30 Ag31 Ag35 71.373(14) . .
S41 Ag31 Ag42 98.83(3) . .
Pt3 Ag31 Ag42 110.630(16) . .
Ag25 Ag31 Ag42 115.040(18) . .
Ag26 Ag31 Ag42 61.938(14) . .
Ag32 Ag31 Ag42 63.088(14) . .
Ag34 Ag31 Ag42 117.362(18) . .
Ag30 Ag31 Ag42 170.45(2) . .
Ag35 Ag31 Ag42 115.076(17) . .
S43 Ag32 Pt3 162.68(4) . .
S43 Ag32 Ag33 108.20(4) . .
Pt3 Ag32 Ag33 58.494(12) . .
S43 Ag32 Ag31 124.49(4) . .
Pt3 Ag32 Ag31 57.820(12) . .
Ag33 Ag32 Ag31 108.630(17) . .
S43 Ag32 Ag34 107.97(3) . .
Pt3 Ag32 Ag34 56.743(11) . .
Ag33 Ag32 Ag34 60.315(14) . .
Ag31 Ag32 Ag34 60.028(14) . .
S43 Ag32 Ag27 126.76(4) . .
Pt3 Ag32 Ag27 58.702(12) . .
Ag33 Ag32 Ag27 59.498(14) . .
Ag31 Ag32 Ag27 107.502(17) . .
Ag34 Ag32 Ag27 107.081(16) . .
S43 Ag32 Ag26 139.34(4) . .
Pt3 Ag32 Ag26 57.871(12) . .
Ag33 Ag32 Ag26 107.395(17) . .
Ag31 Ag32 Ag26 58.922(14) . .
Ag34 Ag32 Ag26 106.328(16) . .
Ag27 Ag32 Ag26 59.962(14) . .
S43 Ag32 Ag43 86.83(3) . .
Pt3 Ag32 Ag43 108.758(16) . .
Ag33 Ag32 Ag43 116.818(18) . .
Ag31 Ag32 Ag43 111.031(18) . .
Ag34 Ag32 Ag43 165.165(18) . .
Ag27 Ag32 Ag43 62.754(14) . .
Ag26 Ag32 Ag43 59.653(14) . .
S43 Ag32 Ag36 59.48(3) . .
Pt3 Ag32 Ag36 111.471(15) . .
Ag33 Ag32 Ag36 107.413(17) . .
Ag31 Ag32 Ag36 70.673(14) . .
Ag34 Ag32 Ag36 59.637(13) . .
Ag27 Ag32 Ag36 166.045(19) . .
Ag26 Ag32 Ag36 125.343(18) . .
Ag43 Ag32 Ag36 131.131(18) . .
S43 Ag32 Ag42 86.35(4) . .
Pt3 Ag32 Ag42 106.842(16) . .
Ag33 Ag32 Ag42 165.305(18) . .
Ag31 Ag32 Ag42 59.445(14) . .
Ag34 Ag32 Ag42 114.018(17) . .
Ag27 Ag32 Ag42 113.666(17) . .
Ag26 Ag32 Ag42 59.848(14) . .
Ag43 Ag32 Ag42 64.761(14) . .
Ag36 Ag32 Ag42 77.809(15) . .
S38 Ag33 Pt3 151.48(4) . .
S38 Ag33 Ag28 146.47(4) . .
Pt3 Ag33 Ag28 58.403(13) . .
S38 Ag33 Ag27 113.64(4) . .
Pt3 Ag33 Ag27 59.202(12) . .
Ag28 Ag33 Ag27 61.550(15) . .
S38 Ag33 Ag32 93.32(4) . .
Pt3 Ag33 Ag32 58.559(12) . .
Ag28 Ag33 Ag32 109.213(18) . .
Ag27 Ag33 Ag32 60.840(14) . .
S38 Ag33 Ag34 107.19(3) . .
Pt3 Ag33 Ag34 56.660(12) . .
Ag28 Ag33 Ag34 105.555(17) . .
Ag27 Ag33 Ag34 107.898(18) . .
Ag32 Ag33 Ag34 60.018(14) . .
S38 Ag33 Ag29 136.73(4) . .
Pt3 Ag33 Ag29 58.345(12) . .
Ag28 Ag33 Ag29 60.313(14) . .
Ag27 Ag33 Ag29 109.629(17) . .
Ag32 Ag33 Ag29 107.229(17) . .
Ag34 Ag33 Ag29 57.164(13) . .
S38 Ag33 Ag44 100.22(4) . .
Pt3 Ag33 Ag44 107.659(16) . .
Ag28 Ag33 Ag44 60.175(15) . .
Ag27 Ag33 Ag44 115.385(18) . .
Ag32 Ag33 Ag44 166.096(19) . .
Ag34 Ag33 Ag44 112.187(17) . .
Ag29 Ag33 Ag44 60.348(14) . .
S38 Ag33 Ag37 52.06(3) . .
Pt3 Ag33 Ag37 109.461(15) . .
Ag28 Ag33 Ag37 157.605(18) . .
Ag27 Ag33 Ag37 131.555(18) . .
Ag32 Ag33 Ag37 73.256(14) . .
Ag34 Ag33 Ag37 55.424(13) . .
Ag29 Ag33 Ag37 97.424(15) . .
Ag44 Ag33 Ag37 112.857(17) . .
Pt4 Ag34 Pt3 174.025(18) . .
Pt4 Ag34 Ag29 123.249(16) . .
Pt3 Ag34 Ag29 61.208(12) . .
Pt4 Ag34 Ag37 60.894(11) . .
Pt3 Ag34 Ag37 122.613(16) . .
Ag29 Ag34 Ag37 109.798(18) . .
Pt4 Ag34 Ag30 116.418(15) . .
Pt3 Ag34 Ag30 61.128(12) . .
Ag29 Ag34 Ag30 62.143(15) . .
Ag37 Ag34 Ag30 169.32(2) . .
Pt4 Ag34 Ag31 115.543(16) . .
Pt3 Ag34 Ag31 58.499(12) . .
Ag29 Ag34 Ag31 110.635(17) . .
Ag37 Ag34 Ag31 129.767(18) . .
Ag30 Ag34 Ag31 60.915(14) . .
Pt4 Ag34 Ag32 119.206(15) . .
Pt3 Ag34 Ag32 59.166(11) . .
Ag29 Ag34 Ag32 111.563(17) . .
Ag37 Ag34 Ag32 78.331(15) . .
Ag30 Ag34 Ag32 110.709(17) . .
Ag31 Ag34 Ag32 59.852(14) . .
Pt4 Ag34 Ag33 125.926(17) . .
Pt3 Ag34 Ag33 59.008(12) . .
Ag29 Ag34 Ag33 62.811(14) . .
Ag37 Ag34 Ag33 67.011(14) . .
Ag30 Ag34 Ag33 111.965(17) . .
Ag31 Ag34 Ag33 107.971(16) . .
Ag32 Ag34 Ag33 59.667(14) . .
Pt4 Ag34 Ag38 61.458(11) . 3_655
Pt3 Ag34 Ag38 124.234(17) . 3_655
Ag29 Ag34 Ag38 66.467(15) . 3_655
Ag37 Ag34 Ag38 60.187(14) . 3_655
Ag30 Ag34 Ag38 109.188(17) . 3_655
Ag31 Ag34 Ag38 168.157(19) . 3_655
Ag32 Ag34 Ag38 131.975(18) . 3_655
Ag33 Ag34 Ag38 81.301(16) . 3_655
Pt4 Ag34 Ag35 58.650(11) . .
Pt3 Ag34 Ag35 115.659(17) . .
Ag29 Ag34 Ag35 128.984(18) . .
Ag37 Ag34 Ag35 111.243(17) . .
Ag30 Ag34 Ag35 72.628(15) . .
Ag31 Ag34 Ag35 60.826(14) . .
Ag32 Ag34 Ag35 105.296(17) . .
Ag33 Ag34 Ag35 164.943(19) . .
Ag38 Ag34 Ag35 111.287(16) 3_655 .
Pt4 Ag34 Ag36 60.519(11) . .
Pt3 Ag34 Ag36 115.698(16) . .
Ag29 Ag34 Ag36 171.473(19) . .
Ag37 Ag34 Ag36 64.445(14) . .
Ag30 Ag34 Ag36 124.370(19) . .
Ag31 Ag34 Ag36 71.536(15) . .
Ag32 Ag34 Ag36 61.887(13) . .
Ag33 Ag34 Ag36 108.674(17) . .
Ag38 Ag34 Ag36 113.130(17) 3_655 .
Ag35 Ag34 Ag36 59.465(14) . .
Pt4 Ag34 Ag39 58.112(11) . 3_655
Pt3 Ag34 Ag39 121.603(16) . 3_655
Ag29 Ag34 Ag39 79.241(15) . 3_655
Ag37 Ag34 Ag39 109.853(17) . 3_655
Ag30 Ag34 Ag39 62.910(14) . 3_655
Ag31 Ag34 Ag39 105.873(17) . 3_655
Ag32 Ag34 Ag39 164.01(2) . 3_655
Ag33 Ag34 Ag39 135.850(19) . 3_655
Ag38 Ag34 Ag39 62.505(14) 3_655 3_655
Ag35 Ag34 Ag39 59.202(14) . 3_655
Ag36 Ag34 Ag39 108.373(16) . 3_655
S41 Ag35 Pt4 163.95(3) . .
S41 Ag35 Ag37 135.73(3) . 3_655
Pt4 Ag35 Ag37 59.676(12) . 3_655
S41 Ag35 Ag38 119.17(3) . .
Pt4 Ag35 Ag38 60.970(12) . .
Ag37 Ag35 Ag38 60.047(14) 3_655 .
S41 Ag35 Ag39 129.60(3) . 3_655
Pt4 Ag35 Ag39 58.034(11) . 3_655
Ag37 Ag35 Ag39 59.988(14) 3_655 3_655
Ag38 Ag35 Ag39 109.012(17) . 3_655
S41 Ag35 Ag36 104.94(3) . .
Pt4 Ag35 Ag36 60.171(12) . .
Ag37 Ag35 Ag36 109.769(17) 3_655 .
Ag38 Ag35 Ag36 61.262(14) . .
Ag39 Ag35 Ag36 110.567(18) 3_655 .
S41 Ag35 Ag34 112.47(3) . .
Pt4 Ag35 Ag34 56.329(11) . .
Ag37 Ag35 Ag34 108.214(17) 3_655 .
Ag38 Ag35 Ag34 108.699(17) . .
Ag39 Ag35 Ag34 60.866(14) 3_655 .
Ag36 Ag35 Ag34 60.489(14) . .
S41 Ag35 Ag31 54.20(3) . .
Pt4 Ag35 Ag31 111.844(16) . .
Ag37 Ag35 Ag31 165.61(2) 3_655 .
Ag38 Ag35 Ag31 128.203(18) . .
Ag39 Ag35 Ag31 105.875(17) 3_655 .
Ag36 Ag35 Ag31 71.271(14) . .
Ag34 Ag35 Ag31 59.164(13) . .
S42 Ag36 S43 95.61(4) . .
S42 Ag36 Pt4 136.99(3) . .
S43 Ag36 Pt4 127.40(3) . .
S42 Ag36 Ag39 131.47(3) . .
S43 Ag36 Ag39 91.79(3) . .
Pt4 Ag36 Ag39 57.109(11) . .
S42 Ag36 Ag35 83.81(3) . .
S43 Ag36 Ag35 155.36(3) . .
Pt4 Ag36 Ag35 57.261(11) . .
Ag39 Ag36 Ag35 107.084(16) . .
S42 Ag36 Ag34 122.57(3) . .
S43 Ag36 Ag34 101.06(3) . .
Pt4 Ag36 Ag34 55.340(10) . .
Ag39 Ag36 Ag34 102.640(17) . .
Ag35 Ag36 Ag34 60.046(14) . .
S42 Ag36 Ag38 86.52(3) . .
S43 Ag36 Ag38 145.44(3) . .
Pt4 Ag36 Ag38 59.291(11) . .
Ag39 Ag36 Ag38 62.588(14) . .
Ag35 Ag36 Ag38 59.199(14) . .
Ag34 Ag36 Ag38 106.738(16) . .
S42 Ag36 Ag32 93.78(3) . .
S43 Ag36 Ag32 52.20(3) . .
Pt4 Ag36 Ag32 111.101(15) . .
Ag39 Ag36 Ag32 127.032(19) . .
Ag35 Ag36 Ag32 103.188(16) . .
Ag34 Ag36 Ag32 58.476(13) . .
Ag38 Ag36 Ag32 162.283(19) . .
S42 Ag36 Ag37 165.41(3) . .
S43 Ag36 Ag37 71.39(3) . .
Pt4 Ag36 Ag37 56.306(11) . .
Ag39 Ag36 Ag37 57.589(14) . .
Ag35 Ag36 Ag37 105.159(16) . .
Ag34 Ag36 Ag37 56.236(13) . .
Ag38 Ag36 Ag37 107.908(17) . .
Ag32 Ag36 Ag37 73.160(14) . .
S38 Ag37 Pt4 163.24(4) . .
S38 Ag37 Ag34 108.58(3) . .
Pt4 Ag37 Ag34 56.830(11) . .
S38 Ag37 Ag35 126.99(4) . 3_655
Pt4 Ag37 Ag35 58.058(11) . 3_655
Ag34 Ag37 Ag35 106.834(17) . 3_655
S38 Ag37 Ag39 138.93(4) . .
Pt4 Ag37 Ag39 57.718(11) . .
Ag34 Ag37 Ag39 105.569(17) . .
Ag35 Ag37 Ag39 60.506(14) 3_655 .
S38 Ag37 Ag38 106.39(4) . 3_655
Pt4 Ag37 Ag38 60.558(12) . 3_655
Ag34 Ag37 Ag38 61.258(14) . 3_655
Ag35 Ag37 Ag38 60.370(14) 3_655 3_655
Ag39 Ag37 Ag38 109.691(17) . 3_655
S38 Ag37 Ag36 124.93(4) . .
Pt4 Ag37 Ag36 57.521(11) . .
Ag34 Ag37 Ag36 59.319(14) . .
Ag35 Ag37 Ag36 106.823(16) 3_655 .
Ag39 Ag37 Ag36 58.137(14) . .
Ag38 Ag37 Ag36 109.854(17) 3_655 .
S38 Ag37 Ag33 51.32(3) . .
Pt4 Ag37 Ag33 112.879(15) . .
Ag34 Ag37 Ag33 57.565(13) . .
Ag35 Ag37 Ag33 135.808(18) 3_655 .
Ag39 Ag37 Ag33 156.939(19) . .
Ag38 Ag37 Ag33 77.400(15) 3_655 .
Ag36 Ag37 Ag33 98.824(16) . .
S40 Ag38 S37 87.93(5) 3_655 3_655
S40 Ag38 Pt4 128.24(4) 3_655 .
S37 Ag38 Pt4 141.59(3) 3_655 .
S40 Ag38 Ag37 151.90(4) 3_655 3_655
S37 Ag38 Ag37 83.85(3) 3_655 3_655
Pt4 Ag38 Ag37 58.256(11) . 3_655
S40 Ag38 Ag35 148.52(4) 3_655 .
S37 Ag38 Ag35 100.20(3) 3_655 .
Pt4 Ag38 Ag35 57.074(11) . .
Ag37 Ag38 Ag35 59.580(14) 3_655 .
S40 Ag38 Ag34 100.66(4) 3_655 3_655
S37 Ag38 Ag34 112.05(3) 3_655 3_655
Pt4 Ag38 Ag34 55.267(11) . 3_655
Ag37 Ag38 Ag34 58.556(14) 3_655 3_655
Ag35 Ag38 Ag34 104.173(17) . 3_655
S40 Ag38 Ag36 95.29(3) 3_655 .
S37 Ag38 Ag36 140.79(4) 3_655 .
Pt4 Ag38 Ag36 58.346(11) . .
Ag37 Ag38 Ag36 108.005(17) 3_655 .
Ag35 Ag38 Ag36 59.538(14) . .
Ag34 Ag38 Ag36 105.725(17) 3_655 .
S40 Ag38 Ag39 73.00(4) 3_655 .
S37 Ag38 Ag39 155.93(3) 3_655 .
Pt4 Ag38 Ag39 55.252(11) . .
Ag37 Ag38 Ag39 106.021(17) 3_655 .
Ag35 Ag38 Ag39 103.722(17) . .
Ag34 Ag38 Ag39 59.288(13) 3_655 .
Ag36 Ag38 Ag39 57.864(14) . .
S40 Ag38 Ag29 52.10(3) 3_655 3_655
S37 Ag38 Ag29 83.77(3) 3_655 3_655
Pt4 Ag38 Ag29 107.215(15) . 3_655
Ag37 Ag38 Ag29 100.192(16) 3_655 3_655
Ag35 Ag38 Ag29 158.386(19) . 3_655
Ag34 Ag38 Ag29 55.321(13) 3_655 3_655
Ag36 Ag38 Ag29 128.066(18) . 3_655
Ag39 Ag38 Ag29 72.986(14) . 3_655
S30 Ag39 Pt4 175.09(4) . .
S30 Ag39 Ag37 125.16(4) . .
Pt4 Ag39 Ag37 59.588(11) . .
S30 Ag39 Ag35 121.99(4) . 3_655
Pt4 Ag39 Ag35 58.293(11) . 3_655
Ag37 Ag39 Ag35 59.511(14) . 3_655
S30 Ag39 Ag36 121.96(4) . .
Pt4 Ag39 Ag36 60.284(11) . .
Ag37 Ag39 Ag36 64.274(14) . .
Ag35 Ag39 Ag36 110.892(17) 3_655 .
S30 Ag39 Ag34 119.36(4) . 3_655
Pt4 Ag39 Ag34 56.076(10) . 3_655
Ag37 Ag39 Ag34 107.106(16) . 3_655
Ag35 Ag39 Ag34 59.934(14) 3_655 3_655
Ag36 Ag39 Ag34 106.210(16) . 3_655
S30 Ag39 Ag30 67.51(4) . 3_655
Pt4 Ag39 Ag30 108.997(15) . 3_655
Ag37 Ag39 Ag30 126.438(19) . 3_655
Ag35 Ag39 Ag30 70.392(15) 3_655 3_655
Ag36 Ag39 Ag30 160.751(19) . 3_655
Ag34 Ag39 Ag30 56.897(13) 3_655 3_655
S30 Ag39 Ag38 117.54(4) . .
Pt4 Ag39 Ag38 59.133(11) . .
Ag37 Ag39 Ag38 110.753(17) . .
Ag35 Ag39 Ag38 108.345(16) 3_655 .
Ag36 Ag39 Ag38 59.548(14) . .
Ag34 Ag39 Ag38 58.207(13) 3_655 .
Ag30 Ag39 Ag38 101.425(16) 3_655 .
S24 Ag40 S27 129.09(5) . .
S24 Ag40 S25 115.48(6) . .
S27 Ag40 S25 111.49(5) . .
S24 Ag40 Ag25 88.61(4) . .
S27 Ag40 Ag25 114.11(4) . .
S25 Ag40 Ag25 85.23(4) . .
S24 Ag40 Ag23 72.02(4) . .
S27 Ag40 Ag23 82.30(4) . .
S25 Ag40 Ag23 143.08(4) . .
Ag25 Ag40 Ag23 58.201(14) . .
S24 Ag40 Ag24 127.83(4) . .
S27 Ag40 Ag24 56.44(4) . .
S25 Ag40 Ag24 101.32(4) . .
Ag25 Ag40 Ag24 57.859(14) . .
Ag23 Ag40 Ag24 56.719(14) . .
S25 Ag41 S28 115.64(5) . .
S25 Ag41 S29 120.84(5) . .
S28 Ag41 S29 121.02(5) . .
S25 Ag41 Ag30 140.85(4) . .
S28 Ag41 Ag30 88.82(4) . .
S29 Ag41 Ag30 56.97(3) . .
S25 Ag41 Ag24 106.18(4) . .
S28 Ag41 Ag24 59.82(4) . .
S29 Ag41 Ag24 115.45(4) . .
Ag30 Ag41 Ag24 58.570(14) . .
S25 Ag41 Ag25 83.41(4) . .
S28 Ag41 Ag25 117.25(4) . .
S29 Ag41 Ag25 85.45(3) . .
Ag30 Ag41 Ag25 57.712(13) . .
Ag24 Ag41 Ag25 57.446(14) . .
S31 Ag42 S42 125.37(5) . .
S31 Ag42 S44 113.00(5) . .
S42 Ag42 S44 107.01(5) . .
S31 Ag42 Ag31 86.56(4) . .
S42 Ag42 Ag31 79.91(3) . .
S44 Ag42 Ag31 146.00(4) . .
S31 Ag42 Ag26 61.01(4) . .
S42 Ag42 Ag26 137.44(4) . .
S44 Ag42 Ag26 106.34(4) . .
Ag31 Ag42 Ag26 57.740(13) . .
S31 Ag42 Ag32 119.11(4) . .
S42 Ag42 Ag32 96.99(4) . .
S44 Ag42 Ag32 88.53(4) . .
Ag31 Ag42 Ag32 57.467(13) . .
Ag26 Ag42 Ag32 58.320(14) . .
S31 Ag42 Ag43 93.49(4) . .
S42 Ag42 Ag43 141.09(4) . .
S44 Ag42 Ag43 50.69(3) . .
Ag31 Ag42 Ag43 102.985(17) . .
Ag26 Ag42 Ag43 56.407(13) . .
Ag32 Ag42 Ag43 56.642(13) . .
S33 Ag43 S44 117.92(5) . .
S33 Ag43 S32 126.98(5) . .
S44 Ag43 S32 110.97(5) . .
S33 Ag43 Ag26 120.26(4) . .
S44 Ag43 Ag26 107.55(4) . .
S32 Ag43 Ag26 57.56(3) . .
S33 Ag43 Ag32 83.10(4) . .
S44 Ag43 Ag32 89.96(3) . .
S32 Ag43 Ag32 116.98(4) . .
Ag26 Ag43 Ag32 59.491(13) . .
S33 Ag43 Ag27 62.66(4) . .
S44 Ag43 Ag27 147.48(4) . .
S32 Ag43 Ag27 86.65(4) . .
Ag26 Ag43 Ag27 58.150(14) . .
Ag32 Ag43 Ag27 57.519(13) . .
S33 Ag43 Ag42 137.28(4) . .
S44 Ag43 Ag42 50.66(3) . .
S32 Ag43 Ag42 89.77(4) . .
Ag26 Ag43 Ag42 57.673(14) . .
Ag32 Ag43 Ag42 58.597(14) . .
Ag27 Ag43 Ag42 104.735(16) . .
S35 Ag44 S39 120.14(5) . .
S35 Ag44 S37 117.03(5) . .
S39 Ag44 S37 119.21(5) . .
S35 Ag44 Ag28 69.25(4) . .
S39 Ag44 Ag28 85.52(5) . .
S37 Ag44 Ag28 134.20(4) . .
S35 Ag44 Ag29 125.87(4) . .
S39 Ag44 Ag29 72.12(5) . .
S37 Ag44 Ag29 90.67(4) . .
Ag28 Ag44 Ag29 58.972(14) . .
S35 Ag44 Ag33 80.80(4) . .
S39 Ag44 Ag33 128.86(5) . .
S37 Ag44 Ag33 78.29(4) . .
Ag28 Ag44 Ag33 57.228(14) . .
Ag29 Ag44 Ag33 59.277(14) . .
O23 C67 C68 108.3(6) . .
C67 C68 C69 114.7(6) . .
C71 C70 O24 113.3(9) . .
C70 C71 C72 116.2(12) . .
O25 C73 C74 109.6(6) . .
C73 C74 C75 111.8(6) . .
O26 C76 C77 108.4(6) . .
C76 C77 C78 113.4(8) . .
C80 C79 O27 115.1(9) . .
C79 C80 C81 116.7(12) . .
O28 C82 C83 110.7(7) . .
C84 C83 C82 112.5(15) . .
O29 C85 C86 107.8(5) . .
C85 C86 C87 110.5(5) . .
C89 C88 O30 112.6(7) . .
C90 C89 C88 126.7(12) . .
C92 C91 O31 112.1(7) . .
C91 C92 C93 131.3(10) . .
C95 C94 O32 112.0(8) . .
C96 C95 C94 122.8(10) . .
C98 C97 O33 116.1(8) . .
C97 C98 C99 109.3(10) . .
O34 C100 C101 108.1(5) . .
C100 C101 C102 111.2(6) . .
O35 C103 C104 108.4(6) . .
C103 C104 C105 111.0(6) . .
O36 C106 C107 112.5(7) . .
C108 C107 C106 114.6(8) . .
O37 C109 C110 114.2(6) . .
C109 C110 C111 110.1(7) . .
O38 C112 C113 108.0(5) . .
C114 C113 C112 112.4(8) . .
O39 C115 C116 109.9(5) . .
C115 C116 C117 112.2(6) . .
C119 C118 O40 114.7(8) . .
C120 C119 C118 117.8(11) . .
O41 C121 C122 108.2(5) . .
C121 C122 C123 112.0(6) . .
O42 C124 C125 108.3(5) . .
C126 C125 C124 111.8(7) . .
O43 C127 C128 109.4(5) . .
C129 C128 C127 113.4(6) . .
C131 C130 O44 109.5(6) . .
C130 C131 C132 118.7(8) . .
C67 O23 P12 120.2(4) . .
C70 O24 P12 119.9(5) . .
C73 O25 P13 122.1(4) . .
C76 O26 P13 121.4(4) . .
C79 O27 P14 121.1(5) . .
C82 O28 P14 126.8(5) . .
C85 O29 P15 120.8(4) . .
C88 O30 P15 120.9(4) . .
C91 O31 P16 119.1(4) . .
C94 O32 P16 120.0(5) . .
C97 O33 P17 122.5(4) . .
C100 O34 P17 118.7(4) . .
C103 O35 P18 121.2(4) . .
C106 O36 P18 123.3(4) . .
C109 O37 P19 123.3(4) . .
C112 O38 P19 122.1(4) . .
C115 O39 P20 119.0(4) . .
C118 O40 P20 121.9(5) . .
C121 O41 P21 124.3(3) . .
C124 O42 P21 121.5(4) . .
C127 O43 P22 122.1(4) . .
C130 O44 P22 121.1(4) . .
O23 P12 O24 105.4(2) . .
O23 P12 S23 104.48(19) . .
O24 P12 S23 112.7(2) . .
O23 P12 S24 112.65(18) . .
O24 P12 S24 102.7(2) . .
S23 P12 S24 118.45(10) . .
O25 P13 O26 100.1(2) . .
O25 P13 S26 109.81(18) . .
O26 P13 S26 113.20(19) . .
O25 P13 S25 109.17(18) . .
O26 P13 S25 104.27(18) . .
S26 P13 S25 118.59(10) . .
O27 P14 O28 105.8(3) . .
O27 P14 S27 106.95(19) . .
O28 P14 S27 109.91(19) . .
O27 P14 S28 111.88(19) . .
O28 P14 S28 104.12(19) . .
S27 P14 S28 117.56(10) . .
O29 P15 O30 106.7(2) . .
O29 P15 S30 114.73(17) . .
O30 P15 S30 103.83(17) . .
O29 P15 S29 102.40(16) . 3_655
O30 P15 S29 111.13(17) . 3_655
S30 P15 S29 117.76(9) . 3_655
O32 P16 O31 101.5(2) . .
O32 P16 S32 108.27(19) . .
O31 P16 S32 109.95(18) . .
O32 P16 S31 112.74(18) . .
O31 P16 S31 108.29(18) . .
S32 P16 S31 115.21(9) . .
O34 P17 O33 95.5(2) . .
O34 P17 S34 113.42(18) . .
O33 P17 S34 112.46(19) . .
O34 P17 S33 108.17(18) . .
O33 P17 S33 111.08(19) . .
S34 P17 S33 114.56(9) . .
O35 P18 O36 100.2(2) . .
O35 P18 S36 113.74(19) . .
O36 P18 S36 109.9(2) . .
O35 P18 S35 102.55(18) . .
O36 P18 S35 111.4(2) . .
S36 P18 S35 117.52(10) . .
O38 P19 O37 100.1(2) . .
O38 P19 S38 109.56(18) . .
O37 P19 S38 106.11(17) . .
O38 P19 S37 111.41(17) . .
O37 P19 S37 111.70(18) . .
S38 P19 S37 116.58(9) . .
O40 P20 O39 101.1(2) . .
O40 P20 S39 113.31(19) . .
O39 P20 S39 109.17(18) . .
O40 P20 S40 106.93(18) . .
O39 P20 S40 108.85(18) . .
S39 P20 S40 116.37(10) . .
O42 P21 O41 106.3(2) . .
O42 P21 S42 110.54(17) . .
O41 P21 S42 104.91(16) . .
O42 P21 S41 104.28(16) . .
O41 P21 S41 109.83(16) . .
S42 P21 S41 120.27(9) . .
O44 P22 O43 101.5(2) . .
O44 P22 S44 105.57(16) . .
O43 P22 S44 109.38(16) . .
O44 P22 S43 111.49(16) . .
O43 P22 S43 109.02(17) . .
S44 P22 S43 118.55(9) . .
P12 S23 Ag23 93.20(8) . .
P12 S24 Ag40 104.10(8) . .
P13 S25 Ag41 97.08(7) . .
P13 S25 Ag40 105.65(7) . .
Ag41 S25 Ag40 83.80(5) . .
P13 S26 Ag25 106.12(8) . .
P14 S27 Ag40 107.07(8) . .
P14 S27 Ag24 83.37(7) . .
Ag40 S27 Ag24 71.98(4) . .
P14 S28 Ag41 103.26(8) . .
P14 S28 Ag24 81.58(6) . .
Ag41 S28 Ag24 68.44(4) . .
P15 S29 Ag41 99.89(7) 3_655 .
P15 S29 Ag30 90.22(7) 3_655 .
Ag41 S29 Ag30 69.38(4) . .
P15 S30 Ag39 103.05(7) . .
P16 S31 Ag42 102.55(8) . .
P16 S31 Ag26 82.43(7) . .
Ag42 S31 Ag26 67.56(4) . .
P16 S32 Ag43 104.57(7) . .
P16 S32 Ag26 86.74(7) . .
Ag43 S32 Ag26 68.57(4) . .
P17 S33 Ag43 100.68(8) . .
P17 S33 Ag27 78.83(6) . .
Ag43 S33 Ag27 68.40(4) . .
P17 S34 Ag27 90.03(7) . .
P18 S35 Ag44 106.55(8) . .
P18 S36 Ag28 89.87(7) . .
P19 S37 Ag44 99.37(7) . .
P19 S37 Ag38 115.99(8) . 3_655
Ag44 S37 Ag38 101.10(5) . 3_655
P19 S38 Ag33 97.10(7) . .
P19 S38 Ag37 100.56(7) . .
Ag33 S38 Ag37 76.62(4) . .
P20 S39 Ag44 98.42(8) . .
P20 S40 Ag29 96.36(7) . .
P20 S40 Ag38 129.95(8) . 3_655
Ag29 S40 Ag38 73.25(4) . 3_655
P21 S41 Ag31 95.97(7) . .
P21 S41 Ag35 98.43(7) . .
Ag31 S41 Ag35 70.45(4) . .
P21 S42 Ag42 96.22(7) . .
P21 S42 Ag36 115.22(7) . .
Ag42 S42 Ag36 91.39(5) . .
P22 S43 Ag32 110.36(7) . .
P22 S43 Ag36 110.95(7) . .
Ag32 S43 Ag36 68.31(3) . .
P22 S44 Ag42 97.84(7) . .
P22 S44 Ag43 104.08(7) . .
Ag42 S44 Ag43 78.64(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pt1 Ag12 2.6795(4) .
Pt1 Ag1 2.7266(4) .
Pt1 Ag10 2.7404(5) .
Pt1 Ag3 2.7441(5) .
Pt1 Ag2 2.7477(4) .
Pt1 Ag8 2.7535(5) .
Pt1 Ag6 2.7557(5) .
Pt1 Ag5 2.7574(5) .
Pt1 Ag9 2.7696(4) .
Pt1 Ag4 2.7790(4) .
Pt1 Ag11 2.8045(4) .
Pt1 Ag7 2.8127(5) .
Pt2 Ag12 2.6700(4) 3_576
Pt2 Ag12 2.6701(4) .
Pt2 Ag16 2.7353(4) .
Pt2 Ag16 2.7353(4) 3_576
Pt2 Ag17 2.7482(4) 3_576
Pt2 Ag17 2.7482(4) .
Pt2 Ag13 2.7889(4) 3_576
Pt2 Ag13 2.7889(4) .
Pt2 Ag14 2.8265(4) .
Pt2 Ag14 2.8266(4) 3_576
Pt2 Ag15 2.8589(4) .
Pt2 Ag15 2.8590(4) 3_576
Ag1 S1 2.4503(15) .
Ag1 Ag3 2.8953(6) .
Ag1 Ag4 2.8977(6) .
Ag1 Ag2 2.9077(6) .
Ag1 Ag5 2.9092(6) .
Ag1 Ag6 2.9215(6) .
Ag1 Ag18 3.0692(6) .
Ag2 S5 2.6577(16) .
Ag2 S6 2.8754(17) .
Ag2 Ag3 2.8949(6) .
Ag2 Ag7 2.9082(6) .
Ag2 Ag11 2.9131(6) .
Ag2 Ag22 2.9302(6) .
Ag2 Ag6 2.9312(6) .
Ag2 Ag18 3.1861(6) .
Ag3 S18 2.5257(15) .
Ag3 Ag8 2.8681(6) .
Ag3 S17 2.9141(16) .
Ag3 Ag7 2.9316(6) .
Ag3 Ag4 2.9324(6) .
Ag3 Ag21 2.9424(6) .
Ag4 S16 2.5300(15) .
Ag4 Ag8 2.8709(6) .
Ag4 Ag5 2.9224(6) .
Ag4 Ag9 2.9227(6) .
Ag4 Ag20 3.0478(6) .
Ag5 S14 2.7039(15) .
Ag5 S13 2.7593(16) .
Ag5 Ag10 2.8692(6) .
Ag5 Ag6 2.8844(6) .
Ag5 Ag9 2.9244(6) .
Ag5 Ag20 2.9549(6) .
Ag5 Ag19 3.0022(6) .
Ag6 S4 2.4793(16) .
Ag6 Ag10 2.8505(6) .
Ag6 Ag11 2.9275(6) .
Ag6 Ag18 2.9798(6) .
Ag6 Ag22 3.0847(6) .
Ag7 S22 2.6798(19) 3_576
Ag7 Ag12 2.8257(6) .
Ag7 Ag11 2.9137(6) .
Ag7 Ag8 2.9739(6) .
Ag7 Ag21 2.9990(6) .
Ag7 Ag15 3.1311(6) 3_576
Ag8 S20 2.5463(14) .
Ag8 Ag9 2.8697(6) .
Ag8 Ag12 2.8839(6) .
Ag8 Ag21 2.9959(6) .
Ag8 Ag13 3.1091(6) .
Ag9 S12 2.5641(14) .
Ag9 Ag12 2.8727(5) .
Ag9 Ag10 2.9015(6) .
Ag9 Ag20 2.9692(6) .
Ag9 Ag14 2.9829(6) .
Ag9 Ag19 3.0365(6) .
Ag10 S9 2.5343(14) .
Ag10 Ag12 2.8707(6) .
Ag10 Ag11 2.9048(6) .
Ag10 Ag17 2.9373(6) 3_576
Ag10 Ag19 2.9594(6) .
Ag11 S7 2.6486(15) .
Ag11 Ag12 2.8413(6) .
Ag11 Ag22 2.9428(6) .
Ag11 Ag16 3.0494(6) 3_576
Ag12 Ag13 2.8449(6) .
Ag12 Ag15 2.8915(6) 3_576
Ag12 Ag16 2.9048(5) 3_576
Ag12 Ag17 2.9107(6) 3_576
Ag12 Ag14 2.9614(6) .
Ag13 S20 2.5834(14) .
Ag13 Ag15 2.8607(6) 3_576
Ag13 Ag17 2.8657(6) .
Ag13 Ag16 2.8710(6) .
Ag13 Ag14 3.0851(6) .
Ag14 S12 2.7324(15) .
Ag14 S10 2.7622(15) .
Ag14 Ag17 2.8782(6) 3_576
Ag14 Ag16 2.9005(6) .
Ag14 Ag15 2.9314(6) .
Ag15 S22 2.6234(16) .
Ag15 S19 2.7508(14) 3_576
Ag15 Ag17 2.8726(6) 3_576
Ag15 Ag16 3.0561(6) .
Ag16 S8 2.4809(14) .
Ag16 Ag17 2.8881(6) .
Ag17 S9 2.5622(14) 3_576
Ag18 S2 2.4665(17) .
Ag18 S6 2.5095(17) .
Ag18 S3 2.5631(15) .
Ag19 S13 2.5159(16) .
Ag19 S10 2.5228(15) .
Ag19 S11 2.5511(15) .
Ag19 Ag20 3.2806(6) .
Ag20 S15 2.4823(16) .
Ag20 S14 2.5383(15) .
Ag20 S11 2.5540(16) .
Ag21 S21 2.4957(17) .
Ag21 S17 2.5142(15) .
Ag21 S19 2.5262(15) .
Ag22 S3 2.5012(16) .
Ag22 S7 2.5296(15) .
Ag22 S5 2.5507(18) .
C1 C2 1.400(12) .
C1 O1 1.463(8) .
C2 C3 1.537(13) .
C4 O2 1.440(7) .
C4 C5 1.478(9) .
C5 C6 1.443(12) .
C7 C8 1.316(11) .
C7 O3 1.456(8) .
C8 C9 1.341(12) .
C10 O4 1.449(8) .
C10 C11 1.539(12) .
C11 C12 1.304(14) .
C13 C14 1.420(13) .
C13 O5 1.452(9) .
C14 C15 1.328(15) .
C16 O6 1.445(8) .
C16 C17 1.449(12) .
C17 C18 1.515(12) .
C19 O7 1.467(7) .
C19 C20 1.476(8) .
C20 C21 1.519(8) .
C22 C23 1.394(13) .
C22 O8 1.405(8) .
C23 C24 1.438(9) .
C25 O9 1.468(12) .
C25 C26 1.476(15) .
C26 C27 1.506(9) .
C25B O9 1.469(12) .
C25B C26B 1.471(15) .
C26B C27B 1.520(15) .
C28 O10 1.450(7) .
C28 C29 1.483(9) .
C29 C30 1.502(9) .
C31 O11 1.341(11) .
C31 C32 1.518(8) .
C32 C33 1.510(9) .
C31B O11 1.247(11) .
C31B C32B 1.485(14) .
C32B C33B 1.476(15) .
C34 O12 1.466(14) .
C34 C35 1.50(2) .
C35 C36 1.44(2) .
C34B O12 1.471(13) .
C34B C35B 1.51(2) .
C35B C36B 1.44(2) .
C37 O13 1.459(7) .
C37 C38 1.471(9) .
C38 C39 1.504(12) .
C40 O14 1.461(8) .
C40 C41 1.471(10) .
C41 C42 1.451(11) .
C43 O15 1.461(7) .
C43 C44 1.508(10) .
C44 C45 1.447(11) .
C46 C47 1.400(10) .
C46 O16 1.411(8) .
C47 C48 1.484(13) .
C49 O17 1.441(7) .
C49 C50 1.482(9) .
C50 C51 1.511(10) .
C52 C53 1.332(12) .
C52 O18 1.442(8) .
C53 C54 1.394(12) .
C55 O19 1.465(7) .
C55 C56 1.506(8) .
C56 C57 1.520(9) .
C58 O20 1.464(6) .
C58 C59 1.503(8) .
C59 C60 1.520(9) .
C61 O21 1.452(7) .
C61 C62 1.502(8) .
C62 C63 1.505(11) .
C64 O22 1.454(8) .
C64 C65 1.456(12) .
C65 C66 1.380(13) .
O1 P1 1.586(4) .
O2 P1 1.584(4) .
O3 P2 1.577(4) .
O4 P2 1.578(4) .
O5 P3 1.582(5) .
O6 P3 1.573(4) .
O7 P4 1.575(4) .
O8 P4 1.586(4) .
O9 P5 1.582(4) .
O10 P5 1.585(4) .
O11 P6 1.564(4) .
O12 P6 1.567(4) .
O13 P7 1.576(4) .
O14 P7 1.568(4) .
O15 P8 1.587(4) .
O16 P8 1.589(4) .
O17 P9 1.586(4) .
O18 P9 1.570(4) .
O19 P10 1.578(4) .
O20 P10 1.577(4) .
O21 P11 1.589(4) .
O22 P11 1.570(4) .
P1 S1 1.983(2) .
P1 S2 1.991(2) .
P2 S4 1.978(2) .
P2 S3 2.023(2) .
P3 S6 1.985(2) .
P3 S5 2.013(2) .
P4 S8 1.990(2) 3_576
P4 S7 2.004(2) .
P5 S10 2.000(2) .
P5 S9 2.005(2) .
P6 S11 1.998(2) .
P6 S12 2.004(2) .
P7 S14 2.003(2) .
P7 S13 2.005(2) .
P8 S16 1.977(2) .
P8 S15 2.005(2) .
P9 S18 1.981(2) .
P9 S17 2.003(2) .
P10 S20 2.006(2) .
P10 S19 2.0094(19) .
P11 S22 1.979(2) 3_576
P11 S21 1.996(2) .
Pt3 Ag34 2.6847(4) .
Pt3 Ag31 2.7271(5) .
Pt3 Ag23 2.7324(4) .
Pt3 Ag28 2.7349(5) .
Pt3 Ag24 2.7421(4) .
Pt3 Ag33 2.7548(5) .
Pt3 Ag32 2.7567(4) .
Pt3 Ag26 2.7611(5) .
Pt3 Ag25 2.7612(5) .
Pt3 Ag27 2.7816(4) .
Pt3 Ag29 2.7991(5) .
Pt3 Ag30 2.8103(4) .
Pt4 Ag34 2.6719(4) 3_655
Pt4 Ag34 2.6719(4) .
Pt4 Ag39 2.7340(4) .
Pt4 Ag39 2.7341(4) 3_655
Pt4 Ag35 2.7418(4) 3_655
Pt4 Ag35 2.7418(4) .
Pt4 Ag37 2.7890(4) .
Pt4 Ag37 2.7890(4) 3_655
Pt4 Ag36 2.8277(4) 3_655
Pt4 Ag36 2.8278(4) .
Pt4 Ag38 2.8561(4) 3_655
Pt4 Ag38 2.8561(4) .
Ag23 S23 2.4626(15) .
Ag23 Ag28 2.8868(6) .
Ag23 Ag26 2.9011(6) .
Ag23 Ag27 2.9105(6) .
Ag23 Ag24 2.9195(6) .
Ag23 Ag25 2.9276(6) .
Ag23 Ag40 3.0618(6) .
Ag24 S27 2.7028(16) .
Ag24 S28 2.7666(15) .
Ag24 Ag29 2.8760(6) .
Ag24 Ag30 2.8977(6) .
Ag24 Ag28 2.9112(6) .
Ag24 Ag25 2.9235(6) .
Ag24 Ag41 2.9763(6) .
Ag24 Ag40 3.0842(6) .
Ag25 S26 2.4746(16) .
Ag25 Ag31 2.8467(6) .
Ag25 Ag26 2.8759(6) .
Ag25 Ag30 2.9229(6) .
Ag25 Ag40 2.9548(6) .
Ag25 Ag41 3.1025(6) .
Ag26 S32 2.6704(15) .
Ag26 S31 2.8275(17) .
Ag26 Ag31 2.8632(6) .
Ag26 Ag27 2.9244(6) .
Ag26 Ag32 2.9404(6) .
Ag26 Ag43 2.9453(6) .
Ag26 Ag42 2.9878(6) .
Ag27 S34 2.5422(15) .
Ag27 Ag33 2.8727(6) .
Ag27 Ag32 2.9116(6) .
Ag27 Ag28 2.9274(6) .
Ag27 S33 2.9318(15) .
Ag27 Ag43 3.0685(6) .
Ag28 S36 2.4825(15) .
Ag28 Ag33 2.8484(6) .
Ag28 Ag29 2.9271(6) .
Ag28 Ag44 2.9389(6) .
Ag29 S40 2.5812(15) .
Ag29 Ag34 2.8094(6) .
Ag29 Ag30 2.9137(6) .
Ag29 Ag33 2.9742(6) .
Ag29 Ag44 3.0067(6) .
Ag29 Ag38 3.1322(6) 3_655
Ag30 S29 2.6402(15) .
Ag30 Ag34 2.8359(5) .
Ag30 Ag31 2.9003(6) .
Ag30 Ag41 2.9474(6) .
Ag30 Ag39 3.0139(6) 3_655
Ag31 S41 2.5253(14) .
Ag31 Ag32 2.8800(6) .
Ag31 Ag34 2.8851(6) .
Ag31 Ag35 2.9339(6) .
Ag31 Ag42 2.9417(6) .
Ag32 S43 2.5410(14) .
Ag32 Ag33 2.8776(6) .
Ag32 Ag34 2.8878(5) .
Ag32 Ag43 2.9808(6) .
Ag32 Ag36 2.9881(6) .
Ag32 Ag42 3.0461(6) .
Ag33 S38 2.5350(14) .
Ag33 Ag34 2.8964(6) .
Ag33 Ag44 3.0075(6) .
Ag33 Ag37 3.1592(6) .
Ag34 Ag37 2.8256(6) .
Ag34 Ag38 2.9039(6) 3_655
Ag34 Ag35 2.9102(6) .
Ag34 Ag36 2.9231(6) .
Ag34 Ag39 2.9373(5) 3_655
Ag35 S41 2.5611(14) .
Ag35 Ag37 2.8600(6) 3_655
Ag35 Ag38 2.8830(6) .
Ag35 Ag39 2.8885(6) 3_655
Ag35 Ag36 2.8931(6) .
Ag36 S42 2.7543(15) .
Ag36 S43 2.7703(14) .
Ag36 Ag39 2.8909(6) .
Ag36 Ag38 2.9430(6) .
Ag36 Ag37 3.0664(6) .
Ag37 S38 2.5612(14) .
Ag37 Ag39 2.8736(6) .
Ag37 Ag38 2.8737(6) 3_655
Ag38 S40 2.6680(15) 3_655
Ag38 S37 2.7917(15) 3_655
Ag38 Ag39 3.0306(6) .
Ag39 S30 2.4831(14) .
Ag40 S24 2.4794(16) .
Ag40 S27 2.5409(18) .
Ag40 S25 2.5772(16) .
Ag41 S25 2.5028(16) .
Ag41 S28 2.5128(16) .
Ag41 S29 2.5362(15) .
Ag42 S31 2.5273(16) .
Ag42 S42 2.5374(15) .
Ag42 S44 2.5466(14) .
Ag42 Ag43 3.2281(6) .
Ag43 S33 2.4886(16) .
Ag43 S44 2.5477(15) .
Ag43 S32 2.5554(15) .
Ag44 S35 2.4842(15) .
Ag44 S39 2.4934(17) .
Ag44 S37 2.5473(15) .
C67 O23 1.457(7) .
C67 C68 1.477(9) .
C68 C69 1.493(9) .
C70 C71 1.416(12) .
C70 O24 1.450(9) .
C71 C72 1.418(16) .
C73 O25 1.457(7) .
C73 C74 1.486(9) .
C74 C75 1.509(11) .
C76 O26 1.436(8) .
C76 C77 1.474(10) .
C77 C78 1.490(12) .
C79 C80 1.347(13) .
C79 O27 1.451(8) .
C80 C81 1.494(15) .
C82 O28 1.418(9) .
C82 C83 1.482(13) .
C83 C84 1.37(2) .
C85 O29 1.466(6) .
C85 C86 1.497(8) .
C86 C87 1.528(8) .
C88 C89 1.418(11) .
C88 O30 1.454(7) .
C89 C90 1.256(15) .
C91 C92 1.386(11) .
C91 O31 1.456(7) .
C92 C93 1.398(8) .
C94 C95 1.433(12) .
C94 O32 1.457(9) .
C95 C96 1.373(14) .
C97 C98 1.387(11) .
C97 O33 1.408(9) .
C98 C99 1.558(14) .
C100 O34 1.441(7) .
C100 C101 1.511(9) .
C101 C102 1.513(10) .
C103 O35 1.454(7) .
C103 C104 1.502(9) .
C104 C105 1.506(10) .
C106 O36 1.448(8) .
C106 C107 1.468(11) .
C107 C108 1.453(12) .
C109 O37 1.458(7) .
C109 C110 1.477(9) .
C110 C111 1.522(10) .
C112 O38 1.445(7) .
C112 C113 1.505(9) .
C113 C114 1.390(12) .
C115 O39 1.451(7) .
C115 C116 1.490(8) .
C116 C117 1.510(10) .
C118 C119 1.402(13) .
C118 O40 1.449(8) .
C119 C120 1.329(14) .
C121 O41 1.451(7) .
C121 C122 1.496(8) .
C122 C123 1.512(9) .
C124 O42 1.454(7) .
C124 C125 1.500(9) .
C125 C126 1.478(12) .
C127 O43 1.452(7) .
C127 C128 1.496(8) .
C128 C129 1.476(10) .
C130 C131 1.437(10) .
C130 O44 1.469(7) .
C131 C132 1.451(12) .
O23 P12 1.587(4) .
O24 P12 1.589(5) .
O25 P13 1.572(4) .
O26 P13 1.581(4) .
O27 P14 1.574(5) .
O28 P14 1.580(5) .
O29 P15 1.576(4) .
O30 P15 1.580(4) .
O31 P16 1.579(4) .
O32 P16 1.574(4) .
O33 P17 1.595(4) .
O34 P17 1.585(4) .
O35 P18 1.577(4) .
O36 P18 1.587(4) .
O37 P19 1.576(4) .
O38 P19 1.576(4) .
O39 P20 1.583(4) .
O40 P20 1.573(5) .
O41 P21 1.584(4) .
O42 P21 1.573(4) .
O43 P22 1.581(4) .
O44 P22 1.565(4) .
P12 S23 1.972(2) .
P12 S24 1.995(2) .
P13 S26 1.980(2) .
P13 S25 2.016(2) .
P14 S27 1.994(2) .
P14 S28 2.000(2) .
P15 S30 1.988(2) .
P15 S29 2.008(2) 3_655
P16 S32 1.994(2) .
P16 S31 1.999(2) .
P17 S34 1.972(2) .
P17 S33 2.011(2) .
P18 S36 1.979(2) .
P18 S35 2.004(2) .
P19 S38 2.001(2) .
P19 S37 2.010(2) .
P20 S39 1.988(2) .
P20 S40 1.999(2) .
P21 S42 1.998(2) .
P21 S41 2.000(2) .
P22 S44 2.003(2) .
P22 S43 2.011(2) .
