#------------------------------------------------------------------------------
#$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $
#$Revision: 282777 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/08/1550817.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_1550817
loop_
_publ_author_name
'Wang, Zhi'
'Sun, Hao-Tian'
'Kurmoo, Mohamedally'
'Liu, Qing-Yun'
'Zhuang, Gui-Lin'
'Zhao, Quan-Qin'
'Wang, Xing-Po'
'Tung, Chen-Ho'
'Sun, Di'
_publ_section_title
;
 Carboxylic acid stimulated silver shell isomerism in a triple core--shell
 Ag ₈₄ nanocluster
;
_journal_issue                   18
_journal_name_full               'Chemical Science'
_journal_page_first              4862
_journal_page_last               4867
_journal_paper_doi               10.1039/C8SC05666H
_journal_volume                  10
_journal_year                    2019
_chemical_formula_moiety         'C192 H406 Ag84 O88 S42 W14, 2(C H3 O)'
_chemical_formula_sum            'C194 H412 Ag84 O90 S42 W14'
_chemical_formula_weight         17166.71
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_audit_creation_date             2018-02-26
_audit_creation_method
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_audit_update_record
;
2018-11-14 deposited with the CCDC.    2019-03-29 downloaded from the CCDC.
;
_cell_angle_alpha                109.7140(10)
_cell_angle_beta                 100.1000(10)
_cell_angle_gamma                109.0090(10)
_cell_formula_units_Z            1
_cell_length_a                   20.2607(2)
_cell_length_b                   20.6711(2)
_cell_length_c                   26.2425(3)
_cell_measurement_reflns_used    57340
_cell_measurement_temperature    99.99(10)
_cell_measurement_theta_max      30.8580
_cell_measurement_theta_min      3.3780
_cell_volume                     9266.3(2)
_computing_cell_refinement       'CrysAlisPro 1.171.39.30d (Rigaku OD, 2017)'
_computing_data_collection       'CrysAlisPro 1.171.39.30d (Rigaku OD, 2017)'
_computing_data_reduction        'CrysAlisPro 1.171.39.30d (Rigaku OD, 2017)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      99.99(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω     -6.00  75.00   0.50   40.00    --    6.48  57.00  60.00  162
  2  ω     -5.00  75.00   0.50   40.00    --    6.48  46.00-177.00  160
  3  ω    -21.00  28.00   0.50   40.00    --   -5.30 -99.00   0.00   98
  4  ω    -63.00  20.00   0.50   40.00    --    6.48 -46.00  33.00  166
  5  ω    -64.00  17.00   0.50   40.00    --    6.48 -19.00 -90.00  162
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy, Dualflex, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0385537000
_diffrn_orient_matrix_UB_12      0.0120603000
_diffrn_orient_matrix_UB_13      0.0053443000
_diffrn_orient_matrix_UB_21      -0.0009383000
_diffrn_orient_matrix_UB_22      0.0207212000
_diffrn_orient_matrix_UB_23      -0.0166404000
_diffrn_orient_matrix_UB_31      0.0063822000
_diffrn_orient_matrix_UB_32      0.0321038000
_diffrn_orient_matrix_UB_33      0.0247638000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0295
_diffrn_reflns_av_unetI/netI     0.0270
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            96913
_diffrn_reflns_point_group_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        25.123
_diffrn_reflns_theta_max         25.123
_diffrn_reflns_theta_min         3.270
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    8.936
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.56599
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.30d (Rigaku Oxford Diffraction, 2017)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            red
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    3.076
_exptl_crystal_description       block
_exptl_crystal_F_000             7952
_exptl_crystal_size_max          0.08
_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.05
_refine_diff_density_max         3.937
_refine_diff_density_min         -1.789
_refine_diff_density_rms         0.272
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.041
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2033
_refine_ls_number_reflns         32790
_refine_ls_number_restraints     383
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0637
_refine_ls_R_factor_gt           0.0578
_refine_ls_shift/su_max          0.039
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0906P)²+124.7965P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1548
_refine_ls_wR_factor_ref         0.1596
_reflns_Friedel_coverage         0.000
_reflns_number_gt                29005
_reflns_number_total             32790
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8sc05666h2.cif
_cod_data_source_block           SD_Ag84a
_cod_original_cell_volume        9266.29(18)
_cod_database_code               1550817
_shelx_shelxl_version_number     2014/7
_chemical_oxdiff_formula         AgS
_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_max   0.664
_shelx_estimated_absorpt_t_min   0.535
_reflns_odcompleteness_completeness 99.32
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 O36-O35
 2.35 with sigma of 0.01
 C65-C66
 1.55 with sigma of 0.01
 C64-C65
 1.55 with sigma of 0.01
 C64-C66
 2.35 with sigma of 0.01
 C66-O35
 2.35 with sigma of 0.01
 C73-C74
 1.55 with sigma of 0.01
 C72-C73
 1.55 with sigma of 0.01
 C72-C74
 2.35 with sigma of 0.01
 C68-C70
 2.35 with sigma of 0.01
 C69-C68
 1.55 with sigma of 0.01
 C70-C69
 1.55 with sigma of 0.01
 C69-C71
 2.35 with sigma of 0.01
 C70-C71
 1.55 with sigma of 0.01
 C77-C78
 1.55 with sigma of 0.01
 C91-C90
 1.55 with sigma of 0.01
 O36-C67
 1.25 with sigma of 0.01
 C67-O35
 1.25 with sigma of 0.01
 C67-C66
 1.55 with sigma of 0.01
 C67-C65
 2.35 with sigma of 0.01
 C82-C83
 1.55 with sigma of 0.01
 C5-S6
 1.85 with sigma of 0.01
 Ag3B-C5
 3 with sigma of 0.01
 C34-C36
 1.55 with sigma of 0.01
 C29-C28
 1.55 with sigma of 0.01
 C81-C82
 1.55 with sigma of 0.01
 C80-C81
 1.55 with sigma of 0.01
 C80-C82
 2.64 with sigma of 0.01
 C5-C4
 1.55 with sigma of 0.01
 C4-S6
 2.75 with sigma of 0.01
 C62-Ag3A
 3 with sigma of 0.01
 C29-C30
 1.55 with sigma of 0.01
 C28-C30
 2.35 with sigma of 0.01
 C20-S13
 1.85 with sigma of 0.01
 C5-C6
 1.55 with sigma of 0.01
 S6-C6
 2.75 with sigma of 0.01
 C6-C4
 2.35 with sigma of 0.01
 C6-Ag3B
 3.2 with sigma of 0.01
 C61-C62
 1.55 with sigma of 0.01
 C62-C63
 1.55 with sigma of 0.01
3. Restrained planarity
 C66, C67, O35, O36
 with sigma of 0.01
4. Uiso/Uaniso restraints and constraints
C72 \\sim C73 \\sim C74 \\sim C75 \\sim O27 \\sim O28: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
C68 \\sim C69 \\sim C70 \\sim C71 \\sim O33 \\sim O34: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
C76 \\sim C77 \\sim C78 \\sim C79 \\sim O29 \\sim O30: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
C7 \\sim C8 \\sim C9 \\sim C88 \\sim O37 \\sim O38: within 1.7A with sigma of
0.004 and sigma for terminal atoms of 0.008
C34 \\sim C35 \\sim C36: within 1.7A with sigma of 0.004 and sigma for terminal
atoms of 0.08
C13 \\sim C14 \\sim C15: within 1.7A with sigma of 0.004 and sigma for terminal
atoms of 0.008
C55 \\sim C56 \\sim C57: within 1.7A with sigma of 0.004 and sigma for terminal
atoms of 0.008
C89 \\sim C90 \\sim C91 \\sim C92 \\sim O41 \\sim O42: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
Ag4 \\sim Ag4A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag9 \\sim Ag9A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag6 \\sim Ag6A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag7B \\sim Ag16: within 1.7A with sigma of 0.004 and sigma for terminal atoms
of 0.08
Ag17: within 1.7A with sigma of 0.004 and sigma for terminal atoms of 0.008
Ag8B \\sim Ag17: within 1.7A with sigma of 0.004 and sigma for terminal atoms
of 0.08
C64 \\sim C65 \\sim C66 \\sim C67 \\sim O35 \\sim O36: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
Ag3 \\sim Ag3A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag1 \\sim Ag1A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag8 \\sim Ag8A: within 1.7A with sigma of 0.004 and sigma for terminal atoms of
0.08
Ag1B \\sim Ag10: within 1.7A with sigma of 0.004 and sigma for terminal atoms
of 0.08
Ag2B \\sim Ag11: within 1.7A with sigma of 0.004 and sigma for terminal atoms
of 0.08
Ag3B \\sim Ag12 \\sim Ag38: within 1.7A with sigma of 0.001 and sigma for
terminal atoms of 0.004
Ag5B \\sim Ag14: within 1.7A with sigma of 0.004 and sigma for terminal atoms
of 0.08
Ag4B \\sim Ag13 \\sim Ag31: within 1.7A with sigma of 0.004 and sigma for
terminal atoms of 0.08
C80 \\sim C81 \\sim C82 \\sim C83 \\sim O25 \\sim O26: within 1.7A with sigma
of 0.004 and sigma for terminal atoms of 0.008
C28 \\sim C29 \\sim C30 \\sim S16: within 1.7A with sigma of 0.004 and sigma
for terminal atoms of 0.008
C45 \\sim C44 \\sim C43: within 1.7A with sigma of 0.004 and sigma for terminal
atoms of 0.08
C21 \\sim C20 \\sim C19 \\sim S13: within 1.7A with sigma of 0.004 and sigma
for terminal atoms of 0.08
C4 \\sim C5 \\sim C6 \\sim S6: within 1.7A with sigma of 0.002 and sigma for
terminal atoms of 0.004
C62 \\sim S21 \\sim C63 \\sim C61: within 1.7A with sigma of 0.004 and sigma
for terminal atoms of 0.008
5. Others
 Sof(Ag1A)=1-FVAR(1)
 Sof(Ag1)=FVAR(1)
 Sof(Ag2A)=1-FVAR(2)
 Sof(Ag2)=FVAR(2)
 Sof(Ag3A)=1-FVAR(3)
 Sof(Ag3)=FVAR(3)
 Sof(Ag4A)=1-FVAR(4)
 Sof(Ag4)=FVAR(4)
 Sof(Ag5A)=1-FVAR(5)
 Sof(Ag5)=FVAR(5)
 Sof(Ag6A)=1-FVAR(6)
 Sof(Ag6)=FVAR(6)
 Sof(Ag7A)=1-FVAR(7)
 Sof(Ag7)=FVAR(7)
 Sof(Ag8A)=1-FVAR(8)
 Sof(Ag8)=FVAR(8)
 Sof(Ag9A)=1-FVAR(9)
 Sof(Ag9)=FVAR(9)
 Sof(Ag1B)=1-FVAR(10)
 Sof(Ag10)=FVAR(10)
 Sof(Ag2B)=1-FVAR(11)
 Sof(Ag11)=FVAR(11)
 Sof(Ag3B)=1-FVAR(12)
 Sof(Ag12)=FVAR(12)
 Sof(Ag4B)=Sof(Ag5B)=1-FVAR(13)
 Sof(Ag13)=Sof(Ag14)=FVAR(13)
 Sof(Ag7B)=1-FVAR(14)
 Sof(Ag16)=FVAR(14)
 Sof(Ag9B)=1-FVAR(15)
 Sof(Ag18)=FVAR(15)
 Fixed Sof: Ag8B(0.1) Ag17(0.9)
6.a Riding coordinates:
 C1(H1A,H1B,H1C), C3(H3A,H3B,H3C), C7(H7A,H7B,H7C), C10(H10A,H10B,H10C),
 C12(H12A,H12B,H12C), C13(H13A,H13B,H13C), C15(H15A,H15B,H15C), C16(H16A,H16B,
 H16C), C18(H18A,H18B,H18C), C19(H19A,H19B,H19C), C21(H21A,H21B,H21C), C22(H22A,
 H22B,H22C), C24(H24A,H24B,H24C), C25(H25A,H25B,H25C), C27(H27A,H27B,H27C),
 C28(H28A,H28B,H28C), C30(H30A,H30B,H30C), C31(H31A,H31B,H31C), C33(H33A,H33B,
 H33C), C34(H34A,H34B,H34C), C35(H35A,H35B,H35C), C37(H37A,H37B,H37C), C39(H39A,
 H39B,H39C), C40(H40A,H40B,H40C), C42(H42A,H42B,H42C), C43(H43A,H43B,H43C),
 C45(H45A,H45B,H45C), C46(H46A,H46B,H46C), C48(H48A,H48B,H48C), C49(H49A,H49B,
 H49C), C51(H51A,H51B,H51C), C52(H52A,H52B,H52C), C54(H54A,H54B,H54C), C55(H55A,
 H55B,H55C), C57(H57A,H57B,H57C), C58(H58A,H58B,H58C), C60(H60A,H60B,H60C),
 C62(H62), C64(H64A,H64B,H64C), C68(H68A,H68B,H68C), C72(H72A,H72B,H72C),
 C76(H76A,H76B,H76C), C84(H84A,H84B,H84C), C89(H89A,H89B,H89C), C93(H93A,H93B,
 H93C)
6.b Ternary CH refined with riding coordinates:
 C2(H2), C5(H5), C11(H11), C14(H14), C17(H17), C20(H20), C23(H23), C26(H26),
 C29(H29), C32(H32), C36(H36), C38(H38), C41(H41), C44(H44), C47(H47), C50(H50),
  C53(H53), C56(H56), C59(H59)
6.c Secondary CH2 refined with riding coordinates:
 C8(H8A,H8B), C9(H9A,H9B), C65(H65A,H65B), C66(H66A,H66B), C69(H69A,H69B),
 C70(H70A,H70B), C73(H73A,H73B), C74(H74A,H74B), C77(H77A,H77B), C78(H78A,H78B),
  C81(H81A,H81B), C82(H82A,H82B), C85(H85A,H85B), C86(H86A,H86B), C90(H90A,
 H90B), C91(H91A,H91B), C94(H94A,H94B), C95(H95A,H95B)
6.d Me refined with riding coordinates:
 C4(H4A,H4B,H4C), C6(H6A,H6B,H6C), C61(H61A,H61B,H61C), C63(H63A,H63B,H63C),
 C80(H80A,H80B,H80C)
6.e Idealised Me refined as rotating group:
 C97(H97A,H97B,H97C)
;
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.474
_oxdiff_exptl_absorpt_empirical_full_min 0.723
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.4296(4) 0.1155(3) 0.1062(3) 0.0911(17) Uani 0.578(15) 1 d . U P A 1
Ag1A Ag 0.4085(5) 0.1178(4) 0.1259(4) 0.1006(17) Uani 0.422(15) 1 d . U P A 2
Ag1B Ag 0.5559(9) 0.1911(9) 0.2572(6) 0.075(3) Uani 0.096(3) 1 d . U P A 2
Ag2 Ag 0.2960(2) 0.5894(2) 0.41118(8) 0.0550(8) Uani 0.818(14) 1 d . . P A 1
Ag2A Ag 0.3312(13) 0.6271(16) 0.4175(4) 0.076(6) Uani 0.182(14) 1 d . . P A 2
Ag2B Ag 0.1948(7) 0.1529(7) 0.2300(6) 0.060(3) Uani 0.082(3) 1 d . U P A 2
Ag3 Ag 0.10329(7) 0.33888(7) 0.31152(5) 0.0512(4) Uani 0.824(3) 1 d . U P A 1
Ag3A Ag 0.1245(4) 0.3936(5) 0.2838(3) 0.081(2) Uani 0.176(3) 1 d D U P A 2
Ag3B Ag 0.6538(8) 0.3298(9) 0.2403(6) 0.086(5) Uani 0.100(4) 1 d D U P A 2
Ag4 Ag 0.22675(7) 0.45580(9) 0.25221(6) 0.0597(4) Uani 0.872(4) 1 d . U P A 1
Ag4A Ag 0.2408(5) 0.5149(7) 0.2604(4) 0.066(2) Uani 0.128(4) 1 d . U P A 2
Ag4B Ag 0.1425(7) 0.0695(8) 0.2903(7) 0.102(6) Uani 0.107(3) 1 d . U P A 2
Ag5 Ag 0.14201(9) 0.16320(15) 0.37565(8) 0.0620(8) Uani 0.853(9) 1 d . . P A 1
Ag5A Ag 0.1297(5) 0.2009(8) 0.3916(4) 0.065(4) Uani 0.147(9) 1 d . . P A 2
Ag5B Ag 0.2849(8) 0.0772(8) 0.1591(5) 0.081(3) Uani 0.107(3) 1 d . U P A 2
Ag6 Ag 0.80404(7) 0.67069(15) 0.43721(6) 0.0526(5) Uani 0.857(7) 1 d . U P A 1
Ag6A Ag 0.8032(4) 0.6342(9) 0.4377(4) 0.050(2) Uani 0.143(7) 1 d . U P A 2
Ag7 Ag 0.59925(12) 0.69732(14) 0.28284(9) 0.0589(7) Uani 0.874(8) 1 d . . P A 1
Ag7A Ag 0.5586(12) 0.6534(12) 0.2581(7) 0.072(6) Uani 0.126(8) 1 d . . P A 2
Ag7B Ag 0.5917(13) 0.7751(9) 0.3785(7) 0.071(3) Uani 0.079(4) 1 d . U P A 2
Ag8 Ag 0.48178(10) 0.27870(10) 0.13727(8) 0.0600(5) Uani 0.882(7) 1 d . U P A 1
Ag8A Ag 0.4610(7) 0.2595(8) 0.1551(6) 0.060(3) Uani 0.118(7) 1 d . U P A 2
Ag8B Ag 0.7766(10) 0.6606(11) 0.5563(7) 0.051(2) Uani 0.1 1 d . U P A 2
Ag9 Ag 0.09182(9) 0.21534(9) 0.21197(11) 0.0614(5) Uani 0.879(7) 1 d . U P A 1
Ag9A Ag 0.0942(6) 0.2288(8) 0.2412(8) 0.063(2) Uani 0.121(7) 1 d . U P A 2
Ag9B Ag 0.3131(11) 0.0573(10) 0.2981(8) 0.060(6) Uani 0.059(4) 1 d . . P A 2
Ag10 Ag 0.50077(10) 0.12721(9) 0.23167(6) 0.0777(5) Uani 0.904(3) 1 d . U P A 1
Ag11 Ag 0.14978(6) 0.13304(6) 0.25940(5) 0.0551(3) Uani 0.918(3) 1 d . U P A 1
Ag12 Ag 0.60567(7) 0.29551(7) 0.28458(5) 0.0582(4) Uani 0.900(4) 1 d . U P A 1
Ag13 Ag 0.21177(7) 0.03713(7) 0.30682(6) 0.0642(4) Uani 0.893(3) 1 d . U P A 1
Ag14 Ag 0.25700(8) 0.12098(9) 0.16379(6) 0.0738(5) Uani 0.893(3) 1 d . U P A 1
Ag15 Ag 0.46259(6) 0.51205(7) 0.18431(5) 0.0596(3) Uani 1 1 d . . . . .
Ag16 Ag 0.54113(9) 0.75592(7) 0.38139(5) 0.0618(4) Uani 0.921(4) 1 d . U P A 1
Ag17 Ag 0.75845(8) 0.64227(9) 0.53928(6) 0.0455(4) Uani 0.9 1 d . U P A 1
Ag18 Ag 0.33515(7) 0.05623(7) 0.23966(6) 0.0693(4) Uani 0.941(4) 1 d . . P A 1
Ag19 Ag 0.24264(8) 0.19526(8) 0.08037(7) 0.0822(4) Uani 1 1 d . . . . .
Ag20 Ag 0.36441(7) 0.18537(7) 0.03444(5) 0.0635(3) Uani 1 1 d . . . . .
Ag21 Ag 0.15353(7) 0.29217(8) 0.14665(7) 0.0784(4) Uani 1 1 d . . . . .
Ag22 Ag 0.15012(9) 0.34601(9) 0.05123(8) 0.0954(5) Uani 1 1 d . . . . .
Ag23 Ag 0.37412(7) 0.59421(6) 0.21716(5) 0.0614(3) Uani 1 1 d . . . . .
Ag24 Ag 0.38174(7) 0.70588(7) 0.33351(5) 0.0670(3) Uani 1 1 d . . . . .
Ag25 Ag 0.50395(7) 0.70842(6) 0.47412(5) 0.0599(3) Uani 1 1 d . . . . .
Ag26 Ag 0.56579(5) 0.58655(4) 0.49947(3) 0.03847(18) Uani 1 1 d . . . . .
Ag27 Ag 0.48841(4) 0.44162(4) 0.41768(3) 0.03487(17) Uani 1 1 d . . . . .
Ag28 Ag 0.41324(5) 0.52321(5) 0.47195(4) 0.03819(18) Uani 1 1 d . . . . .
Ag29 Ag 0.19586(7) 0.46164(7) 0.42459(5) 0.0615(3) Uani 1 1 d . . . . .
Ag30 Ag 0.27923(8) 0.21241(7) 0.50788(5) 0.0720(3) Uani 1 1 d . . . . .
Ag31 Ag 0.37116(8) 0.11579(7) 0.43320(6) 0.0703(3) Uani 1 1 d . U . . .
Ag32 Ag 0.46885(7) 0.11582(8) 0.33946(6) 0.0699(3) Uani 1 1 d . . . . .
Ag33 Ag 0.33104(10) 0.35531(9) 0.07625(6) 0.0857(4) Uani 1 1 d . . . . .
Ag34 Ag 0.55571(7) 0.43550(7) 0.14110(5) 0.0654(3) Uani 1 1 d . . . . .
Ag35 Ag 0.68765(7) 0.53722(8) 0.24114(5) 0.0737(3) Uani 1 1 d . . . . .
Ag36 Ag 0.75643(7) 0.48186(6) 0.33638(5) 0.0641(3) Uani 1 1 d . . . . .
Ag37 Ag 0.78683(6) 0.43163(6) 0.45222(5) 0.0578(3) Uani 1 1 d . . . . .
Ag38 Ag 0.66141(6) 0.28883(6) 0.41457(5) 0.0598(3) Uani 1 1 d . U . . .
Ag39 Ag 0.65320(5) 0.48622(5) 0.43657(4) 0.04313(19) Uani 1 1 d . . . . .
Ag40 Ag 0.21712(8) 0.50270(8) 0.12152(7) 0.0794(4) Uani 1 1 d . . . . .
Ag41 Ag 0.74019(8) 0.69231(8) 0.32191(7) 0.0738(3) Uani 1 1 d . . . . .
Ag42 Ag 0.53367(5) 0.32211(5) 0.43144(4) 0.0462(2) Uani 1 1 d . . . . .
C1 C 0.8793(9) 0.3839(11) 0.3501(9) 0.082(5) Uani 1 1 d . . . . .
H1A H 0.8919 0.4285 0.3433 0.123 Uiso 1 1 d R . . . .
H1B H 0.9112 0.3599 0.3394 0.123 Uiso 1 1 d R . . . .
H1C H 0.8853 0.3975 0.3899 0.123 Uiso 1 1 d R . . . .
C2 C 0.8015(8) 0.3297(9) 0.3156(7) 0.060(3) Uani 1 1 d . . . . .
H2 H 0.7933 0.3232 0.2759 0.072 Uiso 1 1 calc R . . . .
C3 C 0.7819(11) 0.2530(10) 0.3168(10) 0.089(6) Uani 1 1 d . . . . .
H3A H 0.7729 0.2546 0.3518 0.133 Uiso 1 1 d R . . . .
H3B H 0.8219 0.2385 0.3134 0.133 Uiso 1 1 d R . . . .
H3C H 0.7384 0.2170 0.2851 0.133 Uiso 1 1 d R . . . .
C4 C 0.6653(16) 0.187(3) 0.173(2) 0.299(19) Uiso 1 1 d D U . . .
H4A H 0.6530 0.1557 0.1931 0.448 Uiso 1 1 calc R . . . .
H4B H 0.6926 0.1700 0.1492 0.448 Uiso 1 1 calc R . . . .
H4C H 0.6947 0.2384 0.2001 0.448 Uiso 1 1 calc R . . . .
C5 C 0.5948(11) 0.1813(12) 0.1362(11) 0.298(19) Uiso 1 1 d D U . . .
H5 H 0.5646 0.1295 0.1073 0.357 Uiso 1 1 calc R . . . .
C6 C 0.6257(16) 0.2337(19) 0.1086(9) 0.300(19) Uiso 1 1 d D U . . .
H6A H 0.5858 0.2351 0.0838 0.450 Uiso 1 1 calc R . . . .
H6B H 0.6564 0.2837 0.1378 0.450 Uiso 1 1 calc R . . . .
H6C H 0.6543 0.2153 0.0868 0.450 Uiso 1 1 calc R . . . .
C7 C 0.7858(15) 0.335(2) 0.0221(12) 0.149(7) Uani 1 1 d . U . . .
H7A H 0.7725 0.3278 -0.0171 0.224 Uiso 1 1 d R . . . .
H7B H 0.7830 0.2884 0.0236 0.224 Uiso 1 1 d R . . . .
H7C H 0.8353 0.3731 0.0422 0.224 Uiso 1 1 d R . . . .
C8 C 0.7383(15) 0.361(2) 0.0491(11) 0.145(5) Uani 1 1 d . U . . .
H8A H 0.7134 0.3779 0.0245 0.174 Uiso 1 1 calc R . . . .
H8B H 0.7009 0.3177 0.0490 0.174 Uiso 1 1 calc R . . . .
C9 C 0.7627(14) 0.414(2) 0.0997(11) 0.143(5) Uani 1 1 d . U . . .
H9A H 0.7969 0.4580 0.0983 0.172 Uiso 1 1 calc R . . . .
H9B H 0.7922 0.3988 0.1231 0.172 Uiso 1 1 calc R . . . .
C10 C 0.9346(11) 0.6256(16) 0.3633(10) 0.106(8) Uani 1 1 d . . . . .
H10A H 0.9224 0.6355 0.3981 0.158 Uiso 1 1 d R . . . .
H10B H 0.9821 0.6633 0.3705 0.158 Uiso 1 1 d R . . . .
H10C H 0.9355 0.5766 0.3495 0.158 Uiso 1 1 d R . . . .
C11 C 0.8818(8) 0.6278(10) 0.3224(7) 0.067(4) Uani 1 1 d . . . . .
H11 H 0.8739 0.5887 0.2852 0.080 Uiso 1 1 calc R . . . .
C12 C 0.9062(14) 0.7027(17) 0.3179(14) 0.128(10) Uani 1 1 d . . . . .
H12A H 0.8632 0.7071 0.3001 0.192 Uiso 1 1 d R . . . .
H12B H 0.9368 0.7012 0.2938 0.192 Uiso 1 1 d R . . . .
H12C H 0.9333 0.7455 0.3542 0.192 Uiso 1 1 d R . . . .
C13 C 0.6991(13) 0.6360(13) 0.1564(9) 0.103(5) Uani 1 1 d . U . . .
H13A H 0.7258 0.6665 0.1963 0.154 Uiso 1 1 d R . . . .
H13B H 0.7145 0.6646 0.1351 0.154 Uiso 1 1 d R . . . .
H13C H 0.7089 0.5918 0.1438 0.154 Uiso 1 1 d R . . . .
C14 C 0.6209(13) 0.6137(12) 0.1481(8) 0.094(5) Uani 1 1 d . U . . .
H14 H 0.5928 0.5721 0.1101 0.113 Uiso 1 1 calc R . . . .
C15 C 0.6042(14) 0.6781(12) 0.1518(9) 0.101(5) Uani 1 1 d . U . . .
H15A H 0.5518 0.6628 0.1419 0.152 Uiso 1 1 d R . . . .
H15B H 0.6219 0.6962 0.1254 0.152 Uiso 1 1 d R . . . .
H15C H 0.6278 0.7177 0.1898 0.152 Uiso 1 1 d R . . . .
C16 C 0.3252(11) 0.4804(14) 0.0129(7) 0.092(6) Uani 1 1 d . . . . .
H16A H 0.3364 0.4370 0.0036 0.139 Uiso 1 1 d R . . . .
H16B H 0.3382 0.5046 -0.0117 0.139 Uiso 1 1 d R . . . .
H16C H 0.2734 0.4649 0.0075 0.139 Uiso 1 1 d R . . . .
C17 C 0.3678(10) 0.5341(10) 0.0718(7) 0.070(4) Uani 1 1 d . . . . .
H17 H 0.4200 0.5458 0.0765 0.084 Uiso 1 1 calc R . . . .
C18 C 0.3586(13) 0.6040(13) 0.0861(9) 0.096(6) Uani 1 1 d . . . . .
H18A H 0.3085 0.5952 0.0840 0.144 Uiso 1 1 d R . . . .
H18B H 0.3717 0.6247 0.0597 0.144 Uiso 1 1 d R . . . .
H18C H 0.3905 0.6390 0.1243 0.144 Uiso 1 1 d R . . . .
C19 C 0.1230(14) 0.1525(15) -0.0865(12) 0.142(12) Uani 1 1 d . U . . .
H19A H 0.1023 0.1334 -0.0616 0.213 Uiso 1 1 d R . . . .
H19B H 0.1255 0.1123 -0.1169 0.213 Uiso 1 1 d R . . . .
H19C H 0.0926 0.1727 -0.1024 0.213 Uiso 1 1 d R . . . .
C20 C 0.1968(13) 0.2113(12) -0.0508(5) 0.101(7) Uani 1 1 d D U . . .
H20 H 0.2318 0.1879 -0.0524 0.121 Uiso 1 1 calc R . . . .
C21 C 0.215(2) 0.2635(19) -0.0739(12) 0.181(17) Uani 1 1 d . U . . .
H21A H 0.1912 0.2966 -0.0623 0.272 Uiso 1 1 d R . . . .
H21B H 0.1996 0.2390 -0.1149 0.272 Uiso 1 1 d R . . . .
H21C H 0.2675 0.2922 -0.0594 0.272 Uiso 1 1 d R . . . .
C22 C 0.1962(12) -0.0412(11) 0.0364(10) 0.098(6) Uani 1 1 d . . . . .
H22A H 0.2302 -0.0452 0.0644 0.147 Uiso 1 1 d R . . . .
H22B H 0.1668 -0.0902 0.0056 0.147 Uiso 1 1 d R . . . .
H22C H 0.1648 -0.0216 0.0537 0.147 Uiso 1 1 d R . . . .
C23 C 0.2379(10) 0.0096(9) 0.0129(7) 0.072(4) Uani 1 1 d . . . . .
H23 H 0.2702 -0.0110 -0.0039 0.086 Uiso 1 1 calc R . . . .
C24 C 0.1896(11) 0.0186(11) -0.0310(8) 0.089(6) Uani 1 1 d . . . . .
H24A H 0.1574 0.0381 -0.0148 0.133 Uiso 1 1 d R . . . .
H24B H 0.1608 -0.0293 -0.0632 0.133 Uiso 1 1 d R . . . .
H24C H 0.2194 0.0534 -0.0432 0.133 Uiso 1 1 d R . . . .
C25 C 0.0212(11) 0.0415(10) 0.0931(10) 0.096(7) Uani 1 1 d . . . . .
H25A H 0.0519 0.0228 0.1107 0.144 Uiso 1 1 d R . . . .
H25B H -0.0172 0.0004 0.0598 0.144 Uiso 1 1 d R . . . .
H25C H -0.0005 0.0643 0.1198 0.144 Uiso 1 1 d R . . . .
C26 C 0.0640(8) 0.0985(9) 0.0772(6) 0.065(4) Uani 1 1 d . . . . .
H26 H 0.0819 0.0730 0.0476 0.078 Uiso 1 1 calc R . . . .
C27 C 0.0217(9) 0.1289(11) 0.0528(9) 0.084(5) Uani 1 1 d . . . . .
H27A H 0.0195 0.1698 0.0827 0.127 Uiso 1 1 d R . . . .
H27B H -0.0273 0.0909 0.0307 0.127 Uiso 1 1 d R . . . .
H27C H 0.0445 0.1476 0.0285 0.127 Uiso 1 1 d R . . . .
C28 C -0.0350(11) 0.0582(9) 0.2622(10) 0.103(5) Uani 1 1 d D U . . .
H28A H -0.0697 0.0261 0.2245 0.155 Uiso 1 1 d R . . . .
H28B H -0.0565 0.0474 0.2897 0.155 Uiso 1 1 d R . . . .
H28C H 0.0088 0.0491 0.2650 0.155 Uiso 1 1 d R . . . .
C29 C -0.0106(9) 0.1429(9) 0.2802(9) 0.086(3) Uani 1 1 d D U . . .
H29 H -0.0243 0.1435 0.2427 0.104 Uiso 1 1 calc R . . . .
C30 C -0.0724(11) 0.1563(12) 0.3013(11) 0.121(6) Uani 1 1 d D U . . .
H30A H -0.0469 0.1790 0.3416 0.182 Uiso 1 1 d R . . . .
H30B H -0.1137 0.1098 0.2913 0.182 Uiso 1 1 d R . . . .
H30C H -0.0896 0.1902 0.2916 0.182 Uiso 1 1 d R . . . .
C31 C 0.1669(13) -0.1042(12) 0.1591(12) 0.117(9) Uani 1 1 d . . . . .
H31A H 0.2125 -0.0856 0.1517 0.175 Uiso 1 1 d R . . . .
H31B H 0.1341 -0.1522 0.1283 0.175 Uiso 1 1 d R . . . .
H31C H 0.1761 -0.1098 0.1941 0.175 Uiso 1 1 d R . . . .
C32 C 0.1323(10) -0.0506(9) 0.1652(8) 0.074(4) Uani 1 1 d . . . . .
H32 H 0.1177 -0.0504 0.1276 0.089 Uiso 1 1 calc R . . . .
C33 C 0.0623(11) -0.0745(11) 0.1811(10) 0.097(6) Uani 1 1 d . . . . .
H33A H 0.0737 -0.0682 0.2200 0.145 Uiso 1 1 d R . . . .
H33B H 0.0298 -0.1262 0.1563 0.145 Uiso 1 1 d R . . . .
H33C H 0.0388 -0.0424 0.1767 0.145 Uiso 1 1 d R . . . .
C34 C 0.391(2) -0.0587(18) 0.3762(12) 0.188(16) Uani 1 1 d D U . . .
H34A H 0.4397 -0.0264 0.3808 0.282 Uiso 1 1 d R . . . .
H34B H 0.3870 -0.1089 0.3680 0.282 Uiso 1 1 d R . . . .
H34C H 0.3792 -0.0396 0.4108 0.282 Uiso 1 1 d R . . . .
C35 C 0.3583(18) -0.0901(14) 0.2679(13) 0.133(10) Uani 1 1 d . U . . .
H35A H 0.3208 -0.0931 0.2381 0.200 Uiso 1 1 d R . . . .
H35B H 0.3559 -0.1398 0.2603 0.200 Uiso 1 1 d R . . . .
H35C H 0.4058 -0.0581 0.2694 0.200 Uiso 1 1 d R . . . .
C36 C 0.3459(14) -0.0566(12) 0.3235(10) 0.098(6) Uani 1 1 d D U . . .
H36 H 0.2943 -0.0872 0.3174 0.118 Uiso 1 1 calc R . . . .
C37 C 0.5910(16) 0.0331(11) 0.2696(9) 0.105(8) Uani 1 1 d . . . . .
H37A H 0.5389 0.0197 0.2578 0.157 Uiso 1 1 d R . . . .
H37B H 0.5996 -0.0079 0.2741 0.157 Uiso 1 1 d R . . . .
H37C H 0.6109 0.0437 0.2413 0.157 Uiso 1 1 d R . . . .
C38 C 0.6299(9) 0.1035(8) 0.3281(7) 0.066(4) Uani 1 1 d . . . . .
H38 H 0.6815 0.1290 0.3313 0.079 Uiso 1 1 calc R . . . .
C39 C 0.6278(10) 0.0831(10) 0.3781(8) 0.073(4) Uani 1 1 d . . . . .
H39A H 0.6534 0.1287 0.4127 0.109 Uiso 1 1 d R . . . .
H39B H 0.6518 0.0497 0.3774 0.109 Uiso 1 1 d R . . . .
H39C H 0.5778 0.0588 0.3765 0.109 Uiso 1 1 d R . . . .
C40 C 0.3534(16) 0.0219(11) 0.5288(9) 0.112(9) Uani 1 1 d . . . . .
H40A H 0.3576 0.0029 0.4913 0.167 Uiso 1 1 d R . . . .
H40B H 0.3260 -0.0196 0.5362 0.167 Uiso 1 1 d R . . . .
H40C H 0.4017 0.0498 0.5566 0.167 Uiso 1 1 d R . . . .
C41 C 0.3104(14) 0.0689(10) 0.5340(10) 0.099(7) Uani 1 1 d . . . . .
H41 H 0.3044 0.0831 0.5719 0.119 Uiso 1 1 calc R . . . .
C42 C 0.2367(13) 0.0294(11) 0.4906(13) 0.121(9) Uani 1 1 d . . . . .
H42A H 0.2160 0.0652 0.4912 0.181 Uiso 1 1 d R . . . .
H42B H 0.2057 -0.0087 0.4995 0.181 Uiso 1 1 d R . . . .
H42C H 0.2401 0.0062 0.4533 0.181 Uiso 1 1 d R . . . .
C43 C 0.1183(18) 0.1387(15) 0.5480(11) 0.145(12) Uani 1 1 d . U . . .
H43A H 0.1689 0.1464 0.5589 0.217 Uiso 1 1 d R . . . .
H43B H 0.0880 0.0930 0.5493 0.217 Uiso 1 1 d R . . . .
H43C H 0.1126 0.1807 0.5738 0.217 Uiso 1 1 d R . . . .
C44 C 0.0969(14) 0.1312(12) 0.4887(10) 0.108(8) Uani 1 1 d . U . . .
H44 H 0.0983 0.0850 0.4629 0.130 Uiso 1 1 calc R . . . .
C45 C 0.0210(16) 0.124(2) 0.4749(17) 0.183(16) Uani 1 1 d . U . . .
H45A H 0.0081 0.1537 0.5053 0.274 Uiso 1 1 d R . . . .
H45B H -0.0106 0.0718 0.4611 0.274 Uiso 1 1 d R . . . .
H45C H 0.0150 0.1398 0.4443 0.274 Uiso 1 1 d R . . . .
C46 C 0.3068(11) 0.7937(11) 0.4378(10) 0.090(6) Uani 1 1 d . . . . .
H46A H 0.3130 0.8016 0.4047 0.134 Uiso 1 1 d R . . . .
H46B H 0.2952 0.8325 0.4615 0.134 Uiso 1 1 d R . . . .
H46C H 0.2674 0.7452 0.4261 0.134 Uiso 1 1 d R . . . .
C47 C 0.3763(10) 0.7968(9) 0.4704(7) 0.070(4) Uani 1 1 d . . . . .
H47 H 0.3696 0.7929 0.5055 0.084 Uiso 1 1 calc R . . . .
C48 C 0.4435(11) 0.8661(10) 0.4878(9) 0.083(5) Uani 1 1 d . . . . .
H48A H 0.4851 0.8636 0.5096 0.125 Uiso 1 1 d R . . . .
H48B H 0.4361 0.9088 0.5106 0.125 Uiso 1 1 d R . . . .
H48C H 0.4523 0.8713 0.4542 0.125 Uiso 1 1 d R . . . .
C49 C 0.5158(16) 0.8022(14) 0.2198(10) 0.117(8) Uani 1 1 d . . . . .
H49A H 0.5593 0.7933 0.2275 0.175 Uiso 1 1 d R . . . .
H49B H 0.5291 0.8521 0.2216 0.175 Uiso 1 1 d R . . . .
H49C H 0.4828 0.7657 0.1824 0.175 Uiso 1 1 d R . . . .
C50 C 0.4821(9) 0.7972(9) 0.2650(8) 0.074(5) Uani 1 1 d . . . . .
H50 H 0.4311 0.7905 0.2512 0.088 Uiso 1 1 calc R . . . .
C51 C 0.5205(15) 0.8683(11) 0.3178(10) 0.104(7) Uani 1 1 d . . . . .
H51A H 0.4991 0.8638 0.3470 0.156 Uiso 1 1 d R . . . .
H51B H 0.5166 0.9096 0.3104 0.156 Uiso 1 1 d R . . . .
H51C H 0.5715 0.8776 0.3304 0.156 Uiso 1 1 d R . . . .
C52 C 0.5134(11) 0.2875(11) -0.0111(8) 0.086(5) Uani 1 1 d . . . . .
H52A H 0.5606 0.3211 0.0174 0.130 Uiso 1 1 d R . . . .
H52B H 0.5178 0.2792 -0.0484 0.130 Uiso 1 1 d R . . . .
H52C H 0.4965 0.2401 -0.0082 0.130 Uiso 1 1 d R . . . .
C53 C 0.4604(10) 0.3223(11) -0.0010(7) 0.079(5) Uani 1 1 d . . . . .
H53 H 0.4142 0.2911 -0.0329 0.095 Uiso 1 1 calc R . . . .
C54 C 0.4890(11) 0.4025(13) 0.0025(8) 0.093(6) Uani 1 1 d . . . . .
H54A H 0.4550 0.4235 0.0130 0.139 Uiso 1 1 d R . . . .
H54B H 0.4921 0.4015 -0.0339 0.139 Uiso 1 1 d R . . . .
H54C H 0.5368 0.4330 0.0308 0.139 Uiso 1 1 d R . . . .
C55 C 0.9631(9) 0.5693(10) 0.5020(9) 0.079(4) Uani 1 1 d . U . . .
H55A H 0.9371 0.5262 0.5083 0.119 Uiso 1 1 d R . . . .
H55B H 1.0145 0.5906 0.5233 0.119 Uiso 1 1 d R . . . .
H55C H 0.9571 0.5539 0.4620 0.119 Uiso 1 1 d R . . . .
C56 C 0.9328(9) 0.6270(10) 0.5223(10) 0.084(4) Uani 1 1 d . U . . .
H56 H 0.9419 0.6563 0.4997 0.101 Uiso 1 1 calc R . . . .
C57 C 0.9667(11) 0.6788(12) 0.5784(11) 0.107(5) Uani 1 1 d . U . . .
H57A H 0.9379 0.7066 0.5895 0.160 Uiso 1 1 d R . . . .
H57B H 1.0148 0.7129 0.5824 0.160 Uiso 1 1 d R . . . .
H57C H 0.9716 0.6532 0.6024 0.160 Uiso 1 1 d R . . . .
C58 C 0.0474(12) 0.4729(16) 0.1531(12) 0.112(8) Uani 1 1 d . . . . .
H58A H 0.0794 0.5115 0.1901 0.169 Uiso 1 1 d R . . . .
H58B H -0.0020 0.4691 0.1487 0.169 Uiso 1 1 d R . . . .
H58C H 0.0637 0.4857 0.1242 0.169 Uiso 1 1 d R . . . .
C59 C 0.0473(11) 0.4005(15) 0.1457(11) 0.101(7) Uani 1 1 d . . . . .
H59 H 0.0333 0.3899 0.1769 0.121 Uiso 1 1 calc R . . . .
C60 C -0.0047(11) 0.3351(17) 0.0908(14) 0.142(12) Uani 1 1 d . . . . .
H60A H 0.0079 0.3483 0.0609 0.213 Uiso 1 1 d R . . . .
H60B H -0.0540 0.3298 0.0890 0.213 Uiso 1 1 d R . . . .
H60C H -0.0016 0.2882 0.0860 0.213 Uiso 1 1 d R . . . .
C61 C 0.1437(14) 0.5993(17) 0.3165(14) 0.144(7) Uani 1 1 d D U . . .
H61A H 0.1858 0.5984 0.3048 0.216 Uiso 1 1 calc R . . . .
H61B H 0.1038 0.5871 0.2842 0.216 Uiso 1 1 calc R . . . .
H61C H 0.1561 0.6488 0.3452 0.216 Uiso 1 1 calc R . . . .
C62 C 0.1207(11) 0.5416(8) 0.3411(10) 0.132(7) Uani 1 1 d D U . . .
H62 H 0.1544 0.5800 0.3790 0.159 Uiso 1 1 d R . . . .
C63 C 0.0640(11) 0.5091(17) 0.3674(11) 0.119(6) Uani 1 1 d D U . . .
H63A H 0.0734 0.4711 0.3766 0.178 Uiso 1 1 calc R . . . .
H63B H 0.0677 0.5487 0.4016 0.178 Uiso 1 1 calc R . . . .
H63C H 0.0154 0.4871 0.3406 0.178 Uiso 1 1 calc R . . . .
C64 C 0.419(3) -0.158(3) 0.083(2) 0.297(14) Uiso 1 1 d D U . . .
H64A H 0.4657 -0.1252 0.0843 0.445 Uiso 1 1 d R . . . .
H64B H 0.3946 -0.1994 0.0455 0.445 Uiso 1 1 d R . . . .
H64C H 0.4253 -0.1774 0.1110 0.445 Uiso 1 1 d R . . . .
C65 C 0.360(2) -0.128(2) 0.0940(19) 0.297(12) Uiso 1 1 d D U . . .
H65A H 0.3124 -0.1680 0.0859 0.356 Uiso 1 1 calc R . . . .
H65B H 0.3533 -0.0990 0.0726 0.356 Uiso 1 1 calc R . . . .
C66 C 0.398(3) -0.077(3) 0.1592(15) 0.296(11) Uiso 1 1 d D U . . .
H66A H 0.3732 -0.0983 0.1820 0.355 Uiso 1 1 calc R . . . .
H66B H 0.4495 -0.0667 0.1712 0.355 Uiso 1 1 calc R . . . .
C67 C 0.3860(18) -0.0062(16) 0.1606(10) 0.294(11) Uiso 1 1 d D U . . .
C68 C 0.2451(14) 0.059(2) -0.1899(15) 0.196(9) Uani 1 1 d D U . . .
H68A H 0.2243 0.0863 -0.1649 0.294 Uiso 1 1 d R . . . .
H68B H 0.2283 0.0085 -0.1937 0.294 Uiso 1 1 d R . . . .
H68C H 0.2300 0.0593 -0.2267 0.294 Uiso 1 1 d R . . . .
C69 C 0.3282(16) 0.1113(17) -0.1632(12) 0.180(6) Uani 1 1 d D U . . .
H69A H 0.3382 0.1586 -0.1320 0.215 Uiso 1 1 calc R . . . .
H69B H 0.3498 0.1215 -0.1914 0.215 Uiso 1 1 calc R . . . .
C70 C 0.3550(18) 0.0600(19) -0.1420(10) 0.172(6) Uani 1 1 d D U . . .
H70A H 0.3197 0.0076 -0.1615 0.207 Uiso 1 1 calc R . . . .
H70B H 0.4027 0.0640 -0.1459 0.207 Uiso 1 1 calc R . . . .
C71 C 0.359(2) 0.096(2) -0.0786(10) 0.163(5) Uani 1 1 d D U . . .
C72 C 0.1288(19) 0.391(2) -0.1224(14) 0.195(8) Uani 1 1 d D U . . .
H72A H 0.1202 0.3464 -0.1547 0.293 Uiso 1 1 d R . . . .
H72B H 0.1625 0.3960 -0.0893 0.293 Uiso 1 1 d R . . . .
H72C H 0.1494 0.4346 -0.1299 0.293 Uiso 1 1 d R . . . .
C73 C 0.0526(15) 0.3839(18) -0.1163(13) 0.184(6) Uani 1 1 d D U . . .
H73A H 0.0254 0.3363 -0.1154 0.221 Uiso 1 1 calc R . . . .
H73B H 0.0233 0.3898 -0.1464 0.221 Uiso 1 1 calc R . . . .
C74 C 0.0780(19) 0.4518(19) -0.0574(12) 0.177(6) Uani 1 1 d D U . . .
H74A H 0.1163 0.4941 -0.0581 0.212 Uiso 1 1 calc R . . . .
H74B H 0.0366 0.4651 -0.0549 0.212 Uiso 1 1 calc R . . . .
C75 C 0.107(2) 0.447(3) -0.0012(16) 0.167(5) Uani 1 1 d . U . . .
C76 C -0.2198(14) 0.1912(16) 0.0941(11) 0.124(6) Uani 1 1 d . U . . .
H76A H -0.2239 0.1661 0.0548 0.186 Uiso 1 1 d R . . . .
H76B H -0.2117 0.2427 0.1031 0.186 Uiso 1 1 d R . . . .
H76C H -0.2644 0.1660 0.1005 0.186 Uiso 1 1 d R . . . .
C77 C -0.1593(11) 0.1898(11) 0.1269(8) 0.100(4) Uani 1 1 d D U . . .
H77A H -0.1289 0.1784 0.1035 0.120 Uiso 1 1 calc R . . . .
H77B H -0.1761 0.1496 0.1390 0.120 Uiso 1 1 calc R . . . .
C78 C -0.1121(10) 0.2646(10) 0.1799(8) 0.089(3) Uani 1 1 d D U . . .
H78A H -0.1067 0.3059 0.1689 0.106 Uiso 1 1 calc R . . . .
H78B H -0.1384 0.2693 0.2075 0.106 Uiso 1 1 calc R . . . .
C79 C -0.0381(10) 0.2735(12) 0.2082(8) 0.079(2) Uani 1 1 d . U . . .
C80 C 0.2823(14) 0.7493(16) 0.1569(12) 0.151(7) Uani 1 1 d D U . . .
H80A H 0.2867 0.7527 0.1220 0.227 Uiso 1 1 calc R . . . .
H80B H 0.2888 0.7974 0.1843 0.227 Uiso 1 1 calc R . . . .
H80C H 0.3194 0.7351 0.1718 0.227 Uiso 1 1 calc R . . . .
C81 C 0.2050(12) 0.6891(15) 0.1451(8) 0.130(4) Uani 1 1 d D U . . .
H81A H 0.1989 0.6414 0.1164 0.155 Uiso 1 1 calc R . . . .
H81B H 0.1684 0.7036 0.1288 0.155 Uiso 1 1 calc R . . . .
C82 C 0.1884(11) 0.6762(14) 0.1971(10) 0.115(4) Uani 1 1 d D U . . .
H82A H 0.1431 0.6313 0.1844 0.138 Uiso 1 1 calc R . . . .
H82B H 0.1824 0.7190 0.2224 0.138 Uiso 1 1 calc R . . . .
C83 C 0.2540(12) 0.6664(14) 0.2291(10) 0.103(3) Uani 1 1 d D U . . .
C84 C 0.8056(18) 1.053(2) 0.357(2) 0.20(2) Uani 1 1 d . . . . .
H84A H 0.7913 1.0658 0.3263 0.302 Uiso 1 1 d R . . . .
H84B H 0.8564 1.0610 0.3649 0.302 Uiso 1 1 d R . . . .
H84C H 0.7993 1.0847 0.3908 0.302 Uiso 1 1 d R . . . .
C85 C 0.7585(15) 0.9754(16) 0.3433(15) 0.135(11) Uani 1 1 d . . . . .
H85A H 0.7388 0.9751 0.3744 0.162 Uiso 1 1 calc R . . . .
H85B H 0.7172 0.9576 0.3096 0.162 Uiso 1 1 calc R . . . .
C86 C 0.7899(12) 0.9234(12) 0.3333(12) 0.100(7) Uani 1 1 d . . . . .
H86A H 0.8328 0.9433 0.3664 0.120 Uiso 1 1 calc R . . . .
H86B H 0.8079 0.9231 0.3013 0.120 Uiso 1 1 calc R . . . .
C87 C 0.7451(11) 0.8401(11) 0.3206(9) 0.080(5) Uani 1 1 d . . . . .
C88 C 0.7152(14) 0.441(2) 0.1344(10) 0.136(4) Uani 1 1 d . U . . .
C89 C 0.8964(12) 0.1798(14) 0.5292(11) 0.109(5) Uani 1 1 d . U . . .
H89A H 0.8731 0.1272 0.5208 0.164 Uiso 1 1 d R . . . .
H89B H 0.9009 0.2098 0.5677 0.164 Uiso 1 1 d R . . . .
H89C H 0.9445 0.1912 0.5249 0.164 Uiso 1 1 d R . . . .
C90 C 0.8484(11) 0.1976(9) 0.4816(9) 0.094(3) Uani 1 1 d D U . . .
H90A H 0.8634 0.1879 0.4477 0.113 Uiso 1 1 calc R . . . .
H90B H 0.7959 0.1676 0.4708 0.113 Uiso 1 1 calc R . . . .
C91 C 0.8684(10) 0.2820(9) 0.5146(9) 0.082(3) Uani 1 1 d D U . . .
H91A H 0.8643 0.2913 0.5525 0.099 Uiso 1 1 calc R . . . .
H91B H 0.9193 0.3108 0.5191 0.099 Uiso 1 1 calc R . . . .
C92 C 0.8192(9) 0.3102(10) 0.4849(8) 0.072(2) Uani 1 1 d . U . . .
C93 C -0.0638(13) -0.1415(17) 0.2688(12) 0.131(10) Uani 1 1 d . . . . .
H93A H -0.1134 -0.1496 0.2519 0.196 Uiso 1 1 d R . . . .
H93B H -0.0610 -0.1894 0.2600 0.196 Uiso 1 1 d R . . . .
H93C H -0.0314 -0.1132 0.2539 0.196 Uiso 1 1 d R . . . .
C94 C -0.0394(13) -0.0985(17) 0.3335(14) 0.130(10) Uani 1 1 d . . . . .
H94A H -0.0728 -0.1272 0.3481 0.156 Uiso 1 1 calc R . . . .
H94B H -0.0434 -0.0507 0.3426 0.156 Uiso 1 1 calc R . . . .
C95 C 0.0425(12) -0.0824(12) 0.3654(11) 0.103(7) Uani 1 1 d . . . . .
H95A H 0.0524 -0.0604 0.4064 0.124 Uiso 1 1 calc R . . . .
H95B H 0.0486 -0.1293 0.3545 0.124 Uiso 1 1 calc R . . . .
C96 C 0.0963(12) -0.0279(9) 0.3489(9) 0.085(6) Uani 1 1 d . . . . .
C97 C 0.9062(13) 0.4541(14) 0.2360(11) 0.105(7) Uani 1 1 d . . . . .
H97A H 0.8985 0.4177 0.1987 0.158 Uiso 1 1 calc GR . . . .
H97B H 0.9396 0.4500 0.2643 0.158 Uiso 1 1 calc GR . . . .
H97C H 0.9266 0.5040 0.2376 0.158 Uiso 1 1 calc GR . . . .
O1 O 0.2129(5) 0.3364(5) 0.2795(4) 0.0480(19) Uani 1 1 d . . . . .
O2 O 0.2527(4) 0.2560(4) 0.3330(3) 0.0402(17) Uani 1 1 d . . . . .
O3 O 0.3430(5) 0.1903(4) 0.3090(3) 0.0446(18) Uani 1 1 d . . . . .
O4 O 0.4206(5) 0.2508(5) 0.4244(4) 0.0462(19) Uani 1 1 d . . . . .
O5 O 0.3216(4) 0.3137(4) 0.4453(3) 0.0401(17) Uani 1 1 d . . . . .
O6 O 0.3918(5) 0.1904(5) 0.2197(3) 0.049(2) Uani 1 1 d . . . . .
O7 O 0.4954(5) 0.2704(5) 0.3290(4) 0.050(2) Uani 1 1 d . . . . .
O8 O 0.3887(4) 0.3297(4) 0.3590(3) 0.0366(16) Uani 1 1 d . . . . .
O9 O 0.3168(4) 0.2809(4) 0.2495(3) 0.0404(17) Uani 1 1 d . . . . .
O10 O 0.3017(4) 0.4148(4) 0.3935(3) 0.0410(17) Uani 1 1 d . . . . .
O11 O 0.2896(4) 0.3740(5) 0.1944(4) 0.0474(19) Uani 1 1 d . . . . .
O12 O 0.3761(5) 0.3013(5) 0.1611(4) 0.0488(19) Uani 1 1 d . . . . .
O13 O 0.4535(4) 0.3512(4) 0.2771(3) 0.0407(17) Uani 1 1 d . . . . .
O14 O 0.3650(4) 0.4210(4) 0.3089(3) 0.0365(16) Uani 1 1 d . . . . .
O15 O 0.6038(4) 0.4206(4) 0.3323(3) 0.0417(17) Uani 1 1 d . . . . .
O16 O 0.5511(5) 0.4017(5) 0.2208(4) 0.050(2) Uani 1 1 d . . . . .
O17 O 0.5153(4) 0.5025(4) 0.3596(3) 0.0373(16) Uani 1 1 d . . . . .
O18 O 0.4441(4) 0.4547(4) 0.2494(3) 0.0410(17) Uani 1 1 d . . . . .
O19 O 0.3577(5) 0.5399(5) 0.2838(3) 0.0431(18) Uani 1 1 d . . . . .
O20 O 0.4139(4) 0.5609(5) 0.3957(3) 0.0419(17) Uani 1 1 d . . . . .
O21 O 0.5081(4) 0.6081(4) 0.3346(3) 0.0392(17) Uani 1 1 d . . . . .
O22 O 0.5986(4) 0.5397(5) 0.3053(3) 0.0430(18) Uani 1 1 d . . . . .
O23 O 0.6704(4) 0.5852(5) 0.4197(3) 0.0424(17) Uani 1 1 d . . . . .
O24 O 0.5800(4) 0.6559(4) 0.4464(3) 0.0412(17) Uani 1 1 d . . . . .
O25 O 0.2980(8) 0.7244(9) 0.2805(7) 0.100(3) Uani 1 1 d . U . . .
O26 O 0.2621(9) 0.6122(9) 0.2125(7) 0.104(3) Uani 1 1 d . U . . .
O27 O 0.1577(12) 0.5092(14) 0.0423(10) 0.161(6) Uani 1 1 d . U . . .
O28 O 0.0941(13) 0.3837(15) -0.0080(10) 0.166(6) Uani 1 1 d . U . . .
O29 O -0.0055(7) 0.3243(8) 0.2564(6) 0.084(3) Uani 1 1 d . U . . .
O30 O -0.0104(7) 0.2305(7) 0.1818(5) 0.077(2) Uani 1 1 d . U . . .
O31 O 0.0840(8) 0.0299(8) 0.3509(7) 0.100(4) Uani 1 1 d . . . . .
O32 O 0.1455(8) -0.0420(7) 0.3371(7) 0.090(4) Uani 1 1 d . . . . .
O33 O 0.3311(12) 0.1443(15) -0.0619(8) 0.156(6) Uani 1 1 d . U . . .
O34 O 0.3945(13) 0.0867(15) -0.0421(9) 0.160(6) Uani 1 1 d . U . . .
O35 O 0.330(2) -0.003(2) 0.1706(18) 0.296(11) Uiso 1 1 d D U . . .
O36 O 0.442(2) 0.025(2) 0.1504(18) 0.292(11) Uiso 1 1 d D U . . .
O37 O 0.7396(9) 0.4734(13) 0.1860(6) 0.135(5) Uani 1 1 d . U . . .
O38 O 0.6519(8) 0.4309(12) 0.1052(6) 0.132(5) Uani 1 1 d . U . . .
O39 O 0.6592(5) 0.6896(5) 0.3756(4) 0.050(2) Uani 1 1 d . . . . .
O40 O 0.2669(5) 0.1596(4) 0.3818(4) 0.048(2) Uani 1 1 d . . . . .
O41 O 0.8476(6) 0.3736(7) 0.4882(5) 0.072(2) Uani 1 1 d . U . . .
O42 O 0.7527(6) 0.2657(7) 0.4606(5) 0.072(2) Uani 1 1 d . U . . .
O43 O 0.7799(7) 0.7982(8) 0.3119(8) 0.099(4) Uani 1 1 d . . . . .
O44 O 0.6808(7) 0.8200(7) 0.3183(6) 0.084(3) Uani 1 1 d . . . . .
O45 O 0.8365(9) 0.4402(9) 0.2470(6) 0.104(4) Uani 1 1 d . . . . .
S1 S 0.79308(18) 0.6043(2) 0.33689(14) 0.0520(7) Uani 1 1 d . . . . .
S2 S 0.73740(18) 0.3667(2) 0.34410(15) 0.0534(7) Uani 1 1 d . . . . .
S3 S 0.83052(17) 0.5769(2) 0.50078(15) 0.0511(7) Uani 1 1 d . . . . .
S4 S 0.66052(16) 0.40714(17) 0.48423(13) 0.0436(6) Uani 1 1 d . . . . .
S5 S 0.5854(2) 0.1693(2) 0.33042(17) 0.0614(9) Uani 1 1 d . . . . .
S6 S 0.5426(2) 0.2162(2) 0.17973(17) 0.0664(9) Uani 1 1 d D U . . .
S7 S 0.5963(2) 0.5818(2) 0.20356(16) 0.0639(9) Uani 1 1 d . . . . .
S8 S 0.4795(2) 0.7160(2) 0.28070(16) 0.0581(8) Uani 1 1 d . . . . .
S9 S 0.3925(2) 0.7139(2) 0.42982(16) 0.0621(9) Uani 1 1 d . . . . .
S10 S 0.3415(2) 0.4906(2) 0.12082(15) 0.0560(8) Uani 1 1 d . . . . .
S11 S 0.4404(2) 0.3263(2) 0.06626(15) 0.0624(9) Uani 1 1 d . . . . .
S12 S 0.1443(2) 0.4079(3) 0.15411(19) 0.0684(10) Uani 1 1 d . . . . .
S13 S 0.2024(3) 0.2573(4) 0.0249(2) 0.0926(15) Uani 1 1 d D U . . .
S14 S 0.2956(2) 0.1018(2) 0.07463(17) 0.0690(10) Uani 1 1 d . . . . .
S15 S 0.1469(2) 0.1710(2) 0.13898(17) 0.0653(9) Uani 1 1 d . . . . .
S16 S 0.0817(2) 0.2018(2) 0.30542(18) 0.0648(9) Uani 1 1 d . U . . .
S17 S 0.1999(2) 0.0446(2) 0.21385(16) 0.0603(9) Uani 1 1 d . . . . .
S18 S 0.3508(3) 0.0390(2) 0.3357(2) 0.0737(11) Uani 1 1 d . . . . .
S19 S 0.1605(2) 0.2139(2) 0.48144(16) 0.0661(10) Uani 1 1 d . . . . .
S20 S 0.3635(3) 0.1565(2) 0.52761(17) 0.0701(10) Uani 1 1 d . . . . .
S21 S 0.1831(2) 0.4816(2) 0.33874(17) 0.0623(9) Uani 1 1 d . U . . .
W1 W 0.29258(2) 0.34632(2) 0.32616(2) 0.03641(11) Uani 1 1 d . . . . .
W2 W 0.33243(3) 0.24428(2) 0.38651(2) 0.03927(11) Uani 1 1 d . . . . .
W3 W 0.40856(3) 0.25836(3) 0.28892(2) 0.03967(11) Uani 1 1 d . . . . .
W4 W 0.36186(3) 0.35605(3) 0.22318(2) 0.03924(11) Uani 1 1 d . . . . .
W5 W 0.42594(2) 0.52795(2) 0.32806(2) 0.03670(11) Uani 1 1 d . . . . .
W6 W 0.54279(2) 0.43988(3) 0.28918(2) 0.03935(11) Uani 1 1 d . . . . .
W7 W 0.60413(3) 0.61130(3) 0.38486(2) 0.03884(11) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.8490 6.8722 '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
Ag8 Ag1 Ag10 97.66(15) . .
Ag8 Ag1 Ag20 55.40(9) . .
Ag20 Ag1 Ag10 148.2(2) . .
O36 Ag1 Ag8 140.0(10) . .
O36 Ag1 Ag10 42.6(9) . .
O36 Ag1 Ag20 161.8(9) . .
O36 Ag1 S14 112.7(9) . .
S6 Ag1 Ag8 52.93(14) . .
S6 Ag1 Ag10 53.37(15) . .
S6 Ag1 Ag20 107.4(2) . .
S6 Ag1 O36 90.1(9) . .
S6 Ag1 S14 133.5(3) . .
S14 Ag1 Ag8 88.94(18) . .
S14 Ag1 Ag10 120.0(4) . .
S14 Ag1 Ag20 51.11(12) . .
Ag5B Ag1A Ag20 103.7(4) . .
Ag8A Ag1A Ag5B 108.7(6) . .
Ag8A Ag1A Ag20 59.5(4) . .
Ag8A Ag1A O6 67.5(5) . .
Ag8A Ag1A S6 51.4(3) . .
O6 Ag1A Ag5B 53.0(4) . .
O6 Ag1A Ag20 108.1(3) . .
O6 Ag1A S6 81.2(3) . .
O36 Ag1A Ag5B 89.8(9) . .
O36 Ag1A Ag8A 139.0(10) . .
O36 Ag1A Ag20 152.0(10) . .
O36 Ag1A O6 99.6(10) . .
O36 Ag1A S6 89.1(9) . .
S6 Ag1A Ag5B 133.2(5) . .
S6 Ag1A Ag20 98.7(3) . .
S14 Ag1A Ag5B 57.5(4) . .
S14 Ag1A Ag8A 91.7(4) . .
S14 Ag1A Ag20 49.2(2) . .
S14 Ag1A O6 90.9(4) . .
S14 Ag1A O36 128.3(9) . .
S14 Ag1A S6 142.6(4) . .
S5 Ag1B Ag3B 124.1(7) . .
S5 Ag1B S6 171.1(8) . .
S6 Ag1B Ag3B 50.4(4) . .
S4 Ag2 Ag29 66.54(10) 2_666 .
S9 Ag2 Ag29 163.79(12) . .
S9 Ag2 S4 98.08(15) . 2_666
S21 Ag2 Ag29 52.11(12) . .
S21 Ag2 S4 118.62(19) . 2_666
S21 Ag2 S9 143.14(15) . .
Ag25 Ag2A Ag24 78.0(7) . .
O20 Ag2A Ag24 87.5(5) . .
O20 Ag2A Ag25 57.3(4) . .
O20 Ag2A S4 85.6(4) . 2_666
S4 Ag2A Ag24 159.8(10) 2_666 .
S4 Ag2A Ag25 82.3(3) 2_666 .
S9 Ag2A Ag24 46.8(5) . .
S9 Ag2A Ag25 49.0(5) . .
S9 Ag2A O20 96.2(9) . .
S9 Ag2A S4 115.3(7) . 2_666
Ag4B Ag2B Ag5B 108.1(5) . .
Ag4B Ag2B Ag9A 95.1(6) . .
Ag9A Ag2B Ag5B 151.4(7) . .
O2 Ag2B Ag4B 79.0(5) . .
O2 Ag2B Ag5B 123.9(5) . .
O2 Ag2B Ag9A 76.1(5) . .
O2 Ag2B S15 126.0(5) . .
S15 Ag2B Ag4B 139.7(6) . .
S15 Ag2B Ag5B 84.6(5) . .
S15 Ag2B Ag9A 66.8(5) . .
S17 Ag2B Ag4B 58.2(4) . .
S17 Ag2B Ag5B 50.9(4) . .
S17 Ag2B Ag9A 142.7(7) . .
S17 Ag2B O2 118.0(6) . .
S17 Ag2B S15 115.3(6) . .
Ag9 Ag3 Ag29 147.57(6) . .
O1 Ag3 Ag9 57.8(2) . .
O1 Ag3 Ag29 92.89(19) . .
O1 Ag3 S16 85.4(2) . .
O1 Ag3 S21 76.5(2) . .
O29 Ag3 Ag9 84.5(3) . .
O29 Ag3 Ag29 126.9(3) . .
O29 Ag3 O1 125.7(4) . .
O29 Ag3 S16 105.3(4) . .
O29 Ag3 S21 99.7(4) . .
S16 Ag3 Ag9 55.63(10) . .
S16 Ag3 Ag29 113.64(10) . .
S21 Ag3 Ag9 123.92(10) . .
S21 Ag3 Ag29 50.95(9) . .
S21 Ag3 S16 154.64(13) . .
Ag4A Ag3A Ag29 99.9(3) . .
Ag9A Ag3A Ag4A 125.8(5) . .
Ag9A Ag3A Ag29 104.3(4) . .
O1 Ag3A Ag4A 83.6(4) . .
O1 Ag3A Ag9A 51.6(3) . .
O1 Ag3A Ag29 85.5(3) . .
O29 Ag3A Ag4A 140.3(5) . .
O29 Ag3A Ag9A 72.7(4) . .
O29 Ag3A Ag29 109.1(5) . .
O29 Ag3A O1 124.3(5) . .
S21 Ag3A Ag4A 59.2(4) . .
S21 Ag3A Ag9A 142.1(5) . .
S21 Ag3A Ag29 44.5(3) . .
S21 Ag3A O1 97.8(4) . .
S21 Ag3A O29 130.7(5) . .
Ag36 Ag3B Ag1B 124.6(5) . .
S2 Ag3B Ag1B 82.6(5) . .
S2 Ag3B Ag36 48.9(2) . .
S6 Ag3B Ag1B 45.7(4) . .
S6 Ag3B Ag36 160.7(6) . .
S6 Ag3B S2 128.1(7) . .
O19 Ag4 Ag21 123.0(2) . .
O19 Ag4 S12 122.6(2) . .
O19 Ag4 S21 107.9(2) . .
S12 Ag4 Ag21 48.01(11) . .
S12 Ag4 S21 122.99(14) . .
S21 Ag4 Ag21 121.55(11) . .
Ag3A Ag4A Ag23 161.4(4) . .
O19 Ag4A Ag3A 123.3(5) . .
O19 Ag4A Ag23 46.9(3) . .
O19 Ag4A S12 121.5(5) . .
O19 Ag4A S21 110.7(4) . .
S12 Ag4A Ag3A 74.6(3) . .
S12 Ag4A Ag23 97.1(3) . .
S21 Ag4A Ag3A 33.5(2) . .
S21 Ag4A Ag23 154.4(4) . .
S21 Ag4A S12 107.0(4) . .
Ag2B Ag4B Ag5A 98.0(6) . .
O31 Ag4B Ag2B 161.2(8) . .
O31 Ag4B Ag5A 65.0(5) . .
O31 Ag4B S17 150.2(9) . .
S17 Ag4B Ag2B 48.2(5) . .
S17 Ag4B Ag5A 143.8(7) . .
O31 Ag5 Ag11 91.4(4) . .
O31 Ag5 O40 91.7(4) . .
O31 Ag5 S16 113.4(4) . .
O31 Ag5 S19 99.1(4) . .
O40 Ag5 Ag11 76.2(2) . .
S16 Ag5 Ag11 52.96(10) . .
S16 Ag5 O40 121.8(2) . .
S19 Ag5 Ag11 167.66(11) . .
S19 Ag5 O40 96.9(2) . .
S19 Ag5 S16 126.6(2) . .
Ag8B Ag5A Ag4B 125.9(6) 2_666 .
S16 Ag5A Ag4B 70.8(5) . .
S16 Ag5A Ag8B 98.0(6) . 2_666
S19 Ag5A Ag4B 121.3(7) . .
S19 Ag5A Ag8B 79.0(6) . 2_666
S19 Ag5A S16 167.0(9) . .
Ag1A Ag5B Ag2B 140.2(6) . .
O6 Ag5B Ag1A 59.1(4) . .
O6 Ag5B Ag2B 86.6(5) . .
O6 Ag5B S14 91.3(5) . .
O6 Ag5B S17 110.4(6) . .
O35 Ag5B Ag1A 79.2(11) . .
O35 Ag5B Ag2B 128.8(12) . .
O35 Ag5B O6 97.4(12) . .
O35 Ag5B S14 115.0(12) . .
O35 Ag5B S17 90.1(11) . .
S14 Ag5B Ag1A 51.8(4) . .
S14 Ag5B Ag2B 115.9(6) . .
S14 Ag5B S17 144.9(7) . .
S17 Ag5B Ag1A 163.3(6) . .
S17 Ag5B Ag2B 42.5(4) . .
Ag17 Ag6 Ag41 141.54(6) . .
O23 Ag6 Ag17 60.67(18) . .
O23 Ag6 Ag41 86.75(18) . .
S1 Ag6 Ag17 142.00(13) . .
S1 Ag6 Ag41 48.55(9) . .
S1 Ag6 O23 91.4(2) . .
S19 Ag6 Ag17 68.25(10) 2_666 .
S19 Ag6 Ag41 108.06(14) 2_666 .
S19 Ag6 O23 108.3(2) 2_666 .
S19 Ag6 S1 149.53(17) 2_666 .
Ag36 Ag6A Ag8B 126.9(6) . .
O23 Ag6A Ag8B 72.6(4) . .
O23 Ag6A Ag36 80.9(4) . .
O23 Ag6A S1 94.3(3) . .
O23 Ag6A S19 97.2(4) . 2_666
S1 Ag6A Ag8B 166.8(5) . .
S1 Ag6A Ag36 49.7(2) . .
S1 Ag6A S19 121.3(6) . 2_666
S3 Ag6A Ag8B 52.0(4) . .
S3 Ag6A Ag36 88.2(5) . .
S3 Ag6A O23 97.0(5) . .
S3 Ag6A S1 133.7(6) . .
S3 Ag6A S19 101.6(3) . 2_666
S19 Ag6A Ag8B 60.7(4) 2_666 .
S19 Ag6A Ag36 170.2(5) 2_666 .
Ag41 Ag7 Ag16 112.49(8) . .
O44 Ag7 Ag16 84.2(4) . .
O44 Ag7 Ag41 76.9(3) . .
O44 Ag7 S7 128.4(4) . .
O44 Ag7 S8 99.3(4) . .
S7 Ag7 Ag16 146.70(12) . .
S7 Ag7 Ag41 74.65(10) . .
S7 Ag7 S8 119.10(16) . .
S8 Ag7 Ag16 50.15(9) . .
S8 Ag7 Ag41 162.64(12) . .
Ag7B Ag7A Ag23 96.8(5) . .
Ag15 Ag7A Ag7B 141.2(7) . .
Ag15 Ag7A Ag23 55.8(4) . .
S7 Ag7A Ag7B 146.8(9) . .
S7 Ag7A Ag15 60.8(5) . .
S7 Ag7A Ag23 114.2(9) . .
S7 Ag7A S8 155.7(9) . .
S8 Ag7A Ag7B 57.2(5) . .
S8 Ag7A Ag15 102.8(7) . .
S8 Ag7A Ag23 47.1(3) . .
O39 Ag7B Ag7A 65.3(5) . .
O39 Ag7B S8 111.2(6) . .
S8 Ag7B Ag7A 48.4(4) . .
S20 Ag7B Ag7A 161.6(8) 2_666 .
S20 Ag7B O39 96.3(6) 2_666 .
S20 Ag7B S8 148.0(11) 2_666 .
Ag1 Ag8 Ag34 162.9(2) . .
Ag20 Ag8 Ag1 65.00(9) . .
Ag20 Ag8 Ag34 109.51(8) . .
O12 Ag8 Ag1 100.8(3) . .
O12 Ag8 Ag20 76.7(2) . .
O12 Ag8 Ag34 93.2(2) . .
O12 Ag8 S11 77.2(2) . .
O16 Ag8 Ag1 140.8(3) . .
O16 Ag8 Ag20 149.8(2) . .
O16 Ag8 Ag34 50.8(2) . .
O16 Ag8 O12 81.5(3) . .
O16 Ag8 S11 98.0(2) . .
S6 Ag8 Ag1 52.74(13) . .
S6 Ag8 Ag20 116.60(12) . .
S6 Ag8 Ag34 126.09(12) . .
S6 Ag8 O12 122.6(3) . .
S6 Ag8 O16 92.8(2) . .
S6 Ag8 S11 158.83(17) . .
S11 Ag8 Ag1 120.84(14) . .
S11 Ag8 Ag20 56.96(10) . .
S11 Ag8 Ag34 52.81(10) . .
Ag1A Ag8A Ag20 72.9(3) . .
O12 Ag8A Ag1A 111.1(8) . .
O12 Ag8A Ag20 78.0(4) . .
O12 Ag8A S6 158.3(10) . .
S6 Ag8A Ag1A 65.0(4) . .
S6 Ag8A Ag20 118.5(4) . .
Ag5A Ag8B Ag6A 95.6(7) 2_666 .
Ag5A Ag8B Ag29 122.7(7) 2_666 2_666
Ag29 Ag8B Ag6A 100.2(6) 2_666 .
O5 Ag8B Ag5A 95.1(8) 2_666 2_666
O5 Ag8B Ag6A 108.5(7) 2_666 .
O5 Ag8B Ag29 129.6(8) 2_666 2_666
O5 Ag8B S3 145.2(8) 2_666 .
S3 Ag8B Ag5A 111.6(8) . 2_666
S3 Ag8B Ag6A 49.1(4) . .
S3 Ag8B Ag29 52.1(4) . 2_666
Ag3 Ag9 Ag21 101.94(6) . .
Ag11 Ag9 Ag3 102.94(9) . .
Ag11 Ag9 Ag21 126.39(7) . .
O30 Ag9 Ag3 78.0(3) . .
O30 Ag9 Ag11 144.7(3) . .
O30 Ag9 Ag21 86.8(3) . .
O30 Ag9 S15 115.9(3) . .
O30 Ag9 S16 102.3(3) . .
S15 Ag9 Ag3 147.13(12) . .
S15 Ag9 Ag11 82.63(11) . .
S15 Ag9 Ag21 52.75(12) . .
S15 Ag9 S16 136.44(15) . .
S16 Ag9 Ag3 57.97(11) . .
S16 Ag9 Ag11 53.81(10) . .
S16 Ag9 Ag21 154.54(12) . .
Ag2B Ag9A Ag3A 130.9(5) . .
O1 Ag9A Ag2B 78.8(5) . .
O1 Ag9A Ag3A 52.1(4) . .
O30 Ag9A Ag2B 139.2(9) . .
O30 Ag9A Ag3A 75.8(5) . .
O30 Ag9A O1 119.5(6) . .
S16 Ag9A Ag2B 86.8(5) . .
S16 Ag9A Ag3A 105.9(8) . .
S16 Ag9A O1 105.4(7) . .
S16 Ag9A O30 118.0(7) . .
Ag32 Ag9B Ag31 68.9(4) . .
O3 Ag9B Ag31 90.6(5) . .
O3 Ag9B Ag32 81.2(6) . .
O3 Ag9B S17 75.1(6) . .
S17 Ag9B Ag31 140.0(7) . .
S17 Ag9B Ag32 141.4(8) . .
S18 Ag9B Ag31 43.6(6) . .
S18 Ag9B Ag32 56.2(7) . .
S18 Ag9B O3 123.9(11) . .
S18 Ag9B S17 159.7(11) . .
Ag1 Ag10 Ag18 89.72(17) . .
Ag12 Ag10 Ag1 96.45(10) . .
Ag12 Ag10 Ag18 126.28(6) . .
Ag12 Ag10 Ag32 98.99(6) . .
Ag32 Ag10 Ag1 144.89(18) . .
Ag32 Ag10 Ag18 55.87(5) . .
C67 Ag10 Ag1 65.5(6) . .
C67 Ag10 Ag12 160.6(6) . .
C67 Ag10 Ag18 50.8(7) . .
C67 Ag10 Ag32 93.1(6) . .
O36 Ag10 Ag1 51.9(11) . .
O36 Ag10 Ag12 143.7(10) . .
O36 Ag10 Ag18 76.7(9) . .
O36 Ag10 Ag32 117.2(10) . .
O36 Ag10 C67 26.7(4) . .
O36 Ag10 S5 139.6(12) . .
O36 Ag10 S6 93.0(10) . .
S5 Ag10 Ag1 163.33(17) . .
S5 Ag10 Ag12 68.06(9) . .
S5 Ag10 Ag18 104.29(11) . .
S5 Ag10 Ag32 48.44(10) . .
S5 Ag10 C67 130.6(6) . .
S5 Ag10 S6 115.93(14) . .
S6 Ag10 Ag1 47.45(14) . .
S6 Ag10 Ag12 51.15(10) . .
S6 Ag10 Ag18 125.60(10) . .
S6 Ag10 Ag32 146.71(11) . .
S6 Ag10 C67 112.4(6) . .
Ag5 Ag11 Ag13 70.04(7) . .
Ag9 Ag11 Ag5 111.95(9) . .
Ag9 Ag11 Ag13 177.71(7) . .
O2 Ag11 Ag5 68.08(18) . .
O2 Ag11 Ag9 89.21(18) . .
O2 Ag11 Ag13 92.65(18) . .
S16 Ag11 Ag5 54.72(12) . .
S16 Ag11 Ag9 58.11(11) . .
S16 Ag11 Ag13 123.62(11) . .
S16 Ag11 O2 77.8(2) . .
S17 Ag11 Ag5 120.89(12) . .
S17 Ag11 Ag9 127.15(12) . .
S17 Ag11 Ag13 50.86(10) . .
S17 Ag11 O2 110.2(2) . .
S17 Ag11 S16 169.42(14) . .
O15 Ag12 Ag10 139.22(19) . .
O15 Ag12 S2 81.8(2) . .
O15 Ag12 S6 121.4(2) . .
S2 Ag12 Ag10 132.65(10) . .
S2 Ag12 S6 132.79(13) . .
S6 Ag12 Ag10 55.73(11) . .
Ag11 Ag13 Ag18 90.64(5) . .
O32 Ag13 Ag11 122.0(4) . .
O32 Ag13 Ag18 141.6(4) . .
O32 Ag13 O40 108.5(4) . .
O32 Ag13 S17 134.7(4) . .
O32 Ag13 S18 104.4(4) . .
O40 Ag13 Ag11 75.0(2) . .
O40 Ag13 Ag18 98.5(2) . .
O40 Ag13 S17 110.0(2) . .
O40 Ag13 S18 84.7(2) . .
S17 Ag13 Ag11 50.02(10) . .
S17 Ag13 Ag18 51.48(10) . .
S17 Ag13 S18 102.07(14) . .
S18 Ag13 Ag11 133.06(10) . .
S18 Ag13 Ag18 50.71(10) . .
Ag19 Ag14 Ag18 156.25(7) . .
O6 Ag14 Ag18 59.3(2) . .
O6 Ag14 Ag19 102.0(2) . .
O6 Ag14 S14 86.7(2) . .
O6 Ag14 S15 132.3(2) . .
O6 Ag14 S17 106.1(2) . .
S14 Ag14 Ag18 109.71(13) . .
S14 Ag14 Ag19 50.93(11) . .
S14 Ag14 S15 100.32(15) . .
S15 Ag14 Ag18 148.92(11) . .
S15 Ag14 Ag19 54.24(10) . .
S17 Ag14 Ag18 52.61(10) . .
S17 Ag14 Ag19 150.51(11) . .
S17 Ag14 S14 139.13(14) . .
S17 Ag14 S15 98.86(14) . .
Ag7A Ag15 Ag23 74.1(3) . .
Ag7A Ag15 Ag33 167.4(2) . .
Ag7A Ag15 Ag34 104.8(3) . .
Ag23 Ag15 Ag33 98.97(5) . .
Ag23 Ag15 Ag34 173.42(5) . .
Ag34 Ag15 Ag33 80.81(5) . .
O18 Ag15 Ag7A 100.2(3) . .
O18 Ag15 Ag23 93.2(2) . .
O18 Ag15 Ag33 90.60(19) . .
O18 Ag15 Ag34 93.3(2) . .
O18 Ag15 S7 110.1(2) . .
O18 Ag15 S10 111.2(2) . .
S7 Ag15 Ag7A 48.3(3) . .
S7 Ag15 Ag23 119.97(12) . .
S7 Ag15 Ag33 133.42(11) . .
S7 Ag15 Ag34 57.53(11) . .
S7 Ag15 S10 138.57(12) . .
S10 Ag15 Ag7A 119.6(3) . .
S10 Ag15 Ag23 54.48(9) . .
S10 Ag15 Ag33 49.39(9) . .
S10 Ag15 Ag34 122.51(10) . .
Ag24 Ag16 Ag7 108.11(6) . .
Ag24 Ag16 Ag25 85.18(5) . .
Ag25 Ag16 Ag7 135.20(5) . .
S8 Ag16 Ag7 54.25(10) . .
S8 Ag16 Ag24 57.11(10) . .
S8 Ag16 Ag25 135.74(11) . .
S20 Ag16 Ag7 114.46(14) 2_666 .
S20 Ag16 Ag24 136.63(13) 2_666 .
S20 Ag16 Ag25 70.71(11) 2_666 .
S20 Ag16 S8 152.97(14) 2_666 .
Ag29 Ag17 Ag6 117.65(8) 2_666 .
Ag29 Ag17 Ag39 79.12(5) 2_666 .
Ag39 Ag17 Ag6 79.60(5) . .
O5 Ag17 Ag6 108.1(2) 2_666 .
O5 Ag17 Ag29 132.6(2) 2_666 2_666
O5 Ag17 Ag39 98.5(2) 2_666 .
O5 Ag17 S3 167.5(2) 2_666 .
S3 Ag17 Ag6 65.09(10) . .
S3 Ag17 Ag29 52.58(9) . 2_666
S3 Ag17 Ag39 70.40(9) . .
Ag10 Ag18 Ag13 154.48(6) . .
Ag14 Ag18 Ag10 97.89(5) . .
Ag14 Ag18 Ag13 93.44(5) . .
Ag32 Ag18 Ag10 58.75(4) . .
Ag32 Ag18 Ag13 97.98(5) . .
Ag32 Ag18 Ag14 137.69(6) . .
C67 Ag18 Ag10 53.3(6) . .
C67 Ag18 Ag13 148.8(7) . .
C67 Ag18 Ag14 93.3(6) . .
C67 Ag18 Ag32 97.3(6) . .
C67 Ag18 S18 122.2(7) . .
O35 Ag18 Ag10 75.3(12) . .
O35 Ag18 Ag13 129.5(12) . .
O35 Ag18 Ag14 79.8(13) . .
O35 Ag18 Ag32 120.5(12) . .
O35 Ag18 C67 24.1(7) . .
O35 Ag18 S17 97.3(12) . .
O35 Ag18 S18 131.1(13) . .
S17 Ag18 Ag10 147.53(11) . .
S17 Ag18 Ag13 47.70(9) . .
S17 Ag18 Ag14 49.69(10) . .
S17 Ag18 Ag32 141.64(10) . .
S17 Ag18 C67 120.9(6) . .
S17 Ag18 S18 101.82(14) . .
S18 Ag18 Ag10 106.75(12) . .
S18 Ag18 Ag13 54.24(11) . .
S18 Ag18 Ag14 144.18(11) . .
S18 Ag18 Ag32 49.28(11) . .
Ag14 Ag19 Ag21 94.72(6) . .
Ag14 Ag19 Ag33 137.20(6) . .
Ag20 Ag19 Ag14 100.76(6) . .
Ag20 Ag19 Ag21 152.63(6) . .
Ag20 Ag19 Ag33 71.30(5) . .
Ag33 Ag19 Ag21 81.98(5) . .
S13 Ag19 Ag14 163.48(14) . .
S13 Ag19 Ag20 95.76(13) . .
S13 Ag19 Ag21 70.03(13) . .
S13 Ag19 Ag33 49.31(15) . .
S13 Ag19 S14 141.55(17) . .
S13 Ag19 S15 105.91(16) . .
S14 Ag19 Ag14 52.91(11) . .
S14 Ag19 Ag20 53.68(11) . .
S14 Ag19 Ag21 147.50(12) . .
S14 Ag19 Ag33 122.42(12) . .
S14 Ag19 S15 105.19(15) . .
S15 Ag19 Ag14 57.61(10) . .
S15 Ag19 Ag20 158.09(11) . .
S15 Ag19 Ag21 44.82(10) . .
S15 Ag19 Ag33 125.93(11) . .
Ag8 Ag20 Ag1 59.60(9) . .
Ag8 Ag20 Ag19 97.82(7) . .
Ag8A Ag20 Ag1A 47.6(4) . .
Ag19 Ag20 Ag1 99.7(2) . .
Ag19 Ag20 Ag1A 87.2(2) . .
Ag19 Ag20 Ag8A 86.6(3) . .
O33 Ag20 Ag1 127.4(7) . .
O33 Ag20 Ag1A 136.0(7) . .
O33 Ag20 Ag8 144.5(6) . .
O33 Ag20 Ag8A 159.2(7) . .
O33 Ag20 Ag19 113.0(5) . .
O33 Ag20 S11 100.5(7) . .
O33 Ag20 S14 118.4(7) . .
S11 Ag20 Ag1 114.44(13) . .
S11 Ag20 Ag1A 115.18(15) . .
S11 Ag20 Ag8 55.84(10) . .
S11 Ag20 Ag8A 68.2(4) . .
S11 Ag20 Ag19 98.82(10) . .
S14 Ag20 Ag1 53.8(2) . .
S14 Ag20 Ag1A 44.2(2) . .
S14 Ag20 Ag8 93.94(12) . .
S14 Ag20 Ag8A 78.5(4) . .
S14 Ag20 Ag19 53.05(11) . .
S14 Ag20 S11 138.02(13) . .
Ag4 Ag21 Ag19 126.92(5) . .
Ag9 Ag21 Ag4 93.99(7) . .
Ag9 Ag21 Ag19 105.71(6) . .
Ag9 Ag21 Ag22 155.97(7) . .
Ag22 Ag21 Ag4 97.22(5) . .
Ag22 Ag21 Ag19 84.27(6) . .
O11 Ag21 Ag4 54.0(2) . .
O11 Ag21 Ag9 112.1(2) . .
O11 Ag21 Ag19 73.0(2) . .
O11 Ag21 Ag22 91.66(19) . .
S12 Ag21 Ag4 49.71(11) . .
S12 Ag21 Ag9 120.61(12) . .
S12 Ag21 Ag19 133.41(12) . .
S12 Ag21 Ag22 55.48(11) . .
S12 Ag21 O11 84.7(2) . .
S15 Ag21 Ag4 132.31(11) . .
S15 Ag21 Ag9 54.21(11) . .
S15 Ag21 Ag19 52.59(11) . .
S15 Ag21 Ag22 126.60(12) . .
S15 Ag21 O11 101.8(2) . .
S15 Ag21 S12 172.78(14) . .
Ag40 Ag22 Ag21 97.55(7) . .
O28 Ag22 Ag21 150.2(7) . .
O28 Ag22 Ag40 81.7(7) . .
O28 Ag22 S12 110.9(8) . .
O28 Ag22 S13 125.8(8) . .
S12 Ag22 Ag21 49.37(10) . .
S12 Ag22 Ag40 55.51(10) . .
S13 Ag22 Ag21 76.94(14) . .
S13 Ag22 Ag40 130.70(17) . .
S13 Ag22 S12 123.23(17) . .
Ag4A Ag23 Ag7A 135.9(2) . .
Ag15 Ag23 Ag4A 116.1(2) . .
Ag15 Ag23 Ag7A 50.1(3) . .
Ag15 Ag23 Ag24 132.67(5) . .
Ag15 Ag23 Ag40 106.83(5) . .
Ag24 Ag23 Ag4A 69.1(2) . .
Ag24 Ag23 Ag7A 91.8(3) . .
Ag24 Ag23 Ag40 116.44(5) . .
Ag40 Ag23 Ag4A 65.80(16) . .
Ag40 Ag23 Ag7A 151.1(2) . .
O19 Ag23 Ag4A 41.6(3) . .
O19 Ag23 Ag7A 94.5(3) . .
O19 Ag23 Ag15 87.1(2) . .
O19 Ag23 Ag24 66.6(2) . .
O19 Ag23 Ag40 102.0(2) . .
O19 Ag23 O26 92.4(5) . .
O19 Ag23 S8 99.5(2) . .
O19 Ag23 S10 108.6(2) . .
O26 Ag23 Ag4A 53.5(5) . .
O26 Ag23 Ag7A 154.0(5) . .
O26 Ag23 Ag15 155.4(4) . .
O26 Ag23 Ag24 68.3(4) . .
O26 Ag23 Ag40 49.3(4) . .
O26 Ag23 S8 108.7(4) . .
O26 Ag23 S10 102.3(4) . .
S8 Ag23 Ag4A 122.3(2) . .
S8 Ag23 Ag7A 45.4(3) . .
S8 Ag23 Ag15 95.54(10) . .
S8 Ag23 Ag24 54.52(10) . .
S8 Ag23 Ag40 149.48(10) . .
S8 Ag23 S10 136.74(13) . .
S10 Ag23 Ag4A 100.3(2) . .
S10 Ag23 Ag7A 99.1(3) . .
S10 Ag23 Ag15 55.10(9) . .
S10 Ag23 Ag24 168.56(10) . .
S10 Ag23 Ag40 53.29(9) . .
Ag16 Ag24 Ag23 92.76(5) . .
Ag23 Ag24 Ag2A 114.1(3) . .
O25 Ag24 Ag2A 117.7(5) . .
O25 Ag24 Ag16 142.8(4) . .
O25 Ag24 Ag23 83.8(4) . .
O25 Ag24 S8 101.4(4) . .
O25 Ag24 S9 126.2(4) . .
S8 Ag24 Ag2A 137.12(17) . .
S8 Ag24 Ag16 51.75(9) . .
S8 Ag24 Ag23 50.56(9) . .
S9 Ag24 Ag2A 30.4(4) . .
S9 Ag24 Ag16 78.97(11) . .
S9 Ag24 Ag23 138.44(10) . .
S9 Ag24 S8 130.00(14) . .
Ag2A Ag25 Ag26 109.2(4) . .
Ag2A Ag25 Ag31 136.3(3) . 2_666
Ag16 Ag25 Ag26 117.94(5) . .
Ag16 Ag25 Ag31 85.59(4) . 2_666
Ag26 Ag25 Ag31 107.20(4) . 2_666
Ag42 Ag25 Ag2A 81.8(3) 2_666 .
Ag42 Ag25 Ag16 173.83(5) 2_666 .
Ag42 Ag25 Ag26 67.75(3) 2_666 .
Ag42 Ag25 Ag31 90.38(4) 2_666 2_666
O4 Ag25 Ag2A 128.6(3) 2_666 .
O4 Ag25 Ag16 131.6(2) 2_666 .
O4 Ag25 Ag26 63.42(19) 2_666 .
O4 Ag25 Ag31 53.12(19) 2_666 2_666
O4 Ag25 Ag42 47.4(2) 2_666 2_666
O24 Ag25 Ag2A 123.3(3) . .
O24 Ag25 Ag16 75.2(2) . .
O24 Ag25 Ag26 43.1(2) . .
O24 Ag25 Ag31 99.9(2) . 2_666
O24 Ag25 Ag42 110.2(2) . 2_666
O24 Ag25 O4 87.2(3) . 2_666
O24 Ag25 S9 137.5(2) . .
S9 Ag25 Ag2A 32.1(4) . .
S9 Ag25 Ag16 77.35(10) . .
S9 Ag25 Ag26 141.05(10) . .
S9 Ag25 Ag31 109.67(10) . 2_666
S9 Ag25 Ag42 99.69(10) . 2_666
S9 Ag25 O4 135.0(2) . 2_666
Ag25 Ag26 Ag39 134.28(4) . .
Ag27 Ag26 Ag25 105.76(4) 2_666 .
Ag27 Ag26 Ag25 113.09(4) . .
Ag27 Ag26 Ag27 94.66(3) . 2_666
Ag27 Ag26 Ag28 61.98(3) 2_666 2_666
Ag27 Ag26 Ag28 64.28(3) . 2_666
Ag27 Ag26 Ag28 61.76(3) . .
Ag27 Ag26 Ag28 63.66(3) 2_666 .
Ag27 Ag26 Ag39 119.41(3) 2_666 .
Ag27 Ag26 Ag39 59.23(3) . .
Ag28 Ag26 Ag25 72.17(3) . .
Ag28 Ag26 Ag25 166.19(4) 2_666 .
Ag28 Ag26 Ag28 95.62(3) 2_666 .
Ag28 Ag26 Ag39 120.97(3) . .
Ag28 Ag26 Ag39 57.43(3) 2_666 .
O5 Ag26 Ag25 88.86(19) 2_666 .
O5 Ag26 Ag27 100.9(2) 2_666 2_666
O5 Ag26 Ag27 148.5(2) 2_666 .
O5 Ag26 Ag28 99.43(19) 2_666 2_666
O5 Ag26 Ag28 149.6(2) 2_666 .
O5 Ag26 Ag39 89.28(19) 2_666 .
O24 Ag26 Ag25 41.8(2) . .
O24 Ag26 Ag27 147.2(2) . 2_666
O24 Ag26 Ag27 102.7(2) . .
O24 Ag26 Ag28 150.8(2) . 2_666
O24 Ag26 Ag28 100.6(2) . .
O24 Ag26 Ag39 93.4(2) . .
O24 Ag26 O5 78.2(3) . 2_666
Ag26 Ag27 Ag26 85.34(3) . 2_666
Ag26 Ag27 Ag28 58.14(3) . 2_666
Ag26 Ag27 Ag28 58.73(3) 2_666 2_666
Ag26 Ag27 Ag28 59.04(3) 2_666 .
Ag26 Ag27 Ag28 59.97(3) . .
Ag26 Ag27 Ag39 117.81(4) 2_666 .
Ag26 Ag27 Ag39 70.63(3) . .
Ag26 Ag27 Ag42 75.20(3) 2_666 .
Ag26 Ag27 Ag42 117.90(4) . .
Ag28 Ag27 Ag28 90.97(3) . 2_666
Ag28 Ag27 Ag39 59.84(3) 2_666 .
Ag28 Ag27 Ag39 130.57(4) . .
Ag28 Ag27 Ag42 61.39(3) 2_666 .
Ag28 Ag27 Ag42 134.20(4) . .
Ag42 Ag27 Ag39 68.40(3) . .
O8 Ag27 Ag26 158.61(19) . .
O8 Ag27 Ag26 82.07(18) . 2_666
O8 Ag27 Ag28 126.60(18) . 2_666
O8 Ag27 Ag28 98.66(19) . .
O8 Ag27 Ag39 130.68(19) . .
O8 Ag27 Ag42 75.35(18) . .
O8 Ag27 O17 104.7(3) . .
O17 Ag27 Ag26 156.31(19) . 2_666
O17 Ag27 Ag26 80.70(18) . .
O17 Ag27 Ag28 97.31(19) . .
O17 Ag27 Ag28 126.01(19) . 2_666
O17 Ag27 Ag39 75.27(19) . .
O17 Ag27 Ag42 128.35(19) . .
Ag26 Ag28 Ag26 84.37(3) 2_666 .
Ag26 Ag28 Ag27 57.61(3) . 2_666
Ag26 Ag28 Ag27 58.98(3) 2_666 .
Ag26 Ag28 Ag27 57.58(3) 2_666 2_666
Ag26 Ag28 Ag27 58.27(3) . .
Ag26 Ag28 Ag39 71.60(3) 2_666 2_666
Ag26 Ag28 Ag39 119.28(4) . 2_666
Ag26 Ag28 Ag42 116.76(4) 2_666 2_666
Ag26 Ag28 Ag42 74.44(3) . 2_666
Ag27 Ag28 Ag27 89.03(3) . 2_666
Ag27 Ag28 Ag39 130.58(4) . 2_666
Ag27 Ag28 Ag39 62.45(3) 2_666 2_666
Ag27 Ag28 Ag42 132.59(4) . 2_666
Ag27 Ag28 Ag42 60.78(3) 2_666 2_666
Ag39 Ag28 Ag42 69.15(3) 2_666 2_666
O10 Ag28 Ag26 139.63(18) . .
O10 Ag28 Ag26 84.52(18) . 2_666
O10 Ag28 Ag27 139.15(18) . 2_666
O10 Ag28 Ag27 82.91(18) . .
O10 Ag28 Ag39 93.42(18) . 2_666
O10 Ag28 Ag42 143.95(18) . 2_666
O10 Ag28 S4 94.14(19) . 2_666
O20 Ag28 Ag26 139.0(2) . 2_666
O20 Ag28 Ag26 84.75(19) . .
O20 Ag28 Ag27 81.86(19) . .
O20 Ag28 Ag27 139.6(2) . 2_666
O20 Ag28 Ag39 145.85(19) . 2_666
O20 Ag28 Ag42 97.9(2) . 2_666
O20 Ag28 O10 78.7(3) . .
O20 Ag28 S4 96.5(2) . 2_666
S4 Ag28 Ag26 121.99(8) 2_666 2_666
S4 Ag28 Ag26 124.38(8) 2_666 .
S4 Ag28 Ag27 176.84(8) 2_666 .
S4 Ag28 Ag27 93.95(7) 2_666 2_666
S4 Ag28 Ag39 50.53(7) 2_666 2_666
S4 Ag28 Ag42 50.21(7) 2_666 2_666
Ag2 Ag29 Ag3 109.61(6) . .
Ag2 Ag29 Ag17 124.31(6) . 2_666
Ag2 Ag29 Ag37 90.66(5) . 2_666
Ag3 Ag29 Ag17 91.26(5) . 2_666
Ag3 Ag29 Ag37 150.69(6) . 2_666
Ag8B Ag29 Ag3A 104.6(4) 2_666 .
Ag8B Ag29 Ag37 101.6(4) 2_666 2_666
Ag17 Ag29 Ag37 94.45(5) 2_666 2_666
Ag37 Ag29 Ag3A 150.65(13) 2_666 .
S3 Ag29 Ag2 140.05(10) 2_666 .
S3 Ag29 Ag3 110.26(10) 2_666 .
S3 Ag29 Ag3A 136.80(19) 2_666 .
S3 Ag29 Ag8B 55.3(4) 2_666 2_666
S3 Ag29 Ag17 52.35(9) 2_666 2_666
S3 Ag29 Ag37 53.97(9) 2_666 2_666
S21 Ag29 Ag2 54.03(11) . .
S21 Ag29 Ag3 57.83(11) . .
S21 Ag29 Ag3A 30.37(19) . .
S21 Ag29 Ag8B 128.0(4) . 2_666
S21 Ag29 Ag17 133.75(11) . 2_666
S21 Ag29 Ag37 129.82(11) . 2_666
S21 Ag29 S3 163.10(13) . 2_666
S19 Ag30 S20 154.97(15) . .
Ag9B Ag31 Ag25 125.1(3) . 2_666
S18 Ag31 Ag9B 23.4(4) . .
S18 Ag31 Ag25 132.88(13) . 2_666
S20 Ag31 Ag9B 155.9(4) . .
S20 Ag31 Ag25 64.85(11) . 2_666
S20 Ag31 S18 162.09(16) . .
Ag18 Ag32 Ag10 65.38(5) . .
S5 Ag32 Ag9B 151.2(4) . .
S5 Ag32 Ag10 53.36(10) . .
S5 Ag32 Ag18 118.71(11) . .
S5 Ag32 S18 168.49(15) . .
S18 Ag32 Ag9B 28.8(4) . .
S18 Ag32 Ag10 121.57(13) . .
S18 Ag32 Ag18 57.92(12) . .
Ag19 Ag33 Ag15 126.90(5) . .
S10 Ag33 Ag15 48.35(9) . .
S10 Ag33 Ag19 136.79(10) . .
S11 Ag33 Ag15 81.21(10) . .
S11 Ag33 Ag19 92.58(10) . .
S11 Ag33 S10 122.49(14) . .
S13 Ag33 Ag15 154.12(13) . .
S13 Ag33 Ag19 47.96(14) . .
S13 Ag33 S10 114.34(17) . .
S13 Ag33 S11 121.86(17) . .
Ag15 Ag34 Ag8 103.24(6) . .
Ag35 Ag34 Ag8 113.38(6) . .
Ag35 Ag34 Ag15 94.56(5) . .
O16 Ag34 Ag8 51.9(2) . .
O16 Ag34 Ag15 82.7(2) . .
O16 Ag34 Ag35 68.2(2) . .
O16 Ag34 S7 94.5(2) . .
O16 Ag34 S11 99.0(2) . .
O38 Ag34 Ag8 104.3(6) . .
O38 Ag34 Ag15 152.4(6) . .
O38 Ag34 Ag35 76.6(4) . .
O38 Ag34 O16 116.7(6) . .
O38 Ag34 S7 104.4(5) . .
O38 Ag34 S11 106.1(4) . .
S7 Ag34 Ag8 143.37(9) . .
S7 Ag34 Ag15 51.94(9) . .
S7 Ag34 Ag35 53.18(10) . .
S11 Ag34 Ag8 52.77(9) . .
S11 Ag34 Ag15 88.83(10) . .
S11 Ag34 Ag35 166.14(11) . .
S11 Ag34 S7 136.31(14) . .
Ag34 Ag35 Ag36 122.93(6) . .
Ag41 Ag35 Ag34 133.34(7) . .
Ag41 Ag35 Ag36 94.84(5) . .
O37 Ag35 Ag34 81.8(4) . .
O37 Ag35 Ag36 84.0(5) . .
O37 Ag35 Ag41 132.9(5) . .
O37 Ag35 S1 98.9(4) . .
O37 Ag35 S7 123.4(5) . .
S1 Ag35 Ag34 167.49(10) . .
S1 Ag35 Ag36 45.20(9) . .
S1 Ag35 Ag41 54.01(9) . .
S7 Ag35 Ag34 57.80(10) . .
S7 Ag35 Ag36 150.08(10) . .
S7 Ag35 Ag41 75.73(11) . .
S7 Ag35 S1 129.16(14) . .
Ag3B Ag36 Ag6A 158.0(3) . .
Ag3B Ag36 Ag35 80.1(3) . .
Ag6A Ag36 Ag35 93.3(3) . .
S1 Ag36 Ag3B 129.2(3) . .
S1 Ag36 Ag6A 51.8(3) . .
S1 Ag36 Ag35 49.93(9) . .
S2 Ag36 Ag3B 57.3(3) . .
S2 Ag36 Ag6A 124.6(3) . .
S2 Ag36 Ag35 137.27(10) . .
S2 Ag36 S1 171.92(13) . .
Ag29 Ag37 Ag39 74.85(4) 2_666 .
Ag38 Ag37 Ag29 109.22(5) . 2_666
Ag38 Ag37 Ag39 80.28(4) . .
O41 Ag37 Ag29 90.5(3) . 2_666
O41 Ag37 Ag38 82.6(3) . .
O41 Ag37 Ag39 152.3(3) . .
O41 Ag37 S2 111.4(3) . .
O41 Ag37 S3 121.0(3) . .
O41 Ag37 S4 106.6(3) . .
S2 Ag37 Ag29 157.43(9) . 2_666
S2 Ag37 Ag38 69.89(9) . .
S2 Ag37 Ag39 82.91(8) . .
S2 Ag37 S3 117.69(12) . .
S2 Ag37 S4 103.61(10) . .
S3 Ag37 Ag29 49.28(8) . 2_666
S3 Ag37 Ag38 143.54(8) . .
S3 Ag37 Ag39 66.41(7) . .
S3 Ag37 S4 92.06(10) . .
S4 Ag37 Ag29 63.05(7) . 2_666
S4 Ag37 Ag38 52.64(7) . .
S4 Ag37 Ag39 45.76(7) . .
Ag37 Ag38 Ag42 107.73(4) . .
O42 Ag38 Ag37 79.6(3) . .
O42 Ag38 Ag42 140.0(3) . .
O42 Ag38 S4 107.7(3) . .
O42 Ag38 S5 104.3(3) . .
S4 Ag38 Ag37 61.15(8) . .
S4 Ag38 Ag42 51.37(7) . .
S5 Ag38 Ag37 141.86(12) . .
S5 Ag38 Ag42 93.42(10) . .
S5 Ag38 S4 144.24(12) . .
Ag17 Ag39 Ag26 65.80(4) . .
Ag17 Ag39 Ag37 88.18(4) . .
Ag27 Ag39 Ag17 115.55(4) . .
Ag27 Ag39 Ag26 50.14(2) . .
Ag27 Ag39 Ag37 145.15(4) . .
Ag28 Ag39 Ag17 78.76(4) 2_666 .
Ag28 Ag39 Ag26 50.97(2) 2_666 .
Ag28 Ag39 Ag27 57.71(3) 2_666 .
Ag28 Ag39 Ag37 107.08(4) 2_666 .
Ag37 Ag39 Ag26 147.47(4) . .
O15 Ag39 Ag17 143.7(2) . .
O15 Ag39 Ag26 115.68(18) . .
O15 Ag39 Ag27 79.18(18) . .
O15 Ag39 Ag28 132.46(19) . 2_666
O15 Ag39 Ag37 96.85(18) . .
O23 Ag39 Ag17 64.0(2) . .
O23 Ag39 Ag26 67.6(2) . .
O23 Ag39 Ag27 94.5(2) . .
O23 Ag39 Ag28 117.1(2) . 2_666
O23 Ag39 Ag37 119.5(2) . .
O23 Ag39 O15 82.6(3) . .
O23 Ag39 S4 161.8(2) . .
S4 Ag39 Ag17 97.79(9) . .
S4 Ag39 Ag26 106.26(8) . .
S4 Ag39 Ag27 93.76(8) . .
S4 Ag39 Ag28 55.40(7) . 2_666
S4 Ag39 Ag37 56.20(7) . .
S4 Ag39 O15 114.9(2) . .
Ag22 Ag40 Ag23 126.58(7) . .
O26 Ag40 Ag22 153.4(4) . .
O26 Ag40 Ag23 48.7(3) . .
O26 Ag40 S10 98.5(4) . .
O26 Ag40 S12 96.2(4) . .
O27 Ag40 Ag22 83.3(6) . .
O27 Ag40 Ag23 136.9(6) . .
O27 Ag40 O26 117.9(8) . .
O27 Ag40 S10 114.7(7) . .
O27 Ag40 S12 118.2(6) . .
S10 Ag40 Ag22 85.29(10) . .
S10 Ag40 Ag23 50.06(9) . .
S12 Ag40 Ag22 58.03(12) . .
S12 Ag40 Ag23 104.58(10) . .
S12 Ag40 S10 108.25(13) . .
Ag7 Ag41 Ag6 127.19(5) . .
Ag35 Ag41 Ag6 97.01(6) . .
Ag35 Ag41 Ag7 92.41(7) . .
O39 Ag41 Ag6 69.0(2) . .
O39 Ag41 Ag7 58.3(2) . .
O39 Ag41 Ag35 104.2(2) . .
O39 Ag41 S1 103.2(2) . .
O43 Ag41 Ag6 125.1(5) . .
O43 Ag41 Ag7 81.1(4) . .
O43 Ag41 Ag35 131.4(5) . .
O43 Ag41 O39 112.2(5) . .
O43 Ag41 S1 136.5(4) . .
S1 Ag41 Ag6 47.53(9) . .
S1 Ag41 Ag7 140.99(10) . .
S1 Ag41 Ag35 56.73(9) . .
Ag25 Ag42 Ag27 110.83(4) 2_666 .
Ag25 Ag42 Ag28 75.58(4) 2_666 2_666
Ag25 Ag42 Ag38 110.19(4) 2_666 .
Ag27 Ag42 Ag28 57.83(3) . 2_666
Ag38 Ag42 Ag27 130.99(4) . .
Ag38 Ag42 Ag28 109.58(4) . 2_666
O4 Ag42 Ag25 56.8(2) . 2_666
O4 Ag42 Ag27 92.3(2) . .
O4 Ag42 Ag28 109.4(2) . 2_666
O4 Ag42 Ag38 132.9(2) . .
O4 Ag42 O7 88.1(3) . .
O4 Ag42 S4 153.0(2) . .
O7 Ag42 Ag25 142.0(2) . 2_666
O7 Ag42 Ag27 82.2(2) . .
O7 Ag42 Ag28 136.0(2) . 2_666
O7 Ag42 Ag38 81.7(2) . .
O7 Ag42 S4 118.6(2) . .
S4 Ag42 Ag25 96.35(8) . 2_666
S4 Ag42 Ag27 94.87(8) . .
S4 Ag42 Ag28 54.67(7) . 2_666
S4 Ag42 Ag38 54.95(7) . .
C1 C2 C3 113.1(15) . .
C1 C2 S2 110.0(11) . .
C3 C2 S2 106.4(11) . .
C4 C5 C6 101.4(8) . .
C4 C5 S6 111.3(9) . .
C6 C5 S6 110.8(9) . .
C9 C8 C7 122(3) . .
C8 C9 C88 126(2) . .
C10 C11 C12 113.1(19) . .
C10 C11 S1 110.3(13) . .
C12 C11 S1 110.7(13) . .
C13 C14 S7 109.9(14) . .
C15 C14 C13 108.3(19) . .
C15 C14 S7 110.8(16) . .
C16 C17 S10 109.7(13) . .
C18 C17 C16 111.8(16) . .
C18 C17 S10 110.9(13) . .
C19 C20 S13 112.1(17) . .
C21 C20 C19 108(2) . .
C21 C20 S13 111.3(18) . .
C22 C23 S14 106.3(12) . .
C24 C23 C22 113.3(17) . .
C24 C23 S14 110.7(12) . .
C25 C26 S15 109.9(12) . .
C27 C26 C25 113.0(16) . .
C27 C26 S15 113.7(12) . .
C28 C29 S16 120.0(12) . .
C30 C29 C28 102.0(8) . .
C30 C29 S16 128.6(13) . .
C31 C32 C33 112.9(18) . .
C31 C32 S17 109.9(14) . .
C33 C32 S17 113.3(13) . .
C34 C36 S18 113.2(18) . .
C35 C36 C34 118(2) . .
C35 C36 S18 108.7(16) . .
C37 C38 S5 109.1(13) . .
C39 C38 C37 112.5(14) . .
C39 C38 S5 109.8(11) . .
C40 C41 S20 108.8(18) . .
C42 C41 C40 113.2(18) . .
C42 C41 S20 109.3(16) . .
C43 C44 S19 111.3(16) . .
C45 C44 C43 106(3) . .
C45 C44 S19 112(2) . .
C46 C47 S9 110.2(12) . .
C48 C47 C46 116.4(15) . .
C48 C47 S9 108.9(13) . .
C49 C50 S8 113.0(15) . .
C51 C50 C49 110.8(17) . .
C51 C50 S8 110.4(12) . .
C52 C53 C54 112.2(16) . .
C52 C53 S11 111.2(14) . .
C54 C53 S11 108.3(13) . .
C55 C56 S3 108.3(12) . .
C57 C56 C55 115.8(19) . .
C57 C56 S3 115.1(14) . .
C58 C59 C60 116(2) . .
C58 C59 S12 108.7(16) . .
C60 C59 S12 109.9(18) . .
C61 C62 C63 142.5(17) . .
C61 C62 S21 113.8(13) . .
C63 C62 S21 103.7(11) . .
C64 C65 C66 98.2(8) . .
C67 C66 C65 98.3(8) . .
Ag18 C67 Ag10 75.9(7) . .
C66 C67 Ag10 115(2) . .
C66 C67 Ag18 117.3(16) . .
O35 C67 Ag10 108.0(19) . .
O35 C67 Ag18 36.0(17) . .
O35 C67 C66 115.3(12) . .
O35 C67 O36 146(2) . .
O36 C67 Ag10 53.3(18) . .
O36 C67 Ag18 127(2) . .
O36 C67 C66 98(3) . .
C68 C69 C70 99.1(8) . .
C71 C70 C69 99.1(8) . .
O33 C71 C70 121(2) . .
O34 C71 C70 122(3) . .
O34 C71 O33 117(3) . .
C72 C73 C74 99.1(8) . .
C75 C74 C73 121(3) . .
O27 C75 C74 118(3) . .
O28 C75 C74 112(4) . .
O28 C75 O27 127(3) . .
C76 C77 C78 113.3(19) . .
C79 C78 C77 115.5(16) . .
O29 C79 C78 116.6(15) . .
O29 C79 O30 123.3(17) . .
O30 C79 C78 120.0(17) . .
C80 C81 C82 116.4(10) . .
C81 C82 C83 108.0(18) . .
O25 C83 C82 115.9(19) . .
O26 C83 C82 122(2) . .
O26 C83 O25 121.8(17) . .
C86 C85 C84 118(3) . .
C85 C86 C87 121(2) . .
O43 C87 C86 115.3(18) . .
O44 C87 C86 118.6(18) . .
O44 C87 O43 126.0(18) . .
O37 C88 C9 120(2) . .
O37 C88 O38 123(2) . .
O38 C88 C9 116(2) . .
C91 C90 C89 102.1(16) . .
C92 C91 C90 113.1(15) . .
O41 C92 C91 117.6(14) . .
O41 C92 O42 126.0(15) . .
O42 C92 C91 116.4(15) . .
C93 C94 C95 114(2) . .
C96 C95 C94 109(2) . .
O31 C96 C95 115(2) . .
O32 C96 C95 118(2) . .
O32 C96 O31 127.1(18) . .
Ag9A O1 Ag3A 76.3(5) . .
W1 O1 Ag3 120.9(4) . .
W1 O1 Ag3A 137.4(5) . .
W1 O1 Ag9A 125.2(5) . .
W1 O2 Ag2B 105.1(5) . .
W1 O2 Ag11 127.8(4) . .
W1 O2 W2 110.6(4) . .
W2 O2 Ag2B 115.5(4) . .
W2 O2 Ag11 114.6(3) . .
W2 O3 Ag9B 104.5(6) . .
W3 O3 Ag9B 135.8(6) . .
W3 O3 W2 111.8(4) . .
Ag42 O4 Ag25 75.7(3) . 2_666
W2 O4 Ag25 138.2(4) . 2_666
W2 O4 Ag42 129.2(4) . .
Ag8B O5 Ag26 116.4(6) 2_666 2_666
Ag17 O5 Ag26 105.3(3) 2_666 2_666
W2 O5 Ag8B 126.2(6) . 2_666
W2 O5 Ag17 138.1(4) . 2_666
W2 O5 Ag26 110.0(4) . 2_666
Ag5B O6 Ag1A 67.8(5) . .
W3 O6 Ag1A 162.6(5) . .
W3 O6 Ag5B 129.5(6) . .
W3 O6 Ag14 112.0(4) . .
W3 O7 Ag42 121.2(4) . .
W1 O8 Ag27 112.5(3) . .
W1 O8 W2 96.3(3) . .
W2 O8 Ag27 124.6(3) . .
W3 O8 Ag27 114.5(3) . .
W3 O8 W1 108.6(3) . .
W3 O8 W2 98.1(3) . .
W3 O9 W1 102.5(3) . .
W4 O9 W1 103.5(3) . .
W4 O9 W3 105.3(3) . .
W1 O10 Ag28 131.3(4) . .
W4 O11 Ag21 131.9(4) . .
W4 O12 Ag8 135.7(4) . .
W4 O12 Ag8A 128.8(6) . .
W3 O13 W4 105.0(3) . .
W3 O13 W6 149.5(4) . .
W6 O13 W4 105.5(3) . .
W1 O14 W4 104.3(3) . .
W5 O14 W1 148.6(4) . .
W5 O14 W4 106.1(3) . .
Ag39 O15 Ag12 118.7(3) . .
W6 O15 Ag12 114.2(4) . .
W6 O15 Ag39 124.4(4) . .
Ag34 O16 Ag8 77.3(3) . .
W6 O16 Ag8 133.3(5) . .
W6 O16 Ag34 137.7(5) . .
W5 O17 Ag27 111.3(3) . .
W5 O17 W7 97.7(3) . .
W6 O17 Ag27 112.9(3) . .
W6 O17 W5 109.7(3) . .
W6 O17 W7 97.1(3) . .
W7 O17 Ag27 126.2(3) . .
W4 O18 Ag15 119.6(4) . .
W4 O18 W5 102.8(3) . .
W4 O18 W6 104.1(3) . .
W5 O18 Ag15 112.6(3) . .
W6 O18 Ag15 113.9(3) . .
W6 O18 W5 101.8(3) . .
Ag4A O19 Ag23 91.5(4) . .
Ag23 O19 Ag4 106.9(3) . .
W5 O19 Ag4 121.5(4) . .
W5 O19 Ag4A 141.5(5) . .
W5 O19 Ag23 126.9(4) . .
Ag28 O20 Ag2A 94.8(5) . .
W5 O20 Ag2A 123.2(4) . .
W5 O20 Ag28 136.8(4) . .
W5 O21 W7 109.3(3) . .
W6 O22 W7 110.7(4) . .
Ag39 O23 Ag6 116.5(3) . .
Ag39 O23 Ag6A 99.8(5) . .
W7 O23 Ag6 112.8(4) . .
W7 O23 Ag6A 128.5(5) . .
W7 O23 Ag39 130.1(4) . .
Ag25 O24 Ag26 95.1(3) . .
W7 O24 Ag25 143.2(4) . .
W7 O24 Ag26 110.8(4) . .
C83 O25 Ag24 117.1(11) . .
Ag23 O26 Ag40 82.1(5) . .
C83 O26 Ag23 129.7(17) . .
C83 O26 Ag40 136.0(15) . .
C75 O27 Ag40 119.9(19) . .
C75 O28 Ag22 127(2) . .
C79 O29 Ag3 122.2(11) . .
C79 O29 Ag3A 118.9(12) . .
C79 O30 Ag9 131.3(12) . .
C79 O30 Ag9A 115.4(12) . .
C96 O31 Ag4B 104.3(14) . .
C96 O31 Ag5 144.0(13) . .
C96 O32 Ag13 112.4(12) . .
C71 O33 Ag20 104.5(17) . .
C67 O35 Ag5B 124(2) . .
C67 O35 Ag18 120(2) . .
Ag10 O36 Ag1 85.5(14) . .
C67 O36 Ag1 113(2) . .
C67 O36 Ag1A 99(2) . .
C67 O36 Ag10 100(2) . .
C88 O37 Ag35 124.3(18) . .
C88 O38 Ag34 124.9(15) . .
Ag41 O39 Ag7B 116.8(6) . .
W7 O39 Ag7B 108.4(7) . .
W7 O39 Ag41 127.2(5) . .
Ag13 O40 Ag5 90.9(3) . .
W2 O40 Ag5 111.7(4) . .
W2 O40 Ag13 130.0(5) . .
C92 O41 Ag37 125.0(10) . .
C92 O42 Ag38 126.7(10) . .
C87 O43 Ag41 119.8(11) . .
C87 O44 Ag7 124.2(13) . .
Ag6 S1 Ag35 134.85(14) . .
Ag6 S1 Ag41 83.92(13) . .
Ag6A S1 Ag35 136.3(2) . .
Ag6A S1 Ag41 100.1(4) . .
Ag36 S1 Ag6 95.50(14) . .
Ag36 S1 Ag6A 78.5(4) . .
Ag36 S1 Ag35 84.88(12) . .
Ag36 S1 Ag41 140.98(15) . .
Ag41 S1 Ag35 69.26(10) . .
C11 S1 Ag6 114.1(5) . .
C11 S1 Ag6A 114.9(6) . .
C11 S1 Ag35 108.7(6) . .
C11 S1 Ag36 107.6(6) . .
C11 S1 Ag41 108.2(6) . .
Ag12 S2 Ag37 126.24(14) . .
Ag36 S2 Ag3B 73.8(4) . .
Ag36 S2 Ag12 97.80(13) . .
Ag36 S2 Ag37 92.70(13) . .
Ag37 S2 Ag3B 157.1(3) . .
C2 S2 Ag3B 92.0(6) . .
C2 S2 Ag12 115.5(5) . .
C2 S2 Ag36 109.1(5) . .
C2 S2 Ag37 110.1(5) . .
Ag6A S3 Ag8B 78.9(5) . .
Ag6A S3 Ag29 148.5(3) . 2_666
Ag6A S3 Ag37 115.5(3) . .
Ag8B S3 Ag37 132.8(5) . .
Ag17 S3 Ag29 75.07(11) . 2_666
Ag17 S3 Ag37 125.65(14) . .
Ag29 S3 Ag8B 72.6(5) 2_666 .
Ag29 S3 Ag37 76.75(11) 2_666 .
C56 S3 Ag6A 95.8(8) . .
C56 S3 Ag8B 111.2(7) . .
C56 S3 Ag17 120.7(6) . .
C56 S3 Ag29 106.7(8) . 2_666
C56 S3 Ag37 111.5(6) . .
Ag2 S4 Ag37 103.66(12) 2_666 .
Ag28 S4 Ag2 83.79(10) 2_666 2_666
Ag28 S4 Ag2A 82.71(17) 2_666 2_666
Ag28 S4 Ag37 141.41(13) 2_666 .
Ag37 S4 Ag2A 114.4(4) . 2_666
Ag38 S4 Ag2 106.16(12) . 2_666
Ag38 S4 Ag2A 98.7(4) . 2_666
Ag38 S4 Ag28 148.71(13) . 2_666
Ag38 S4 Ag37 66.21(8) . .
Ag39 S4 Ag2 142.53(15) . 2_666
Ag39 S4 Ag2A 152.8(4) . 2_666
Ag39 S4 Ag28 74.07(9) . 2_666
Ag39 S4 Ag37 78.04(9) . .
Ag39 S4 Ag38 108.46(12) . .
Ag39 S4 Ag42 90.53(11) . .
Ag42 S4 Ag2 112.81(15) . 2_666
Ag42 S4 Ag2A 97.1(6) . 2_666
Ag42 S4 Ag28 75.11(9) . 2_666
Ag42 S4 Ag37 131.61(13) . .
Ag42 S4 Ag38 73.68(9) . .
Ag1B S5 Ag32 100.6(5) . .
Ag1B S5 Ag38 109.8(4) . .
Ag32 S5 Ag10 78.20(12) . .
Ag32 S5 Ag38 109.39(17) . .
Ag38 S5 Ag10 137.11(16) . .
C38 S5 Ag1B 120.3(7) . .
C38 S5 Ag10 109.0(6) . .
C38 S5 Ag32 107.8(5) . .
C38 S5 Ag38 108.2(6) . .
Ag1 S6 Ag8 74.34(16) . .
Ag1 S6 Ag10 79.2(2) . .
Ag1 S6 Ag12 145.5(3) . .
Ag1B S6 Ag1A 96.4(5) . .
Ag1B S6 Ag3B 83.9(6) . .
Ag3B S6 Ag1A 165.2(4) . .
Ag8 S6 Ag10 132.64(19) . .
Ag8 S6 Ag12 110.50(16) . .
Ag8A S6 Ag1A 63.5(5) . .
Ag8A S6 Ag1B 122.5(7) . .
Ag8A S6 Ag3B 103.9(5) . .
Ag12 S6 Ag10 73.12(12) . .
C5 S6 Ag1 88.8(7) . .
C5 S6 Ag1A 104.1(7) . .
C5 S6 Ag1B 110.8(12) . .
C5 S6 Ag3B 89.5(6) . .
C5 S6 Ag8 109.9(12) . .
C5 S6 Ag8A 126.0(12) . .
C5 S6 Ag10 108.1(11) . .
C5 S6 Ag12 118.9(9) . .
Ag7 S7 Ag34 156.11(16) . .
Ag7A S7 Ag15 70.9(6) . .
Ag7A S7 Ag34 139.3(6) . .
Ag7A S7 Ag35 122.5(4) . .
Ag15 S7 Ag7 90.96(15) . .
Ag15 S7 Ag34 70.53(11) . .
Ag15 S7 Ag35 120.51(16) . .
Ag35 S7 Ag7 110.87(15) . .
Ag35 S7 Ag34 69.02(12) . .
C14 S7 Ag7 105.6(8) . .
C14 S7 Ag7A 111.8(9) . .
C14 S7 Ag15 115.4(7) . .
C14 S7 Ag34 96.2(7) . .
C14 S7 Ag35 110.6(8) . .
Ag7 S8 Ag24 139.83(15) . .
Ag7A S8 Ag7B 74.4(7) . .
Ag7A S8 Ag23 87.5(6) . .
Ag7A S8 Ag24 135.9(4) . .
Ag16 S8 Ag7 75.59(12) . .
Ag16 S8 Ag23 125.52(15) . .
Ag16 S8 Ag24 71.14(11) . .
Ag23 S8 Ag7 108.54(15) . .
Ag23 S8 Ag7B 138.7(4) . .
Ag23 S8 Ag24 74.92(11) . .
Ag24 S8 Ag7B 92.5(5) . .
C50 S8 Ag7 111.9(6) . .
C50 S8 Ag7A 123.1(7) . .
C50 S8 Ag7B 105.0(7) . .
C50 S8 Ag16 111.5(6) . .
C50 S8 Ag23 115.9(6) . .
C50 S8 Ag24 100.9(6) . .
Ag2A S9 Ag24 102.8(3) . .
Ag2A S9 Ag25 98.9(3) . .
Ag2A S9 C47 117.8(7) . .
Ag24 S9 Ag2 102.38(15) . .
Ag25 S9 Ag2 102.36(14) . .
Ag25 S9 Ag24 112.83(16) . .
C47 S9 Ag2 114.7(6) . .
C47 S9 Ag24 107.8(5) . .
C47 S9 Ag25 116.0(6) . .
Ag15 S10 Ag33 82.26(12) . .
Ag15 S10 Ag40 143.42(15) . .
Ag23 S10 Ag15 70.41(10) . .
Ag23 S10 Ag33 139.62(15) . .
Ag23 S10 Ag40 76.65(12) . .
Ag33 S10 Ag40 115.33(14) . .
C17 S10 Ag15 104.2(6) . .
C17 S10 Ag23 108.3(6) . .
C17 S10 Ag33 106.8(6) . .
C17 S10 Ag40 100.8(6) . .
Ag8 S11 Ag20 67.20(11) . .
Ag8 S11 Ag34 74.42(11) . .
Ag33 S11 Ag8 112.65(15) . .
Ag33 S11 Ag20 91.66(14) . .
Ag33 S11 Ag34 109.13(16) . .
Ag34 S11 Ag20 141.10(17) . .
C53 S11 Ag8 131.7(7) . .
C53 S11 Ag20 99.0(6) . .
C53 S11 Ag33 113.9(7) . .
C53 S11 Ag34 101.8(6) . .
Ag4 S12 Ag22 135.70(17) . .
Ag4 S12 Ag40 100.79(15) . .
Ag21 S12 Ag4 82.29(12) . .
Ag21 S12 Ag4A 105.0(3) . .
Ag21 S12 Ag22 75.14(15) . .
Ag21 S12 Ag40 127.29(19) . .
Ag22 S12 Ag4A 137.6(2) . .
Ag40 S12 Ag4A 82.7(3) . .
Ag40 S12 Ag22 66.46(11) . .
C59 S12 Ag4 117.1(8) . .
C59 S12 Ag4A 111.8(9) . .
C59 S12 Ag21 112.4(8) . .
C59 S12 Ag22 106.7(8) . .
C59 S12 Ag40 112.3(7) . .
Ag19 S13 Ag33 82.73(18) . .
Ag22 S13 Ag19 128.1(2) . .
Ag22 S13 Ag33 93.3(2) . .
C20 S13 Ag19 111.3(9) . .
C20 S13 Ag22 119.4(9) . .
C20 S13 Ag33 106.3(7) . .
Ag1A S14 Ag5B 70.8(5) . .
Ag1A S14 Ag19 129.8(3) . .
Ag1A S14 Ag20 86.6(3) . .
Ag5B S14 Ag19 103.8(4) . .
Ag5B S14 Ag20 148.1(3) . .
Ag14 S14 Ag1 104.9(3) . .
Ag19 S14 Ag1 132.5(2) . .
Ag19 S14 Ag14 76.16(14) . .
Ag19 S14 Ag20 73.26(13) . .
Ag20 S14 Ag1 75.1(2) . .
Ag20 S14 Ag14 135.89(17) . .
C23 S14 Ag1 110.0(7) . .
C23 S14 Ag1A 117.6(7) . .
C23 S14 Ag5B 104.7(7) . .
C23 S14 Ag14 115.0(6) . .
C23 S14 Ag19 112.1(6) . .
C23 S14 Ag20 105.7(6) . .
Ag2B S15 Ag19 115.6(4) . .
Ag9 S15 Ag14 119.46(17) . .
Ag9 S15 Ag19 152.14(18) . .
Ag19 S15 Ag14 68.15(10) . .
Ag21 S15 Ag2B 120.5(3) . .
Ag21 S15 Ag9 73.04(13) . .
Ag21 S15 Ag14 131.85(16) . .
Ag21 S15 Ag19 82.60(14) . .
C26 S15 Ag2B 123.7(6) . .
C26 S15 Ag9 101.8(5) . .
C26 S15 Ag14 114.1(6) . .
C26 S15 Ag19 98.0(6) . .
C26 S15 Ag21 106.9(6) . .
Ag5 S16 Ag3 130.20(18) . .
Ag5 S16 Ag9 138.79(17) . .
Ag9 S16 Ag3 66.39(11) . .
Ag9A S16 Ag5A 151.3(5) . .
Ag11 S16 Ag3 121.18(16) . .
Ag11 S16 Ag5 72.31(13) . .
Ag11 S16 Ag9 68.08(11) . .
C29 S16 Ag3 111.4(6) . .
C29 S16 Ag5 106.2(7) . .
C29 S16 Ag5A 106.6(8) . .
C29 S16 Ag9 97.4(7) . .
C29 S16 Ag9A 101.7(8) . .
C29 S16 Ag11 109.5(6) . .
Ag2B S17 Ag4B 73.6(6) . .
Ag2B S17 Ag5B 86.6(6) . .
Ag2B S17 Ag9B 111.6(5) . .
Ag4B S17 Ag5B 156.3(5) . .
Ag4B S17 Ag9B 84.1(6) . .
Ag5B S17 Ag9B 91.4(5) . .
Ag11 S17 Ag13 79.13(12) . .
Ag11 S17 Ag14 93.09(14) . .
Ag11 S17 Ag18 129.44(15) . .
Ag13 S17 Ag14 144.42(16) . .
Ag13 S17 Ag18 80.82(13) . .
Ag14 S17 Ag18 77.70(12) . .
C32 S17 Ag2B 130.1(7) . .
C32 S17 Ag4B 99.2(7) . .
C32 S17 Ag5B 103.5(7) . .
C32 S17 Ag9B 116.8(8) . .
C32 S17 Ag11 115.7(6) . .
C32 S17 Ag13 101.1(6) . .
C32 S17 Ag14 113.4(6) . .
C32 S17 Ag18 113.5(6) . .
Ag9B S18 Ag31 113.0(8) . .
Ag9B S18 Ag32 94.9(9) . .
Ag9B S18 C36 126.4(11) . .
Ag18 S18 Ag13 75.05(13) . .
Ag31 S18 Ag13 89.48(14) . .
Ag31 S18 Ag18 135.90(17) . .
Ag32 S18 Ag13 134.75(18) . .
Ag32 S18 Ag18 72.80(13) . .
Ag32 S18 Ag31 91.99(18) . .
C36 S18 Ag13 111.6(8) . .
C36 S18 Ag18 111.0(8) . .
C36 S18 Ag31 113.1(8) . .
C36 S18 Ag32 109.2(8) . .
Ag5A S19 Ag6A 111.7(5) . 2_666
Ag5A S19 Ag30 109.9(4) . .
Ag6 S19 Ag5 141.16(19) 2_666 .
Ag6 S19 Ag30 92.51(15) 2_666 .
Ag30 S19 Ag5 95.17(16) . .
Ag30 S19 Ag6A 98.3(2) . 2_666
C44 S19 Ag5 102.9(7) . .
C44 S19 Ag5A 111.1(8) . .
C44 S19 Ag6 111.9(8) . 2_666
C44 S19 Ag6A 120.1(8) . 2_666
C44 S19 Ag30 104.3(9) . .
Ag7B S20 Ag30 96.8(5) 2_666 .
Ag7B S20 Ag31 154.4(7) 2_666 .
Ag16 S20 Ag30 108.68(15) 2_666 .
Ag31 S20 Ag16 130.2(2) . 2_666
Ag31 S20 Ag30 93.87(15) . .
C41 S20 Ag7B 93.2(9) . 2_666
C41 S20 Ag16 108.5(8) . 2_666
C41 S20 Ag30 107.7(8) . .
C41 S20 Ag31 105.6(7) . .
Ag2 S21 Ag3 140.45(17) . .
Ag2 S21 Ag4 99.78(15) . .
Ag3A S21 Ag4A 87.3(4) . .
Ag3A S21 Ag29 105.1(4) . .
Ag3A S21 C62 102.7(6) . .
Ag4 S21 Ag3 95.06(15) . .
Ag29 S21 Ag2 73.85(13) . .
Ag29 S21 Ag3 71.22(11) . .
Ag29 S21 Ag4 139.78(17) . .
Ag29 S21 Ag4A 150.7(2) . .
C62 S21 Ag2 95.3(6) . .
C62 S21 Ag3 112.0(5) . .
C62 S21 Ag4 113.4(6) . .
C62 S21 Ag4A 95.8(6) . .
C62 S21 Ag29 106.7(6) . .
O1 W1 O2 97.9(4) . .
O1 W1 O8 161.3(3) . .
O1 W1 O9 88.4(3) . .
O1 W1 O10 103.8(4) . .
O1 W1 O14 97.0(4) . .
O2 W1 O8 76.5(3) . .
O2 W1 O9 86.9(3) . .
O2 W1 O14 154.2(3) . .
O8 W1 O9 73.6(3) . .
O10 W1 O2 102.5(4) . .
O10 W1 O8 94.8(3) . .
O10 W1 O9 163.1(3) . .
O10 W1 O14 94.1(3) . .
O14 W1 O8 82.6(3) . .
O14 W1 O9 72.6(3) . .
O2 W2 O8 71.9(3) . .
O3 W2 O2 79.9(3) . .
O3 W2 O8 71.7(3) . .
O4 W2 O2 162.2(3) . .
O4 W2 O3 91.2(4) . .
O4 W2 O8 90.7(3) . .
O5 W2 O2 86.3(3) . .
O5 W2 O3 161.2(3) . .
O5 W2 O4 98.5(4) . .
O5 W2 O8 92.1(3) . .
O40 W2 O2 91.6(4) . .
O40 W2 O3 92.5(4) . .
O40 W2 O4 104.2(4) . .
O40 W2 O5 100.6(4) . .
O40 W2 O8 158.6(3) . .
O3 W3 O8 76.2(3) . .
O3 W3 O9 90.4(3) . .
O3 W3 O13 157.6(3) . .
O6 W3 O3 95.1(4) . .
O6 W3 O7 103.8(4) . .
O6 W3 O8 159.8(4) . .
O6 W3 O9 87.2(4) . .
O6 W3 O13 98.3(4) . .
O7 W3 O3 101.7(4) . .
O7 W3 O8 95.9(3) . .
O7 W3 O9 162.7(3) . .
O7 W3 O13 92.4(4) . .
O8 W3 O9 74.8(3) . .
O13 W3 O8 85.2(3) . .
O13 W3 O9 72.6(3) . .
O9 W4 O13 74.7(3) . .
O9 W4 O14 75.3(3) . .
O9 W4 O18 141.4(3) . .
O11 W4 O9 104.1(4) . .
O11 W4 O12 102.2(4) . .
O11 W4 O13 167.3(4) . .
O11 W4 O14 90.2(4) . .
O11 W4 O18 100.2(4) . .
O12 W4 O9 101.9(4) . .
O12 W4 O13 90.3(3) . .
O12 W4 O14 167.6(3) . .
O12 W4 O18 101.7(4) . .
O14 W4 O13 77.3(3) . .
O18 W4 O13 75.1(3) . .
O18 W4 O14 75.1(3) . .
O14 W5 O17 83.7(3) . .
O14 W5 O18 72.3(3) . .
O17 W5 O18 73.8(3) . .
O19 W5 O14 95.7(3) . .
O19 W5 O17 163.9(3) . .
O19 W5 O18 90.6(3) . .
O19 W5 O21 98.0(4) . .
O20 W5 O14 93.2(3) . .
O20 W5 O17 92.7(3) . .
O20 W5 O18 160.9(3) . .
O20 W5 O19 103.4(4) . .
O20 W5 O21 103.2(4) . .
O21 W5 O14 155.5(3) . .
O21 W5 O17 77.6(3) . .
O21 W5 O18 87.3(3) . .
O13 W6 O17 85.8(3) . .
O13 W6 O18 72.9(3) . .
O13 W6 W7 127.4(2) . .
O15 W6 O13 94.5(3) . .
O15 W6 O16 104.0(4) . .
O15 W6 O17 93.7(3) . .
O15 W6 O18 163.1(3) . .
O15 W6 O22 102.0(4) . .
O15 W6 W7 91.1(3) . .
O16 W6 O13 96.7(4) . .
O16 W6 O17 161.8(4) . .
O16 W6 O18 89.0(4) . .
O16 W6 O22 95.5(4) . .
O16 W6 W7 132.3(3) . .
O17 W6 O18 74.5(3) . .
O17 W6 W7 41.6(2) . .
O18 W6 W7 87.9(2) . .
O22 W6 O13 156.4(3) . .
O22 W6 O17 76.6(3) . .
O22 W6 O18 87.2(3) . .
O22 W6 W7 36.8(2) . .
O17 W7 W6 41.3(2) . .
O21 W7 O17 72.1(3) . .
O21 W7 W6 82.3(2) . .
O22 W7 O17 72.1(3) . .
O22 W7 O21 81.0(3) . .
O22 W7 W6 32.5(2) . .
O23 W7 O17 91.8(3) . .
O23 W7 O21 163.6(3) . .
O23 W7 O22 90.7(3) . .
O23 W7 W6 83.1(3) . .
O24 W7 O17 92.9(3) . .
O24 W7 O21 86.7(3) . .
O24 W7 O22 162.9(3) . .
O24 W7 O23 98.0(4) . .
O24 W7 W6 134.0(2) . .
O39 W7 O17 156.3(3) . .
O39 W7 O21 90.3(4) . .
O39 W7 O22 89.9(4) . .
O39 W7 O23 104.0(4) . .
O39 W7 O24 102.1(4) . .
O39 W7 W6 122.4(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 Ag8 2.946(5) .
Ag1 Ag10 3.247(6) .
Ag1 Ag20 3.096(5) .
Ag1 O36 2.56(4) .
Ag1 S6 2.435(6) .
Ag1 S14 2.587(8) .
Ag1A Ag5B 2.761(19) .
Ag1A Ag8A 2.543(18) .
Ag1A Ag20 3.290(9) .
Ag1A O6 2.560(14) .
Ag1A O36 2.47(4) .
Ag1A S6 2.575(8) .
Ag1A S14 2.297(9) .
Ag1B Ag3B 3.13(2) .
Ag1B S5 2.147(14) .
Ag1B S6 2.254(14) .
Ag2 Ag29 2.933(4) .
Ag2 S4 2.700(3) 2_666
Ag2 S9 2.495(6) .
Ag2 S21 2.471(6) .
Ag2A Ag24 3.27(2) .
Ag2A Ag25 3.15(2) .
Ag2A O20 2.513(11) .
Ag2A S4 2.888(16) 2_666
Ag2A S9 1.70(3) .
Ag2B Ag4B 2.80(3) .
Ag2B Ag5B 3.21(2) .
Ag2B Ag9A 2.947(19) .
Ag2B O2 2.568(16) .
Ag2B S15 2.610(15) .
Ag2B S17 2.175(13) .
Ag3 Ag9 2.881(3) .
Ag3 Ag29 2.9375(17) .
Ag3 O1 2.518(9) .
Ag3 O29 2.280(12) .
Ag3 S16 2.665(4) .
Ag3 S21 2.626(4) .
Ag3A Ag4A 3.149(15) .
Ag3A Ag9A 3.010(16) .
Ag3A Ag29 3.318(8) .
Ag3A O1 2.446(11) .
Ag3A O29 2.385(15) .
Ag3A S21 1.738(8) .
Ag3B Ag36 3.020(14) .
Ag3B S2 2.647(14) .
Ag3B S6 2.428(16) .
Ag4 Ag21 3.207(2) .
Ag4 O19 2.450(8) .
Ag4 S12 2.468(4) .
Ag4 S21 2.533(4) .
Ag4A Ag23 3.274(10) .
Ag4A O19 2.176(12) .
Ag4A S12 2.758(11) .
Ag4A S21 2.708(10) .
Ag4B Ag5A 3.22(2) .
Ag4B O31 2.35(3) .
Ag4B S17 2.481(16) .
Ag5 Ag11 2.944(2) .
Ag5 O31 2.411(14) .
Ag5 O40 2.534(9) .
Ag5 S16 2.523(5) .
Ag5 S19 2.523(4) .
Ag5A Ag8B 2.56(2) 2_666
Ag5A S16 2.310(10) .
Ag5A S19 2.228(10) .
Ag5B O6 2.382(15) .
Ag5B O35 2.21(4) .
Ag5B S14 2.465(14) .
Ag5B S17 2.499(16) .
Ag6 Ag17 3.154(3) .
Ag6 Ag41 3.308(3) .
Ag6 O23 2.562(8) .
Ag6 S1 2.454(4) .
Ag6 S19 2.382(5) 2_666
Ag6A Ag8B 3.15(2) .
Ag6A Ag36 3.067(13) .
Ag6A O23 2.439(11) .
Ag6A S1 2.458(9) .
Ag6A S3 2.425(14) .
Ag6A S19 2.890(15) 2_666
Ag7 Ag16 3.070(2) .
Ag7 Ag41 2.908(2) .
Ag7 O44 2.273(13) .
Ag7 S7 2.558(5) .
Ag7 S8 2.573(4) .
Ag7A Ag7B 3.09(2) .
Ag7A Ag15 2.69(2) .
Ag7A Ag23 3.37(2) .
Ag7A S7 2.124(13) .
Ag7A S8 2.400(12) .
Ag7B O39 2.55(2) .
Ag7B S8 2.699(17) .
Ag7B S20 2.218(17) 2_666
Ag8 Ag20 2.8120(17) .
Ag8 Ag34 3.054(3) .
Ag8 O12 2.473(9) .
Ag8 O16 2.464(9) .
Ag8 S6 2.441(4) .
Ag8 S11 2.524(4) .
Ag8A Ag20 2.967(12) .
Ag8A O12 2.169(14) .
Ag8A S6 2.222(12) .
Ag8B Ag5A 2.56(2) 2_666
Ag8B Ag29 2.94(2) 2_666
Ag8B O5 2.22(2) 2_666
Ag8B S3 2.53(2) .
Ag9 Ag11 2.836(2) .
Ag9 Ag21 2.884(3) .
Ag9 O30 2.243(11) .
Ag9 S15 2.446(5) .
Ag9 S16 2.595(5) .
Ag9A O1 2.428(15) .
Ag9A O30 2.418(17) .
Ag9A S16 1.977(18) .
Ag9B Ag31 3.18(2) .
Ag9B Ag32 2.83(2) .
Ag9B O3 2.516(19) .
Ag9B S17 2.77(2) .
Ag9B S18 1.37(2) .
Ag10 Ag12 3.072(2) .
Ag10 Ag18 3.272(2) .
Ag10 Ag32 3.077(2) .
Ag10 C67 2.71(3) .
Ag10 O36 2.20(4) .
Ag10 S5 2.522(4) .
Ag10 S6 2.653(5) .
Ag11 Ag13 3.1295(19) .
Ag11 O2 2.522(8) .
Ag11 S16 2.467(4) .
Ag11 S17 2.442(4) .
Ag12 O15 2.479(8) .
Ag12 S2 2.481(4) .
Ag12 S6 2.500(4) .
Ag13 Ag18 3.299(2) .
Ag13 O32 2.221(13) .
Ag13 O40 2.358(9) .
Ag13 S17 2.471(4) .
Ag13 S18 2.771(5) .
Ag14 Ag18 3.215(2) .
Ag14 Ag19 3.094(2) .
Ag14 O6 2.509(9) .
Ag14 S14 2.542(4) .
Ag14 S15 2.814(5) .
Ag14 S17 2.509(4) .
Ag15 Ag23 2.8946(17) .
Ag15 Ag33 3.342(2) .
Ag15 Ag34 2.9721(17) .
Ag15 O18 2.402(7) .
Ag15 S7 2.482(4) .
Ag15 S10 2.520(4) .
Ag16 Ag24 2.933(2) .
Ag16 Ag25 3.0374(18) .
Ag16 S8 2.434(4) .
Ag16 S20 2.429(4) 2_666
Ag17 Ag29 2.955(2) 2_666
Ag17 Ag39 3.1393(16) .
Ag17 O5 2.136(8) 2_666
Ag17 S3 2.421(4) .
Ag18 Ag32 2.9791(19) .
Ag18 C67 2.61(3) .
Ag18 O35 1.77(4) .
Ag18 S17 2.614(4) .
Ag18 S18 2.642(5) .
Ag19 Ag20 2.964(2) .
Ag19 Ag21 3.377(2) .
Ag19 Ag33 3.258(2) .
Ag19 S13 2.439(6) .
Ag19 S14 2.474(5) .
Ag19 S15 2.705(4) .
Ag20 O33 2.27(2) .
Ag20 S11 2.557(4) .
Ag20 S14 2.494(4) .
Ag21 Ag22 3.063(2) .
Ag21 O11 2.520(8) .
Ag21 S12 2.405(5) .
Ag21 S15 2.400(5) .
Ag22 Ag40 2.822(2) .
Ag22 O28 2.256(19) .
Ag22 S12 2.611(5) .
Ag22 S13 2.373(6) .
Ag23 Ag24 3.0860(17) .
Ag23 Ag40 3.1737(19) .
Ag23 O19 2.390(8) .
Ag23 O26 2.405(15) .
Ag23 S8 2.468(4) .
Ag23 S10 2.501(4) .
Ag24 O25 2.217(14) .
Ag24 S8 2.603(4) .
Ag24 S9 2.442(4) .
Ag25 Ag26 3.3546(13) .
Ag25 Ag31 3.3781(18) 2_666
Ag25 Ag42 2.9201(16) 2_666
Ag25 O4 2.522(8) 2_666
Ag25 O24 2.244(8) .
Ag25 S9 2.409(4) .
Ag26 Ag27 2.7317(11) .
Ag26 Ag27 2.7470(11) 2_666
Ag26 Ag28 2.7487(12) 2_666
Ag26 Ag28 2.7806(12) .
Ag26 Ag39 3.3574(12) .
Ag26 O5 2.307(8) 2_666
Ag26 O24 2.301(8) .
Ag27 Ag26 2.7469(11) 2_666
Ag27 Ag28 2.8296(11) .
Ag27 Ag28 2.9155(11) 2_666
Ag27 Ag39 3.0578(12) .
Ag27 Ag42 3.0058(12) .
Ag27 O8 2.294(8) .
Ag27 O17 2.312(7) .
Ag28 Ag26 2.7486(12) 2_666
Ag28 Ag27 2.9154(11) 2_666
Ag28 Ag39 2.9819(12) 2_666
Ag28 Ag42 3.0235(12) 2_666
Ag28 O10 2.515(8) .
Ag28 O20 2.380(8) .
Ag28 S4 2.553(3) 2_666
Ag29 Ag8B 2.94(2) 2_666
Ag29 Ag17 2.955(2) 2_666
Ag29 Ag37 3.1191(16) 2_666
Ag29 S3 2.429(4) 2_666
Ag29 S21 2.410(4) .
Ag30 S19 2.397(5) .
Ag30 S20 2.428(5) .
Ag31 Ag25 3.3781(17) 2_666
Ag31 S18 2.387(5) .
Ag31 S20 2.384(4) .
Ag32 S5 2.352(4) .
Ag32 S18 2.364(5) .
Ag33 S10 2.560(4) .
Ag33 S11 2.510(5) .
Ag33 S13 2.490(6) .
Ag34 Ag35 2.9346(17) .
Ag34 O16 2.425(9) .
Ag34 O38 2.323(14) .
Ag34 S7 2.660(4) .
Ag34 S11 2.525(4) .
Ag35 Ag36 3.3533(19) .
Ag35 Ag41 2.882(2) .
Ag35 O37 2.257(16) .
Ag35 S1 2.576(4) .
Ag35 S7 2.516(5) .
Ag36 S1 2.389(4) .
Ag36 S2 2.368(4) .
Ag37 Ag29 3.1190(16) 2_666
Ag37 Ag38 2.9004(16) .
Ag37 Ag39 3.2687(14) .
Ag37 O41 2.273(11) .
Ag37 S2 2.532(4) .
Ag37 S3 2.591(4) .
Ag37 S4 2.776(3) .
Ag38 Ag42 2.9535(14) .
Ag38 O42 2.299(10) .
Ag38 S4 2.519(3) .
Ag38 S5 2.449(4) .
Ag39 Ag28 2.9819(12) 2_666
Ag39 O15 2.446(8) .
Ag39 O23 2.170(8) .
Ag39 S4 2.394(3) .
Ag40 O26 2.428(15) .
Ag40 O27 2.280(17) .
Ag40 S10 2.615(4) .
Ag40 S12 2.537(4) .
Ag41 O39 2.342(9) .
Ag41 O43 2.195(12) .
Ag41 S1 2.493(4) .
Ag42 Ag25 2.9200(16) 2_666
Ag42 Ag28 3.0236(12) 2_666
Ag42 O4 2.218(9) .
Ag42 O7 2.400(9) .
Ag42 S4 2.404(3) .
C1 C2 1.49(2) .
C2 C3 1.52(2) .
C2 S2 1.854(13) .
C4 C5 1.525(10) .
C5 C6 1.529(10) .
C5 S6 1.818(10) .
C7 C8 1.43(4) .
C8 C9 1.28(3) .
C9 C88 1.55(3) .
C10 C11 1.40(2) .
C11 C12 1.52(3) .
C11 S1 1.846(13) .
C13 C14 1.45(3) .
C14 C15 1.45(3) .
C14 S7 1.867(16) .
C16 C17 1.46(3) .
C17 C18 1.45(3) .
C17 S10 1.858(15) .
C19 C20 1.46(3) .
C20 C21 1.39(4) .
C20 S13 1.855(9) .
C22 C23 1.50(3) .
C23 C24 1.48(3) .
C23 S14 1.849(15) .
C25 C26 1.45(2) .
C26 C27 1.40(3) .
C26 S15 1.860(14) .
C28 C29 1.526(10) .
C29 C30 1.523(10) .
C29 S16 1.720(15) .
C31 C32 1.47(3) .
C32 C33 1.52(3) .
C32 S17 1.821(16) .
C34 C36 1.537(10) .
C35 C36 1.50(3) .
C36 S18 1.857(18) .
C37 C38 1.55(3) .
C38 C39 1.51(2) .
C38 S5 1.852(16) .
C40 C41 1.49(3) .
C41 C42 1.47(3) .
C41 S20 1.861(18) .
C43 C44 1.48(3) .
C44 C45 1.47(4) .
C44 S19 1.868(18) .
C46 C47 1.48(2) .
C47 C48 1.48(3) .
C47 S9 1.853(15) .
C49 C50 1.48(3) .
C50 C51 1.48(3) .
C50 S8 1.846(14) .
C52 C53 1.49(3) .
C53 C54 1.53(3) .
C53 S11 1.861(15) .
C55 C56 1.50(2) .
C56 C57 1.37(3) .
C56 S3 1.867(16) .
C58 C59 1.44(3) .
C59 C60 1.50(4) .
C59 S12 1.888(19) .
C61 C62 1.521(10) .
C62 C63 1.529(10) .
C62 S21 2.035(15) .
C64 C65 1.548(10) .
C65 C66 1.556(10) .
C66 C67 1.545(10) .
C67 O35 1.231(10) .
C67 O36 1.233(10) .
C68 C69 1.544(10) .
C69 C70 1.547(10) .
C70 C71 1.547(10) .
C71 O33 1.30(4) .
C71 O34 1.20(3) .
C72 C73 1.542(10) .
C73 C74 1.553(10) .
C74 C75 1.54(4) .
C75 O27 1.32(4) .
C75 O28 1.18(4) .
C76 C77 1.38(3) .
C77 C78 1.537(10) .
C78 C79 1.47(2) .
C79 O29 1.22(2) .
C79 O30 1.28(2) .
C80 C81 1.548(10) .
C81 C82 1.549(10) .
C82 C83 1.554(10) .
C83 O25 1.36(3) .
C83 O26 1.14(2) .
C84 C85 1.45(4) .
C85 C86 1.39(3) .
C86 C87 1.55(3) .
C87 O43 1.27(2) .
C87 O44 1.21(2) .
C88 O37 1.21(3) .
C88 O38 1.29(3) .
C89 C90 1.66(3) .
C90 C91 1.536(10) .
C91 C92 1.53(2) .
C92 O41 1.21(2) .
C92 O42 1.251(19) .
C93 C94 1.52(4) .
C94 C95 1.59(4) .
C95 C96 1.53(3) .
C96 O31 1.28(2) .
C96 O32 1.19(2) .
C97 O45 1.45(3) .
O1 W1 1.753(8) .
O2 W1 1.862(7) .
O2 W2 2.080(8) .
O3 W2 2.051(8) .
O3 W3 1.884(8) .
O4 Ag25 2.522(8) 2_666
O4 W2 1.824(8) .
O5 Ag8B 2.22(2) 2_666
O5 Ag17 2.136(8) 2_666
O5 Ag26 2.307(8) 2_666
O5 W2 1.821(8) .
O6 W3 1.773(8) .
O7 W3 1.776(8) .
O8 W1 2.168(7) .
O8 W2 2.187(7) .
O8 W3 2.129(7) .
O9 W1 2.248(8) .
O9 W3 2.226(8) .
O9 W4 1.935(7) .
O10 W1 1.785(8) .
O11 W4 1.735(8) .
O12 W4 1.776(9) .
O13 W3 1.993(8) .
O13 W4 2.180(8) .
O13 W6 1.995(8) .
O14 W1 1.991(7) .
O14 W4 2.174(7) .
O14 W5 1.980(7) .
O15 W6 1.762(8) .
O16 W6 1.764(8) .
O17 W5 2.150(8) .
O17 W6 2.149(7) .
O17 W7 2.163(7) .
O18 W4 1.961(8) .
O18 W5 2.282(8) .
O18 W6 2.250(8) .
O19 W5 1.781(8) .
O20 W5 1.765(8) .
O21 W5 1.859(7) .
O21 W7 2.119(8) .
O22 W6 1.855(8) .
O22 W7 2.070(8) .
O23 W7 1.817(8) .
O24 W7 1.806(8) .
O39 W7 1.763(8) .
O40 W2 1.767(8) .
S3 Ag29 2.429(4) 2_666
S4 Ag2 2.701(3) 2_666
S4 Ag2A 2.888(15) 2_666
S4 Ag28 2.553(3) 2_666
S19 Ag6 2.382(4) 2_666
S19 Ag6A 2.890(15) 2_666
S20 Ag7B 2.218(17) 2_666
S20 Ag16 2.429(4) 2_666
W6 W7 3.2310(7) .
