# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2014

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#                                CCDC 
# 
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# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
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#  fide research purposes only. It may contain copyright material
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data_1

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C24 H56 Ag5 F6 O8 P5 S8'
_chemical_formula_weight         1537.37

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   C2/c

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

_cell_length_a                   35.148(3)
_cell_length_b                   16.7802(16)
_cell_length_c                   23.300(2)
_cell_angle_alpha                90.00
_cell_angle_beta                 127.931(2)
_cell_angle_gamma                90.00
_cell_volume                     10839.1(18)
_cell_formula_units_Z            8
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    7688
_cell_measurement_theta_min      2.22
_cell_measurement_theta_max      25.40

_exptl_crystal_description       film
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.07
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.884
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             6048
_exptl_absorpt_coefficient_mu    2.287
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.4468
_exptl_absorpt_correction_T_max  0.8563
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            30306
_diffrn_reflns_av_R_equivalents  0.0461
_diffrn_reflns_av_sigmaI/netI    0.0528
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_h_max       41
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         1.47
_diffrn_reflns_theta_max         25.00
_reflns_number_total             9527
_reflns_number_gt                6239
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

The isopropoxyl groups on P1 nad P2 were split into two groups, each is 
half occupied.

The used restraints are:

EADP C2 C3
EADP C5' C6'
EADP C5 C6
EADP C7 C7'
EADP C10 C10'
EADP C8' C9'
EADP C8 C9
EADP C11 C12
EADP C11' C12'
EADP C20 C21
EADP C23 C24
EADP O3 O4
EADP O3' O4'
SIZE 0.070 0.210 0.420
DFIX 1.43 0.01 O4 C10  O4' C10'  O3 C7  O2 C4  O2' C4'
DFIX 1.54 0.01 C4 C6  C4' C6'  C7 C8  C7 C9  C10 C11  C10 C12  C7' C8'  C7' C9'
DFIX 1.54 0.01 C4' C5'  C4 C5  C10' C11'  C10' C12'
DELU C1 C3
DELU C4 C5
DELU C4 C6
DELU C4' C6'
DELU C4' C5'
DELU C7 C8
DELU C7' C8'
DELU C7 C9
DELU C7' C9'
DELU C10 C11
DELU C10' C11'
DELU C22 C23
DELU O2 C4
DELU O2' C4'
DELU O3 C7
DELU O3' C7'
DELU O4' C10'
DELU P2 O4
DELU P2 O4'

Residual densities in solvent accessible voids cannot be modeled as 
solvent molecules. SQUEEZE was applied and results were listed in 
following.

# SQUEEZE RESULTS
loop_
  _platon_squeeze_void_nr
  _platon_squeeze_void_average_x
  _platon_squeeze_void_average_y
  _platon_squeeze_void_average_z
  _platon_squeeze_void_volume
  _platon_squeeze_void_count_electrons
  _platon_squeeze_void_content
   1  0.500 0.077 0.250          156       39 ' '
   2  0.500-0.077 0.750          156       39 ' '
   3  0.000 0.423 0.750          156       39 ' '       
   4  0.000 0.577 0.250          156       39 ' '
# END
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0807P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         9527
_refine_ls_number_parameters     547
_refine_ls_number_restraints     36
_refine_ls_R_factor_all          0.0775
_refine_ls_R_factor_gt           0.0481
_refine_ls_wR_factor_ref         0.1378
_refine_ls_wR_factor_gt          0.1242
_refine_ls_goodness_of_fit_ref   0.978
_refine_ls_restrained_S_all      0.979
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.16513(2) 0.07215(3) 0.16399(3) 0.06074(17) Uani 1 1 d . . .
Ag2 Ag 0.23614(2) -0.00900(4) 0.31671(3) 0.06376(17) Uani 1 1 d . . .
Ag3 Ag 0.27379(2) 0.13620(4) 0.27074(3) 0.07039(19) Uani 1 1 d . . .
Ag4 Ag 0.24600(2) -0.04157(4) 0.19536(3) 0.07339(19) Uani 1 1 d . . .
Ag5 Ag 0.22104(2) 0.29359(3) 0.19804(4) 0.07302(19) Uani 1 1 d . . .
C1 C 0.0976(3) -0.2184(6) 0.2026(6) 0.090(3) Uani 1 1 d U . .
H1 H 0.0791 -0.1686 0.1844 0.108 Uiso 1 1 calc R . .
C2 C 0.1177(5) -0.2306(9) 0.2780(8) 0.155(4) Uani 1 1 d . . .
H2A H 0.1363 -0.2789 0.2956 0.233 Uiso 1 1 calc R . .
H2B H 0.0921 -0.2347 0.2817 0.233 Uiso 1 1 calc R . .
H2C H 0.1381 -0.1864 0.3067 0.233 Uiso 1 1 calc R . .
C3 C 0.0669(5) -0.2867(9) 0.1539(8) 0.155(4) Uani 1 1 d U . .
H3A H 0.0566 -0.2770 0.1056 0.233 Uiso 1 1 calc R . .
H3B H 0.0392 -0.2918 0.1526 0.233 Uiso 1 1 calc R . .
H3C H 0.0854 -0.3351 0.1723 0.233 Uiso 1 1 calc R . .
C4 C 0.0779(5) -0.0893(9) 0.0336(8) 0.072(4) Uani 0.50 1 d PDU A 1
H4 H 0.0979 -0.0417 0.0574 0.086 Uiso 0.50 1 calc PR A 1
C5 C 0.0893(10) -0.1250(19) -0.0156(13) 0.126(6) Uani 0.50 1 d PDU A 1
H5A H 0.0597 -0.1387 -0.0621 0.189 Uiso 0.50 1 calc PR A 1
H5B H 0.1087 -0.1720 0.0069 0.189 Uiso 0.50 1 calc PR A 1
H5C H 0.1066 -0.0866 -0.0222 0.189 Uiso 0.50 1 calc PR A 1
C6 C 0.0277(7) -0.0726(17) 0.0121(12) 0.126(6) Uani 0.50 1 d PDU A 1
H6A H 0.0211 -0.0166 0.0038 0.189 Uiso 0.50 1 calc PR A 1
H6B H 0.0268 -0.0895 0.0506 0.189 Uiso 0.50 1 calc PR A 1
H6C H 0.0039 -0.1014 -0.0316 0.189 Uiso 0.50 1 calc PR A 1
C7 C 0.4371(6) -0.0752(15) 0.4034(11) 0.106(5) Uani 0.50 1 d PDU B 1
H7A H 0.4464 -0.0212 0.4004 0.127 Uiso 0.50 1 calc PR B 1
C8 C 0.4272(9) -0.1231(16) 0.3398(13) 0.132(6) Uani 0.50 1 d PDU B 1
H8A H 0.4152 -0.1749 0.3389 0.197 Uiso 0.50 1 calc PR B 1
H8B H 0.4565 -0.1288 0.3455 0.197 Uiso 0.50 1 calc PR B 1
H8C H 0.4036 -0.0958 0.2951 0.197 Uiso 0.50 1 calc PR B 1
C9 C 0.4776(8) -0.1085(17) 0.4791(13) 0.132(6) Uani 0.50 1 d PDU B 1
H9A H 0.5075 -0.0827 0.4973 0.197 Uiso 0.50 1 calc PR B 1
H9B H 0.4807 -0.1648 0.4757 0.197 Uiso 0.50 1 calc PR B 1
H9C H 0.4701 -0.0988 0.5117 0.197 Uiso 0.50 1 calc PR B 1
C10 C 0.3752(7) 0.0605(12) 0.4913(8) 0.090(5) Uani 0.50 1 d PDU C 1
H10 H 0.3460 0.0484 0.4861 0.107 Uiso 0.50 1 calc PR C 1
C11 C 0.4173(8) 0.0080(13) 0.5509(12) 0.130(8) Uani 0.50 1 d PDU C 1
H11A H 0.4099 -0.0134 0.5812 0.195 Uiso 0.50 1 calc PR C 1
H11B H 0.4461 0.0396 0.5800 0.195 Uiso 0.50 1 calc PR C 1
H11C H 0.4222 -0.0348 0.5287 0.195 Uiso 0.50 1 calc PR C 1
C12 C 0.3886(11) 0.1493(13) 0.5105(16) 0.130(8) Uani 0.50 1 d PD C 1
H12A H 0.4142 0.1623 0.5082 0.195 Uiso 0.50 1 calc PR C 1
H12B H 0.3990 0.1590 0.5588 0.195 Uiso 0.50 1 calc PR C 1
H12C H 0.3609 0.1816 0.4765 0.195 Uiso 0.50 1 calc PR C 1
C4' C 0.0787(8) -0.1577(15) 0.0254(10) 0.138(8) Uani 0.50 1 d PDU D 2
H4' H 0.0890 -0.2131 0.0302 0.166 Uiso 0.50 1 calc PR D 2
C5' C 0.0740(11) -0.108(2) -0.0338(14) 0.188(12) Uani 0.50 1 d PDU D 2
H5D H 0.0500 -0.0670 -0.0504 0.282 Uiso 0.50 1 calc PR D 2
H5E H 0.0646 -0.1413 -0.0738 0.282 Uiso 0.50 1 calc PR D 2
H5F H 0.1044 -0.0831 -0.0141 0.282 Uiso 0.50 1 calc PR D 2
C6' C 0.0247(8) -0.144(2) -0.0152(12) 0.188(12) Uani 0.50 1 d PDU D 2
H6D H 0.0169 -0.1526 0.0171 0.282 Uiso 0.50 1 calc PR D 2
H6E H 0.0065 -0.1795 -0.0557 0.282 Uiso 0.50 1 calc PR D 2
H6F H 0.0168 -0.0896 -0.0326 0.282 Uiso 0.50 1 calc PR D 2
C7' C 0.4208(7) -0.0926(14) 0.3809(15) 0.106(5) Uani 0.50 1 d PDU E 2
H7B H 0.4015 -0.1139 0.3313 0.127 Uiso 0.50 1 calc PR E 2
C8' C 0.4489(11) -0.0282(17) 0.374(3) 0.27(2) Uani 0.50 1 d PDU E 2
H8D H 0.4761 -0.0521 0.3805 0.404 Uiso 0.50 1 calc PR E 2
H8E H 0.4600 0.0117 0.4109 0.404 Uiso 0.50 1 calc PR E 2
H8F H 0.4282 -0.0040 0.3269 0.404 Uiso 0.50 1 calc PR E 2
C9' C 0.4572(11) -0.1609(18) 0.421(3) 0.27(2) Uani 0.50 1 d PDU E 2
H9D H 0.4770 -0.1517 0.4726 0.404 Uiso 0.50 1 calc PR E 2
H9E H 0.4772 -0.1634 0.4060 0.404 Uiso 0.50 1 calc PR E 2
H9F H 0.4403 -0.2104 0.4097 0.404 Uiso 0.50 1 calc PR E 2
C10' C 0.3953(8) 0.0709(13) 0.5001(10) 0.090(5) Uani 0.50 1 d PDU F 2
H10' H 0.4296 0.0569 0.5307 0.107 Uiso 0.50 1 calc PR F 2
C11' C 0.3853(12) 0.0363(18) 0.5498(14) 0.152(9) Uani 0.50 1 d PDU F 2
H11D H 0.3620 0.0689 0.5477 0.228 Uiso 0.50 1 calc PR F 2
H11E H 0.4146 0.0349 0.5989 0.228 Uiso 0.50 1 calc PR F 2
H11F H 0.3729 -0.0168 0.5343 0.228 Uiso 0.50 1 calc PR F 2
C12' C 0.4022(16) 0.1612(14) 0.500(2) 0.152(9) Uani 0.50 1 d PD F 2
H12D H 0.3992 0.1758 0.4577 0.228 Uiso 0.50 1 calc PR F 2
H12E H 0.4337 0.1757 0.5430 0.228 Uiso 0.50 1 calc PR F 2
H12F H 0.3781 0.1885 0.5000 0.228 Uiso 0.50 1 calc PR F 2
C13 C 0.2102(4) 0.3013(7) 0.3981(6) 0.106(3) Uani 1 1 d . . .
H13 H 0.2075 0.2554 0.4215 0.127 Uiso 1 1 calc R . .
C14 C 0.2587(4) 0.3308(6) 0.4440(5) 0.099(3) Uani 1 1 d . . .
H14A H 0.2791 0.2954 0.4415 0.148 Uiso 1 1 calc R . .
H14B H 0.2699 0.3337 0.4933 0.148 Uiso 1 1 calc R . .
H14C H 0.2596 0.3829 0.4279 0.148 Uiso 1 1 calc R . .
C15 C 0.1753(5) 0.3655(9) 0.3846(9) 0.198(9) Uani 1 1 d . . .
H15A H 0.1920 0.4155 0.4027 0.298 Uiso 1 1 calc R . .
H15B H 0.1621 0.3519 0.4091 0.298 Uiso 1 1 calc R . .
H15C H 0.1497 0.3698 0.3332 0.298 Uiso 1 1 calc R . .
C16 C 0.1078(3) 0.1575(6) 0.2837(4) 0.076(2) Uani 1 1 d . . .
H16 H 0.1026 0.2150 0.2748 0.092 Uiso 1 1 calc R . .
C17 C 0.1064(4) 0.1361(9) 0.3444(6) 0.128(5) Uani 1 1 d . . .
H17A H 0.1072 0.0792 0.3492 0.192 Uiso 1 1 calc R . .
H17B H 0.0772 0.1564 0.3342 0.192 Uiso 1 1 calc R . .
H17C H 0.1337 0.1590 0.3889 0.192 Uiso 1 1 calc R . .
C18 C 0.0723(3) 0.1145(7) 0.2153(6) 0.105(3) Uani 1 1 d . . .
H18A H 0.0790 0.1238 0.1817 0.158 Uiso 1 1 calc R . .
H18B H 0.0404 0.1333 0.1946 0.158 Uiso 1 1 calc R . .
H18C H 0.0743 0.0585 0.2250 0.158 Uiso 1 1 calc R . .
C19 C 0.2388(4) 0.0892(5) 0.0086(5) 0.084(3) Uani 1 1 d . . .
H19 H 0.2542 0.0544 0.0513 0.101 Uiso 1 1 calc R . .
C20 C 0.2755(5) 0.1356(8) 0.0118(8) 0.148(4) Uani 1 1 d . . .
H20A H 0.2604 0.1650 -0.0327 0.222 Uiso 1 1 calc R . .
H20B H 0.2993 0.1002 0.0181 0.222 Uiso 1 1 calc R . .
H20C H 0.2908 0.1721 0.0520 0.222 Uiso 1 1 calc R . .
C21 C 0.2106(5) 0.0417(8) -0.0579(8) 0.148(4) Uani 1 1 d . . .
H21A H 0.1851 0.0150 -0.0615 0.222 Uiso 1 1 calc R . .
H21B H 0.2312 0.0030 -0.0568 0.222 Uiso 1 1 calc R . .
H21C H 0.1971 0.0760 -0.0993 0.222 Uiso 1 1 calc R . .
C22 C 0.1110(3) 0.1950(5) -0.0308(4) 0.072(2) Uani 1 1 d U . .
H22 H 0.1116 0.1489 -0.0561 0.086 Uiso 1 1 calc R . .
C23 C 0.0755(4) 0.1803(8) -0.0156(6) 0.126(3) Uani 1 1 d U . .
H23A H 0.0777 0.2227 0.0140 0.189 Uiso 1 1 calc R . .
H23B H 0.0829 0.1306 0.0096 0.189 Uiso 1 1 calc R . .
H23C H 0.0434 0.1783 -0.0607 0.189 Uiso 1 1 calc R . .
C24 C 0.0987(4) 0.2669(8) -0.0745(6) 0.126(3) Uani 1 1 d . . .
H24A H 0.0976 0.3117 -0.0500 0.189 Uiso 1 1 calc R . .
H24B H 0.0678 0.2601 -0.1211 0.189 Uiso 1 1 calc R . .
H24C H 0.1227 0.2761 -0.0812 0.189 Uiso 1 1 calc R . .
F1 F 0.0555(2) 0.3259(6) 0.2960(5) 0.175(3) Uani 1 1 d . . .
F2 F -0.0050(4) 0.3928(6) 0.2004(5) 0.194(4) Uani 1 1 d . . .
F3 F -0.0023(4) 0.2611(7) 0.2021(6) 0.233(5) Uani 1 1 d . . .
F4 F 0.0550(3) 0.0909(7) 0.8100(5) 0.204(4) Uani 1 1 d . . .
F5 F 0.0000 -0.0024(8) 0.7500 0.216(7) Uani 1 2 d S . .
F6 F -0.0080(5) 0.0880(9) 0.8069(7) 0.251(6) Uani 1 1 d . . .
F8 F 0.0000 0.1790(9) 0.7500 0.279(11) Uani 1 2 d S . .
O1 O 0.1388(2) -0.2144(3) 0.2000(3) 0.0725(14) Uani 1 1 d . . .
O2 O 0.0962(6) -0.1511(7) 0.0871(7) 0.057(4) Uani 0.50 1 d PDU A 1
O3 O 0.4006(5) -0.0684(9) 0.4116(6) 0.079(3) Uani 0.50 1 d PDU B 1
O4 O 0.3650(5) 0.0599(9) 0.4216(7) 0.079(3) Uani 0.50 1 d PDU C 1
O2' O 0.1035(6) -0.1121(11) 0.0904(9) 0.086(5) Uani 0.50 1 d PDU D 2
O3' O 0.3900(5) -0.1006(7) 0.3933(8) 0.074(3) Uani 0.50 1 d PU E 2
O4' O 0.3824(5) 0.0335(7) 0.4361(8) 0.074(3) Uani 0.50 1 d PDU F 2
O5 O 0.1940(2) 0.2793(3) 0.3273(3) 0.0852(16) Uani 1 1 d . . .
O6 O 0.15769(17) 0.1374(3) 0.3100(3) 0.0676(13) Uani 1 1 d . . .
O7 O 0.20645(18) 0.1440(3) 0.0069(2) 0.0593(12) Uani 1 1 d . . .
O8 O 0.15858(17) 0.2063(3) 0.0387(2) 0.0612(12) Uani 1 1 d . . .
P1 P 0.14641(7) -0.14039(11) 0.16797(10) 0.0532(4) Uani 1 1 d . . .
P2 P 0.35342(7) -0.02787(13) 0.37880(11) 0.0618(5) Uani 1 1 d U . .
P3 P 0.18866(7) 0.19101(10) 0.29876(10) 0.0527(4) Uani 1 1 d . . .
P4 P 0.20120(7) 0.14757(10) 0.06929(9) 0.0505(4) Uani 1 1 d . . .
P5 P 0.0000 0.3239(2) 0.2500 0.0889(10) Uani 1 2 d S . .
P6 P 0.0000 0.0891(3) 0.7500 0.1289(17) Uani 1 2 d S . .
S1 S 0.15004(7) -0.04082(10) 0.21901(11) 0.0569(4) Uani 1 1 d . A .
S2 S 0.20189(7) -0.17102(11) 0.16923(10) 0.0605(5) Uani 1 1 d . . .
S3 S 0.31077(7) -0.09082(10) 0.39108(10) 0.0591(4) Uani 1 1 d . . .
S4 S 0.32552(7) 0.01888(13) 0.28077(12) 0.0704(5) Uani 1 1 d . B .
S5 S 0.25358(6) 0.13679(10) 0.35750(9) 0.0540(4) Uani 1 1 d . . .
S6 S 0.15733(7) 0.21139(11) 0.19399(10) 0.0604(4) Uani 1 1 d . . .
S7 S 0.26007(7) 0.19620(11) 0.15773(10) 0.0574(4) Uani 1 1 d . . .
S8 S 0.18256(7) 0.03685(11) 0.07833(10) 0.0612(5) Uani 1 1 d . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 S8 2.4927(19) . ?
Ag1 S6 2.5017(19) . ?
Ag1 S1 2.5207(18) . ?
Ag1 Ag4 3.1146(9) . ?
Ag1 Ag2 3.1348(8) . ?
Ag1 Ag3 3.2015(9) . ?
Ag2 S1 2.481(2) . ?
Ag2 S3 2.486(2) . ?
Ag2 S5 2.5588(18) . ?
Ag2 Ag4 3.1013(8) . ?
Ag2 Ag3 3.2523(8) . ?
Ag3 S5 2.5212(18) . ?
Ag3 S7 2.5726(18) . ?
Ag3 S4 2.591(2) . ?
Ag3 Ag5 3.0694(9) . ?
Ag3 Ag4 3.2906(10) . ?
Ag4 S4 2.442(2) . ?
Ag4 S2 2.516(2) . ?
Ag4 S8 2.581(2) . ?
Ag5 S3 2.5436(19) 4 ?
Ag5 S6 2.582(2) . ?
Ag5 S2 2.637(2) 4 ?
Ag5 S7 2.6493(19) . ?
C1 C2 1.449(15) . ?
C1 O1 1.490(10) . ?
C1 C3 1.504(15) . ?
C4 O2 1.434(9) . ?
C4 C6 1.534(10) . ?
C4 C5 1.549(10) . ?
C7 O3 1.414(10) . ?
C7 C8 1.526(10) . ?
C7 C9 1.537(10) . ?
C10 O4 1.431(10) . ?
C10 C11 1.538(10) . ?
C10 C12 1.542(10) . ?
C4' O2' 1.420(10) . ?
C4' C6' 1.533(10) . ?
C4' C5' 1.535(10) . ?
C7' O3' 1.29(2) . ?
C7' C9' 1.535(10) . ?
C7' C8' 1.536(10) . ?
C10' O4' 1.411(9) . ?
C10' C11' 1.520(10) . ?
C10' C12' 1.533(10) . ?
C13 O5 1.425(10) . ?
C13 C14 1.433(13) . ?
C13 C15 1.512(16) . ?
C16 C18 1.475(13) . ?
C16 C17 1.488(12) . ?
C16 O6 1.499(8) . ?
C19 O7 1.444(9) . ?
C19 C21 1.460(14) . ?
C19 C20 1.470(14) . ?
C22 O8 1.458(9) . ?
C22 C24 1.462(13) . ?
C22 C23 1.512(13) . ?
F1 P5 1.546(7) . ?
F2 P5 1.565(9) . ?
F3 P5 1.499(8) . ?
F4 P6 1.538(8) . ?
F5 P6 1.536(14) . ?
F6 P6 1.514(12) . ?
F8 P6 1.507(15) . ?
O1 P1 1.553(5) . ?
O2 P1 1.615(14) . ?
O3 P2 1.495(13) . ?
O4 P2 1.683(15) . ?
O2' P1 1.554(18) . ?
O3' P2 1.649(15) . ?
O4' P2 1.487(12) . ?
O5 P3 1.587(6) . ?
O6 P3 1.554(5) . ?
O7 P4 1.574(4) . ?
O8 P4 1.553(5) . ?
P1 S2 2.000(3) . ?
P1 S1 2.009(2) . ?
P2 S3 1.993(3) . ?
P2 S4 2.010(3) . ?
P3 S6 1.996(3) . ?
P3 S5 2.017(2) . ?
P4 S7 1.988(3) . ?
P4 S8 2.024(2) . ?
P5 F3 1.499(8) 2 ?
P5 F1 1.546(7) 2 ?
P5 F2 1.565(9) 2 ?
P6 F6 1.514(12) 2_556 ?
P6 F4 1.538(8) 2_556 ?
S2 Ag5 2.637(2) 4_545 ?
S3 Ag5 2.5437(19) 4_545 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
S8 Ag1 S6 124.67(6) . . ?
S8 Ag1 S1 117.43(6) . . ?
S6 Ag1 S1 117.82(6) . . ?
S8 Ag1 Ag4 53.44(5) . . ?
S6 Ag1 Ag4 138.38(5) . . ?
S1 Ag1 Ag4 82.35(4) . . ?
S8 Ag1 Ag2 112.93(5) . . ?
S6 Ag1 Ag2 103.65(5) . . ?
S1 Ag1 Ag2 50.63(5) . . ?
Ag4 Ag1 Ag2 59.504(19) . . ?
S8 Ag1 Ag3 86.49(5) . . ?
S6 Ag1 Ag3 75.68(5) . . ?
S1 Ag1 Ag3 112.38(5) . . ?
Ag4 Ag1 Ag3 62.78(2) . . ?
Ag2 Ag1 Ag3 61.755(19) . . ?
S1 Ag2 S3 133.62(6) . . ?
S1 Ag2 S5 115.16(6) . . ?
S3 Ag2 S5 111.09(6) . . ?
S1 Ag2 Ag4 83.25(4) . . ?
S3 Ag2 Ag4 82.92(5) . . ?
S5 Ag2 Ag4 111.81(4) . . ?
S1 Ag2 Ag1 51.76(4) . . ?
S3 Ag2 Ag1 142.54(5) . . ?
S5 Ag2 Ag1 81.27(4) . . ?
Ag4 Ag2 Ag1 59.92(2) . . ?
S1 Ag2 Ag3 111.89(5) . . ?
S3 Ag2 Ag3 100.06(5) . . ?
S5 Ag2 Ag3 49.69(4) . . ?
Ag4 Ag2 Ag3 62.33(2) . . ?
Ag1 Ag2 Ag3 60.132(19) . . ?
S5 Ag3 S7 148.34(6) . . ?
S5 Ag3 S4 117.30(6) . . ?
S7 Ag3 S4 93.97(6) . . ?
S5 Ag3 Ag5 93.83(4) . . ?
S7 Ag3 Ag5 55.17(4) . . ?
S4 Ag3 Ag5 148.86(5) . . ?
S5 Ag3 Ag1 80.49(4) . . ?
S7 Ag3 Ag1 87.29(4) . . ?
S4 Ag3 Ag1 104.53(5) . . ?
Ag5 Ag3 Ag1 80.37(2) . . ?
S5 Ag3 Ag2 50.70(4) . . ?
S7 Ag3 Ag2 140.54(5) . . ?
S4 Ag3 Ag2 78.82(5) . . ?
Ag5 Ag3 Ag2 126.61(3) . . ?
Ag1 Ag3 Ag2 58.113(18) . . ?
S5 Ag3 Ag4 107.10(4) . . ?
S7 Ag3 Ag4 90.07(4) . . ?
S4 Ag3 Ag4 47.23(5) . . ?
Ag5 Ag3 Ag4 127.23(3) . . ?
Ag1 Ag3 Ag4 57.318(19) . . ?
Ag2 Ag3 Ag4 56.584(18) . . ?
S4 Ag4 S2 141.45(7) . . ?
S4 Ag4 S8 117.50(7) . . ?
S2 Ag4 S8 100.42(6) . . ?
S4 Ag4 Ag2 84.10(5) . . ?
S2 Ag4 Ag2 88.58(5) . . ?
S8 Ag4 Ag2 111.42(5) . . ?
S4 Ag4 Ag1 111.04(6) . . ?
S2 Ag4 Ag1 97.73(5) . . ?
S8 Ag4 Ag1 50.86(5) . . ?
Ag2 Ag4 Ag1 60.572(18) . . ?
S4 Ag4 Ag3 51.17(5) . . ?
S2 Ag4 Ag3 148.03(5) . . ?
S8 Ag4 Ag3 83.22(4) . . ?
Ag2 Ag4 Ag3 61.086(19) . . ?
Ag1 Ag4 Ag3 59.903(19) . . ?
S3 Ag5 S6 116.20(6) 4 . ?
S3 Ag5 S2 113.88(6) 4 4 ?
S6 Ag5 S2 113.93(6) . 4 ?
S3 Ag5 S7 104.15(6) 4 . ?
S6 Ag5 S7 106.49(6) . . ?
S2 Ag5 S7 99.92(6) 4 . ?
S3 Ag5 Ag3 156.92(5) 4 . ?
S6 Ag5 Ag3 77.09(4) . . ?
S2 Ag5 Ag3 73.14(5) 4 . ?
S7 Ag5 Ag3 52.85(4) . . ?
C2 C1 O1 107.1(8) . . ?
C2 C1 C3 113.3(10) . . ?
O1 C1 C3 105.5(9) . . ?
O2 C4 C6 103.1(14) . . ?
O2 C4 C5 100.6(17) . . ?
C6 C4 C5 126.7(18) . . ?
O3 C7 C8 119.3(16) . . ?
O3 C7 C9 98.8(16) . . ?
C8 C7 C9 115(2) . . ?
O4 C10 C11 116.8(18) . . ?
O4 C10 C12 98.9(17) . . ?
C11 C10 C12 109.8(18) . . ?
O2' C4' C6' 106.9(17) . . ?
O2' C4' C5' 109(2) . . ?
C6' C4' C5' 87(2) . . ?
O3' C7' C9' 107(2) . . ?
O3' C7' C8' 141(3) . . ?
C9' C7' C8' 103.9(19) . . ?
O4' C10' C11' 124.1(17) . . ?
O4' C10' C12' 112.9(18) . . ?
C11' C10' C12' 119.2(19) . . ?
O5 C13 C14 113.4(8) . . ?
O5 C13 C15 104.3(10) . . ?
C14 C13 C15 110.5(10) . . ?
C18 C16 C17 114.1(9) . . ?
C18 C16 O6 109.3(7) . . ?
C17 C16 O6 105.8(7) . . ?
O7 C19 C21 108.1(9) . . ?
O7 C19 C20 108.4(7) . . ?
C21 C19 C20 110.1(8) . . ?
O8 C22 C24 108.2(8) . . ?
O8 C22 C23 108.0(7) . . ?
C24 C22 C23 111.4(8) . . ?
C1 O1 P1 121.0(5) . . ?
C4 O2 P1 121.2(11) . . ?
C7 O3 P2 141.4(14) . . ?
C10 O4 P2 118.7(12) . . ?
C4' O2' P1 126.6(19) . . ?
C7' O3' P2 122.3(13) . . ?
C10' O4' P2 148.8(12) . . ?
C13 O5 P3 126.0(6) . . ?
C16 O6 P3 124.5(5) . . ?
C19 O7 P4 122.4(5) . . ?
C22 O8 P4 123.4(5) . . ?
O1 P1 O2' 118.2(7) . . ?
O1 P1 O2 94.8(5) . . ?
O2' P1 O2 25.0(6) . . ?
O1 P1 S2 104.0(2) . . ?
O2' P1 S2 109.7(7) . . ?
O2 P1 S2 110.2(7) . . ?
O1 P1 S1 110.3(2) . . ?
O2' P1 S1 95.6(6) . . ?
O2 P1 S1 114.1(6) . . ?
S2 P1 S1 119.91(12) . . ?
O4' P2 O3 85.6(7) . . ?
O4' P2 O3' 108.1(6) . . ?
O3 P2 O3' 23.0(6) . . ?
O4' P2 O4 22.9(6) . . ?
O3 P2 O4 107.9(6) . . ?
O3' P2 O4 130.7(6) . . ?
O4' P2 S3 113.5(5) . . ?
O3 P2 S3 112.4(6) . . ?
O3' P2 S3 98.0(4) . . ?
O4 P2 S3 107.9(5) . . ?
O4' P2 S4 109.7(5) . . ?
O3 P2 S4 111.8(5) . . ?
O3' P2 S4 107.2(5) . . ?
O4 P2 S4 95.9(4) . . ?
S3 P2 S4 119.03(12) . . ?
O6 P3 O5 112.6(3) . . ?
O6 P3 S6 112.8(2) . . ?
O5 P3 S6 100.8(2) . . ?
O6 P3 S5 104.0(2) . . ?
O5 P3 S5 110.1(2) . . ?
S6 P3 S5 116.79(11) . . ?
O8 P4 O7 103.2(3) . . ?
O8 P4 S7 108.1(2) . . ?
O7 P4 S7 109.6(2) . . ?
O8 P4 S8 110.3(2) . . ?
O7 P4 S8 106.86(19) . . ?
S7 P4 S8 117.79(11) . . ?
F3 P5 F3 90.8(11) . 2 ?
F3 P5 F1 89.9(5) . . ?
F3 P5 F1 91.8(5) 2 . ?
F3 P5 F1 91.8(5) . 2 ?
F3 P5 F1 89.9(5) 2 2 ?
F1 P5 F1 177.5(7) . 2 ?
F3 P5 F2 175.8(7) . 2 ?
F3 P5 F2 92.3(6) 2 2 ?
F1 P5 F2 87.1(5) . 2 ?
F1 P5 F2 91.0(5) 2 2 ?
F3 P5 F2 92.3(6) . . ?
F3 P5 F2 175.8(7) 2 . ?
F1 P5 F2 91.0(5) . . ?
F1 P5 F2 87.1(5) 2 . ?
F2 P5 F2 84.8(9) 2 . ?
F8 P6 F6 90.7(6) . 2_556 ?
F8 P6 F6 90.7(6) . . ?
F6 P6 F6 178.5(13) 2_556 . ?
F8 P6 F5 180.000(6) . . ?
F6 P6 F5 89.3(6) 2_556 . ?
F6 P6 F5 89.3(6) . . ?
F8 P6 F4 88.9(5) . 2_556 ?
F6 P6 F4 90.6(6) 2_556 2_556 ?
F6 P6 F4 89.4(6) . 2_556 ?
F5 P6 F4 91.1(5) . 2_556 ?
F8 P6 F4 88.9(5) . . ?
F6 P6 F4 89.4(6) 2_556 . ?
F6 P6 F4 90.6(6) . . ?
F5 P6 F4 91.1(5) . . ?
F4 P6 F4 177.7(9) 2_556 . ?
P1 S1 Ag2 108.66(9) . . ?
P1 S1 Ag1 106.32(9) . . ?
Ag2 S1 Ag1 77.61(5) . . ?
P1 S2 Ag4 103.41(9) . . ?
P1 S2 Ag5 111.38(9) . 4_545 ?
Ag4 S2 Ag5 82.80(6) . 4_545 ?
P2 S3 Ag2 99.89(9) . . ?
P2 S3 Ag5 106.18(9) . 4_545 ?
Ag2 S3 Ag5 96.09(7) . 4_545 ?
P2 S4 Ag4 106.17(10) . . ?
P2 S4 Ag3 102.96(10) . . ?
Ag4 S4 Ag3 81.60(6) . . ?
P3 S5 Ag3 102.50(9) . . ?
P3 S5 Ag2 105.45(9) . . ?
Ag3 S5 Ag2 79.61(5) . . ?
P3 S6 Ag1 96.25(8) . . ?
P3 S6 Ag5 103.46(9) . . ?
Ag1 S6 Ag5 105.52(7) . . ?
P4 S7 Ag3 108.74(9) . . ?
P4 S7 Ag5 100.66(9) . . ?
Ag3 S7 Ag5 71.98(5) . . ?
P4 S8 Ag1 96.88(8) . . ?
P4 S8 Ag4 116.95(10) . . ?
Ag1 S8 Ag4 75.71(5) . . ?

_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         1.097
_refine_diff_density_min         -0.760
_refine_diff_density_rms         0.135
_database_code_depnum_ccdc_archive 'CCDC 977326'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_2

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C36 H84 Ag8 F7 O12 P7 S12'
_chemical_formula_weight         2306.50

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   C2/c

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

_cell_length_a                   24.1642(10)
_cell_length_b                   13.1505(6)
_cell_length_c                   24.9918(11)
_cell_angle_alpha                90.00
_cell_angle_beta                 92.3660(10)
_cell_angle_gamma                90.00
_cell_volume                     7934.9(6)
_cell_formula_units_Z            4
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9984
_cell_measurement_theta_min      2.30
_cell_measurement_theta_max      26.35

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.19
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.931
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             4528
_exptl_absorpt_coefficient_mu    2.447
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5686
_exptl_absorpt_correction_T_max  0.6535
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            24740
_diffrn_reflns_av_R_equivalents  0.0276
_diffrn_reflns_av_sigmaI/netI    0.0279
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_h_max       30
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         1.63
_diffrn_reflns_theta_max         26.42
_reflns_number_total             8147
_reflns_number_gt                6485
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

The isopropoxyl groups that contain O2 and O5 were split into two groups, 
and each is half occupied. Attempts to split the isopropoxyl group that 
contains O1 into two groups still result in large ADPs. Appropriated model 
for this disorder was not found. Thus, this isopropoxyl group of disorder 
were modelled best large ADPs on single sites and it could be attributed 
to the dynamic disorder at ambient temperature (296 K). PF6 anion was 
split into two groups and each is half occupied. 

The used restraints are:

EADP C5 C6
EADP C5' C6'
EADP F2 F3 F4
EADP F2' F3' F4'
DFIX 1.62 0.01 P1 O2'
DFIX 1.54 0.01 C4 C5  C4' C5'  C4' C6'  C4 C6  C1 C2
DFIX 1.43 0.01 O2' C4'  O2 C4  O5' C13'
DFIX 1.57 0.01 P4 F4'  P4 F2  P4 F3
DELU C1 C3
DELU C1 C2
DELU C4 C5
DELU C4 C6
DELU C4' C5'
DELU C4' C6'
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0386P)²+19.5186P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       0.00055(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         8147
_refine_ls_number_parameters     450
_refine_ls_number_restraints     18
_refine_ls_R_factor_all          0.0461
_refine_ls_R_factor_gt           0.0338
_refine_ls_wR_factor_ref         0.0907
_refine_ls_wR_factor_gt          0.0834
_refine_ls_goodness_of_fit_ref   1.015
_refine_ls_restrained_S_all      1.018
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.151193(15) 0.28156(3) 0.451668(13) 0.06711(12) Uani 1 1 d . . .
Ag2 Ag 0.231273(14) 0.45862(3) 0.490112(14) 0.06829(12) Uani 1 1 d . . .
Ag3 Ag 0.327728(15) 0.33897(3) 0.439214(14) 0.06613(11) Uani 1 1 d . . .
Ag4 Ag 0.253135(15) 0.33953(3) 0.598501(16) 0.06932(12) Uani 1 1 d . . .
C1 C 0.2862(3) 0.5350(7) 0.2937(4) 0.152(4) Uani 1 1 d DU . .
H1 H 0.2984 0.4696 0.2795 0.182 Uiso 1 1 calc R . .
C2 C 0.3331(5) 0.5865(10) 0.3264(4) 0.233(7) Uani 1 1 d DU . .
H2A H 0.3223 0.6546 0.3351 0.350 Uiso 1 1 calc R . .
H2B H 0.3657 0.5884 0.3058 0.350 Uiso 1 1 calc R . .
H2C H 0.3406 0.5488 0.3588 0.350 Uiso 1 1 calc R . .
C3 C 0.2676(5) 0.6018(10) 0.2510(5) 0.227(7) Uani 1 1 d U . .
H3A H 0.2340 0.5757 0.2345 0.340 Uiso 1 1 calc R . .
H3B H 0.2955 0.6060 0.2248 0.340 Uiso 1 1 calc R . .
H3C H 0.2610 0.6683 0.2652 0.340 Uiso 1 1 calc R . .
C4 C 0.1510(8) 0.3465(10) 0.2767(6) 0.119(5) Uani 0.50 1 d PDU A 1
H4 H 0.1675 0.2821 0.2891 0.143 Uiso 0.50 1 calc PR A 1
C5 C 0.0898(8) 0.359(2) 0.2891(8) 0.154(6) Uani 0.50 1 d PDU A 1
H5A H 0.0849 0.3455 0.3263 0.231 Uiso 0.50 1 calc PR A 1
H5B H 0.0679 0.3126 0.2676 0.231 Uiso 0.50 1 calc PR A 1
H5C H 0.0784 0.4276 0.2810 0.231 Uiso 0.50 1 calc PR A 1
C6 C 0.1523(8) 0.364(2) 0.2156(5) 0.154(6) Uani 0.50 1 d PDU A 1
H6A H 0.1400 0.4312 0.2072 0.231 Uiso 0.50 1 calc PR A 1
H6B H 0.1284 0.3152 0.1975 0.231 Uiso 0.50 1 calc PR A 1
H6C H 0.1895 0.3547 0.2042 0.231 Uiso 0.50 1 calc PR A 1
C4' C 0.1270(4) 0.3878(10) 0.2808(5) 0.091(4) Uani 0.50 1 d PDU B 2
H4' H 0.1188 0.4537 0.2970 0.109 Uiso 0.50 1 calc PR B 2
C5' C 0.0848(8) 0.3074(16) 0.2957(9) 0.147(6) Uani 0.50 1 d PDU B 2
H5D H 0.0917 0.2457 0.2765 0.221 Uiso 0.50 1 calc PR B 2
H5E H 0.0482 0.3313 0.2864 0.221 Uiso 0.50 1 calc PR B 2
H5F H 0.0881 0.2945 0.3335 0.221 Uiso 0.50 1 calc PR B 2
C6' C 0.1241(7) 0.394(2) 0.2196(5) 0.147(6) Uani 0.50 1 d PDU B 2
H6D H 0.1544 0.4341 0.2077 0.221 Uiso 0.50 1 calc PR B 2
H6E H 0.0897 0.4251 0.2078 0.221 Uiso 0.50 1 calc PR B 2
H6F H 0.1262 0.3268 0.2048 0.221 Uiso 0.50 1 calc PR B 2
C7 C 0.0641(3) 0.5944(5) 0.5640(3) 0.119(2) Uani 1 1 d . . .
H7 H 0.0931 0.6135 0.5907 0.143 Uiso 1 1 calc R . .
C8 C 0.0714(5) 0.6503(7) 0.5141(5) 0.185(5) Uani 1 1 d . . .
H8A H 0.1085 0.6410 0.5028 0.278 Uiso 1 1 calc R . .
H8B H 0.0647 0.7213 0.5199 0.278 Uiso 1 1 calc R . .
H8C H 0.0457 0.6252 0.4869 0.278 Uiso 1 1 calc R . .
C9 C 0.0074(4) 0.6099(7) 0.5867(4) 0.184(5) Uani 1 1 d . . .
H9A H -0.0207 0.6008 0.5587 0.277 Uiso 1 1 calc R . .
H9B H 0.0050 0.6775 0.6009 0.277 Uiso 1 1 calc R . .
H9C H 0.0020 0.5614 0.6146 0.277 Uiso 1 1 calc R . .
C10 C 0.0693(3) 0.3183(5) 0.6633(2) 0.0940(19) Uani 1 1 d . . .
H10 H 0.0713 0.2552 0.6426 0.113 Uiso 1 1 calc R . .
C11 C 0.0945(3) 0.3016(7) 0.7174(3) 0.131(3) Uani 1 1 d . . .
H11A H 0.1082 0.3650 0.7316 0.197 Uiso 1 1 calc R . .
H11B H 0.1245 0.2541 0.7154 0.197 Uiso 1 1 calc R . .
H11C H 0.0671 0.2748 0.7404 0.197 Uiso 1 1 calc R . .
C12 C 0.0115(3) 0.3518(7) 0.6642(3) 0.146(3) Uani 1 1 d . . .
H12A H 0.0095 0.4146 0.6836 0.218 Uiso 1 1 calc R . .
H12B H -0.0101 0.3010 0.6815 0.218 Uiso 1 1 calc R . .
H12C H -0.0029 0.3616 0.6282 0.218 Uiso 1 1 calc R . .
C13 C 0.3186(4) 0.6419(9) 0.6112(5) 0.090(3) Uani 0.60 1 d P C 1
H13 H 0.2910 0.5873 0.6107 0.109 Uiso 0.60 1 calc PR C 1
C14 C 0.2936(17) 0.735(3) 0.5819(19) 0.23(2) Uani 0.60 1 d P C 1
H14A H 0.2610 0.7563 0.5994 0.343 Uiso 0.60 1 calc PR C 1
H14B H 0.2839 0.7167 0.5454 0.343 Uiso 0.60 1 calc PR C 1
H14C H 0.3201 0.7889 0.5825 0.343 Uiso 0.60 1 calc PR C 1
C15 C 0.3351(8) 0.6639(16) 0.6663(6) 0.185(9) Uani 0.60 1 d P C 1
H15A H 0.3490 0.6032 0.6833 0.277 Uiso 0.60 1 calc PR C 1
H15B H 0.3037 0.6883 0.6848 0.277 Uiso 0.60 1 calc PR C 1
H15C H 0.3635 0.7150 0.6673 0.277 Uiso 0.60 1 calc PR C 1
C13' C 0.3413(8) 0.6869(8) 0.5841(6) 0.086(4) Uani 0.40 1 d PD D 2
H13' H 0.3654 0.7037 0.5548 0.103 Uiso 0.40 1 calc PR D 2
C14' C 0.2866(13) 0.718(3) 0.5716(19) 0.103(9) Uani 0.40 1 d P D 2
H14D H 0.2747 0.6915 0.5373 0.155 Uiso 0.40 1 calc PR D 2
H14E H 0.2851 0.7912 0.5706 0.155 Uiso 0.40 1 calc PR D 2
H14F H 0.2626 0.6936 0.5984 0.155 Uiso 0.40 1 calc PR D 2
C15' C 0.3630(9) 0.7360(14) 0.6360(9) 0.123(7) Uani 0.40 1 d P D 2
H15D H 0.3416 0.7126 0.6651 0.184 Uiso 0.40 1 calc PR D 2
H15E H 0.3598 0.8086 0.6331 0.184 Uiso 0.40 1 calc PR D 2
H15F H 0.4011 0.7178 0.6425 0.184 Uiso 0.40 1 calc PR D 2
C16 C 0.47355(19) 0.4976(4) 0.5873(2) 0.0701(12) Uani 1 1 d . . .
H16 H 0.4564 0.4964 0.6221 0.084 Uiso 1 1 calc R . .
C17 C 0.5091(2) 0.5893(5) 0.5829(3) 0.0964(18) Uani 1 1 d . . .
H17A H 0.5258 0.5897 0.5487 0.145 Uiso 1 1 calc R . .
H17B H 0.5376 0.5882 0.6108 0.145 Uiso 1 1 calc R . .
H17C H 0.4869 0.6493 0.5864 0.145 Uiso 1 1 calc R . .
C18 C 0.5042(2) 0.4008(5) 0.5787(3) 0.0977(18) Uani 1 1 d . . .
H18A H 0.4786 0.3449 0.5779 0.147 Uiso 1 1 calc R . .
H18B H 0.5313 0.3911 0.6075 0.147 Uiso 1 1 calc R . .
H18C H 0.5224 0.4042 0.5454 0.147 Uiso 1 1 calc R . .
F1 F 0.2500 0.2500 0.5000 0.0524(7) Uani 1 2 d S . .
F2 F 0.4858(7) 0.5919(10) 0.7116(6) 0.192(4) Uani 0.50 1 d PD E 1
F3 F 0.4436(5) 0.4511(12) 0.7219(5) 0.192(4) Uani 0.50 1 d PD E 1
F4 F 0.4725(6) 0.4372(14) 0.7887(6) 0.192(4) Uani 0.50 1 d P E 1
F2' F 0.5479(7) 0.5422(15) 0.7080(5) 0.236(5) Uani 0.50 1 d P E 2
F3' F 0.4599(8) 0.5588(17) 0.7175(6) 0.236(5) Uani 0.50 1 d P E 2
F4' F 0.4992(9) 0.4067(12) 0.7910(6) 0.236(5) Uani 0.50 1 d PD E 2
O2 O 0.1797(3) 0.4343(7) 0.2956(3) 0.092(2) Uani 0.50 1 d PD A 1
O2' O 0.1793(2) 0.3483(5) 0.3011(2) 0.0589(17) Uani 0.50 1 d PD B 2
O1 O 0.24128(19) 0.5206(4) 0.3304(2) 0.139(2) Uani 1 1 d . A .
O3 O 0.06844(15) 0.4879(3) 0.55134(19) 0.0992(13) Uani 1 1 d . . .
O4 O 0.10151(17) 0.3987(3) 0.63690(14) 0.0931(12) Uani 1 1 d . . .
O5 O 0.3672(3) 0.6066(6) 0.5824(3) 0.0564(19) Uani 0.50 1 d P C 1
O5' O 0.3422(4) 0.5807(6) 0.5941(3) 0.077(2) Uani 0.50 1 d PD D 2
O6 O 0.43024(12) 0.5040(3) 0.54342(12) 0.0673(8) Uani 1 1 d . C .
P1 P 0.21641(5) 0.41575(12) 0.34537(4) 0.0746(4) Uani 1 1 d D . .
P2 P 0.11261(4) 0.41343(8) 0.57634(4) 0.0540(3) Uani 1 1 d . . .
P3 P 0.36745(4) 0.49824(8) 0.55477(4) 0.0512(2) Uani 1 1 d . . .
P4 P 0.5000 0.4987(3) 0.7500 0.1778(19) Uani 1 2 d SD . .
S1 S 0.16942(5) 0.44889(9) 0.40747(4) 0.0592(3) Uani 1 1 d . A .
S2 S 0.27676(5) 0.31300(9) 0.35099(4) 0.0599(3) Uani 1 1 d . . .
S3 S 0.14632(4) 0.12083(9) 0.39747(4) 0.0592(3) Uani 1 1 d . . .
S4 S 0.18724(4) 0.48093(8) 0.57848(4) 0.0573(3) Uani 1 1 d . . .
S5 S 0.32999(4) 0.51074(8) 0.48187(4) 0.0533(2) Uani 1 1 d . C .
S6 S 0.40264(4) 0.21457(8) 0.46438(4) 0.0525(2) Uani 1 1 d . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 S1 2.5094(11) . ?
Ag1 S3 2.5106(12) . ?
Ag1 S6 2.5143(10) 7_556 ?
Ag1 Ag4 3.1131(5) 7_556 ?
Ag1 Ag2 3.1521(5) . ?
Ag1 Ag3 3.1770(5) 7_556 ?
Ag2 S5 2.4986(11) . ?
Ag2 S1 2.5023(12) . ?
Ag2 S4 2.5080(11) . ?
Ag2 Ag3 3.1259(5) . ?
Ag2 Ag4 3.1546(5) . ?
Ag3 S5 2.4974(11) . ?
Ag3 S6 2.5010(11) . ?
Ag3 S2 2.5041(11) . ?
Ag3 Ag4 3.1725(5) 7_556 ?
Ag3 Ag1 3.1771(5) 7_556 ?
Ag4 S3 2.4828(11) 7_556 ?
Ag4 S4 2.4855(12) . ?
Ag4 S2 2.4927(11) 7_556 ?
Ag4 Ag1 3.1131(5) 7_556 ?
Ag4 Ag3 3.1725(5) 7_556 ?
C1 C3 1.441(11) . ?
C1 O1 1.461(7) . ?
C1 C2 1.526(9) . ?
C1 H1 0.9800 . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C4 O2 1.417(9) . ?
C4 C5 1.532(10) . ?
C4 C6 1.545(10) . ?
C4 H4 0.9800 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C4' O2' 1.439(8) . ?
C4' C5' 1.525(9) . ?
C4' C6' 1.532(9) . ?
C4' H4' 0.9800 . ?
C5' H5D 0.9600 . ?
C5' H5E 0.9600 . ?
C5' H5F 0.9600 . ?
C6' H6D 0.9600 . ?
C6' H6E 0.9600 . ?
C6' H6F 0.9600 . ?
C7 O3 1.440(8) . ?
C7 C8 1.465(12) . ?
C7 C9 1.518(11) . ?
C7 H7 0.9800 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C10 C12 1.465(10) . ?
C10 C11 1.478(10) . ?
C10 O4 1.483(6) . ?
C10 H10 0.9800 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C15 1.447(17) . ?
C13 O5 1.477(11) . ?
C13 C14 1.53(4) . ?
C13 H13 0.9800 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C13' C14' 1.41(4) . ?
C13' O5' 1.419(9) . ?
C13' C15' 1.52(2) . ?
C13' H13' 0.9800 . ?
C14' H14D 0.9600 . ?
C14' H14E 0.9600 . ?
C14' H14F 0.9600 . ?
C15' H15D 0.9600 . ?
C15' H15E 0.9600 . ?
C15' H15F 0.9600 . ?
C16 O6 1.486(5) . ?
C16 C17 1.488(7) . ?
C16 C18 1.491(8) . ?
C16 H16 0.9800 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
F2 P4 1.586(9) . ?
F3 P4 1.632(8) . ?
F4 P4 1.443(14) . ?
F2' P4 1.694(18) . ?
F3' P4 1.469(15) . ?
F4' P4 1.586(9) . ?
O2 P1 1.517(7) . ?
O2' P1 1.653(6) . ?
O1 P1 1.556(5) . ?
O3 P2 1.560(4) . ?
O4 P2 1.560(3) . ?
O5 P3 1.584(7) . ?
O5' P3 1.601(8) . ?
O6 P3 1.557(3) . ?
P1 S2 1.9888(18) . ?
P1 S1 2.0082(16) . ?
P2 S6 1.9935(15) 7_556 ?
P2 S4 2.0087(15) . ?
P3 S3 2.0050(15) 7_556 ?
P3 S5 2.0074(15) . ?
P4 F4 1.443(14) 2_656 ?
P4 F3' 1.470(16) 2_656 ?
P4 F4' 1.586(9) 2_656 ?
P4 F2 1.586(9) 2_656 ?
P4 F3 1.632(8) 2_656 ?
P4 F2' 1.694(18) 2_656 ?
S2 Ag4 2.4927(11) 7_556 ?
S3 P3 2.0050(15) 7_556 ?
S3 Ag4 2.4828(11) 7_556 ?
S6 P2 1.9935(15) 7_556 ?
S6 Ag1 2.5144(10) 7_556 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
S1 Ag1 S3 120.39(4) . . ?
S1 Ag1 S6 117.12(4) . 7_556 ?
S3 Ag1 S6 116.93(4) . 7_556 ?
S1 Ag1 Ag4 97.15(3) . 7_556 ?
S3 Ag1 Ag4 51.03(3) . 7_556 ?
S6 Ag1 Ag4 139.89(3) 7_556 7_556 ?
S1 Ag1 Ag2 50.93(3) . . ?
S3 Ag1 Ag2 143.21(3) . . ?
S6 Ag1 Ag2 93.61(3) 7_556 . ?
Ag4 Ag1 Ag2 92.514(14) 7_556 . ?
S1 Ag1 Ag3 142.23(3) . 7_556 ?
S3 Ag1 Ag3 92.60(3) . 7_556 ?
S6 Ag1 Ag3 50.51(3) 7_556 7_556 ?
Ag4 Ag1 Ag3 89.721(14) 7_556 7_556 ?
Ag2 Ag1 Ag3 91.848(14) . 7_556 ?
S5 Ag2 S1 119.06(4) . . ?
S5 Ag2 S4 118.80(4) . . ?
S1 Ag2 S4 118.18(4) . . ?
S5 Ag2 Ag3 51.25(3) . . ?
S1 Ag2 Ag3 93.92(3) . . ?
S4 Ag2 Ag3 140.16(3) . . ?
S5 Ag2 Ag1 138.91(3) . . ?
S1 Ag2 Ag1 51.13(3) . . ?
S4 Ag2 Ag1 94.44(3) . . ?
Ag3 Ag2 Ag1 87.868(14) . . ?
S5 Ag2 Ag4 94.61(3) . . ?
S1 Ag2 Ag4 139.16(3) . . ?
S4 Ag2 Ag4 50.51(3) . . ?
Ag3 Ag2 Ag4 89.902(14) . . ?
Ag1 Ag2 Ag4 88.507(14) . . ?
S5 Ag3 S6 118.78(4) . . ?
S5 Ag3 S2 120.03(4) . . ?
S6 Ag3 S2 117.18(4) . . ?
S5 Ag3 Ag2 51.29(3) . . ?
S6 Ag3 Ag2 140.45(3) . . ?
S2 Ag3 Ag2 94.53(3) . . ?
S5 Ag3 Ag4 142.98(3) . 7_556 ?
S6 Ag3 Ag4 91.22(3) . 7_556 ?
S2 Ag3 Ag4 50.43(3) . 7_556 ?
Ag2 Ag3 Ag4 91.886(14) . 7_556 ?
S5 Ag3 Ag1 94.87(3) . 7_556 ?
S6 Ag3 Ag1 50.88(2) . 7_556 ?
S2 Ag3 Ag1 138.02(3) . 7_556 ?
Ag2 Ag3 Ag1 89.865(13) . 7_556 ?
Ag4 Ag3 Ag1 87.757(14) 7_556 7_556 ?
S3 Ag4 S4 117.96(4) 7_556 . ?
S3 Ag4 S2 116.87(4) 7_556 7_556 ?
S4 Ag4 S2 120.48(4) . 7_556 ?
S3 Ag4 Ag1 51.83(3) 7_556 7_556 ?
S4 Ag4 Ag1 141.43(3) . 7_556 ?
S2 Ag4 Ag1 91.60(3) 7_556 7_556 ?
S3 Ag4 Ag2 93.41(3) 7_556 . ?
S4 Ag4 Ag2 51.14(3) . . ?
S2 Ag4 Ag2 142.43(3) 7_556 . ?
Ag1 Ag4 Ag2 90.510(14) 7_556 . ?
S3 Ag4 Ag3 139.21(3) 7_556 7_556 ?
S4 Ag4 Ag3 96.44(3) . 7_556 ?
S2 Ag4 Ag3 50.75(3) 7_556 7_556 ?
Ag1 Ag4 Ag3 87.731(14) 7_556 7_556 ?
Ag2 Ag4 Ag3 91.887(14) . 7_556 ?
C3 C1 O1 109.0(7) . . ?
C3 C1 C2 109.1(9) . . ?
O1 C1 C2 106.1(8) . . ?
C3 C1 H1 110.8 . . ?
O1 C1 H1 110.8 . . ?
C2 C1 H1 110.8 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C3 H3A 109.5 . . ?
C1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
O2 C4 C5 107.8(14) . . ?
O2 C4 C6 100.4(11) . . ?
C5 C4 C6 104.0(17) . . ?
O2 C4 H4 114.4 . . ?
C5 C4 H4 114.4 . . ?
C6 C4 H4 114.4 . . ?
O2' C4' C5' 104.5(12) . . ?
O2' C4' C6' 112.0(10) . . ?
C5' C4' C6' 106.0(13) . . ?
O2' C4' H4' 111.3 . . ?
C5' C4' H4' 111.3 . . ?
C6' C4' H4' 111.3 . . ?
C4' C5' H5D 109.5 . . ?
C4' C5' H5E 109.5 . . ?
H5D C5' H5E 109.5 . . ?
C4' C5' H5F 109.5 . . ?
H5D C5' H5F 109.5 . . ?
H5E C5' H5F 109.5 . . ?
C4' C6' H6D 109.5 . . ?
C4' C6' H6E 109.5 . . ?
H6D C6' H6E 109.5 . . ?
C4' C6' H6F 109.5 . . ?
H6D C6' H6F 109.5 . . ?
H6E C6' H6F 109.5 . . ?
O3 C7 C8 106.8(7) . . ?
O3 C7 C9 106.8(7) . . ?
C8 C7 C9 113.1(7) . . ?
O3 C7 H7 110.0 . . ?
C8 C7 H7 110.0 . . ?
C9 C7 H7 110.0 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C12 C10 C11 112.8(5) . . ?
C12 C10 O4 108.2(6) . . ?
C11 C10 O4 108.0(5) . . ?
C12 C10 H10 109.3 . . ?
C11 C10 H10 109.3 . . ?
O4 C10 H10 109.3 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C15 C13 O5 109.4(11) . . ?
C15 C13 C14 112.5(18) . . ?
O5 C13 C14 109(2) . . ?
C15 C13 H13 108.7 . . ?
O5 C13 H13 108.7 . . ?
C14 C13 H13 108.7 . . ?
C14' C13' O5' 110(2) . . ?
C14' C13' C15' 111(2) . . ?
O5' C13' C15' 105.4(13) . . ?
C14' C13' H13' 110.4 . . ?
O5' C13' H13' 110.4 . . ?
C15' C13' H13' 110.4 . . ?
C13' C14' H14D 109.5 . . ?
C13' C14' H14E 109.5 . . ?
H14D C14' H14E 109.5 . . ?
C13' C14' H14F 109.5 . . ?
H14D C14' H14F 109.5 . . ?
H14E C14' H14F 109.5 . . ?
C13' C15' H15D 109.5 . . ?
C13' C15' H15E 109.5 . . ?
H15D C15' H15E 109.5 . . ?
C13' C15' H15F 109.5 . . ?
H15D C15' H15F 109.5 . . ?
H15E C15' H15F 109.5 . . ?
O6 C16 C17 106.9(4) . . ?
O6 C16 C18 106.4(4) . . ?
C17 C16 C18 112.9(5) . . ?
O6 C16 H16 110.2 . . ?
C17 C16 H16 110.2 . . ?
C18 C16 H16 110.2 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C4 O2 P1 113.8(11) . . ?
C4' O2' P1 119.1(6) . . ?
C1 O1 P1 124.8(5) . . ?
C7 O3 P2 125.2(4) . . ?
C10 O4 P2 129.3(3) . . ?
C13 O5 P3 120.8(7) . . ?
C13' O5' P3 124.2(10) . . ?
C16 O6 P3 121.7(3) . . ?
O2 P1 O1 83.0(4) . . ?
O2 P1 O2' 41.8(4) . . ?
O1 P1 O2' 121.2(3) . . ?
O2 P1 S2 124.7(3) . . ?
O1 P1 S2 109.25(16) . . ?
O2' P1 S2 93.4(2) . . ?
O2 P1 S1 105.6(3) . . ?
O1 P1 S1 103.3(2) . . ?
O2' P1 S1 109.0(2) . . ?
S2 P1 S1 121.95(7) . . ?
O3 P2 O4 108.9(3) . . ?
O3 P2 S6 102.50(16) . 7_556 ?
O4 P2 S6 110.79(14) . 7_556 ?
O3 P2 S4 109.39(17) . . ?
O4 P2 S4 102.66(16) . . ?
S6 P2 S4 122.25(6) 7_556 . ?
O6 P3 O5 93.2(3) . . ?
O6 P3 O5' 118.6(4) . . ?
O5 P3 O5' 27.7(3) . . ?
O6 P3 S3 109.47(13) . 7_556 ?
O5 P3 S3 116.0(3) . 7_556 ?
O5' P3 S3 95.0(3) . 7_556 ?
O6 P3 S5 103.71(12) . . ?
O5 P3 S5 108.2(3) . . ?
O5' P3 S5 109.4(3) . . ?
S3 P3 S5 121.64(6) 7_556 . ?
F4 P4 F4 111.9(16) . 2_656 ?
F4 P4 F3' 111.2(11) . . ?
F4 P4 F3' 104.0(9) 2_656 . ?
F4 P4 F3' 104.0(9) . 2_656 ?
F4 P4 F3' 111.2(11) 2_656 2_656 ?
F3' P4 F3' 115(2) . 2_656 ?
F4 P4 F4' 91.4(9) . 2_656 ?
F4 P4 F4' 28.5(9) 2_656 2_656 ?
F3' P4 F4' 94.5(11) . 2_656 ?
F3' P4 F4' 137.9(13) 2_656 2_656 ?
F4 P4 F4' 28.5(9) . . ?
F4 P4 F4' 91.4(9) 2_656 . ?
F3' P4 F4' 137.9(13) . . ?
F3' P4 F4' 94.5(11) 2_656 . ?
F4' P4 F4' 80.6(14) 2_656 . ?
F4 P4 F2 97.0(9) . 2_656 ?
F4 P4 F2 138.1(10) 2_656 2_656 ?
F3' P4 F2 92.3(9) . 2_656 ?
F3' P4 F2 29.3(10) 2_656 2_656 ?
F4' P4 F2 166.6(10) 2_656 2_656 ?
F4' P4 F2 101.9(10) . 2_656 ?
F4 P4 F2 138.1(10) . . ?
F4 P4 F2 97.0(9) 2_656 . ?
F3' P4 F2 29.3(10) . . ?
F3' P4 F2 92.3(9) 2_656 . ?
F4' P4 F2 101.9(10) 2_656 . ?
F4' P4 F2 166.6(10) . . ?
F2 P4 F2 78.8(12) 2_656 . ?
F4 P4 F3 71.0(7) . . ?
F4 P4 F3 84.0(8) 2_656 . ?
F3' P4 F3 56.5(9) . . ?
F3' P4 F3 164.7(12) 2_656 . ?
F4' P4 F3 57.4(8) 2_656 . ?
F4' P4 F3 87.3(10) . . ?
F2 P4 F3 135.5(9) 2_656 . ?
F2 P4 F3 83.1(7) . . ?
F4 P4 F3 84.0(8) . 2_656 ?
F4 P4 F3 71.0(7) 2_656 2_656 ?
F3' P4 F3 164.7(13) . 2_656 ?
F3' P4 F3 56.5(9) 2_656 2_656 ?
F4' P4 F3 87.3(10) 2_656 2_656 ?
F4' P4 F3 57.4(8) . 2_656 ?
F2 P4 F3 83.1(7) 2_656 2_656 ?
F2 P4 F3 135.5(9) . 2_656 ?
F3 P4 F3 134.9(13) . 2_656 ?
F4 P4 F2' 55.2(8) . 2_656 ?
F4 P4 F2' 161.7(11) 2_656 2_656 ?
F3' P4 F2' 73.0(9) . 2_656 ?
F3' P4 F2' 85.9(8) 2_656 2_656 ?
F4' P4 F2' 133.2(9) 2_656 2_656 ?
F4' P4 F2' 80.3(8) . 2_656 ?
F2 P4 F2' 60.0(7) 2_656 2_656 ?
F2 P4 F2' 88.7(10) . 2_656 ?
F3 P4 F2' 79.4(8) . 2_656 ?
F3 P4 F2' 116.3(7) 2_656 2_656 ?
F4 P4 F2' 161.7(10) . . ?
F4 P4 F2' 55.2(8) 2_656 . ?
F3' P4 F2' 85.9(9) . . ?
F3' P4 F2' 73.0(9) 2_656 . ?
F4' P4 F2' 80.3(8) 2_656 . ?
F4' P4 F2' 133.2(9) . . ?
F2 P4 F2' 88.7(10) 2_656 . ?
F2 P4 F2' 60.0(7) . . ?
F3 P4 F2' 116.3(7) . . ?
F3 P4 F2' 79.4(8) 2_656 . ?
F2' P4 F2' 140.5(12) 2_656 . ?
P1 S1 Ag2 108.15(6) . . ?
P1 S1 Ag1 105.37(7) . . ?
Ag2 S1 Ag1 77.95(3) . . ?
P1 S2 Ag4 110.83(6) . 7_556 ?
P1 S2 Ag3 107.58(6) . . ?
Ag4 S2 Ag3 78.83(3) 7_556 . ?
P3 S3 Ag4 109.03(6) 7_556 7_556 ?
P3 S3 Ag1 109.97(5) 7_556 . ?
Ag4 S3 Ag1 77.14(3) 7_556 . ?
P2 S4 Ag4 103.99(5) . . ?
P2 S4 Ag2 109.75(6) . . ?
Ag4 S4 Ag2 78.36(3) . . ?
P3 S5 Ag3 108.33(5) . . ?
P3 S5 Ag2 107.40(5) . . ?
Ag3 S5 Ag2 77.46(3) . . ?
P2 S6 Ag3 107.89(5) 7_556 . ?
P2 S6 Ag1 110.61(5) 7_556 7_556 ?
Ag3 S6 Ag1 78.61(3) . 7_556 ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        26.42
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         0.668
_refine_diff_density_min         -0.821
_refine_diff_density_rms         0.100
_database_code_depnum_ccdc_archive 'CCDC 977327'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_4

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C36 H84 Ag8 Br F6 O12 P7 S12'
_chemical_formula_weight         2367.41

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Br Br -0.2901 2.4595 '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'

_symmetry_cell_setting           Triclinic
_symmetry_space_group_name_H-M   P-1

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.870(4)
_cell_length_b                   13.066(2)
_cell_length_c                   13.778(2)
_cell_angle_alpha                117.176(3)
_cell_angle_beta                 99.416(5)
_cell_angle_gamma                95.281(5)
_cell_volume                     1996.3(8)
_cell_formula_units_Z            1
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    8011
_cell_measurement_theta_min      2.38
_cell_measurement_theta_max      25.39

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.28
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.969
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1158
_exptl_absorpt_coefficient_mu    2.930
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.4540
_exptl_absorpt_correction_T_max  0.4942
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            11357
_diffrn_reflns_av_R_equivalents  0.0373
_diffrn_reflns_av_sigmaI/netI    0.0570
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_theta_min         1.63
_diffrn_reflns_theta_max         25.00
_reflns_number_total             6896
_reflns_number_gt                5864
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

C2, C3, C4, C5, C6, O5, C16, C17, C18 were disordered and split into two 
parts, each is half occupied. Attempts to solve the disorder of the 
isopropyl groups that containing O6 were failed. It will result in unstable 
refinement that increasing R values largely. They were modelled best large 
ADP on single sites as multiple sites were not resolved. Attempts to solve 
the disorder of PF6 anion were failed. It was refined isotropically.

The used restraints are:

DFIX 1.43 0.01 O6 C13  O5 C16
DFIX 1.54 0.01 C13 C14  C13 C15  C16 C18
DFIX 1.57 0.01 P4 F1  P4 F3
DELU O6 C13
DELU O2 C4
DELU O2 C4'
DELU C1 C2
DELU C1 C3
DELU C4 C5
DELU C4 C6
DELU C4' C5'
DELU C4' C6'
DELU C13 C14
DELU C13 C15
DELU C16 C17
DELU C16 C18
DELU C16' C17'
DELU C16' C18'
EADP C5 C6
EADP C5' C6'
EADP C14 C15
EADP C17 C18
EADP C17' C18'
EADP F1 F2 F3
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.1254P)²+5.5472P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6896
_refine_ls_number_parameters     402
_refine_ls_number_restraints     22
_refine_ls_R_factor_all          0.0696
_refine_ls_R_factor_gt           0.0631
_refine_ls_wR_factor_ref         0.1981
_refine_ls_wR_factor_gt          0.1886
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_restrained_S_all      1.032
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.41536(6) 1.03839(5) 0.69269(5) 0.0617(2) Uani 1 1 d . . .
Ag2 Ag 0.50061(5) 0.78992(5) 0.52841(5) 0.0585(2) Uani 1 1 d . C .
Ag3 Ag 0.71870(5) 0.96020(6) 0.53416(6) 0.0639(2) Uani 1 1 d . . .
Ag4 Ag 0.36191(5) 0.79624(5) 0.29601(6) 0.0623(2) Uani 1 1 d . . .
Br1 Br 0.5000 1.0000 0.5000 0.0477(3) Uani 1 2 d S . .
C1 C 0.1422(8) 0.5385(8) 0.3077(9) 0.083(3) Uani 1 1 d U . .
H1 H 0.1410 0.5857 0.2692 0.100 Uiso 1 1 calc R A 1
C2 C 0.197(3) 0.456(3) 0.246(3) 0.128(18) Uani 0.50 1 d PU B 1
H2A H 0.2147 0.4097 0.2816 0.192 Uiso 0.50 1 calc PR B 1
H2B H 0.2615 0.4943 0.2408 0.192 Uiso 0.50 1 calc PR B 1
H2C H 0.1527 0.4061 0.1719 0.192 Uiso 0.50 1 calc PR B 1
C3 C 0.036(2) 0.514(3) 0.302(4) 0.17(2) Uani 0.50 1 d PU B 1
H3A H 0.0064 0.4346 0.2449 0.253 Uiso 0.50 1 calc PR B 1
H3B H -0.0003 0.5662 0.2825 0.253 Uiso 0.50 1 calc PR B 1
H3C H 0.0252 0.5247 0.3727 0.253 Uiso 0.50 1 calc PR B 1
C2' C 0.211(4) 0.436(4) 0.247(4) 0.16(3) Uani 0.50 1 d P B 2
H2D H 0.1634 0.3677 0.1865 0.237 Uiso 0.50 1 calc PR B 2
H2E H 0.2470 0.4159 0.3012 0.237 Uiso 0.50 1 calc PR B 2
H2F H 0.2635 0.4646 0.2186 0.237 Uiso 0.50 1 calc PR B 2
C3' C 0.071(2) 0.462(3) 0.350(2) 0.108(10) Uani 0.50 1 d P B 2
H3D H -0.0024 0.4717 0.3384 0.162 Uiso 0.50 1 calc PR B 2
H3E H 0.0993 0.4891 0.4283 0.162 Uiso 0.50 1 calc PR B 2
H3F H 0.0741 0.3806 0.3079 0.162 Uiso 0.50 1 calc PR B 2
C4 C 0.083(3) 0.855(4) 0.599(4) 0.100(12) Uani 0.50 1 d PU C 1
H4 H 0.1098 0.9160 0.5812 0.120 Uiso 0.50 1 calc PR C 1
C5 C -0.048(4) 0.822(8) 0.547(4) 0.28(4) Uani 0.50 1 d PU C 1
H5A H -0.0729 0.7401 0.5213 0.419 Uiso 0.50 1 calc PR C 1
H5B H -0.0645 0.8385 0.4862 0.419 Uiso 0.50 1 calc PR C 1
H5C H -0.0831 0.8676 0.6050 0.419 Uiso 0.50 1 calc PR C 1
C6 C 0.108(3) 0.906(7) 0.711(4) 0.28(4) Uani 0.50 1 d PU C 1
H6A H 0.0474 0.8867 0.7364 0.419 Uiso 0.50 1 calc PR C 1
H6B H 0.1268 0.9890 0.7425 0.419 Uiso 0.50 1 calc PR C 1
H6C H 0.1676 0.8768 0.7350 0.419 Uiso 0.50 1 calc PR C 1
C4' C 0.064(3) 0.864(4) 0.587(4) 0.098(9) Uani 0.50 1 d PU C 2
H4' H 0.1181 0.9342 0.6113 0.118 Uiso 0.50 1 calc PR C 2
C5' C -0.024(4) 0.869(5) 0.528(4) 0.150(12) Uani 0.50 1 d PU C 2
H5D H -0.0842 0.8528 0.5551 0.225 Uiso 0.50 1 calc PR C 2
H5E H -0.0334 0.8125 0.4506 0.225 Uiso 0.50 1 calc PR C 2
H5F H -0.0193 0.9462 0.5351 0.225 Uiso 0.50 1 calc PR C 2
C6' C 0.049(3) 0.850(4) 0.693(4) 0.150(12) Uani 0.50 1 d PU C 2
H6D H 0.1144 0.8862 0.7507 0.225 Uiso 0.50 1 calc PR C 2
H6E H 0.0332 0.7680 0.6715 0.225 Uiso 0.50 1 calc PR C 2
H6F H -0.0085 0.8865 0.7209 0.225 Uiso 0.50 1 calc PR C 2
C7 C 0.6724(7) 0.5099(7) 0.3507(8) 0.065(2) Uani 1 1 d . . .
H7 H 0.6133 0.4613 0.2851 0.078 Uiso 1 1 calc R . .
C8 C 0.7688(11) 0.4589(11) 0.3329(14) 0.111(4) Uani 1 1 d . . .
H8A H 0.8133 0.4992 0.3067 0.167 Uiso 1 1 calc R . .
H8B H 0.7484 0.3774 0.2781 0.167 Uiso 1 1 calc R . .
H8C H 0.8078 0.4667 0.4023 0.167 Uiso 1 1 calc R . .
C9 C 0.6378(12) 0.5228(12) 0.4541(13) 0.110(4) Uani 1 1 d . . .
H9A H 0.6094 0.4469 0.4434 0.164 Uiso 1 1 calc R . .
H9B H 0.5836 0.5702 0.4679 0.164 Uiso 1 1 calc R . .
H9C H 0.6984 0.5596 0.5171 0.164 Uiso 1 1 calc R . .
C10 C 0.6891(8) 0.5616(8) 0.1033(8) 0.076(3) Uani 1 1 d . . .
H10 H 0.7592 0.5917 0.1563 0.091 Uiso 1 1 calc R . .
C11 C 0.6765(16) 0.6207(14) 0.0302(11) 0.133(6) Uani 1 1 d . . .
H11A H 0.6125 0.5811 -0.0284 0.199 Uiso 1 1 calc R . .
H11B H 0.7375 0.6172 -0.0023 0.199 Uiso 1 1 calc R . .
H11C H 0.6717 0.7011 0.0753 0.199 Uiso 1 1 calc R . .
C12 C 0.6697(12) 0.4276(10) 0.0302(11) 0.110(4) Uani 1 1 d . . .
H12A H 0.6919 0.3928 0.0764 0.165 Uiso 1 1 calc R . .
H12B H 0.7103 0.4081 -0.0263 0.165 Uiso 1 1 calc R . .
H12C H 0.5948 0.3983 -0.0050 0.165 Uiso 1 1 calc R . .
C13 C 0.657(2) 0.8403(16) 0.889(2) 0.232(12) Uani 1 1 d DU . .
H13 H 0.7184 0.8081 0.8605 0.278 Uiso 1 1 calc R . .
C14 C 0.552(3) 0.752(3) 0.848(2) 0.316(17) Uani 1 1 d DU . .
H14A H 0.5095 0.7804 0.9029 0.474 Uiso 1 1 calc R . .
H14B H 0.5679 0.6780 0.8388 0.474 Uiso 1 1 calc R . .
H14C H 0.5135 0.7425 0.7782 0.474 Uiso 1 1 calc R . .
C15 C 0.675(3) 0.909(3) 1.0186(19) 0.316(17) Uani 1 1 d DU . .
H15A H 0.7468 0.9095 1.0527 0.474 Uiso 1 1 calc R . .
H15B H 0.6245 0.8724 1.0422 0.474 Uiso 1 1 calc R . .
H15C H 0.6661 0.9884 1.0411 0.474 Uiso 1 1 calc R . .
C16 C 0.856(4) 1.138(3) 0.918(3) 0.096(10) Uani 0.50 1 d PDU D 1
H16 H 0.8151 1.1912 0.9034 0.115 Uiso 0.50 1 calc PR D 1
C17 C 0.960(3) 1.147(6) 0.879(3) 0.194(19) Uani 0.50 1 d PU D 1
H17A H 1.0208 1.1645 0.9387 0.291 Uiso 0.50 1 calc PR D 1
H17B H 0.9643 1.2077 0.8583 0.291 Uiso 0.50 1 calc PR D 1
H17C H 0.9610 1.0735 0.8152 0.291 Uiso 0.50 1 calc PR D 1
C18 C 0.898(3) 1.197(6) 1.046(3) 0.194(19) Uani 0.50 1 d PDU D 1
H18A H 0.8478 1.1699 1.0777 0.291 Uiso 0.50 1 calc PR D 1
H18B H 0.9056 1.2803 1.0767 0.291 Uiso 0.50 1 calc PR D 1
H18C H 0.9660 1.1774 1.0629 0.291 Uiso 0.50 1 calc PR D 1
C16' C 0.868(4) 1.172(3) 0.934(4) 0.107(9) Uani 0.50 1 d PU E 2
H16' H 0.8520 1.2288 0.9089 0.129 Uiso 0.50 1 calc PR E 2
C17' C 0.982(3) 1.158(5) 0.939(3) 0.21(2) Uani 0.50 1 d PU E 2
H17D H 1.0267 1.2195 1.0082 0.318 Uiso 0.50 1 calc PR E 2
H17E H 1.0039 1.1607 0.8771 0.318 Uiso 0.50 1 calc PR E 2
H17F H 0.9887 1.0834 0.9353 0.318 Uiso 0.50 1 calc PR E 2
C18' C 0.853(3) 1.207(5) 1.043(3) 0.21(2) Uani 0.50 1 d PU E 2
H18D H 0.8387 1.1396 1.0533 0.318 Uiso 0.50 1 calc PR E 2
H18E H 0.7925 1.2465 1.0532 0.318 Uiso 0.50 1 calc PR E 2
H18F H 0.9157 1.2598 1.0979 0.318 Uiso 0.50 1 calc PR E 2
O1 O 0.2167(4) 0.6231(4) 0.4162(5) 0.0600(13) Uani 1 1 d . B .
O2 O 0.1094(5) 0.7578(5) 0.5273(5) 0.0691(15) Uani 1 1 d U . .
O3 O 0.6974(4) 0.6278(4) 0.3598(5) 0.0577(13) Uani 1 1 d . . .
O4 O 0.6005(5) 0.5832(5) 0.1624(5) 0.0631(14) Uani 1 1 d . . .
O5 O 0.7774(14) 1.0408(15) 0.8979(15) 0.086(5) Uani 0.50 1 d PD D 1
O5' O 0.8172(13) 1.0457(16) 0.8447(18) 0.105(7) Uani 0.50 1 d P E 2
O6 O 0.6262(16) 0.9283(9) 0.8642(9) 0.184(7) Uani 1 1 d DU D .
P1 P 0.21453(14) 0.75726(15) 0.48305(16) 0.0468(4) Uani 1 1 d . B .
P2 P 0.61945(15) 0.67121(14) 0.29144(15) 0.0451(4) Uani 1 1 d . C .
P3 P 0.6808(2) 0.98977(18) 0.80551(19) 0.0736(7) Uani 1 1 d . . .
P4 P 0.0000 0.5000 0.0000 0.90(7) Uiso 1 2 d SD . .
F1 F 0.103(2) 0.593(3) 0.080(3) 0.494(15) Uiso 1 1 d D . .
F2 F -0.048(4) 0.512(4) 0.112(4) 0.494(15) Uiso 1 1 d . . .
F3 F 0.073(3) 0.412(3) 0.004(4) 0.494(15) Uiso 1 1 d D . .
S1 S 0.34085(14) 0.82121(14) 0.61551(15) 0.0483(4) Uani 1 1 d . . .
S2 S 0.19807(15) 0.82437(16) 0.37662(17) 0.0546(4) Uani 1 1 d . . .
S3 S 0.70469(16) 0.82743(15) 0.32839(18) 0.0552(5) Uani 1 1 d . . .
S4 S 0.47205(15) 0.65469(14) 0.31962(16) 0.0510(4) Uani 1 1 d . . .
S5 S 0.40153(19) 0.88036(17) 0.17168(16) 0.0609(5) Uani 1 1 d . . .
S6 S 0.68778(17) 0.86490(18) 0.65326(19) 0.0605(5) Uani 1 1 d . C .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 S3 2.522(2) 2_676 ?
Ag1 S5 2.541(2) 2_676 ?
Ag1 S1 2.5517(18) . ?
Ag1 Br1 2.8840(8) . ?
Ag1 Ag3 3.3227(10) 2_676 ?
Ag1 Ag4 3.3640(12) 2_676 ?
Ag2 S1 2.520(2) . ?
Ag2 S6 2.528(2) . ?
Ag2 S4 2.535(2) . ?
Ag2 Br1 2.9448(7) . ?
Ag3 S3 2.522(2) . ?
Ag3 S6 2.528(2) . ?
Ag3 S2 2.537(2) 2_676 ?
Ag3 Br1 2.9110(11) . ?
Ag3 Ag1 3.3227(10) 2_676 ?
Ag3 Ag4 3.3584(9) 2_676 ?
Ag4 S5 2.511(2) . ?
Ag4 S2 2.520(2) . ?
Ag4 S4 2.5332(19) . ?
Ag4 Br1 2.9674(8) . ?
Ag4 Ag3 3.3583(9) 2_676 ?
Ag4 Ag1 3.3639(12) 2_676 ?
Br1 Ag1 2.8841(8) 2_676 ?
Br1 Ag3 2.9109(11) 2_676 ?
Br1 Ag2 2.9448(8) 2_676 ?
Br1 Ag4 2.9673(8) 2_676 ?
C1 C3 1.36(3) . ?
C1 C2 1.37(4) . ?
C1 O1 1.485(10) . ?
C1 C3' 1.65(3) . ?
C1 C2' 1.65(5) . ?
C4 O2 1.33(4) . ?
C4 C6 1.34(7) . ?
C4 C5 1.65(6) . ?
C4' C5' 1.31(7) . ?
C4' O2 1.49(4) . ?
C4' C6' 1.60(7) . ?
C7 C8 1.465(13) . ?
C7 O3 1.487(9) . ?
C7 C9 1.502(15) . ?
C10 O4 1.482(10) . ?
C10 C11 1.522(17) . ?
C10 C12 1.539(13) . ?
C13 O6 1.413(9) . ?
C13 C14 1.532(10) . ?
C13 C15 1.552(10) . ?
C16 O5 1.432(10) . ?
C16 C18 1.539(10) . ?
C16 C17 1.54(6) . ?
C16' C18' 1.41(7) . ?
C16' C17' 1.48(7) . ?
C16' O5' 1.54(3) . ?
O1 P1 1.570(5) . ?
O2 P1 1.572(6) . ?
O3 P2 1.581(5) . ?
O4 P2 1.576(5) . ?
O5 P3 1.471(15) . ?
O5' P3 1.732(18) . ?
O6 P3 1.572(12) . ?
P1 S1 2.014(3) . ?
P1 S2 2.018(3) . ?
P2 S4 2.010(3) . ?
P2 S3 2.021(3) . ?
P3 S6 2.008(3) . ?
P3 S5 2.014(3) 2_676 ?
P4 F3 1.569(10) 2_565 ?
P4 F3 1.569(10) . ?
P4 F1 1.570(10) 2_565 ?
P4 F1 1.570(10) . ?
P4 F2 1.71(5) . ?
P4 F2 1.71(5) 2_565 ?
S2 Ag3 2.537(2) 2_676 ?
S3 Ag1 2.522(2) 2_676 ?
S5 P3 2.013(3) 2_676 ?
S5 Ag1 2.541(2) 2_676 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
S3 Ag1 S5 121.23(7) 2_676 2_676 ?
S3 Ag1 S1 120.56(7) 2_676 . ?
S5 Ag1 S1 116.66(7) 2_676 . ?
S3 Ag1 Br1 94.72(5) 2_676 . ?
S5 Ag1 Br1 94.06(6) 2_676 . ?
S1 Ag1 Br1 93.65(5) . . ?
S3 Ag1 Ag3 48.81(5) 2_676 2_676 ?
S5 Ag1 Ag3 140.23(6) 2_676 2_676 ?
S1 Ag1 Ag3 92.40(5) . 2_676 ?
Br1 Ag1 Ag3 55.39(2) . 2_676 ?
S3 Ag1 Ag4 93.41(5) 2_676 2_676 ?
S5 Ag1 Ag4 47.87(5) 2_676 2_676 ?
S1 Ag1 Ag4 137.53(5) . 2_676 ?
Br1 Ag1 Ag4 56.077(18) . 2_676 ?
Ag3 Ag1 Ag4 92.36(3) 2_676 2_676 ?
S1 Ag2 S6 119.59(7) . . ?
S1 Ag2 S4 119.34(6) . . ?
S6 Ag2 S4 120.24(7) . . ?
S1 Ag2 Br1 92.88(4) . . ?
S6 Ag2 Br1 93.36(5) . . ?
S4 Ag2 Br1 92.81(5) . . ?
S3 Ag3 S6 117.59(7) . . ?
S3 Ag3 S2 119.92(7) . 2_676 ?
S6 Ag3 S2 121.03(7) . 2_676 ?
S3 Ag3 Br1 94.06(5) . . ?
S6 Ag3 Br1 94.17(5) . . ?
S2 Ag3 Br1 93.81(5) 2_676 . ?
S3 Ag3 Ag1 48.80(5) . 2_676 ?
S6 Ag3 Ag1 137.51(6) . 2_676 ?
S2 Ag3 Ag1 91.98(5) 2_676 2_676 ?
Br1 Ag3 Ag1 54.635(17) . 2_676 ?
S3 Ag3 Ag4 140.30(5) . 2_676 ?
S6 Ag3 Ag4 92.26(5) . 2_676 ?
S2 Ag3 Ag4 48.18(5) 2_676 2_676 ?
Br1 Ag3 Ag4 55.951(17) . 2_676 ?
Ag1 Ag3 Ag4 91.57(2) 2_676 2_676 ?
S5 Ag4 S2 121.77(7) . . ?
S5 Ag4 S4 119.83(7) . . ?
S2 Ag4 S4 117.79(7) . . ?
S5 Ag4 Br1 92.71(5) . . ?
S2 Ag4 Br1 92.81(5) . . ?
S4 Ag4 Br1 92.31(5) . . ?
S5 Ag4 Ag3 91.74(5) . 2_676 ?
S2 Ag4 Ag3 48.60(5) . 2_676 ?
S4 Ag4 Ag3 136.49(5) . 2_676 ?
Br1 Ag4 Ag3 54.37(2) . 2_676 ?
S5 Ag4 Ag1 48.64(5) . 2_676 ?
S2 Ag4 Ag1 138.45(5) . 2_676 ?
S4 Ag4 Ag1 90.37(5) . 2_676 ?
Br1 Ag4 Ag1 53.755(18) . 2_676 ?
Ag3 Ag4 Ag1 89.87(3) 2_676 2_676 ?
Ag1 Br1 Ag1 180.0 . 2_676 ?
Ag1 Br1 Ag3 69.97(2) . 2_676 ?
Ag1 Br1 Ag3 110.03(2) 2_676 2_676 ?
Ag1 Br1 Ag3 110.03(2) . . ?
Ag1 Br1 Ag3 69.97(2) 2_676 . ?
Ag3 Br1 Ag3 180.0 2_676 . ?
Ag1 Br1 Ag2 108.420(18) . 2_676 ?
Ag1 Br1 Ag2 71.581(18) 2_676 2_676 ?
Ag3 Br1 Ag2 70.602(19) 2_676 2_676 ?
Ag3 Br1 Ag2 109.398(19) . 2_676 ?
Ag1 Br1 Ag2 71.580(18) . . ?
Ag1 Br1 Ag2 108.419(18) 2_676 . ?
Ag3 Br1 Ag2 109.398(19) 2_676 . ?
Ag3 Br1 Ag2 70.602(19) . . ?
Ag2 Br1 Ag2 180.0 2_676 . ?
Ag1 Br1 Ag4 70.17(2) . 2_676 ?
Ag1 Br1 Ag4 109.83(2) 2_676 2_676 ?
Ag3 Br1 Ag4 110.32(2) 2_676 2_676 ?
Ag3 Br1 Ag4 69.68(2) . 2_676 ?
Ag2 Br1 Ag4 71.20(2) 2_676 2_676 ?
Ag2 Br1 Ag4 108.80(2) . 2_676 ?
Ag1 Br1 Ag4 109.83(2) . . ?
Ag1 Br1 Ag4 70.17(2) 2_676 . ?
Ag3 Br1 Ag4 69.68(2) 2_676 . ?
Ag3 Br1 Ag4 110.32(2) . . ?
Ag2 Br1 Ag4 108.80(2) 2_676 . ?
Ag2 Br1 Ag4 71.20(2) . . ?
Ag4 Br1 Ag4 180.0 2_676 . ?
C3 C1 C2 122.9(19) . . ?
C3 C1 O1 120.3(18) . . ?
C2 C1 O1 108.3(13) . . ?
C3 C1 C3' 47(2) . . ?
C2 C1 C3' 100(3) . . ?
O1 C1 C3' 99.7(11) . . ?
C3 C1 C2' 123(2) . . ?
C2 C1 C2' 7(3) . . ?
O1 C1 C2' 104(2) . . ?
C3' C1 C2' 94.8(19) . . ?
O2 C4 C6 127(5) . . ?
O2 C4 C5 99(4) . . ?
C6 C4 C5 112(4) . . ?
C5' C4' O2 114(4) . . ?
C5' C4' C6' 115(3) . . ?
O2 C4' C6' 99(3) . . ?
C8 C7 O3 106.4(8) . . ?
C8 C7 C9 114.6(9) . . ?
O3 C7 C9 108.9(8) . . ?
O4 C10 C11 106.9(9) . . ?
O4 C10 C12 104.8(8) . . ?
C11 C10 C12 110.6(10) . . ?
O6 C13 C14 103.1(19) . . ?
O6 C13 C15 98.6(16) . . ?
C14 C13 C15 105(2) . . ?
O5 C16 C18 102(3) . . ?
O5 C16 C17 133(4) . . ?
C18 C16 C17 102(3) . . ?
C18' C16' C17' 106(3) . . ?
C18' C16' O5' 117(4) . . ?
C17' C16' O5' 97(3) . . ?
C1 O1 P1 125.0(6) . . ?
C4 O2 C4' 12(4) . . ?
C4 O2 P1 123(2) . . ?
C4' O2 P1 124.5(17) . . ?
C7 O3 P2 122.4(5) . . ?
C10 O4 P2 122.4(6) . . ?
C16 O5 P3 123(2) . . ?
C16' O5' P3 124(2) . . ?
C13 O6 P3 129.4(16) . . ?
O1 P1 O2 102.8(3) . . ?
O1 P1 S1 104.5(2) . . ?
O2 P1 S1 107.9(3) . . ?
O1 P1 S2 109.5(2) . . ?
O2 P1 S2 109.1(3) . . ?
S1 P1 S2 121.45(11) . . ?
O4 P2 O3 109.0(3) . . ?
O4 P2 S4 102.6(2) . . ?
O3 P2 S4 109.7(2) . . ?
O4 P2 S3 110.1(2) . . ?
O3 P2 S3 102.8(2) . . ?
S4 P2 S3 122.29(11) . . ?
O5 P3 O6 91.0(10) . . ?
O5 P3 O5' 34.5(9) . . ?
O6 P3 O5' 122.2(11) . . ?
O5 P3 S6 119.9(8) . . ?
O6 P3 S6 107.9(4) . . ?
O5' P3 S6 93.5(6) . . ?
O5 P3 S5 106.5(7) . 2_676 ?
O6 P3 S5 102.2(6) . 2_676 ?
O5' P3 S5 109.6(6) . 2_676 ?
S6 P3 S5 123.03(13) . 2_676 ?
F3 P4 F3 179.999(3) 2_565 . ?
F3 P4 F1 82.9(19) 2_565 2_565 ?
F3 P4 F1 97.1(19) . 2_565 ?
F3 P4 F1 97.1(19) 2_565 . ?
F3 P4 F1 82.9(19) . . ?
F1 P4 F1 179.998(4) 2_565 . ?
F3 P4 F2 86(2) 2_565 . ?
F3 P4 F2 94(2) . . ?
F1 P4 F2 88.7(18) 2_565 . ?
F1 P4 F2 91.3(18) . . ?
F3 P4 F2 94(2) 2_565 2_565 ?
F3 P4 F2 86(2) . 2_565 ?
F1 P4 F2 91.3(18) 2_565 2_565 ?
F1 P4 F2 88.7(18) . 2_565 ?
F2 P4 F2 179.999(5) . 2_565 ?
P1 S1 Ag2 103.89(9) . . ?
P1 S1 Ag1 113.29(9) . . ?
Ag2 S1 Ag1 84.48(6) . . ?
P1 S2 Ag4 105.38(9) . . ?
P1 S2 Ag3 114.21(10) . 2_676 ?
Ag4 S2 Ag3 83.23(6) . 2_676 ?
P2 S3 Ag1 111.79(10) . 2_676 ?
P2 S3 Ag3 105.97(10) . . ?
Ag1 S3 Ag3 82.39(6) 2_676 . ?
P2 S4 Ag4 114.20(9) . . ?
P2 S4 Ag2 103.56(9) . . ?
Ag4 S4 Ag2 85.55(6) . . ?
P3 S5 Ag4 109.17(13) 2_676 . ?
P3 S5 Ag1 110.25(10) 2_676 2_676 ?
Ag4 S5 Ag1 83.48(7) . 2_676 ?
P3 S6 Ag3 108.69(11) . . ?
P3 S6 Ag2 108.56(12) . . ?
Ag3 S6 Ag2 84.02(7) . . ?

_diffrn_measured_fraction_theta_max 0.979
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.979
_refine_diff_density_max         1.457
_refine_diff_density_min         -1.659
_refine_diff_density_rms         0.223
_database_code_depnum_ccdc_archive 'CCDC 977328'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_5

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C36 H85 Ag8 F6 O12 P7 S12'
_chemical_formula_weight         2288.51

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   C2/c

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

_cell_length_a                   24.1617(8)
_cell_length_b                   13.1118(5)
_cell_length_c                   24.9456(9)
_cell_angle_alpha                90.00
_cell_angle_beta                 92.3010(10)
_cell_angle_gamma                90.00
_cell_volume                     7896.5(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9951
_cell_measurement_theta_min      2.20
_cell_measurement_theta_max      26.35

_exptl_crystal_description       film
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.04
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.925
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             4496
_exptl_absorpt_coefficient_mu    2.457
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.4553
_exptl_absorpt_correction_T_max  0.9081
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            34095
_diffrn_reflns_av_R_equivalents  0.0389
_diffrn_reflns_av_sigmaI/netI    0.0286
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_theta_min         1.63
_diffrn_reflns_theta_max         25.00
_reflns_number_total             6961
_reflns_number_gt                5426
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker XSCANS'
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

The isopropoxyl groups on P1 and P3 were split into two groups, which is 
half occupied for each. PF6 were split into two groups and each is half 
occupied.

The used restraints are:

DFIX 1.43 0.01 O1 C1  O1' C1'  O2' C4'  O2 C4  O6 C16  O6' C16'
DFIX 1.54 0.01 C1' C2'  C1 C2  C1 C3  C1' C3'  C4 C5  C4 C6  C4' C5'
DFIX 1.54 0.01 C4' C6'  C16' C18'  C16 C17  C16 C18
DFIX 1.57 0.01 P4 F2
DFIX 1.62 0.01 P3 O6'
DELU P1 O1'
DELU O1' C1'
DELU O1 C1
DELU O2' C4'
DELU C1 C2
DELU C1 C3
DELU C1' C2'
DELU C1' C3'
DELU C4 C5
DELU C4 C6
DELU C4' C5'
DELU C4' C6'
DELU C16 C17
DELU C16 C18
DELU C16' C17'
DELU C16' C18'
EADP C1 C1'
EADP C2 C3
EADP C2' C3'
EADP C4 C4'
EADP C5 C6
EADP C5' C6'
EADP C17 C18
EADP C17' C18'
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0595P)²+47.9032P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6961
_refine_ls_number_parameters     479
_refine_ls_number_restraints     35
_refine_ls_R_factor_all          0.0660
_refine_ls_R_factor_gt           0.0499
_refine_ls_wR_factor_ref         0.1437
_refine_ls_wR_factor_gt          0.1292
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_restrained_S_all      1.075
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.14386(5) 0.78280(8) -0.05195(4) 0.0713(3) Uani 0.67 1 d P . .
Ag2 Ag 0.17651(10) 0.77455(15) -0.03579(8) 0.0656(5) Uani 0.33 1 d P . .
Ag3 Ag 0.25323(4) 0.84457(7) 0.10510(5) 0.0716(3) Uani 0.67 1 d P . .
Ag4 Ag 0.25276(6) 0.81303(13) 0.06939(9) 0.0634(4) Uani 0.33 1 d P . .
Ag5 Ag 0.16747(4) 0.65613(7) 0.06478(4) 0.0663(3) Uani 0.67 1 d P . .
Ag6 Ag 0.19169(9) 0.68316(15) 0.04494(8) 0.0666(5) Uani 0.33 1 d P . .
Ag7 Ag 0.26971(4) 0.52909(9) 0.01003(4) 0.0671(3) Uani 0.67 1 d P . .
Ag8 Ag 0.26427(7) 0.59741(19) 0.00713(7) 0.0655(5) Uani 0.33 1 d P . .
S1 S 0.22321(8) 0.68753(14) 0.14814(6) 0.0625(4) Uani 1 1 d . A .
S2 S 0.33030(7) 0.55184(14) 0.09141(6) 0.0607(4) Uani 1 1 d . . .
S3 S 0.09771(6) 0.78399(13) 0.03519(6) 0.0548(4) Uani 1 1 d . . .
S4 S 0.31190(7) 0.52183(13) -0.07848(7) 0.0610(4) Uani 1 1 d . . .
S5 S 0.17110(7) 0.49072(12) 0.01832(6) 0.0563(4) Uani 1 1 d . B .
S6 S 0.35229(7) 0.87797(14) 0.10233(6) 0.0624(4) Uani 1 1 d . . .
P1 P 0.28346(8) 0.58444(19) 0.15384(7) 0.0738(6) Uani 1 1 d U . .
P2 P 0.11301(7) 0.91216(13) 0.07606(7) 0.0558(4) Uani 1 1 d . . .
P3 P 0.13327(7) 0.50294(12) -0.05462(6) 0.0524(4) Uani 1 1 d D . .
P4 P 0.0000 0.5027(6) 0.7500 0.181(3) Uani 1 2 d SD . .
F1 F 0.0231(7) 0.4211(11) 0.7858(4) 0.269(7) Uani 1 1 d . . .
F2 F -0.0141(7) 0.5878(9) 0.7893(4) 0.264(6) Uani 1 1 d D . .
F3A F 0.0588(7) 0.5484(15) 0.7793(5) 0.158(6) Uani 0.50 1 d P . .
F3B F -0.0472(9) 0.4677(18) 0.7930(6) 0.185(7) Uani 0.50 1 d P . .
O1 O 0.3188(5) 0.5669(11) 0.2034(4) 0.093(3) Uani 0.50 1 d PDU A 1
O2 O 0.2533(7) 0.4629(10) 0.1583(6) 0.072(4) Uani 0.50 1 d PD A 1
O1' O 0.3219(4) 0.6535(7) 0.1996(3) 0.058(2) Uani 0.50 1 d PDU A 2
O2' O 0.2635(8) 0.4967(11) 0.1805(6) 0.074(4) Uani 0.50 1 d PDU A 2
O3 O 0.0688(2) 0.9881(4) 0.0511(3) 0.1005(19) Uani 1 1 d . . .
O4 O 0.1018(3) 0.8976(4) 0.1370(2) 0.098(2) Uani 1 1 d . . .
O5 O 0.07051(18) 0.4982(4) -0.04315(19) 0.0702(13) Uani 1 1 d . B .
O6 O 0.1341(4) 0.3943(8) -0.0827(4) 0.053(3) Uani 0.50 1 d PD B 1
O6' O 0.1591(6) 0.4217(8) -0.0953(5) 0.081(3) Uani 0.50 1 d PD B 2
C1 C 0.3535(8) 0.6463(13) 0.2246(8) 0.104(4) Uani 0.50 1 d PDU A 1
H1 H 0.3380 0.7122 0.2131 0.124 Uiso 0.50 1 calc PR A 1
C2 C 0.4132(10) 0.639(3) 0.2066(13) 0.163(10) Uani 0.50 1 d PDU A 1
H2A H 0.4192 0.5735 0.1908 0.244 Uiso 0.50 1 calc PR A 1
H2B H 0.4383 0.6481 0.2370 0.244 Uiso 0.50 1 calc PR A 1
H2C H 0.4196 0.6914 0.1806 0.244 Uiso 0.50 1 calc PR A 1
C3 C 0.3455(11) 0.633(3) 0.2849(8) 0.163(10) Uani 0.50 1 d PDU A 1
H3A H 0.3074 0.6460 0.2925 0.244 Uiso 0.50 1 calc PR A 1
H3B H 0.3688 0.6806 0.3046 0.244 Uiso 0.50 1 calc PR A 1
H3C H 0.3551 0.5649 0.2954 0.244 Uiso 0.50 1 calc PR A 1
C4 C 0.2138(11) 0.455(3) 0.2004(10) 0.135(7) Uani 0.50 1 d PDU A 1
H4 H 0.1985 0.5235 0.2029 0.162 Uiso 0.50 1 calc PR A 1
C5 C 0.1656(19) 0.392(4) 0.1756(16) 0.23(2) Uani 0.50 1 d PDU A 1
H5A H 0.1545 0.4196 0.1413 0.348 Uiso 0.50 1 calc PR A 1
H5B H 0.1349 0.3934 0.1989 0.348 Uiso 0.50 1 calc PR A 1
H5C H 0.1774 0.3222 0.1711 0.348 Uiso 0.50 1 calc PR A 1
C6 C 0.236(2) 0.432(3) 0.2579(14) 0.23(2) Uani 0.50 1 d PDU A 1
H6A H 0.2713 0.4632 0.2639 0.348 Uiso 0.50 1 calc PR A 1
H6B H 0.2393 0.3591 0.2626 0.348 Uiso 0.50 1 calc PR A 1
H6C H 0.2103 0.4579 0.2831 0.348 Uiso 0.50 1 calc PR A 1
C1' C 0.3737(7) 0.6089(15) 0.2189(7) 0.104(4) Uani 0.50 1 d PDU A 2
H1' H 0.3817 0.5429 0.2025 0.124 Uiso 0.50 1 calc PR A 2
C2' C 0.4147(10) 0.693(2) 0.2053(13) 0.144(8) Uani 0.50 1 d PDU A 2
H2D H 0.4075 0.7150 0.1690 0.216 Uiso 0.50 1 calc PR A 2
H2E H 0.4518 0.6669 0.2091 0.216 Uiso 0.50 1 calc PR A 2
H2F H 0.4106 0.7495 0.2292 0.216 Uiso 0.50 1 calc PR A 2
C3' C 0.3766(10) 0.607(3) 0.2802(7) 0.144(8) Uani 0.50 1 d PDU A 2
H3D H 0.3774 0.6757 0.2936 0.216 Uiso 0.50 1 calc PR A 2
H3E H 0.4096 0.5720 0.2925 0.216 Uiso 0.50 1 calc PR A 2
H3F H 0.3448 0.5724 0.2929 0.216 Uiso 0.50 1 calc PR A 2
C4' C 0.2148(10) 0.476(3) 0.2110(12) 0.135(7) Uani 0.50 1 d PDU A 2
H4' H 0.2024 0.5344 0.2321 0.162 Uiso 0.50 1 calc PR A 2
C5' C 0.1698(14) 0.430(3) 0.1730(13) 0.166(9) Uani 0.50 1 d PDU A 2
H5'1 H 0.1546 0.4826 0.1499 0.249 Uiso 0.50 1 calc PR A 2
H5'2 H 0.1410 0.4016 0.1936 0.249 Uiso 0.50 1 calc PR A 2
H5'3 H 0.1858 0.3778 0.1516 0.249 Uiso 0.50 1 calc PR A 2
C6' C 0.2312(15) 0.382(3) 0.2446(16) 0.166(9) Uani 0.50 1 d PDU A 2
H6'1 H 0.2344 0.3239 0.2213 0.249 Uiso 0.50 1 calc PR A 2
H6'2 H 0.2034 0.3687 0.2701 0.249 Uiso 0.50 1 calc PR A 2
H6'3 H 0.2661 0.3938 0.2633 0.249 Uiso 0.50 1 calc PR A 2
C7 C 0.0653(5) 1.0946(9) 0.0641(6) 0.129(4) Uani 1 1 d . . .
H7A H 0.0947 1.1129 0.0906 0.155 Uiso 1 1 calc R . .
C8 C 0.0723(7) 1.1503(10) 0.0151(7) 0.183(7) Uani 1 1 d . . .
H8A H 0.1089 1.1390 0.0028 0.275 Uiso 1 1 calc R . .
H8B H 0.0670 1.2217 0.0215 0.275 Uiso 1 1 calc R . .
H8C H 0.0455 1.1272 -0.0117 0.275 Uiso 1 1 calc R . .
C9 C 0.0091(6) 1.1100(12) 0.0878(7) 0.201(8) Uani 1 1 d . . .
H9A H 0.0076 1.0729 0.1209 0.302 Uiso 1 1 calc R . .
H9B H -0.0193 1.0856 0.0630 0.302 Uiso 1 1 calc R . .
H9C H 0.0035 1.1813 0.0945 0.302 Uiso 1 1 calc R . .
C10 C 0.0683(4) 0.8182(7) 0.1626(4) 0.096(3) Uani 1 1 d . . .
H10A H 0.0697 0.7551 0.1417 0.115 Uiso 1 1 calc R . .
C11 C 0.0931(6) 0.8002(10) 0.2166(5) 0.143(5) Uani 1 1 d . . .
H11A H 0.0725 0.7484 0.2343 0.215 Uiso 1 1 calc R . .
H11B H 0.0923 0.8622 0.2370 0.215 Uiso 1 1 calc R . .
H11C H 0.1308 0.7782 0.2138 0.215 Uiso 1 1 calc R . .
C12 C 0.0109(4) 0.8529(12) 0.1641(5) 0.154(5) Uani 1 1 d . . .
H12A H -0.0111 0.8015 0.1807 0.231 Uiso 1 1 calc R . .
H12B H -0.0034 0.8649 0.1282 0.231 Uiso 1 1 calc R . .
H12C H 0.0094 0.9149 0.1845 0.231 Uiso 1 1 calc R . .
C13 C 0.0271(3) 0.5045(6) -0.0869(3) 0.0692(18) Uani 1 1 d . . .
H13A H 0.0443 0.5061 -0.1218 0.083 Uiso 1 1 calc R B .
C14 C -0.0077(4) 0.4116(7) -0.0826(4) 0.102(3) Uani 1 1 d . B .
H14A H 0.0145 0.3522 -0.0886 0.152 Uiso 1 1 calc R . .
H14B H -0.0376 0.4143 -0.1091 0.152 Uiso 1 1 calc R . .
H14C H -0.0224 0.4083 -0.0475 0.152 Uiso 1 1 calc R . .
C15 C -0.0045(4) 0.5998(8) -0.0787(4) 0.102(3) Uani 1 1 d . B .
H15A H 0.0197 0.6574 -0.0818 0.153 Uiso 1 1 calc R . .
H15B H -0.0195 0.5992 -0.0436 0.153 Uiso 1 1 calc R . .
H15C H -0.0342 0.6045 -0.1053 0.153 Uiso 1 1 calc R . .
C16 C 0.1816(5) 0.3581(13) -0.1109(6) 0.076(4) Uani 0.50 1 d PDU B 1
H16 H 0.2097 0.4120 -0.1096 0.091 Uiso 0.50 1 calc PR B 1
C17 C 0.2069(18) 0.2629(19) -0.0835(10) 0.147(8) Uani 0.50 1 d PDU B 1
H17A H 0.2307 0.2833 -0.0537 0.220 Uiso 0.50 1 calc PR B 1
H17B H 0.2279 0.2256 -0.1088 0.220 Uiso 0.50 1 calc PR B 1
H17C H 0.1778 0.2204 -0.0709 0.220 Uiso 0.50 1 calc PR B 1
C18 C 0.1620(12) 0.343(2) -0.1694(7) 0.147(8) Uani 0.50 1 d PDU B 1
H18A H 0.1319 0.2955 -0.1713 0.220 Uiso 0.50 1 calc PR B 1
H18B H 0.1920 0.3178 -0.1896 0.220 Uiso 0.50 1 calc PR B 1
H18C H 0.1497 0.4076 -0.1842 0.220 Uiso 0.50 1 calc PR B 1
C16' C 0.1603(11) 0.3142(10) -0.0868(8) 0.113(6) Uani 0.50 1 d PDU B 2
H16' H 0.1335 0.2954 -0.0600 0.135 Uiso 0.50 1 calc PR B 2
C17' C 0.2141(17) 0.284(2) -0.0693(14) 0.152(9) Uani 0.50 1 d PU B 2
H17D H 0.2395 0.2971 -0.0970 0.228 Uiso 0.50 1 calc PR B 2
H17E H 0.2140 0.2118 -0.0615 0.228 Uiso 0.50 1 calc PR B 2
H17F H 0.2252 0.3207 -0.0375 0.228 Uiso 0.50 1 calc PR B 2
C18' C 0.1423(11) 0.2695(17) -0.1417(10) 0.152(9) Uani 0.50 1 d PDU B 2
H18D H 0.1495 0.3182 -0.1693 0.228 Uiso 0.50 1 calc PR B 2
H18E H 0.1035 0.2541 -0.1422 0.228 Uiso 0.50 1 calc PR B 2
H18F H 0.1628 0.2082 -0.1478 0.228 Uiso 0.50 1 calc PR B 2
H0 H 0.2500 0.7500 0.0000 0.050 Uiso 1 2 d S . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Ag2 0.878(2) . ?
Ag1 S6 2.458(2) 7_565 ?
Ag1 S2 2.472(2) 7_565 ?
Ag1 S3 2.4827(17) . ?
Ag1 Ag4 2.845(2) 7_565 ?
Ag1 Ag8 2.906(2) 7_565 ?
Ag1 Ag6 2.943(2) . ?
Ag1 Ag3 3.3157(15) 7_565 ?
Ag1 Ag7 3.3709(15) 7_565 ?
Ag2 Ag4 2.249(3) 7_565 ?
Ag2 Ag8 2.301(3) 7_565 ?
Ag2 Ag6 2.359(3) . ?
Ag2 S3 2.654(2) . ?
Ag2 S2 2.668(3) 7_565 ?
Ag2 S6 2.673(3) 7_565 ?
Ag2 Ag3 2.923(2) 7_565 ?
Ag2 Ag7 2.943(2) 7_565 ?
Ag2 Ag5 2.966(2) . ?
Ag2 Ag4 3.185(3) . ?
Ag2 Ag6 3.250(3) 7_565 ?
Ag2 H0 1.982(2) . ?
Ag3 Ag4 0.9819(19) . ?
Ag3 S4 2.429(2) 7_565 ?
Ag3 S6 2.4369(18) . ?
Ag3 S1 2.4457(19) . ?
Ag3 Ag8 2.916(2) 7_565 ?
Ag3 Ag2 2.924(2) 7_565 ?
Ag3 Ag6 2.960(2) . ?
Ag3 Ag1 3.3158(15) 7_565 ?
Ag3 Ag7 3.3426(14) 7_565 ?
Ag3 Ag5 3.3531(14) . ?
Ag4 Ag2 2.249(3) 7_565 ?
Ag4 Ag8 2.265(3) 7_565 ?
Ag4 Ag6 2.319(3) . ?
Ag4 S6 2.651(2) . ?
Ag4 S1 2.681(2) . ?
Ag4 S4 2.685(2) 7_565 ?
Ag4 Ag1 2.845(2) 7_565 ?
Ag4 Ag7 2.902(2) 7_565 ?
Ag4 Ag5 2.911(2) . ?
Ag4 Ag6 3.201(3) 7_565 ?
Ag4 H0 1.917(2) . ?
Ag5 Ag6 0.858(2) . ?
Ag5 S5 2.4622(19) . ?
Ag5 S1 2.466(2) . ?
Ag5 S3 2.4692(19) . ?
Ag5 Ag8 2.898(2) . ?
Ag5 Ag7 3.3184(14) . ?
Ag6 Ag8 2.316(3) . ?
Ag6 S3 2.630(2) . ?
Ag6 S5 2.651(3) . ?
Ag6 S1 2.656(2) . ?
Ag6 Ag7 2.920(2) . ?
Ag6 Ag4 3.201(3) 7_565 ?
Ag6 Ag2 3.250(3) 7_565 ?
Ag6 H0 2.034(3) . ?
Ag7 Ag8 0.908(2) . ?
Ag7 S5 2.4518(18) . ?
Ag7 S4 2.4707(18) . ?
Ag7 S2 2.4727(19) . ?
Ag7 Ag4 2.902(2) 7_565 ?
Ag7 Ag2 2.943(2) 7_565 ?
Ag7 Ag3 3.3426(14) 7_565 ?
Ag7 Ag1 3.3709(15) 7_565 ?
Ag8 Ag4 2.265(3) 7_565 ?
Ag8 Ag2 2.301(3) 7_565 ?
Ag8 S2 2.656(2) . ?
Ag8 S4 2.658(2) . ?
Ag8 S5 2.675(2) . ?
Ag8 Ag1 2.906(2) 7_565 ?
Ag8 Ag3 2.916(2) 7_565 ?
Ag8 H0 2.037(3) . ?
S1 P1 1.987(3) . ?
S2 P1 2.008(2) . ?
S2 Ag1 2.471(2) 7_565 ?
S2 Ag2 2.667(3) 7_565 ?
S3 P2 1.993(2) . ?
S4 P2 2.009(2) 7_565 ?
S4 Ag3 2.429(2) 7_565 ?
S4 Ag4 2.685(2) 7_565 ?
S5 P3 2.010(2) . ?
S6 P3 2.002(2) 7_565 ?
S6 Ag1 2.458(2) 7_565 ?
S6 Ag2 2.673(3) 7_565 ?
P1 O2' 1.423(16) . ?
P1 O1 1.492(11) . ?
P1 O1' 1.704(10) . ?
P1 O2 1.758(14) . ?
P2 O4 1.566(5) . ?
P2 O3 1.570(6) . ?
P2 S4 2.009(2) 7_565 ?
P3 O5 1.556(5) . ?
P3 O6 1.587(9) . ?
P3 O6' 1.613(8) . ?
P3 S6 2.002(2) 7_565 ?
P4 F1 1.488(12) . ?
P4 F1 1.488(12) 2_556 ?
P4 F2 1.534(8) 2_556 ?
P4 F2 1.534(8) . ?
P4 F3B 1.66(2) . ?
P4 F3B 1.66(2) 2_556 ?
P4 F3A 1.681(14) . ?
P4 F3A 1.682(14) 2_556 ?
F2 F3B 1.77(2) . ?
O1 C1 1.426(10) . ?
O2 C4 1.450(10) . ?
O1' C1' 1.447(9) . ?
O2' C4' 1.450(10) . ?
O3 C7 1.437(12) . ?
O4 C10 1.480(9) . ?
O5 C13 1.485(8) . ?
O6 C16 1.450(9) . ?
O6' C16' 1.425(10) . ?
C1 C2 1.530(10) . ?
C1 C3 1.535(10) . ?
C1 H1 0.9800 . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C4 C5 1.538(10) . ?
C4 C6 1.539(10) . ?
C4 H4 0.9800 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C1' C3' 1.526(10) . ?
C1' C2' 1.529(10) . ?
C1' H1' 0.9800 . ?
C2' H2D 0.9600 . ?
C2' H2E 0.9600 . ?
C2' H2F 0.9600 . ?
C3' H3D 0.9600 . ?
C3' H3E 0.9600 . ?
C3' H3F 0.9600 . ?
C4' C5' 1.538(10) . ?
C4' C6' 1.539(10) . ?
C4' H4' 0.9800 . ?
C5' H5'1 0.9600 . ?
C5' H5'2 0.9600 . ?
C5' H5'3 0.9600 . ?
C6' H6'1 0.9600 . ?
C6' H6'2 0.9600 . ?
C6' H6'3 0.9600 . ?
C7 C8 1.440(17) . ?
C7 C9 1.516(16) . ?
C7 H7A 0.9800 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C10 C12 1.462(15) . ?
C10 C11 1.472(15) . ?
C10 H10A 0.9800 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C15 1.484(12) . ?
C13 C14 1.486(10) . ?
C13 H13A 0.9800 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C16 C18 1.531(10) . ?
C16 C17 1.537(10) . ?
C16 H16 0.9800 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C16' C17' 1.41(4) . ?
C16' C18' 1.537(10) . ?
C16' H16' 0.9800 . ?
C17' H17D 0.9600 . ?
C17' H17E 0.9600 . ?
C17' H17F 0.9600 . ?
C18' H18D 0.9600 . ?
C18' H18E 0.9600 . ?
C18' H18F 0.9600 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Ag2 Ag1 S6 94.44(17) . 7_565 ?
Ag2 Ag1 S2 93.12(16) . 7_565 ?
S6 Ag1 S2 122.24(7) 7_565 7_565 ?
Ag2 Ag1 S3 91.46(15) . . ?
S6 Ag1 S3 118.72(7) 7_565 . ?
S2 Ag1 S3 118.21(7) 7_565 . ?
Ag2 Ag1 Ag4 40.34(15) . 7_565 ?
S6 Ag1 Ag4 59.44(6) 7_565 7_565 ?
S2 Ag1 Ag4 95.12(6) 7_565 7_565 ?
S3 Ag1 Ag4 124.37(7) . 7_565 ?
Ag2 Ag1 Ag8 39.80(16) . 7_565 ?
S6 Ag1 Ag8 128.05(7) 7_565 7_565 ?
S2 Ag1 Ag8 58.52(6) 7_565 7_565 ?
S3 Ag1 Ag8 91.31(6) . 7_565 ?
Ag4 Ag1 Ag8 68.64(7) 7_565 7_565 ?
Ag2 Ag1 Ag6 41.60(15) . . ?
S6 Ag1 Ag6 91.00(6) 7_565 . ?
S2 Ag1 Ag6 128.27(8) 7_565 . ?
S3 Ag1 Ag6 57.25(6) . . ?
Ag4 Ag1 Ag6 67.13(6) 7_565 . ?
Ag8 Ag1 Ag6 69.83(7) 7_565 . ?
Ag2 Ag1 Ag3 56.45(15) . 7_565 ?
S6 Ag1 Ag3 47.09(5) 7_565 7_565 ?
S2 Ag1 Ag3 94.43(5) 7_565 7_565 ?
S3 Ag1 Ag3 136.36(6) . 7_565 ?
Ag4 Ag1 Ag3 16.13(4) 7_565 7_565 ?
Ag8 Ag1 Ag3 81.53(5) 7_565 7_565 ?
Ag6 Ag1 Ag3 80.14(5) . 7_565 ?
Ag2 Ag1 Ag7 54.11(16) . 7_565 ?
S6 Ag1 Ag7 138.64(6) 7_565 7_565 ?
S2 Ag1 Ag7 47.03(5) 7_565 7_565 ?
S3 Ag1 Ag7 91.05(5) . 7_565 ?
Ag4 Ag1 Ag7 80.43(5) 7_565 7_565 ?
Ag8 Ag1 Ag7 14.31(4) 7_565 7_565 ?
Ag6 Ag1 Ag7 81.50(5) . 7_565 ?
Ag3 Ag1 Ag7 91.57(4) 7_565 7_565 ?
Ag1 Ag2 Ag4 125.02(19) . 7_565 ?
Ag1 Ag2 Ag8 126.1(2) . 7_565 ?
Ag4 Ag2 Ag8 90.91(10) 7_565 7_565 ?
Ag1 Ag2 Ag6 124.10(19) . . ?
Ag4 Ag2 Ag6 87.96(10) 7_565 . ?
Ag8 Ag2 Ag6 91.83(11) 7_565 . ?
Ag1 Ag2 S3 69.23(15) . . ?
Ag4 Ag2 S3 148.06(10) 7_565 . ?
Ag8 Ag2 S3 102.27(9) 7_565 . ?
Ag6 Ag2 S3 62.96(7) . . ?
Ag1 Ag2 S2 67.69(16) . 7_565 ?
Ag4 Ag2 S2 105.89(8) 7_565 7_565 ?
Ag8 Ag2 S2 64.12(8) 7_565 7_565 ?
Ag6 Ag2 S2 151.83(11) . 7_565 ?
S3 Ag2 S2 106.04(9) . 7_565 ?
Ag1 Ag2 S6 66.44(16) . 7_565 ?
Ag4 Ag2 S6 64.49(8) 7_565 7_565 ?
Ag8 Ag2 S6 151.87(10) 7_565 7_565 ?
Ag6 Ag2 S6 100.24(9) . 7_565 ?
S3 Ag2 S6 105.86(9) . 7_565 ?
S2 Ag2 S6 107.84(9) 7_565 7_565 ?
Ag1 Ag2 Ag3 109.05(17) . 7_565 ?
Ag4 Ag2 Ag3 15.99(5) 7_565 7_565 ?
Ag8 Ag2 Ag3 101.83(9) 7_565 7_565 ?
Ag6 Ag2 Ag3 99.17(9) . 7_565 ?
S3 Ag2 Ag3 150.28(9) . 7_565 ?
S2 Ag2 Ag3 99.99(7) 7_565 7_565 ?
S6 Ag2 Ag3 51.39(5) 7_565 7_565 ?
Ag1 Ag2 Ag7 111.90(18) . 7_565 ?
Ag4 Ag2 Ag7 101.10(9) 7_565 7_565 ?
Ag8 Ag2 Ag7 14.16(6) 7_565 7_565 ?
Ag6 Ag2 Ag7 101.88(9) . 7_565 ?
S3 Ag2 Ag7 97.81(7) . 7_565 ?
S2 Ag2 Ag7 52.01(5) 7_565 7_565 ?
S6 Ag2 Ag7 153.07(8) 7_565 7_565 ?
Ag3 Ag2 Ag7 109.55(7) 7_565 7_565 ?
Ag1 Ag2 Ag5 110.96(17) . . ?
Ag4 Ag2 Ag5 97.52(9) 7_565 . ?
Ag8 Ag2 Ag5 100.67(9) 7_565 . ?
Ag6 Ag2 Ag5 13.17(6) . . ?
S3 Ag2 Ag5 51.76(5) . . ?
S2 Ag2 Ag5 151.84(8) 7_565 . ?
S6 Ag2 Ag5 96.17(7) 7_565 . ?
Ag3 Ag2 Ag5 106.55(7) 7_565 . ?
Ag7 Ag2 Ag5 108.67(7) 7_565 . ?
Ag1 Ag2 Ag4 146.93(18) . . ?
Ag4 Ag2 Ag4 87.98(10) 7_565 . ?
Ag8 Ag2 Ag4 45.30(7) 7_565 . ?
Ag6 Ag2 Ag4 46.56(7) . . ?
S3 Ag2 Ag4 81.36(7) . . ?
S2 Ag2 Ag4 108.35(8) 7_565 . ?
S6 Ag2 Ag4 139.25(9) 7_565 . ?
Ag3 Ag2 Ag4 103.97(8) 7_565 . ?
Ag7 Ag2 Ag4 56.35(5) 7_565 . ?
Ag5 Ag2 Ag4 56.35(5) . . ?
Ag1 Ag2 Ag6 144.25(18) . 7_565 ?
Ag4 Ag2 Ag6 45.52(7) 7_565 7_565 ?
Ag8 Ag2 Ag6 45.44(7) 7_565 7_565 ?
Ag6 Ag2 Ag6 91.57(11) . 7_565 ?
S3 Ag2 Ag6 140.36(9) . 7_565 ?
S2 Ag2 Ag6 81.83(7) 7_565 7_565 ?
S6 Ag2 Ag6 108.39(8) 7_565 7_565 ?
Ag3 Ag2 Ag6 57.02(5) 7_565 7_565 ?
Ag7 Ag2 Ag6 55.99(5) 7_565 7_565 ?
Ag5 Ag2 Ag6 104.74(9) . 7_565 ?
Ag4 Ag2 Ag6 59.65(6) . 7_565 ?
Ag1 Ag2 H0 177.7(2) . . ?
Ag4 Ag2 H0 53.43(8) 7_565 . ?
Ag8 Ag2 H0 56.20(8) 7_565 . ?
Ag6 Ag2 H0 55.05(8) . . ?
S3 Ag2 H0 111.15(9) . . ?
S2 Ag2 H0 114.10(9) 7_565 . ?
S6 Ag2 H0 111.38(9) 7_565 . ?
Ag3 Ag2 H0 69.42(6) 7_565 . ?
Ag7 Ag2 H0 70.36(7) 7_565 . ?
Ag5 Ag2 H0 68.22(6) . . ?
Ag4 Ag2 H0 34.55(5) . . ?
Ag6 Ag2 H0 36.52(5) 7_565 . ?
Ag4 Ag3 S4 94.11(13) . 7_565 ?
Ag4 Ag3 S6 91.47(12) . . ?
S4 Ag3 S6 119.26(7) 7_565 . ?
Ag4 Ag3 S1 92.91(12) . . ?
S4 Ag3 S1 121.79(7) 7_565 . ?
S6 Ag3 S1 118.21(7) . . ?
Ag4 Ag3 Ag8 40.76(12) . 7_565 ?
S4 Ag3 Ag8 58.80(6) 7_565 7_565 ?
S6 Ag3 Ag8 91.76(6) . 7_565 ?
S1 Ag3 Ag8 127.38(7) . 7_565 ?
Ag4 Ag3 Ag2 39.13(12) . 7_565 ?
S4 Ag3 Ag2 127.49(7) 7_565 7_565 ?
S6 Ag3 Ag2 58.99(6) . 7_565 ?
S1 Ag3 Ag2 89.96(6) . 7_565 ?
Ag8 Ag3 Ag2 68.70(7) 7_565 7_565 ?
Ag4 Ag3 Ag6 41.54(12) . . ?
S4 Ag3 Ag6 94.02(6) 7_565 . ?
S6 Ag3 Ag6 126.02(7) . . ?
S1 Ag3 Ag6 57.92(6) . . ?
Ag8 Ag3 Ag6 69.46(7) 7_565 . ?
Ag2 Ag3 Ag6 67.05(7) 7_565 . ?
Ag4 Ag3 Ag1 53.61(11) . 7_565 ?
S4 Ag3 Ag1 137.88(6) 7_565 7_565 ?
S6 Ag3 Ag1 47.62(5) . 7_565 ?
S1 Ag3 Ag1 89.53(5) . 7_565 ?
Ag8 Ag3 Ag1 80.19(5) 7_565 7_565 ?
Ag2 Ag3 Ag1 14.50(4) 7_565 7_565 ?
Ag6 Ag3 Ag1 78.85(5) . 7_565 ?
Ag4 Ag3 Ag7 55.50(11) . 7_565 ?
S4 Ag3 Ag7 47.50(5) 7_565 7_565 ?
S6 Ag3 Ag7 90.90(5) . 7_565 ?
S1 Ag3 Ag7 138.82(6) . 7_565 ?
Ag8 Ag3 Ag7 14.75(4) 7_565 7_565 ?
Ag2 Ag3 Ag7 80.61(5) 7_565 7_565 ?
Ag6 Ag3 Ag7 81.73(5) . 7_565 ?
Ag1 Ag3 Ag7 90.41(4) 7_565 7_565 ?
Ag4 Ag3 Ag5 55.45(11) . . ?
S4 Ag3 Ag5 93.65(5) 7_565 . ?
S6 Ag3 Ag5 136.03(6) . . ?
S1 Ag3 Ag5 47.21(5) . . ?
Ag8 Ag3 Ag5 80.80(5) 7_565 . ?
Ag2 Ag3 Ag5 78.19(5) 7_565 . ?
Ag6 Ag3 Ag5 13.91(4) . . ?
Ag1 Ag3 Ag5 88.46(4) 7_565 . ?
Ag7 Ag3 Ag5 91.62(4) 7_565 . ?
Ag3 Ag4 Ag2 124.88(15) . 7_565 ?
Ag3 Ag4 Ag8 122.79(16) . 7_565 ?
Ag2 Ag4 Ag8 93.77(10) 7_565 7_565 ?
Ag3 Ag4 Ag6 122.15(15) . . ?
Ag2 Ag4 Ag6 90.69(10) 7_565 . ?
Ag8 Ag4 Ag6 93.84(10) 7_565 . ?
Ag3 Ag4 S6 66.79(11) . . ?
Ag2 Ag4 S6 65.54(8) 7_565 . ?
Ag8 Ag4 S6 103.10(8) 7_565 . ?
Ag6 Ag4 S6 151.32(10) . . ?
Ag3 Ag4 S1 65.63(12) . . ?
Ag2 Ag4 S1 100.86(8) 7_565 . ?
Ag8 Ag4 S1 153.01(9) 7_565 . ?
Ag6 Ag4 S1 63.68(8) . . ?
S6 Ag4 S1 103.59(8) . . ?
Ag3 Ag4 S4 64.49(12) . 7_565 ?
Ag2 Ag4 S4 153.74(9) 7_565 7_565 ?
Ag8 Ag4 S4 64.30(8) 7_565 7_565 ?
Ag6 Ag4 S4 104.37(8) . 7_565 ?
S6 Ag4 S4 103.80(9) . 7_565 ?
S1 Ag4 S4 105.08(8) . 7_565 ?
Ag3 Ag4 Ag1 110.26(13) . 7_565 ?
Ag2 Ag4 Ag1 14.64(6) 7_565 7_565 ?
Ag8 Ag4 Ag1 103.36(9) 7_565 7_565 ?
Ag6 Ag4 Ag1 100.88(9) . 7_565 ?
S6 Ag4 Ag1 52.99(6) . 7_565 ?
S1 Ag4 Ag1 95.86(7) . 7_565 ?
S4 Ag4 Ag1 152.43(8) 7_565 7_565 ?
Ag3 Ag4 Ag7 108.31(14) . 7_565 ?
Ag2 Ag4 Ag7 103.53(9) 7_565 7_565 ?
Ag8 Ag4 Ag7 14.50(6) 7_565 7_565 ?
Ag6 Ag4 Ag7 104.17(9) . 7_565 ?
S6 Ag4 Ag7 97.18(6) . 7_565 ?
S1 Ag4 Ag7 152.89(8) . 7_565 ?
S4 Ag4 Ag7 52.32(5) 7_565 7_565 ?
Ag1 Ag4 Ag7 110.61(7) 7_565 7_565 ?
Ag3 Ag4 Ag5 108.42(13) . . ?
Ag2 Ag4 Ag5 99.89(9) 7_565 . ?
Ag8 Ag4 Ag5 103.23(9) 7_565 . ?
Ag6 Ag4 Ag5 13.73(5) . . ?
S6 Ag4 Ag5 150.62(8) . . ?
S1 Ag4 Ag5 52.14(5) . . ?
S4 Ag4 Ag5 99.21(6) 7_565 . ?
Ag1 Ag4 Ag5 107.83(7) 7_565 . ?
Ag7 Ag4 Ag5 111.38(7) 7_565 . ?
Ag3 Ag4 Ag2 143.08(14) . . ?
Ag2 Ag4 Ag2 92.02(10) 7_565 . ?
Ag8 Ag4 Ag2 46.24(7) 7_565 . ?
Ag6 Ag4 Ag2 47.63(7) . . ?
S6 Ag4 Ag2 142.55(8) . . ?
S1 Ag4 Ag2 110.13(7) . . ?
S4 Ag4 Ag2 83.00(7) 7_565 . ?
Ag1 Ag4 Ag2 106.65(9) 7_565 . ?
Ag7 Ag4 Ag2 57.62(5) 7_565 . ?
Ag5 Ag4 Ag2 58.02(5) . . ?
Ag3 Ag4 Ag6 144.28(14) . 7_565 ?
Ag2 Ag4 Ag6 47.45(7) 7_565 7_565 ?
Ag8 Ag4 Ag6 46.32(7) 7_565 7_565 ?
Ag6 Ag4 Ag6 93.57(10) . 7_565 ?
S6 Ag4 Ag6 82.15(7) . 7_565 ?
S1 Ag4 Ag6 142.74(9) . 7_565 ?
S4 Ag4 Ag6 109.20(7) 7_565 7_565 ?
Ag1 Ag4 Ag6 57.90(5) 7_565 7_565 ?
Ag7 Ag4 Ag6 56.92(5) 7_565 7_565 ?
Ag5 Ag4 Ag6 107.30(8) . 7_565 ?
Ag2 Ag4 Ag6 61.18(6) . 7_565 ?
Ag3 Ag4 H0 178.53(16) . . ?
Ag2 Ag4 H0 56.13(8) 7_565 . ?
Ag8 Ag4 H0 57.58(8) 7_565 . ?
Ag6 Ag4 H0 56.44(8) . . ?
S6 Ag4 H0 114.62(8) . . ?
S1 Ag4 H0 113.35(8) . . ?
S4 Ag4 H0 115.13(9) 7_565 . ?
Ag1 Ag4 H0 70.76(6) 7_565 . ?
Ag7 Ag4 H0 72.08(6) 7_565 . ?
Ag5 Ag4 H0 70.17(6) . . ?
Ag2 Ag4 H0 35.89(5) . . ?
Ag6 Ag4 H0 37.13(5) 7_565 . ?
Ag6 Ag5 S5 93.12(16) . . ?
Ag6 Ag5 S1 93.18(16) . . ?
S5 Ag5 S1 121.02(7) . . ?
Ag6 Ag5 S3 91.16(16) . . ?
S5 Ag5 S3 119.61(7) . . ?
S1 Ag5 S3 118.81(7) . . ?
Ag6 Ag5 Ag8 40.63(15) . . ?
S5 Ag5 Ag8 59.19(6) . . ?
S1 Ag5 Ag8 92.21(6) . . ?
S3 Ag5 Ag8 125.93(7) . . ?
Ag6 Ag5 Ag4 39.89(15) . . ?
S5 Ag5 Ag4 127.06(7) . . ?
S1 Ag5 Ag4 59.14(6) . . ?
S3 Ag5 Ag4 90.32(6) . . ?
Ag8 Ag5 Ag4 67.87(7) . . ?
Ag6 Ag5 Ag2 38.81(15) . . ?
S5 Ag5 Ag2 93.31(6) . . ?
S1 Ag5 Ag2 124.72(7) . . ?
S3 Ag5 Ag2 57.60(6) . . ?
Ag8 Ag5 Ag2 68.35(7) . . ?
Ag4 Ag5 Ag2 65.63(6) . . ?
Ag6 Ag5 Ag7 55.52(15) . . ?
S5 Ag5 Ag7 47.39(5) . . ?
S1 Ag5 Ag7 92.32(5) . . ?
S3 Ag5 Ag7 136.74(5) . . ?
Ag8 Ag5 Ag7 14.91(4) . . ?
Ag4 Ag5 Ag7 80.42(5) . . ?
Ag2 Ag5 Ag7 80.41(5) . . ?
Ag6 Ag5 Ag3 56.02(15) . . ?
S5 Ag5 Ag3 139.20(6) . . ?
S1 Ag5 Ag3 46.69(5) . . ?
S3 Ag5 Ag3 89.75(5) . . ?
Ag8 Ag5 Ag3 80.99(5) . . ?
Ag4 Ag5 Ag3 16.13(4) . . ?
Ag2 Ag5 Ag3 78.60(5) . . ?
Ag7 Ag5 Ag3 91.84(4) . . ?
Ag5 Ag6 Ag8 125.4(2) . . ?
Ag5 Ag6 Ag4 126.38(19) . . ?
Ag8 Ag6 Ag4 88.82(11) . . ?
Ag5 Ag6 Ag2 128.0(2) . . ?
Ag8 Ag6 Ag2 89.62(10) . . ?
Ag4 Ag6 Ag2 85.81(11) . . ?
Ag5 Ag6 S3 69.81(15) . . ?
Ag8 Ag6 S3 150.63(10) . . ?
Ag4 Ag6 S3 101.13(9) . . ?
Ag2 Ag6 S3 64.01(8) . . ?
Ag5 Ag6 S5 68.03(16) . . ?
Ag8 Ag6 S5 64.75(8) . . ?
Ag4 Ag6 S5 151.14(10) . . ?
Ag2 Ag6 S5 104.39(9) . . ?
S3 Ag6 S5 107.61(9) . . ?
Ag5 Ag6 S1 68.00(15) . . ?
Ag8 Ag6 S1 102.29(9) . . ?
Ag4 Ag6 S1 64.82(8) . . ?
Ag2 Ag6 S1 147.69(11) . . ?
S3 Ag6 S1 106.96(9) . . ?
S5 Ag6 S1 107.87(9) . . ?
Ag5 Ag6 Ag7 110.46(18) . . ?
Ag8 Ag6 Ag7 14.98(6) . . ?
Ag4 Ag6 Ag7 100.07(9) . . ?
Ag2 Ag6 Ag7 100.19(9) . . ?
S3 Ag6 Ag7 152.31(8) . . ?
S5 Ag6 Ag7 51.95(5) . . ?
S1 Ag6 Ag7 98.08(7) . . ?
Ag5 Ag6 Ag1 113.76(18) . . ?
Ag8 Ag6 Ag1 99.20(9) . . ?
Ag4 Ag6 Ag1 96.59(9) . . ?
Ag2 Ag6 Ag1 14.30(5) . . ?
S3 Ag6 Ag1 52.54(5) . . ?
S5 Ag6 Ag1 98.82(7) . . ?
S1 Ag6 Ag1 150.98(8) . . ?
Ag7 Ag6 Ag1 107.41(7) . . ?
Ag5 Ag6 Ag3 110.07(17) . . ?
Ag8 Ag6 Ag3 100.39(9) . . ?
Ag4 Ag6 Ag3 16.31(5) . . ?
Ag2 Ag6 Ag3 97.32(9) . . ?
S3 Ag6 Ag3 95.84(7) . . ?
S5 Ag6 Ag3 153.22(8) . . ?
S1 Ag6 Ag3 51.28(5) . . ?
Ag7 Ag6 Ag3 109.19(7) . . ?
Ag1 Ag6 Ag3 105.77(7) . . ?
Ag5 Ag6 Ag4 147.19(18) . 7_565 ?
Ag8 Ag6 Ag4 45.02(7) . 7_565 ?
Ag4 Ag6 Ag4 86.43(10) . 7_565 ?
Ag2 Ag6 Ag4 44.60(7) . 7_565 ?
S3 Ag6 Ag4 107.52(8) . 7_565 ?
S5 Ag6 Ag4 82.70(7) . 7_565 ?
S1 Ag6 Ag4 138.51(9) . 7_565 ?
Ag7 Ag6 Ag4 56.37(5) . 7_565 ?
Ag1 Ag6 Ag4 54.98(5) . 7_565 ?
Ag3 Ag6 Ag4 102.74(8) . 7_565 ?
Ag5 Ag6 Ag2 143.50(19) . 7_565 ?
Ag8 Ag6 Ag2 45.08(7) . 7_565 ?
Ag4 Ag6 Ag2 43.79(7) . 7_565 ?
Ag2 Ag6 Ag2 88.43(11) . 7_565 ?
S3 Ag6 Ag2 138.81(10) . 7_565 ?
S5 Ag6 Ag2 108.62(8) . 7_565 ?
S1 Ag6 Ag2 79.67(7) . 7_565 ?
Ag7 Ag6 Ag2 56.69(6) . 7_565 ?
Ag1 Ag6 Ag2 102.72(9) . 7_565 ?
Ag3 Ag6 Ag2 55.94(5) . 7_565 ?
Ag4 Ag6 Ag2 59.17(6) 7_565 7_565 ?
Ag5 Ag6 H0 178.1(2) . . ?
Ag8 Ag6 H0 55.39(8) . . ?
Ag4 Ag6 H0 51.75(7) . . ?
Ag2 Ag6 H0 52.99(8) . . ?
S3 Ag6 H0 110.30(9) . . ?
S5 Ag6 H0 113.53(9) . . ?
S1 Ag6 H0 110.30(9) . . ?
Ag7 Ag6 H0 70.36(6) . . ?
Ag1 Ag6 H0 67.28(6) . . ?
Ag3 Ag6 H0 68.06(6) . . ?
Ag4 Ag6 H0 34.67(5) 7_565 . ?
Ag2 Ag6 H0 35.44(5) 7_565 . ?
Ag8 Ag7 S5 94.09(15) . . ?
Ag8 Ag7 S4 91.73(14) . . ?
S5 Ag7 S4 120.31(7) . . ?
Ag8 Ag7 S2 91.45(15) . . ?
S5 Ag7 S2 120.05(6) . . ?
S4 Ag7 S2 119.10(7) . . ?
Ag8 Ag7 Ag4 38.66(13) . 7_565 ?
S5 Ag7 Ag4 92.77(6) . 7_565 ?
S4 Ag7 Ag4 59.32(6) . 7_565 ?
S2 Ag7 Ag4 124.25(7) . 7_565 ?
Ag8 Ag7 Ag6 41.24(13) . . ?
S5 Ag7 Ag6 58.37(6) . . ?
S4 Ag7 Ag6 125.99(7) . . ?
S2 Ag7 Ag6 92.28(6) . . ?
Ag4 Ag7 Ag6 66.72(7) 7_565 . ?
Ag8 Ag7 Ag2 38.32(14) . 7_565 ?
S5 Ag7 Ag2 125.67(7) . 7_565 ?
S4 Ag7 Ag2 91.97(6) . 7_565 ?
S2 Ag7 Ag2 58.24(6) . 7_565 ?
Ag4 Ag7 Ag2 66.03(6) 7_565 7_565 ?
Ag6 Ag7 Ag2 67.32(7) . 7_565 ?
Ag8 Ag7 Ag5 55.24(13) . . ?
S5 Ag7 Ag5 47.66(5) . . ?
S4 Ag7 Ag5 136.70(6) . . ?
S2 Ag7 Ag5 91.58(5) . . ?
Ag4 Ag7 Ag5 78.52(5) 7_565 . ?
Ag6 Ag7 Ag5 14.02(4) . . ?
Ag2 Ag7 Ag5 78.49(5) 7_565 . ?
Ag8 Ag7 Ag3 54.83(13) . 7_565 ?
S5 Ag7 Ag3 92.64(5) . 7_565 ?
S4 Ag7 Ag3 46.47(5) . 7_565 ?
S2 Ag7 Ag3 135.88(6) . 7_565 ?
Ag4 Ag7 Ag3 16.19(4) 7_565 7_565 ?
Ag6 Ag7 Ag3 80.01(5) . 7_565 ?
Ag2 Ag7 Ag3 79.08(5) 7_565 7_565 ?
Ag5 Ag7 Ag3 90.25(4) . 7_565 ?
Ag8 Ag7 Ag1 52.30(13) . 7_565 ?
S5 Ag7 Ag1 135.72(6) . 7_565 ?
S4 Ag7 Ag1 91.87(5) . 7_565 ?
S2 Ag7 Ag1 47.00(5) . 7_565 ?
Ag4 Ag7 Ag1 77.67(5) 7_565 7_565 ?
Ag6 Ag7 Ag1 78.50(5) . 7_565 ?
Ag2 Ag7 Ag1 13.99(4) 7_565 7_565 ?
Ag5 Ag7 Ag1 88.12(4) . 7_565 ?
Ag3 Ag7 Ag1 89.04(4) 7_565 7_565 ?
Ag7 Ag8 Ag4 126.84(17) . 7_565 ?
Ag7 Ag8 Ag2 127.52(18) . 7_565 ?
Ag4 Ag8 Ag2 88.46(11) 7_565 7_565 ?
Ag7 Ag8 Ag6 123.78(17) . . ?
Ag4 Ag8 Ag6 88.66(11) 7_565 . ?
Ag2 Ag8 Ag6 89.48(11) 7_565 . ?
Ag7 Ag8 S2 68.56(14) . . ?
Ag4 Ag8 S2 150.11(10) 7_565 . ?
Ag2 Ag8 S2 64.65(8) 7_565 . ?
Ag6 Ag8 S2 103.15(8) . . ?
Ag7 Ag8 S4 68.30(13) . . ?
Ag4 Ag8 S4 65.54(8) 7_565 . ?
Ag2 Ag8 S4 103.76(8) 7_565 . ?
Ag6 Ag8 S4 150.19(10) . . ?
S2 Ag8 S4 106.65(9) . . ?
Ag7 Ag8 S5 66.12(14) . . ?
Ag4 Ag8 S5 103.53(8) 7_565 . ?
Ag2 Ag8 S5 149.85(10) 7_565 . ?
Ag6 Ag8 S5 63.71(8) . . ?
S2 Ag8 S5 106.32(9) . . ?
S4 Ag8 S5 106.39(9) . . ?
Ag7 Ag8 Ag5 109.85(15) . . ?
Ag4 Ag8 Ag5 99.06(9) 7_565 . ?
Ag2 Ag8 Ag5 98.98(9) 7_565 . ?
Ag6 Ag8 Ag5 13.96(6) . . ?
S2 Ag8 Ag5 97.93(6) . . ?
S4 Ag8 Ag5 151.85(8) . . ?
S5 Ag8 Ag5 52.25(5) . . ?
Ag7 Ag8 Ag1 113.38(16) . 7_565 ?
Ag4 Ag8 Ag1 98.87(9) 7_565 7_565 ?
Ag2 Ag8 Ag1 14.14(6) 7_565 7_565 ?
Ag6 Ag8 Ag1 99.21(9) . 7_565 ?
S2 Ag8 Ag1 52.53(5) . 7_565 ?
S4 Ag8 Ag1 99.33(7) . 7_565 ?
S5 Ag8 Ag1 151.12(7) . 7_565 ?
Ag5 Ag8 Ag1 106.54(7) . 7_565 ?
Ag7 Ag8 Ag3 110.42(15) . 7_565 ?
Ag4 Ag8 Ag3 16.45(5) 7_565 7_565 ?
Ag2 Ag8 Ag3 99.93(9) 7_565 7_565 ?
Ag6 Ag8 Ag3 100.45(9) . 7_565 ?
S2 Ag8 Ag3 151.43(8) . 7_565 ?
S4 Ag8 Ag3 51.43(5) . 7_565 ?
S5 Ag8 Ag3 98.42(6) . 7_565 ?
Ag5 Ag8 Ag3 108.56(7) . 7_565 ?
Ag1 Ag8 Ag3 107.91(7) 7_565 7_565 ?
Ag7 Ag8 Ag4 146.82(16) . . ?
Ag4 Ag8 Ag4 86.30(10) 7_565 . ?
Ag2 Ag8 Ag4 43.90(7) 7_565 . ?
Ag6 Ag8 Ag4 45.63(7) . . ?
S2 Ag8 Ag4 82.96(7) . . ?
S4 Ag8 Ag4 139.29(9) . . ?
S5 Ag8 Ag4 108.49(7) . . ?
Ag5 Ag8 Ag4 56.25(5) . . ?
Ag1 Ag8 Ag4 54.79(5) 7_565 . ?
Ag3 Ag8 Ag4 102.74(9) 7_565 . ?
Ag7 Ag8 Ag2 144.16(17) . . ?
Ag4 Ag8 Ag2 42.93(7) 7_565 . ?
Ag2 Ag8 Ag2 88.32(11) 7_565 . ?
Ag6 Ag8 Ag2 45.73(7) . . ?
S2 Ag8 Ag2 140.73(9) . . ?
S4 Ag8 Ag2 107.19(8) . . ?
S5 Ag8 Ag2 82.48(7) . . ?
Ag5 Ag8 Ag2 56.79(5) . . ?
Ag1 Ag8 Ag2 102.46(9) 7_565 . ?
Ag3 Ag8 Ag2 55.76(5) 7_565 . ?
Ag4 Ag8 Ag2 58.30(6) . . ?
Ag7 Ag8 H0 178.5(2) . . ?
Ag4 Ag8 H0 52.60(8) 7_565 . ?
Ag2 Ag8 H0 53.95(8) 7_565 . ?
Ag6 Ag8 H0 55.27(8) . . ?
S2 Ag8 H0 112.60(9) . . ?
S4 Ag8 H0 111.92(9) . . ?
S5 Ag8 H0 112.50(9) . . ?
Ag5 Ag8 H0 69.22(6) . . ?
Ag1 Ag8 H0 68.08(6) 7_565 . ?
Ag3 Ag8 H0 69.04(6) 7_565 . ?
Ag4 Ag8 H0 33.69(5) . . ?
Ag2 Ag8 H0 34.38(5) . . ?
P1 S1 Ag3 112.01(10) . . ?
P1 S1 Ag5 108.68(10) . . ?
Ag3 S1 Ag5 86.10(6) . . ?
P1 S1 Ag6 103.61(9) . . ?
Ag3 S1 Ag6 70.80(7) . . ?
Ag5 S1 Ag6 18.82(5) . . ?
P1 S1 Ag4 104.71(9) . . ?
Ag3 S1 Ag4 21.45(4) . . ?
Ag5 S1 Ag4 68.72(6) . . ?
Ag6 S1 Ag4 51.50(8) . . ?
P1 S2 Ag1 106.35(10) . 7_565 ?
P1 S2 Ag7 109.20(9) . . ?
Ag1 S2 Ag7 85.97(6) 7_565 . ?
P1 S2 Ag8 103.11(9) . . ?
Ag1 S2 Ag8 68.94(7) 7_565 . ?
Ag7 S2 Ag8 19.98(4) . . ?
P1 S2 Ag2 101.36(10) . 7_565 ?
Ag1 S2 Ag2 19.19(4) 7_565 7_565 ?
Ag7 S2 Ag2 69.75(7) . 7_565 ?
Ag8 S2 Ag2 51.22(8) . 7_565 ?
P2 S3 Ag5 108.01(9) . . ?
P2 S3 Ag1 111.88(8) . . ?
Ag5 S3 Ag1 86.12(6) . . ?
P2 S3 Ag6 103.58(9) . . ?
Ag5 S3 Ag6 19.03(5) . . ?
Ag1 S3 Ag6 70.21(7) . . ?
P2 S3 Ag2 104.91(9) . . ?
Ag5 S3 Ag2 70.63(7) . . ?
Ag1 S3 Ag2 19.31(4) . . ?
Ag6 S3 Ag2 53.03(8) . . ?
P2 S4 Ag3 105.77(9) 7_565 7_565 ?
P2 S4 Ag7 111.17(9) 7_565 . ?
Ag3 S4 Ag7 86.02(6) 7_565 . ?
P2 S4 Ag8 103.58(9) 7_565 . ?
Ag3 S4 Ag8 69.77(7) 7_565 . ?
Ag7 S4 Ag8 19.96(4) . . ?
P2 S4 Ag4 100.24(9) 7_565 7_565 ?
Ag3 S4 Ag4 21.39(4) 7_565 7_565 ?
Ag7 S4 Ag4 68.35(6) . 7_565 ?
Ag8 S4 Ag4 50.16(7) . 7_565 ?
P3 S5 Ag7 108.39(8) . . ?
P3 S5 Ag5 109.42(9) . . ?
Ag7 S5 Ag5 84.95(6) . . ?
P3 S5 Ag6 102.99(9) . . ?
Ag7 S5 Ag6 69.68(7) . . ?
Ag5 S5 Ag6 18.85(4) . . ?
P3 S5 Ag8 102.59(8) . . ?
Ag7 S5 Ag8 19.79(4) . . ?
Ag5 S5 Ag8 68.56(7) . . ?
Ag6 S5 Ag8 51.55(7) . . ?
P3 S6 Ag3 110.59(9) 7_565 . ?
P3 S6 Ag1 110.73(8) 7_565 7_565 ?
Ag3 S6 Ag1 85.28(6) . 7_565 ?
P3 S6 Ag4 104.11(9) 7_565 . ?
Ag3 S6 Ag4 21.74(4) . . ?
Ag1 S6 Ag4 67.57(7) 7_565 . ?
P3 S6 Ag2 105.16(9) 7_565 7_565 ?
Ag3 S6 Ag2 69.62(7) . 7_565 ?
Ag1 S6 Ag2 19.12(4) 7_565 7_565 ?
Ag4 S6 Ag2 49.97(7) . 7_565 ?
O2' P1 O1 71.4(9) . . ?
O2' P1 O1' 107.5(7) . . ?
O1 P1 O1' 41.2(5) . . ?
O2' P1 O2 24.3(7) . . ?
O1 P1 O2 91.8(8) . . ?
O1' P1 O2 131.0(6) . . ?
O2' P1 S1 108.8(7) . . ?
O1 P1 S1 123.8(5) . . ?
O1' P1 S1 93.7(3) . . ?
O2 P1 S1 108.5(5) . . ?
O2' P1 S2 113.8(5) . . ?
O1 P1 S2 106.8(5) . . ?
O1' P1 S2 108.9(3) . . ?
O2 P1 S2 96.0(4) . . ?
S1 P1 S2 121.57(10) . . ?
O4 P2 O3 108.7(4) . . ?
O4 P2 S3 111.0(2) . . ?
O3 P2 S3 102.9(3) . . ?
O4 P2 S4 102.4(2) . 7_565 ?
O3 P2 S4 109.8(3) . 7_565 ?
S3 P2 S4 121.84(10) . 7_565 ?
O5 P3 O6 94.3(4) . . ?
O5 P3 O6' 119.6(6) . . ?
O6 P3 O6' 28.2(4) . . ?
O5 P3 S6 109.5(2) . 7_565 ?
O6 P3 S6 115.6(4) . 7_565 ?
O6' P3 S6 93.5(5) . 7_565 ?
O5 P3 S5 103.98(19) . . ?
O6 P3 S5 108.3(4) . . ?
O6' P3 S5 110.1(5) . . ?
S6 P3 S5 121.10(10) 7_565 . ?
F1 P4 F1 88.1(12) . 2_556 ?
F1 P4 F2 145.0(10) . 2_556 ?
F1 P4 F2 103.1(6) 2_556 2_556 ?
F1 P4 F2 103.1(6) . . ?
F1 P4 F2 145.0(10) 2_556 . ?
F2 P4 F2 86.6(12) 2_556 . ?
F1 P4 F3B 70.4(8) . . ?
F1 P4 F3B 86.5(10) 2_556 . ?
F2 P4 F3B 142.2(12) 2_556 . ?
F2 P4 F3B 67.2(8) . . ?
F1 P4 F3B 86.5(10) . 2_556 ?
F1 P4 F3B 70.4(8) 2_556 2_556 ?
F2 P4 F3B 67.2(8) 2_556 2_556 ?
F2 P4 F3B 142.2(12) . 2_556 ?
F3B P4 F3B 148.0(16) . 2_556 ?
F1 P4 F3A 72.9(8) . . ?
F1 P4 F3A 143.9(12) 2_556 . ?
F2 P4 F3A 79.2(9) 2_556 . ?
F2 P4 F3A 70.6(8) . . ?
F3B P4 F3A 114.1(9) . . ?
F3B P4 F3A 77.8(9) 2_556 . ?
F1 P4 F3A 143.9(12) . 2_556 ?
F1 P4 F3A 72.9(8) 2_556 2_556 ?
F2 P4 F3A 70.6(8) 2_556 2_556 ?
F2 P4 F3A 79.2(9) . 2_556 ?
F3B P4 F3A 77.8(9) . 2_556 ?
F3B P4 F3A 114.1(9) 2_556 2_556 ?
F3A P4 F3A 138.2(15) . 2_556 ?
P4 F2 F3B 59.9(7) . . ?
P4 F3B F2 53.0(8) . . ?
C1 O1 P1 120.2(13) . . ?
C4 O2 P1 113.6(18) . . ?
C1' O1' P1 116.7(10) . . ?
P1 O2' C4' 133.7(18) . . ?
C7 O3 P2 124.9(7) . . ?
C10 O4 P2 128.6(5) . . ?
C13 O5 P3 121.8(4) . . ?
C16 O6 P3 122.1(9) . . ?
C16' O6' P3 124.4(14) . . ?
O1 C1 C2 113.3(19) . . ?
O1 C1 C3 100.6(16) . . ?
C2 C1 C3 116(2) . . ?
O1 C1 H1 108.8 . . ?
C2 C1 H1 108.8 . . ?
C3 C1 H1 108.8 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
O2 C4 C5 105(2) . . ?
O2 C4 C6 119(3) . . ?
C5 C4 C6 120(3) . . ?
O2 C4 H4 103.8 . . ?
C5 C4 H4 103.8 . . ?
C6 C4 H4 103.8 . . ?
O1' C1' C3' 110.1(14) . . ?
O1' C1' C2' 101.2(16) . . ?
C3' C1' C2' 103(2) . . ?
O1' C1' H1' 113.7 . . ?
C3' C1' H1' 113.7 . . ?
C2' C1' H1' 113.7 . . ?
C1' C2' H2D 109.5 . . ?
C1' C2' H2E 109.5 . . ?
H2D C2' H2E 109.5 . . ?
C1' C2' H2F 109.5 . . ?
H2D C2' H2F 109.5 . . ?
H2E C2' H2F 109.5 . . ?
C1' C3' H3D 109.5 . . ?
C1' C3' H3E 109.5 . . ?
H3D C3' H3E 109.5 . . ?
C1' C3' H3F 109.5 . . ?
H3D C3' H3F 109.5 . . ?
H3E C3' H3F 109.5 . . ?
O2' C4' C5' 108(2) . . ?
O2' C4' C6' 104(2) . . ?
C5' C4' C6' 100(3) . . ?
O2' C4' H4' 114.3 . . ?
C5' C4' H4' 114.3 . . ?
C6' C4' H4' 114.3 . . ?
C4' C5' H5'1 109.5 . . ?
C4' C5' H5'2 109.5 . . ?
H5'1 C5' H5'2 109.5 . . ?
C4' C5' H5'3 109.5 . . ?
H5'1 C5' H5'3 109.5 . . ?
H5'2 C5' H5'3 109.5 . . ?
C4' C6' H6'1 109.5 . . ?
C4' C6' H6'2 109.5 . . ?
H6'1 C6' H6'2 109.5 . . ?
C4' C6' H6'3 109.5 . . ?
H6'1 C6' H6'3 109.5 . . ?
H6'2 C6' H6'3 109.5 . . ?
O3 C7 C8 106.9(11) . . ?
O3 C7 C9 106.2(11) . . ?
C8 C7 C9 113.5(11) . . ?
O3 C7 H7A 110.0 . . ?
C8 C7 H7A 110.0 . . ?
C9 C7 H7A 110.0 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C12 C10 C11 112.3(8) . . ?
C12 C10 O4 109.2(9) . . ?
C11 C10 O4 107.4(8) . . ?
C12 C10 H10A 109.3 . . ?
C11 C10 H10A 109.3 . . ?
O4 C10 H10A 109.3 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C15 C13 O5 107.3(6) . . ?
C15 C13 C14 112.6(7) . . ?
O5 C13 C14 106.7(6) . . ?
C15 C13 H13A 110.1 . . ?
O5 C13 H13A 110.1 . . ?
C14 C13 H13A 110.1 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
O6 C16 C18 106.5(13) . . ?
O6 C16 C17 111.1(19) . . ?
C18 C16 C17 115.1(16) . . ?
O6 C16 H16 108.0 . . ?
C18 C16 H16 108.0 . . ?
C17 C16 H16 108.0 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C17' C16' O6' 110(2) . . ?
C17' C16' C18' 113(2) . . ?
O6' C16' C18' 104.0(14) . . ?
C17' C16' H16' 110.0 . . ?
O6' C16' H16' 110.0 . . ?
C18' C16' H16' 110.0 . . ?
C16' C17' H17D 109.5 . . ?
C16' C17' H17E 109.5 . . ?
H17D C17' H17E 109.5 . . ?
C16' C17' H17F 109.5 . . ?
H17D C17' H17F 109.5 . . ?
H17E C17' H17F 109.5 . . ?
C16' C18' H18D 109.5 . . ?
C16' C18' H18E 109.5 . . ?
H18D C18' H18E 109.5 . . ?
C16' C18' H18F 109.5 . . ?
H18D C18' H18F 109.5 . . ?
H18E C18' H18F 109.5 . . ?

_diffrn_measured_fraction_theta_max 1.000
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 1.000
_refine_diff_density_max         3.670
_refine_diff_density_min         -0.584
_refine_diff_density_rms         0.104
_database_code_depnum_ccdc_archive 'CCDC 977329'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_6

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C36 H84 Ag8 O12 P6 S13'
_chemical_formula_weight         2174.59

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Triclinic
_symmetry_space_group_name_H-M   P-1

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.8486(12)
_cell_length_b                   12.9911(6)
_cell_length_c                   13.7516(6)
_cell_angle_alpha                117.1860(10)
_cell_angle_beta                 99.3420(10)
_cell_angle_gamma                95.4300(10)
_cell_volume                     1977.1(2)
_cell_formula_units_Z            1
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    6518
_cell_measurement_theta_min      2.18
_cell_measurement_theta_max      28.09

_exptl_crystal_description       thin
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.34
_exptl_crystal_size_min          0.06
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.826
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1070
_exptl_absorpt_coefficient_mu    2.444
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.3746
_exptl_absorpt_correction_T_max  0.8672
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            13120
_diffrn_reflns_av_R_equivalents  0.0227
_diffrn_reflns_av_sigmaI/netI    0.0327
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_theta_min         1.64
_diffrn_reflns_theta_max         25.00
_reflns_number_total             6878
_reflns_number_gt                5434
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

The isopropoxyl groups on P1 were split into two groups, which is half 
occupied for each.

Attempts to solve the disorder of the isopropyl groups on O5 and O6 were 
failed. It will result in unstable refinement that increasing R values 
largely. They were modelled best large ADP on single sites as multiple 
sites were not resolved.

The used restraints are:
DFIX 1.43 0.01 O2 C4  O2' C4'
DFIX 1.54 0.01 C1 C2  C1 C3  C1' C2'  C1' C3'  C4 C5  C4 C6  C4' C5'  
C4' C6'
DFIX 1.62 0.01 P1 O1'  P1 O1  P1 O2
DELU O1 C1
DELU O1' C1'
DELU C1 C2
DELU C1 C3
DELU C1' C2'
DELU C1' C3'
DELU C4 C5
DELU C4 C6
DELU O2 C4
DELU O2 P1
DELU P1 O1
DELU P1 O1'
DELU C10 C11
DELU C10 C12
DELU C13 C15
EADP O1 O1' O2 O2'
EADP C1 C1' C4' C4
EADP C2 C2' C3 C3' C5 C5' C6 C6'
EADP C14 C15
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0531P)²+1.6595P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6878
_refine_ls_number_parameters     333
_refine_ls_number_restraints     28
_refine_ls_R_factor_all          0.0462
_refine_ls_R_factor_gt           0.0358
_refine_ls_wR_factor_ref         0.1062
_refine_ls_wR_factor_gt          0.1007
_refine_ls_goodness_of_fit_ref   1.076
_refine_ls_restrained_S_all      1.094
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.50069(3) 0.79267(3) 0.52799(3) 0.05742(12) Uani 1 1 d . . .
Ag2 Ag 0.36371(3) 0.79898(3) 0.29889(3) 0.06101(13) Uani 1 1 d . . .
Ag3 Ag 0.28452(3) 1.03896(4) 0.46667(3) 0.06240(13) Uani 1 1 d . . .
Ag4 Ag 0.41709(4) 1.03759(3) 0.68983(3) 0.06000(13) Uani 1 1 d . . .
S1 S 0.34133(10) 0.82137(10) 0.61558(9) 0.0481(3) Uani 1 1 d . . .
S2 S 0.19861(10) 0.82425(11) 0.37681(11) 0.0543(3) Uani 1 1 d . . .
S3 S 0.40156(12) 0.88060(11) 0.17233(10) 0.0612(3) Uani 1 1 d . . .
S4 S 0.31261(11) 1.13490(11) 0.34759(11) 0.0596(3) Uani 1 1 d . . .
S5 S 0.29575(11) 1.17211(10) 0.67228(11) 0.0554(3) Uani 1 1 d . . .
S6 S 0.47176(10) 0.65524(10) 0.32018(10) 0.0518(3) Uani 1 1 d . . .
S7 S 0.5000 1.0000 0.5000 0.0391(3) Uani 1 2 d S . .
P1 P 0.31931(15) 1.01042(12) 0.19534(12) 0.0753(5) Uani 1 1 d DU . .
P2 P 0.61904(10) 0.67146(9) 0.29108(9) 0.0448(3) Uani 1 1 d . . .
P3 P 0.21491(9) 0.75698(10) 0.48329(10) 0.0461(3) Uani 1 1 d . . .
O1 O 0.3290(9) 1.0637(8) 0.1184(7) 0.0912(15) Uani 0.50 1 d PDU A 1
O2 O 0.1893(6) 0.9538(8) 0.1561(7) 0.0912(15) Uani 0.50 1 d PDU A 1
O1' O 0.3980(8) 1.0789(8) 0.1502(7) 0.0912(15) Uani 0.50 1 d PDU A 2
O2' O 0.2196(8) 0.9625(8) 0.1025(7) 0.0912(15) Uani 0.50 1 d PD A 2
O3 O 0.6007(3) 0.5833(3) 0.1629(3) 0.0592(8) Uani 1 1 d . . .
O4 O 0.6963(3) 0.6283(3) 0.3589(3) 0.0570(8) Uani 1 1 d . . .
O5 O 0.1095(3) 0.7575(3) 0.5264(3) 0.0671(9) Uani 1 1 d . . .
O6 O 0.2173(3) 0.6229(3) 0.4176(3) 0.0605(9) Uani 1 1 d . . .
C1 C 0.3471(14) 1.1682(16) 0.1178(14) 0.117(3) Uani 0.50 1 d PDU A 1
H1 H 0.3105 1.2257 0.1684 0.140 Uiso 0.50 1 calc PR A 1
C2 C 0.290(2) 1.120(2) -0.0052(14) 0.159(3) Uani 0.50 1 d PDU A 1
H2A H 0.3094 1.0461 -0.0502 0.239 Uiso 0.50 1 calc PR A 1
H2B H 0.3121 1.1752 -0.0302 0.239 Uiso 0.50 1 calc PR A 1
H2C H 0.2140 1.1096 -0.0126 0.239 Uiso 0.50 1 calc PR A 1
C3 C 0.4634(16) 1.226(2) 0.1277(19) 0.159(3) Uani 0.50 1 d PDU A 1
H3A H 0.4983 1.2762 0.2055 0.239 Uiso 0.50 1 calc PR A 1
H3B H 0.4597 1.2726 0.0896 0.239 Uiso 0.50 1 calc PR A 1
H3C H 0.5037 1.1658 0.0939 0.239 Uiso 0.50 1 calc PR A 1
C4 C 0.1370(17) 0.8332(12) 0.0793(14) 0.117(3) Uani 0.50 1 d PDU A 1
H4 H 0.1774 0.7755 0.0859 0.140 Uiso 0.50 1 calc PR A 1
C5 C 0.0195(17) 0.811(2) 0.0851(19) 0.159(3) Uani 0.50 1 d PDU A 1
H5A H 0.0165 0.8271 0.1600 0.239 Uiso 0.50 1 calc PR A 1
H5B H -0.0129 0.7300 0.0333 0.239 Uiso 0.50 1 calc PR A 1
H5C H -0.0186 0.8614 0.0658 0.239 Uiso 0.50 1 calc PR A 1
C6 C 0.102(2) 0.811(3) -0.0410(17) 0.159(3) Uani 0.50 1 d PDU A 1
H6A H 0.0426 0.8489 -0.0470 0.239 Uiso 0.50 1 calc PR A 1
H6B H 0.0811 0.7278 -0.0911 0.239 Uiso 0.50 1 calc PR A 1
H6C H 0.1611 0.8427 -0.0606 0.239 Uiso 0.50 1 calc PR A 1
C1' C 0.4106(17) 1.1083(14) 0.0903(13) 0.117(3) Uani 0.50 1 d PDU A 2
H1' H 0.4863 1.1033 0.0905 0.140 Uiso 0.50 1 calc PR A 2
C2' C 0.365(2) 1.070(2) -0.0338(13) 0.159(3) Uani 0.50 1 d PDU A 2
H2D H 0.3979 1.0076 -0.0798 0.239 Uiso 0.50 1 calc PR A 2
H2E H 0.3787 1.1356 -0.0471 0.239 Uiso 0.50 1 calc PR A 2
H2F H 0.2884 1.0419 -0.0522 0.239 Uiso 0.50 1 calc PR A 2
C3' C 0.420(2) 1.2445(16) 0.1677(18) 0.159(3) Uani 0.50 1 d PDU A 2
H3D H 0.3957 1.2578 0.2341 0.239 Uiso 0.50 1 calc PR A 2
H3E H 0.3767 1.2755 0.1277 0.239 Uiso 0.50 1 calc PR A 2
H3F H 0.4938 1.2834 0.1886 0.239 Uiso 0.50 1 calc PR A 2
C4' C 0.1406(17) 0.8584(14) 0.0710(16) 0.117(3) Uani 0.50 1 d PD A 2
H4' H 0.1823 0.8172 0.1029 0.140 Uiso 0.50 1 calc PR A 2
C5' C 0.0490(18) 0.878(2) 0.1327(18) 0.159(3) Uani 0.50 1 d PD A 2
H5D H 0.0772 0.9339 0.2107 0.239 Uiso 0.50 1 calc PR A 2
H5E H 0.0166 0.8045 0.1258 0.239 Uiso 0.50 1 calc PR A 2
H5F H -0.0040 0.9078 0.1003 0.239 Uiso 0.50 1 calc PR A 2
C6' C 0.145(2) 0.792(3) -0.0515(17) 0.159(3) Uani 0.50 1 d PD A 2
H6D H 0.1202 0.8347 -0.0892 0.239 Uiso 0.50 1 calc PR A 2
H6E H 0.1010 0.7151 -0.0865 0.239 Uiso 0.50 1 calc PR A 2
H6F H 0.2184 0.7847 -0.0562 0.239 Uiso 0.50 1 calc PR A 2
C7 C 0.6873(5) 0.5609(5) 0.1019(5) 0.0746(16) Uani 1 1 d . . .
H7A H 0.7575 0.5908 0.1551 0.090 Uiso 1 1 calc R . .
C8 C 0.6706(7) 0.4305(6) 0.0307(7) 0.114(3) Uani 1 1 d . . .
H8A H 0.6789 0.3943 0.0780 0.171 Uiso 1 1 calc R . .
H8B H 0.7226 0.4115 -0.0146 0.171 Uiso 1 1 calc R . .
H8C H 0.5995 0.4015 -0.0171 0.171 Uiso 1 1 calc R . .
C9 C 0.6776(10) 0.6224(8) 0.0326(7) 0.137(4) Uani 1 1 d . . .
H9A H 0.6907 0.7061 0.0813 0.205 Uiso 1 1 calc R . .
H9B H 0.6065 0.5971 -0.0148 0.205 Uiso 1 1 calc R . .
H9C H 0.7292 0.6035 -0.0131 0.205 Uiso 1 1 calc R . .
C10 C 0.0701(6) 0.8608(7) 0.5920(7) 0.105(2) Uani 1 1 d U . .
H10A H 0.1202 0.9301 0.6053 0.126 Uiso 1 1 calc R . .
C11 C 0.0678(15) 0.8663(16) 0.6998(12) 0.251(10) Uani 1 1 d U . .
H11A H 0.0428 0.9360 0.7459 0.376 Uiso 1 1 calc R . .
H11B H 0.1388 0.8687 0.7367 0.376 Uiso 1 1 calc R . .
H11C H 0.0202 0.7979 0.6878 0.376 Uiso 1 1 calc R . .
C12 C -0.0322(10) 0.8604(15) 0.5357(12) 0.221(8) Uani 1 1 d U . .
H12A H -0.0276 0.8576 0.4656 0.331 Uiso 1 1 calc R . .
H12B H -0.0565 0.9308 0.5815 0.331 Uiso 1 1 calc R . .
H12C H -0.0821 0.7926 0.5217 0.331 Uiso 1 1 calc R . .
C13 C 0.1438(5) 0.5393(5) 0.3082(5) 0.0847(19) Uani 1 1 d U . .
H13A H 0.1164 0.5793 0.2667 0.102 Uiso 1 1 calc R . .
C14 C 0.0560(8) 0.4796(9) 0.3331(10) 0.195(5) Uani 1 1 d . . .
H14A H 0.0055 0.4249 0.2643 0.293 Uiso 1 1 calc R . .
H14B H 0.0203 0.5373 0.3813 0.293 Uiso 1 1 calc R . .
H14C H 0.0855 0.4379 0.3700 0.293 Uiso 1 1 calc R . .
C15 C 0.2044(8) 0.4501(9) 0.2454(9) 0.195(5) Uani 1 1 d U . .
H15A H 0.1596 0.3944 0.1732 0.293 Uiso 1 1 calc R . .
H15B H 0.2265 0.4098 0.2865 0.293 Uiso 1 1 calc R . .
H15C H 0.2667 0.4880 0.2357 0.293 Uiso 1 1 calc R . .
C16 C 0.6718(5) 0.5105(5) 0.3519(6) 0.0710(15) Uani 1 1 d . . .
H16A H 0.6127 0.4605 0.2862 0.085 Uiso 1 1 calc R . .
C17 C 0.6382(7) 0.5233(7) 0.4530(7) 0.104(2) Uani 1 1 d . . .
H17A H 0.5742 0.5563 0.4582 0.156 Uiso 1 1 calc R . .
H17B H 0.6944 0.5747 0.5181 0.156 Uiso 1 1 calc R . .
H17C H 0.6240 0.4474 0.4490 0.156 Uiso 1 1 calc R . .
C18 C 0.7706(7) 0.4594(8) 0.3341(9) 0.122(3) Uani 1 1 d . . .
H18A H 0.7589 0.3824 0.3280 0.182 Uiso 1 1 calc R . .
H18B H 0.8297 0.5094 0.3967 0.182 Uiso 1 1 calc R . .
H18C H 0.7870 0.4535 0.2663 0.182 Uiso 1 1 calc R . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 S1 2.5135(13) . ?
Ag1 S4 2.5171(14) 2_676 ?
Ag1 S6 2.5218(13) . ?
Ag1 S7 2.8902(4) . ?
Ag1 Ag3 3.3242(6) 2_676 ?
Ag1 Ag4 3.3440(5) . ?
Ag2 S3 2.5007(14) . ?
Ag2 S2 2.5109(14) . ?
Ag2 S6 2.5215(13) . ?
Ag2 S7 2.9151(4) . ?
Ag2 Ag3 3.2966(6) . ?
Ag2 Ag4 3.3000(6) 2_676 ?
Ag3 S4 2.5174(14) . ?
Ag3 S2 2.5201(13) . ?
Ag3 S5 2.5217(13) . ?
Ag3 S7 2.8629(5) . ?
Ag3 Ag4 3.2677(6) . ?
Ag3 Ag1 3.3242(6) 2_676 ?
Ag4 S5 2.5143(13) . ?
Ag4 S3 2.5314(15) 2_676 ?
Ag4 S1 2.5336(12) . ?
Ag4 S7 2.8327(4) . ?
Ag4 Ag2 3.3000(6) 2_676 ?
S1 P3 2.0101(16) . ?
S2 P3 2.0138(17) . ?
S3 P1 2.005(2) . ?
S3 Ag4 2.5315(15) 2_676 ?
S4 P1 1.999(2) . ?
S4 Ag1 2.5172(14) 2_676 ?
S5 P2 2.0117(17) 2_676 ?
S6 P2 2.0082(17) . ?
S7 Ag4 2.8327(4) 2_676 ?
S7 Ag3 2.8629(5) 2_676 ?
S7 Ag1 2.8902(4) 2_676 ?
S7 Ag2 2.9151(4) 2_676 ?
P1 O2' 1.501(9) . ?
P1 O1 1.519(7) . ?
P1 O2 1.653(8) . ?
P1 O1' 1.654(8) . ?
P2 O3 1.564(3) . ?
P2 O4 1.565(3) . ?
P2 S5 2.0118(17) 2_676 ?
P3 O6 1.559(3) . ?
P3 O5 1.563(4) . ?
O1 C1 1.360(18) . ?
O2 C4 1.442(9) . ?
O1' C1' 1.082(18) . ?
O2' C4' 1.452(9) . ?
O3 C7 1.472(7) . ?
O4 C16 1.490(6) . ?
O5 C10 1.428(8) . ?
O6 C13 1.479(6) . ?
C1 C2 1.527(10) . ?
C1 C3 1.565(10) . ?
C4 C6 1.523(10) . ?
C4 C5 1.532(10) . ?
C1' C2' 1.532(10) . ?
C1' C3' 1.574(10) . ?
C4' C6' 1.517(10) . ?
C4' C5' 1.534(10) . ?
C7 C8 1.491(9) . ?
C7 C9 1.496(10) . ?
C10 C12 1.412(13) . ?
C10 C11 1.457(15) . ?
C13 C15 1.473(12) . ?
C13 C14 1.482(13) . ?
C16 C17 1.464(9) . ?
C16 C18 1.492(9) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
S1 Ag1 S4 119.46(4) . 2_676 ?
S1 Ag1 S6 119.15(4) . . ?
S4 Ag1 S6 120.09(5) 2_676 . ?
S1 Ag1 S7 93.64(3) . . ?
S4 Ag1 S7 94.29(3) 2_676 . ?
S6 Ag1 S7 93.44(3) . . ?
S1 Ag1 Ag3 137.41(3) . 2_676 ?
S4 Ag1 Ag3 48.68(3) 2_676 2_676 ?
S6 Ag1 Ag3 92.72(3) . 2_676 ?
S7 Ag1 Ag3 54.320(10) . 2_676 ?
S1 Ag1 Ag4 48.76(3) . . ?
S4 Ag1 Ag4 92.82(3) 2_676 . ?
S6 Ag1 Ag4 136.38(3) . . ?
S7 Ag1 Ag4 53.449(10) . . ?
Ag3 Ag1 Ag4 88.789(14) 2_676 . ?
S3 Ag2 S2 121.63(5) . . ?
S3 Ag2 S6 119.71(5) . . ?
S2 Ag2 S6 117.59(4) . . ?
S3 Ag2 S7 93.74(3) . . ?
S2 Ag2 S7 93.68(3) . . ?
S6 Ag2 S7 92.85(3) . . ?
S3 Ag2 Ag3 92.46(3) . . ?
S2 Ag2 Ag3 49.18(3) . . ?
S6 Ag2 Ag3 136.89(3) . . ?
S7 Ag2 Ag3 54.471(11) . . ?
S3 Ag2 Ag4 49.43(3) . 2_676 ?
S2 Ag2 Ag4 139.19(3) . 2_676 ?
S6 Ag2 Ag4 90.77(3) . 2_676 ?
S7 Ag2 Ag4 53.798(10) . 2_676 ?
Ag3 Ag2 Ag4 90.015(14) . 2_676 ?
S4 Ag3 S2 120.61(5) . . ?
S4 Ag3 S5 117.60(4) . . ?
S2 Ag3 S5 119.65(4) . . ?
S4 Ag3 S7 94.95(3) . . ?
S2 Ag3 S7 94.75(3) . . ?
S5 Ag3 S7 94.90(3) . . ?
S4 Ag3 Ag4 138.08(3) . . ?
S2 Ag3 Ag4 92.66(3) . . ?
S5 Ag3 Ag4 49.45(3) . . ?
S7 Ag3 Ag4 54.557(10) . . ?
S4 Ag3 Ag2 92.53(3) . . ?
S2 Ag3 Ag2 48.94(3) . . ?
S5 Ag3 Ag2 140.95(3) . . ?
S7 Ag3 Ag2 55.959(10) . . ?
Ag4 Ag3 Ag2 91.618(14) . . ?
S4 Ag3 Ag1 48.68(3) . 2_676 ?
S2 Ag3 Ag1 139.67(3) . 2_676 ?
S5 Ag3 Ag1 91.67(3) . 2_676 ?
S7 Ag3 Ag1 55.088(11) . 2_676 ?
Ag4 Ag3 Ag1 89.588(14) . 2_676 ?
Ag2 Ag3 Ag1 90.761(15) . 2_676 ?
S5 Ag4 S3 121.09(5) . 2_676 ?
S5 Ag4 S1 120.04(4) . . ?
S3 Ag4 S1 116.46(4) 2_676 . ?
S5 Ag4 S7 95.81(3) . . ?
S3 Ag4 S7 95.08(3) 2_676 . ?
S1 Ag4 S7 94.60(3) . . ?
S5 Ag4 Ag3 49.64(3) . . ?
S3 Ag4 Ag3 141.13(4) 2_676 . ?
S1 Ag4 Ag3 92.81(3) . . ?
S7 Ag4 Ag3 55.426(11) . . ?
S5 Ag4 Ag2 94.22(3) . 2_676 ?
S3 Ag4 Ag2 48.62(3) 2_676 2_676 ?
S1 Ag4 Ag2 138.27(3) . 2_676 ?
S7 Ag4 Ag2 56.142(10) . 2_676 ?
Ag3 Ag4 Ag2 92.533(14) . 2_676 ?
S5 Ag4 Ag1 139.99(3) . . ?
S3 Ag4 Ag1 91.06(3) 2_676 . ?
S1 Ag4 Ag1 48.25(3) . . ?
S7 Ag4 Ag1 55.048(10) . . ?
Ag3 Ag4 Ag1 90.494(14) . . ?
Ag2 Ag4 Ag1 90.356(15) 2_676 . ?
P3 S1 Ag1 103.75(6) . . ?
P3 S1 Ag4 113.10(6) . . ?
Ag1 S1 Ag4 82.99(4) . . ?
P3 S2 Ag2 105.27(6) . . ?
P3 S2 Ag3 113.68(6) . . ?
Ag2 S2 Ag3 81.88(4) . . ?
P1 S3 Ag2 108.81(8) . . ?
P1 S3 Ag4 110.10(7) . 2_676 ?
Ag2 S3 Ag4 81.95(4) . 2_676 ?
P1 S4 Ag1 108.33(8) . 2_676 ?
P1 S4 Ag3 108.74(7) . . ?
Ag1 S4 Ag3 82.64(4) 2_676 . ?
P2 S5 Ag4 111.26(7) 2_676 . ?
P2 S5 Ag3 105.47(6) 2_676 . ?
Ag4 S5 Ag3 80.91(4) . . ?
P2 S6 Ag2 113.93(6) . . ?
P2 S6 Ag1 103.63(6) . . ?
Ag2 S6 Ag1 84.47(4) . . ?
Ag4 S7 Ag4 179.999(1) . 2_676 ?
Ag4 S7 Ag3 109.983(13) . 2_676 ?
Ag4 S7 Ag3 70.016(13) 2_676 2_676 ?
Ag4 S7 Ag3 70.018(13) . . ?
Ag4 S7 Ag3 109.983(13) 2_676 . ?
Ag3 S7 Ag3 180.0 2_676 . ?
Ag4 S7 Ag1 71.503(11) . . ?
Ag4 S7 Ag1 108.497(11) 2_676 . ?
Ag3 S7 Ag1 70.592(12) 2_676 . ?
Ag3 S7 Ag1 109.408(12) . . ?
Ag4 S7 Ag1 108.496(11) . 2_676 ?
Ag4 S7 Ag1 71.503(11) 2_676 2_676 ?
Ag3 S7 Ag1 109.408(12) 2_676 2_676 ?
Ag3 S7 Ag1 70.592(12) . 2_676 ?
Ag1 S7 Ag1 180.0 . 2_676 ?
Ag4 S7 Ag2 109.940(12) . . ?
Ag4 S7 Ag2 70.061(12) 2_676 . ?
Ag3 S7 Ag2 110.429(12) 2_676 . ?
Ag3 S7 Ag2 69.570(12) . . ?
Ag1 S7 Ag2 71.458(11) . . ?
Ag1 S7 Ag2 108.542(11) 2_676 . ?
Ag4 S7 Ag2 70.060(12) . 2_676 ?
Ag4 S7 Ag2 109.939(13) 2_676 2_676 ?
Ag3 S7 Ag2 69.571(12) 2_676 2_676 ?
Ag3 S7 Ag2 110.430(12) . 2_676 ?
Ag1 S7 Ag2 108.542(11) . 2_676 ?
Ag1 S7 Ag2 71.458(12) 2_676 2_676 ?
Ag2 S7 Ag2 180.0 . 2_676 ?
O2' P1 O1 70.5(5) . . ?
O2' P1 O2 33.9(4) . . ?
O1 P1 O2 101.2(5) . . ?
O2' P1 O1' 100.8(5) . . ?
O1 P1 O1' 31.9(4) . . ?
O2 P1 O1' 133.0(4) . . ?
O2' P1 S4 118.3(4) . . ?
O1 P1 S4 110.4(4) . . ?
O2 P1 S4 94.6(3) . . ?
O1' P1 S4 104.7(3) . . ?
O2' P1 S3 108.7(4) . . ?
O1 P1 S3 114.8(4) . . ?
O2 P1 S3 108.7(3) . . ?
O1' P1 S3 96.1(4) . . ?
S4 P1 S3 122.82(8) . . ?
O3 P2 O4 108.68(19) . . ?
O3 P2 S6 103.16(15) . . ?
O4 P2 S6 109.61(15) . . ?
O3 P2 S5 110.02(15) . 2_676 ?
O4 P2 S5 102.80(14) . 2_676 ?
S6 P2 S5 122.19(7) . 2_676 ?
O6 P3 O5 102.8(2) . . ?
O6 P3 S1 104.08(14) . . ?
O5 P3 S1 108.53(16) . . ?
O6 P3 S2 109.94(15) . . ?
O5 P3 S2 108.50(16) . . ?
S1 P3 S2 121.41(7) . . ?
C1 O1 P1 142.8(10) . . ?
C4 O2 P1 127.9(11) . . ?
C1' O1' P1 150.6(13) . . ?
C4' O2' P1 125.3(11) . . ?
C7 O3 P2 123.7(3) . . ?
C16 O4 P2 123.1(3) . . ?
C10 O5 P3 125.1(4) . . ?
C13 O6 P3 124.1(4) . . ?
O1 C1 C2 96.0(15) . . ?
O1 C1 C3 120.4(19) . . ?
C2 C1 C3 104.5(17) . . ?
O2 C4 C6 112.2(16) . . ?
O2 C4 C5 111.5(16) . . ?
C6 C4 C5 90.9(17) . . ?
O1' C1' C2' 137.6(18) . . ?
O1' C1' C3' 98.6(17) . . ?
C2' C1' C3' 112.2(17) . . ?
O2' C4' C6' 97.1(15) . . ?
O2' C4' C5' 116.3(16) . . ?
C6' C4' C5' 134.2(18) . . ?
O3 C7 C8 106.3(5) . . ?
O3 C7 C9 107.8(6) . . ?
C8 C7 C9 111.9(6) . . ?
C12 C10 O5 111.3(8) . . ?
C12 C10 C11 111.6(10) . . ?
O5 C10 C11 108.0(9) . . ?
C15 C13 O6 106.9(6) . . ?
C15 C13 C14 107.8(8) . . ?
O6 C13 C14 106.4(7) . . ?
C17 C16 O4 109.7(5) . . ?
C17 C16 C18 114.6(6) . . ?
O4 C16 C18 105.9(5) . . ?

_diffrn_measured_fraction_theta_max 0.986
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.986
_refine_diff_density_max         0.833
_refine_diff_density_min         -0.963
_refine_diff_density_rms         0.091
_database_code_depnum_ccdc_archive 'CCDC 977330'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_7

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C36 H84 Ag10 I4 O12 P6 S12'
_chemical_formula_weight         2865.87

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
I I -0.4742 1.8119 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   P2(1)/n

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

_cell_length_a                   14.5923(10)
_cell_length_b                   23.5026(15)
_cell_length_c                   24.2656(16)
_cell_angle_alpha                90.00
_cell_angle_beta                 92.122(2)
_cell_angle_gamma                90.00
_cell_volume                     8316.4(10)
_cell_formula_units_Z            4
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9971
_cell_measurement_theta_min      2.31
_cell_measurement_theta_max      24.87

_exptl_crystal_description       plane
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.08
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.289
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5440
_exptl_absorpt_coefficient_mu    4.243
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5500
_exptl_absorpt_correction_T_max  0.7277
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            73589
_diffrn_reflns_av_R_equivalents  0.0329
_diffrn_reflns_av_sigmaI/netI    0.0246
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -27
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         1.60
_diffrn_reflns_theta_max         25.00
_reflns_number_total             14642
_reflns_number_gt                11842
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 

Restraints on bond lengths and atomic displacement paremeters were applied 
by using DFIX, DELU and EADP command in SHELX program.

C8, C9, C11, C12 were disordered and split into two parts, each is half 
occupied.

The used restraints are:

DFIX 1.54 0.01 C7 C8  C7 C9'  C10 C12  C10 C12'
EADP C8 C9
EADP C8' C9'
EADP C11 C12
EADP C11' C12'
DELU C7 C8
DELU C7 C9
DELU C7 C8'
DELU C7 C9'
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0344P)²+24.0383P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         14642
_refine_ls_number_parameters     760
_refine_ls_number_restraints     8
_refine_ls_R_factor_all          0.0449
_refine_ls_R_factor_gt           0.0331
_refine_ls_wR_factor_ref         0.0855
_refine_ls_wR_factor_gt          0.0781
_refine_ls_goodness_of_fit_ref   1.016
_refine_ls_restrained_S_all      1.016
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.61743(4) 0.28135(2) 0.13043(2) 0.07120(14) Uani 1 1 d . . .
Ag2 Ag 0.51030(4) 0.27958(2) 0.26447(2) 0.07297(15) Uani 1 1 d . . .
Ag3 Ag 0.64318(4) 0.18470(3) 0.22516(2) 0.06909(14) Uani 1 1 d . . .
Ag4 Ag 0.88921(4) 0.21738(2) 0.21388(2) 0.06848(14) Uani 1 1 d . . .
Ag5 Ag 0.77850(4) 0.22931(3) 0.34689(3) 0.08106(17) Uani 1 1 d . . .
Ag6 Ag 0.93018(4) 0.31557(2) 0.30124(2) 0.06393(13) Uani 1 1 d . . .
Ag7 Ag 0.71614(4) 0.41973(2) 0.31978(2) 0.06966(14) Uani 1 1 d . . .
Ag8 Ag 0.61127(3) 0.31060(2) 0.37758(2) 0.06569(14) Uani 1 1 d . . .
Ag9 Ag 0.62634(4) 0.41649(2) 0.19869(2) 0.07657(16) Uani 1 1 d . . .
Ag10 Ag 0.83692(4) 0.31395(3) 0.12551(3) 0.0913(2) Uani 1 1 d . . .
I1 I 0.72981(2) 0.306764(15) 0.245061(14) 0.04574(9) Uani 1 1 d . . .
I2 I 0.95753(3) 0.198161(18) 0.321886(16) 0.05785(11) Uani 1 1 d . . .
I3 I 0.47921(3) 0.211269(18) 0.171745(17) 0.05805(11) Uani 1 1 d . . .
I4 I 0.73903(4) 0.499271(19) 0.239598(18) 0.07214(13) Uani 1 1 d . . .
O1 O 0.4266(3) 0.47915(15) 0.31586(16) 0.0512(9) Uani 1 1 d . . .
O2 O 0.3828(2) 0.38774(16) 0.35446(14) 0.0483(9) Uani 1 1 d . . .
O3 O 0.6524(3) 0.47064(17) 0.03707(16) 0.0609(10) Uani 1 1 d . B .
O4 O 0.6705(3) 0.37356(17) 0.00471(15) 0.0542(9) Uani 1 1 d . D .
O5 O 0.7871(3) 0.39705(16) 0.47499(15) 0.0528(9) Uani 1 1 d . . .
O6 O 0.9184(3) 0.33245(18) 0.47560(15) 0.0547(10) Uani 1 1 d . . .
O7 O 1.1389(2) 0.27027(16) 0.22622(15) 0.0506(9) Uani 1 1 d . . .
O8 O 1.1385(3) 0.33527(19) 0.14362(16) 0.0608(11) Uani 1 1 d . . .
O9 O 0.5777(4) 0.1411(2) 0.4198(2) 0.0955(18) Uani 1 1 d . . .
O10 O 0.4769(3) 0.12046(18) 0.3313(2) 0.0784(14) Uani 1 1 d . . .
O11 O 0.6686(3) 0.12457(16) 0.07874(16) 0.0538(9) Uani 1 1 d . . .
O12 O 0.8432(3) 0.12963(19) 0.07438(15) 0.0625(11) Uani 1 1 d . . .
P1 P 0.46196(9) 0.41618(5) 0.32196(5) 0.0397(3) Uani 1 1 d . . .
P2 P 0.67810(10) 0.40970(6) 0.05924(6) 0.0454(3) Uani 1 1 d . . .
P3 P 0.83113(9) 0.34922(6) 0.43945(6) 0.0442(3) Uani 1 1 d . . .
P4 P 1.07533(9) 0.30950(6) 0.18884(6) 0.0456(3) Uani 1 1 d . . .
P5 P 0.55220(11) 0.16006(6) 0.35832(6) 0.0510(4) Uani 1 1 d . . .
P6 P 0.75663(10) 0.15725(6) 0.10078(5) 0.0434(3) Uani 1 1 d . . .
S1 S 0.57142(9) 0.41370(6) 0.37460(6) 0.0469(3) Uani 1 1 d . . .
S2 S 0.47236(10) 0.38200(6) 0.24682(5) 0.0476(3) Uani 1 1 d . . .
S3 S 0.80313(11) 0.41128(7) 0.09406(7) 0.0610(4) Uani 1 1 d . . .
S4 S 0.57435(9) 0.38121(6) 0.10460(6) 0.0482(3) Uani 1 1 d . . .
S5 S 0.86577(10) 0.38760(6) 0.36989(6) 0.0492(3) Uani 1 1 d . . .
S6 S 0.74828(10) 0.28056(6) 0.43505(6) 0.0529(3) Uani 1 1 d . . .
S7 S 0.98566(10) 0.26187(8) 0.14351(6) 0.0593(4) Uani 1 1 d . . .
S8 S 1.02625(12) 0.36954(7) 0.23639(7) 0.0645(4) Uani 1 1 d . . .
S9 S 0.48987(10) 0.23689(6) 0.35804(6) 0.0513(3) Uani 1 1 d . . .
S10 S 0.67121(10) 0.14830(6) 0.32225(6) 0.0521(3) Uani 1 1 d . . .
S11 S 0.77994(9) 0.14135(6) 0.18100(5) 0.0468(3) Uani 1 1 d . . .
S12 S 0.73746(11) 0.23655(6) 0.07313(6) 0.0518(3) Uani 1 1 d . . .
C1 C 0.4763(5) 0.5240(3) 0.2884(3) 0.0705(19) Uani 1 1 d . . .
H1 H 0.5375 0.5105 0.2794 0.085 Uiso 1 1 calc R . .
C2 C 0.4233(9) 0.5393(4) 0.2368(4) 0.148(5) Uani 1 1 d . . .
H2A H 0.4144 0.5060 0.2144 0.223 Uiso 1 1 calc R . .
H2B H 0.4565 0.5673 0.2168 0.223 Uiso 1 1 calc R . .
H2C H 0.3647 0.5545 0.2460 0.223 Uiso 1 1 calc R . .
C3 C 0.4844(6) 0.5724(3) 0.3267(4) 0.104(3) Uani 1 1 d . . .
H3A H 0.4245 0.5836 0.3376 0.157 Uiso 1 1 calc R . .
H3B H 0.5131 0.6038 0.3087 0.157 Uiso 1 1 calc R . .
H3C H 0.5209 0.5615 0.3587 0.157 Uiso 1 1 calc R . .
C4 C 0.2884(4) 0.3813(3) 0.3308(3) 0.0624(16) Uani 1 1 d . . .
H4 H 0.2885 0.3845 0.2905 0.075 Uiso 1 1 calc R . .
C5 C 0.2308(5) 0.4267(4) 0.3537(5) 0.125(4) Uani 1 1 d . . .
H5A H 0.2289 0.4224 0.3930 0.188 Uiso 1 1 calc R . .
H5B H 0.1697 0.4241 0.3378 0.188 Uiso 1 1 calc R . .
H5C H 0.2564 0.4632 0.3453 0.188 Uiso 1 1 calc R . .
C6 C 0.2576(5) 0.3237(3) 0.3467(4) 0.103(3) Uani 1 1 d . . .
H6A H 0.2591 0.3206 0.3862 0.155 Uiso 1 1 calc R . .
H6B H 0.2977 0.2957 0.3318 0.155 Uiso 1 1 calc R . .
H6C H 0.1962 0.3174 0.3325 0.155 Uiso 1 1 calc R . .
C7 C 0.6541(6) 0.5221(3) 0.0695(3) 0.092(2) Uani 1 1 d DU . .
H7 H 0.6812 0.5124 0.1058 0.110 Uiso 1 1 calc R A 1
C8 C 0.7260(18) 0.5570(8) 0.0393(15) 0.159(10) Uani 0.50 1 d PDU B 1
H8A H 0.7848 0.5389 0.0437 0.239 Uiso 0.50 1 calc PR B 1
H8B H 0.7292 0.5947 0.0546 0.239 Uiso 0.50 1 calc PR B 1
H8C H 0.7087 0.5592 0.0008 0.239 Uiso 0.50 1 calc PR B 1
C9 C 0.5730(19) 0.5494(8) 0.0782(19) 0.159(10) Uani 0.50 1 d PU B 1
H9A H 0.5467 0.5623 0.0435 0.239 Uiso 0.50 1 calc PR B 1
H9B H 0.5840 0.5814 0.1021 0.239 Uiso 0.50 1 calc PR B 1
H9C H 0.5313 0.5236 0.0949 0.239 Uiso 0.50 1 calc PR B 1
C8' C 0.693(2) 0.5720(8) 0.0443(15) 0.147(9) Uani 0.50 1 d PU B 2
H8D H 0.6576 0.5820 0.0118 0.220 Uiso 0.50 1 calc PR B 2
H8E H 0.7552 0.5639 0.0346 0.220 Uiso 0.50 1 calc PR B 2
H8F H 0.6934 0.6031 0.0700 0.220 Uiso 0.50 1 calc PR B 2
C9' C 0.5516(11) 0.5326(9) 0.0798(17) 0.147(9) Uani 0.50 1 d PDU B 2
H9D H 0.5169 0.5306 0.0454 0.220 Uiso 0.50 1 calc PR B 2
H9E H 0.5443 0.5696 0.0958 0.220 Uiso 0.50 1 calc PR B 2
H9F H 0.5299 0.5042 0.1045 0.220 Uiso 0.50 1 calc PR B 2
C10 C 0.7361(5) 0.3795(3) -0.0394(3) 0.0726(19) Uani 1 1 d D . .
H10 H 0.7921 0.4001 -0.0282 0.087 Uiso 1 1 calc R C 1
C11 C 0.6762(14) 0.4102(9) -0.0879(7) 0.089(4) Uani 0.50 1 d P D 1
H11A H 0.6588 0.4475 -0.0760 0.134 Uiso 0.50 1 calc PR D 1
H11B H 0.6221 0.3881 -0.0963 0.134 Uiso 0.50 1 calc PR D 1
H11C H 0.7119 0.4133 -0.1202 0.134 Uiso 0.50 1 calc PR D 1
C12 C 0.753(3) 0.3190(6) -0.0589(9) 0.089(4) Uani 0.50 1 d PD D 1
H12A H 0.6951 0.3006 -0.0670 0.134 Uiso 0.50 1 calc PR D 1
H12B H 0.7860 0.2983 -0.0305 0.134 Uiso 0.50 1 calc PR D 1
H12C H 0.7880 0.3199 -0.0916 0.134 Uiso 0.50 1 calc PR D 1
C11' C 0.727(2) 0.4256(10) -0.0740(10) 0.139(9) Uani 0.50 1 d P D 2
H11D H 0.6643 0.4379 -0.0759 0.209 Uiso 0.50 1 calc PR D 2
H11E H 0.7455 0.4152 -0.1102 0.209 Uiso 0.50 1 calc PR D 2
H11F H 0.7652 0.4561 -0.0602 0.209 Uiso 0.50 1 calc PR D 2
C12' C 0.745(4) 0.3232(7) -0.0694(11) 0.139(9) Uani 0.50 1 d PD D 2
H12D H 0.6907 0.3164 -0.0918 0.209 Uiso 0.50 1 calc PR D 2
H12E H 0.7531 0.2931 -0.0429 0.209 Uiso 0.50 1 calc PR D 2
H12F H 0.7972 0.3246 -0.0923 0.209 Uiso 0.50 1 calc PR D 2
C13 C 0.7580(4) 0.3860(3) 0.5321(2) 0.0608(16) Uani 1 1 d . . .
H13 H 0.7634 0.3452 0.5396 0.073 Uiso 1 1 calc R . .
C14 C 0.6614(6) 0.4023(6) 0.5338(4) 0.143(5) Uani 1 1 d . . .
H14A H 0.6385 0.3929 0.5693 0.215 Uiso 1 1 calc R . .
H14B H 0.6267 0.3821 0.5057 0.215 Uiso 1 1 calc R . .
H14C H 0.6555 0.4425 0.5277 0.215 Uiso 1 1 calc R . .
C15 C 0.8198(7) 0.4168(4) 0.5706(3) 0.112(3) Uani 1 1 d . . .
H15A H 0.8822 0.4074 0.5632 0.168 Uiso 1 1 calc R . .
H15B H 0.8070 0.4062 0.6077 0.168 Uiso 1 1 calc R . .
H15C H 0.8107 0.4570 0.5660 0.168 Uiso 1 1 calc R . .
C16 C 0.9791(4) 0.2860(3) 0.4602(2) 0.0607(16) Uani 1 1 d . . .
H16 H 0.9553 0.2691 0.4256 0.073 Uiso 1 1 calc R . .
C17 C 0.9782(6) 0.2424(4) 0.5039(4) 0.110(3) Uani 1 1 d . . .
H17A H 0.9947 0.2595 0.5388 0.165 Uiso 1 1 calc R . .
H17B H 1.0214 0.2129 0.4960 0.165 Uiso 1 1 calc R . .
H17C H 0.9179 0.2263 0.5054 0.165 Uiso 1 1 calc R . .
C18 C 1.0715(5) 0.3121(4) 0.4506(4) 0.103(3) Uani 1 1 d . . .
H18A H 1.0651 0.3411 0.4229 0.155 Uiso 1 1 calc R . .
H18B H 1.1127 0.2832 0.4385 0.155 Uiso 1 1 calc R . .
H18C H 1.0956 0.3286 0.4843 0.155 Uiso 1 1 calc R . .
C19 C 1.1604(4) 0.2098(3) 0.2171(3) 0.0662(17) Uani 1 1 d . . .
H19 H 1.1029 0.1883 0.2158 0.079 Uiso 1 1 calc R . .
C20 C 1.2161(5) 0.1915(3) 0.2670(4) 0.090(2) Uani 1 1 d . . .
H20A H 1.2725 0.2126 0.2691 0.136 Uiso 1 1 calc R . .
H20B H 1.2294 0.1516 0.2644 0.136 Uiso 1 1 calc R . .
H20C H 1.1822 0.1986 0.2994 0.136 Uiso 1 1 calc R . .
C21 C 1.2076(5) 0.2001(4) 0.1645(4) 0.096(3) Uani 1 1 d . . .
H21A H 1.1675 0.2107 0.1340 0.144 Uiso 1 1 calc R . .
H21B H 1.2233 0.1606 0.1615 0.144 Uiso 1 1 calc R . .
H21C H 1.2624 0.2227 0.1642 0.144 Uiso 1 1 calc R . .
C22 C 1.2276(5) 0.3642(3) 0.1560(3) 0.078(2) Uani 1 1 d . . .
H22 H 1.2513 0.3522 0.1924 0.093 Uiso 1 1 calc R . .
C23 C 1.2140(7) 0.4242(4) 0.1561(6) 0.159(5) Uani 1 1 d . . .
H23A H 1.2722 0.4430 0.1610 0.239 Uiso 1 1 calc R . .
H23B H 1.1755 0.4343 0.1858 0.239 Uiso 1 1 calc R . .
H23C H 1.1853 0.4357 0.1217 0.239 Uiso 1 1 calc R . .
C24 C 1.2912(5) 0.3451(4) 0.1139(4) 0.119(3) Uani 1 1 d . . .
H24A H 1.2672 0.3556 0.0780 0.178 Uiso 1 1 calc R . .
H24B H 1.2980 0.3045 0.1159 0.178 Uiso 1 1 calc R . .
H24C H 1.3499 0.3629 0.1205 0.178 Uiso 1 1 calc R . .
C25 C 0.5249(8) 0.1460(5) 0.4665(4) 0.125(4) Uani 1 1 d . . .
H25 H 0.4621 0.1555 0.4540 0.151 Uiso 1 1 calc R . .
C26 C 0.5556(11) 0.1887(6) 0.5021(4) 0.183(7) Uani 1 1 d . . .
H26A H 0.6142 0.1782 0.5183 0.274 Uiso 1 1 calc R . .
H26B H 0.5124 0.1937 0.5306 0.274 Uiso 1 1 calc R . .
H26C H 0.5614 0.2236 0.4819 0.274 Uiso 1 1 calc R . .
C27 C 0.5227(10) 0.0884(6) 0.4937(5) 0.176(6) Uani 1 1 d . . .
H27A H 0.5838 0.0776 0.5054 0.264 Uiso 1 1 calc R . .
H27B H 0.4981 0.0609 0.4679 0.264 Uiso 1 1 calc R . .
H27C H 0.4847 0.0901 0.5251 0.264 Uiso 1 1 calc R . .
C28 C 0.4922(6) 0.0655(3) 0.3038(4) 0.095(3) Uani 1 1 d . . .
H28 H 0.5466 0.0687 0.2815 0.114 Uiso 1 1 calc R . .
C29 C 0.4103(7) 0.0556(4) 0.2663(5) 0.126(4) Uani 1 1 d . . .
H29A H 0.3568 0.0516 0.2877 0.188 Uiso 1 1 calc R . .
H29B H 0.4192 0.0215 0.2453 0.188 Uiso 1 1 calc R . .
H29C H 0.4025 0.0873 0.2416 0.188 Uiso 1 1 calc R . .
C30 C 0.5087(8) 0.0205(4) 0.3460(5) 0.135(4) Uani 1 1 d . . .
H30A H 0.5681 0.0259 0.3636 0.203 Uiso 1 1 calc R . .
H30B H 0.5062 -0.0162 0.3285 0.203 Uiso 1 1 calc R . .
H30C H 0.4626 0.0227 0.3731 0.203 Uiso 1 1 calc R . .
C31 C 0.6533(5) 0.0632(3) 0.0877(3) 0.0630(16) Uani 1 1 d . . .
H31 H 0.7113 0.0448 0.0990 0.076 Uiso 1 1 calc R . .
C32 C 0.6198(7) 0.0402(4) 0.0331(3) 0.105(3) Uani 1 1 d . . .
H32A H 0.5653 0.0602 0.0211 0.157 Uiso 1 1 calc R . .
H32B H 0.6064 0.0005 0.0367 0.157 Uiso 1 1 calc R . .
H32C H 0.6664 0.0453 0.0066 0.157 Uiso 1 1 calc R . .
C33 C 0.5849(5) 0.0553(3) 0.1317(3) 0.080(2) Uani 1 1 d . . .
H33A H 0.6110 0.0680 0.1664 0.120 Uiso 1 1 calc R . .
H33B H 0.5692 0.0157 0.1342 0.120 Uiso 1 1 calc R . .
H33C H 0.5307 0.0770 0.1225 0.120 Uiso 1 1 calc R . .
C34 C 0.8567(5) 0.1270(3) 0.0154(3) 0.076(2) Uani 1 1 d . . .
H34 H 0.7980 0.1326 -0.0049 0.092 Uiso 1 1 calc R . .
C35 C 0.9224(6) 0.1723(4) 0.0001(4) 0.104(3) Uani 1 1 d . . .
H35A H 0.8969 0.2089 0.0080 0.157 Uiso 1 1 calc R . .
H35B H 0.9337 0.1697 -0.0385 0.157 Uiso 1 1 calc R . .
H35C H 0.9789 0.1674 0.0210 0.157 Uiso 1 1 calc R . .
C36 C 0.8929(7) 0.0684(4) 0.0044(4) 0.106(3) Uani 1 1 d . . .
H36A H 0.9464 0.0615 0.0277 0.160 Uiso 1 1 calc R . .
H36B H 0.9087 0.0655 -0.0336 0.160 Uiso 1 1 calc R . .
H36C H 0.8467 0.0407 0.0121 0.160 Uiso 1 1 calc R . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 S4 2.5034(15) . ?
Ag1 S12 2.5079(16) . ?
Ag1 I3 2.8171(7) . ?
Ag1 I1 3.2319(7) . ?
Ag1 Ag3 3.2435(8) . ?
Ag1 Ag10 3.2997(8) . ?
Ag2 S2 2.5034(15) . ?
Ag2 S9 2.5101(16) . ?
Ag2 I3 2.7877(7) . ?
Ag2 Ag3 3.1272(8) . ?
Ag2 Ag8 3.1522(8) . ?
Ag3 S11 2.5154(15) . ?
Ag3 S10 2.5256(16) . ?
Ag3 I3 2.7505(7) . ?
Ag3 I1 3.1648(7) . ?
Ag4 S7 2.4836(16) . ?
Ag4 S11 2.5056(15) . ?
Ag4 I2 2.8058(6) . ?
Ag4 Ag6 3.1751(7) . ?
Ag4 Ag10 3.1955(8) . ?
Ag4 I1 3.2444(7) . ?
Ag5 S6 2.5082(16) . ?
Ag5 S10 2.5230(16) . ?
Ag5 I2 2.8012(7) . ?
Ag5 I1 3.1296(8) . ?
Ag5 Ag8 3.2084(8) . ?
Ag5 Ag6 3.2276(8) . ?
Ag6 S8 2.4927(16) . ?
Ag6 S5 2.5771(15) . ?
Ag6 I2 2.8301(7) . ?
Ag6 I1 3.1867(7) . ?
Ag7 S1 2.5412(15) . ?
Ag7 S5 2.5730(16) . ?
Ag7 I4 2.7276(7) . ?
Ag7 Ag9 3.1735(8) . ?
Ag7 I1 3.2254(7) . ?
Ag7 Ag8 3.3236(8) . ?
Ag8 S1 2.4923(15) . ?
Ag8 S6 2.4966(15) . ?
Ag8 S9 2.5104(15) . ?
Ag9 S4 2.5195(15) . ?
Ag9 S2 2.6951(15) . ?
Ag9 I4 2.7118(7) . ?
Ag9 I1 3.1734(7) . ?
Ag10 S3 2.4556(18) . ?
Ag10 S7 2.5158(17) . ?
Ag10 S12 2.6259(16) . ?
O1 C1 1.456(7) . ?
O1 P1 1.573(4) . ?
O2 C4 1.481(7) . ?
O2 P1 1.572(4) . ?
O3 C7 1.442(9) . ?
O3 P2 1.571(4) . ?
O4 C10 1.469(7) . ?
O4 P2 1.573(4) . ?
O5 C13 1.486(7) . ?
O5 P3 1.569(4) . ?
O6 C16 1.464(7) . ?
O6 P3 1.569(4) . ?
O7 C19 1.474(7) . ?
O7 P4 1.572(4) . ?
O8 C22 1.487(7) . ?
O8 P4 1.580(4) . ?
O9 C25 1.399(10) . ?
O9 P5 1.587(5) . ?
O10 C28 1.474(8) . ?
O10 P5 1.566(5) . ?
O11 C31 1.477(7) . ?
O11 P6 1.573(4) . ?
O12 C34 1.454(7) . ?
O12 P6 1.577(4) . ?
P1 S2 2.0033(19) . ?
P1 S1 2.0087(19) . ?
P2 S3 1.982(2) . ?
P2 S4 2.0186(19) . ?
P3 S5 1.995(2) . ?
P3 S6 2.017(2) . ?
P4 S8 1.974(2) . ?
P4 S7 2.017(2) . ?
P5 S10 1.993(2) . ?
P5 S9 2.022(2) . ?
P6 S12 1.997(2) . ?
P6 S11 1.9990(19) . ?
C1 C3 1.471(10) . ?
C1 C2 1.491(11) . ?
C1 H1 0.9800 . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C4 C5 1.481(10) . ?
C4 C6 1.483(10) . ?
C4 H4 0.9800 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C7 C9 1.37(3) . ?
C7 C8' 1.45(2) . ?
C7 C8 1.538(10) . ?
C7 C9' 1.546(10) . ?
C7 H7 0.9800 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C8' H8D 0.9600 . ?
C8' H8E 0.9600 . ?
C8' H8F 0.9600 . ?
C9' H9D 0.9600 . ?
C9' H9E 0.9600 . ?
C9' H9F 0.9600 . ?
C10 C11' 1.38(2) . ?
C10 C12' 1.517(10) . ?
C10 C12 1.522(9) . ?
C10 C11 1.61(2) . ?
C10 H10 0.9800 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C11' H11D 0.9600 . ?
C11' H11E 0.9600 . ?
C11' H11F 0.9600 . ?
C12' H12D 0.9600 . ?
C12' H12E 0.9600 . ?
C12' H12F 0.9600 . ?
C13 C14 1.462(10) . ?
C13 C15 1.466(10) . ?
C13 H13 0.9800 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C16 C17 1.475(10) . ?
C16 C18 1.509(10) . ?
C16 H16 0.9800 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C19 C21 1.490(10) . ?
C19 C20 1.495(10) . ?
C19 H19 0.9800 . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 C23 1.424(12) . ?
C22 C24 1.474(11) . ?
C22 H22 0.9800 . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C25 C26 1.386(16) . ?
C25 C27 1.507(14) . ?
C25 H25 0.9800 . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 C30 1.485(13) . ?
C28 C29 1.493(12) . ?
C28 H28 0.9800 . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
C31 C32 1.495(9) . ?
C31 C33 1.499(9) . ?
C31 H31 0.9800 . ?
C32 H32A 0.9600 . ?
C32 H32B 0.9600 . ?
C32 H32C 0.9600 . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C34 C35 1.487(11) . ?
C34 C36 1.504(10) . ?
C34 H34 0.9800 . ?
C35 H35A 0.9600 . ?
C35 H35B 0.9600 . ?
C35 H35C 0.9600 . ?
C36 H36A 0.9600 . ?
C36 H36B 0.9600 . ?
C36 H36C 0.9600 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
S4 Ag1 S12 115.39(5) . . ?
S4 Ag1 I3 117.43(4) . . ?
S12 Ag1 I3 118.41(4) . . ?
S4 Ag1 I1 99.03(4) . . ?
S12 Ag1 I1 102.26(4) . . ?
I3 Ag1 I1 98.57(2) . . ?
S4 Ag1 Ag3 148.80(4) . . ?
S12 Ag1 Ag3 91.95(4) . . ?
I3 Ag1 Ag3 53.419(16) . . ?
I1 Ag1 Ag3 58.516(16) . . ?
S4 Ag1 Ag10 90.48(4) . . ?
S12 Ag1 Ag10 51.59(4) . . ?
I3 Ag1 Ag10 149.03(2) . . ?
I1 Ag1 Ag10 61.703(18) . . ?
Ag3 Ag1 Ag10 95.81(2) . . ?
S2 Ag2 S9 120.41(5) . . ?
S2 Ag2 I3 112.79(4) . . ?
S9 Ag2 I3 118.60(4) . . ?
S2 Ag2 Ag3 140.28(4) . . ?
S9 Ag2 Ag3 94.97(4) . . ?
I3 Ag2 Ag3 55.061(16) . . ?
S2 Ag2 Ag8 91.14(4) . . ?
S9 Ag2 Ag8 51.11(4) . . ?
I3 Ag2 Ag8 153.24(2) . . ?
Ag3 Ag2 Ag8 98.94(2) . . ?
S11 Ag3 S10 99.00(5) . . ?
S11 Ag3 I3 125.54(4) . . ?
S10 Ag3 I3 128.64(4) . . ?
S11 Ag3 Ag2 158.35(4) . . ?
S10 Ag3 Ag2 92.17(4) . . ?
I3 Ag3 Ag2 56.184(17) . . ?
S11 Ag3 I1 96.51(4) . . ?
S10 Ag3 I1 96.59(4) . . ?
I3 Ag3 I1 101.64(2) . . ?
Ag2 Ag3 I1 63.625(17) . . ?
S11 Ag3 Ag1 93.14(4) . . ?
S10 Ag3 Ag1 155.35(4) . . ?
I3 Ag3 Ag1 55.330(16) . . ?
Ag2 Ag3 Ag1 70.122(18) . . ?
I1 Ag3 Ag1 60.559(16) . . ?
S7 Ag4 S11 116.84(5) . . ?
S7 Ag4 I2 121.28(4) . . ?
S11 Ag4 I2 112.49(4) . . ?
S7 Ag4 Ag6 93.18(4) . . ?
S11 Ag4 Ag6 146.39(4) . . ?
I2 Ag4 Ag6 56.073(16) . . ?
S7 Ag4 Ag10 50.72(4) . . ?
S11 Ag4 Ag10 99.18(4) . . ?
I2 Ag4 Ag10 143.99(3) . . ?
Ag6 Ag4 Ag10 88.06(2) . . ?
S7 Ag4 I1 108.49(5) . . ?
S11 Ag4 I1 94.75(4) . . ?
I2 Ag4 I1 96.862(18) . . ?
Ag6 Ag4 I1 59.514(15) . . ?
Ag10 Ag4 I1 62.685(18) . . ?
S6 Ag5 S10 115.94(5) . . ?
S6 Ag5 I2 120.34(4) . . ?
S10 Ag5 I2 109.08(4) . . ?
S6 Ag5 I1 110.62(4) . . ?
S10 Ag5 I1 97.53(4) . . ?
I2 Ag5 I1 99.63(2) . . ?
S6 Ag5 Ag8 49.97(4) . . ?
S10 Ag5 Ag8 91.93(4) . . ?
I2 Ag5 Ag8 158.34(3) . . ?
I1 Ag5 Ag8 71.611(18) . . ?
S6 Ag5 Ag6 97.79(4) . . ?
S10 Ag5 Ag6 145.09(4) . . ?
I2 Ag5 Ag6 55.451(16) . . ?
I1 Ag5 Ag6 60.146(17) . . ?
Ag8 Ag5 Ag6 104.05(2) . . ?
S8 Ag6 S5 107.51(5) . . ?
S8 Ag6 I2 121.94(4) . . ?
S5 Ag6 I2 125.34(4) . . ?
S8 Ag6 Ag4 92.57(4) . . ?
S5 Ag6 Ag4 147.66(4) . . ?
I2 Ag6 Ag4 55.349(16) . . ?
S8 Ag6 I1 106.95(5) . . ?
S5 Ag6 I1 88.19(4) . . ?
I2 Ag6 I1 97.677(18) . . ?
Ag4 Ag6 I1 61.325(15) . . ?
S8 Ag6 Ag5 160.93(5) . . ?
S5 Ag6 Ag5 85.39(4) . . ?
I2 Ag6 Ag5 54.611(17) . . ?
Ag4 Ag6 Ag5 70.008(18) . . ?
I1 Ag6 Ag5 58.402(17) . . ?
S1 Ag7 S5 116.32(5) . . ?
S1 Ag7 I4 122.53(4) . . ?
S5 Ag7 I4 114.46(4) . . ?
S1 Ag7 Ag9 99.24(4) . . ?
S5 Ag7 Ag9 138.13(4) . . ?
I4 Ag7 Ag9 54.076(17) . . ?
S1 Ag7 I1 108.55(4) . . ?
S5 Ag7 I1 87.42(4) . . ?
I4 Ag7 I1 98.71(2) . . ?
Ag9 Ag7 I1 59.457(16) . . ?
S1 Ag7 Ag8 48.05(3) . . ?
S5 Ag7 Ag8 88.28(4) . . ?
I4 Ag7 Ag8 154.21(2) . . ?
Ag9 Ag7 Ag8 101.04(2) . . ?
I1 Ag7 Ag8 68.962(17) . . ?
S1 Ag8 S6 118.19(5) . . ?
S1 Ag8 S9 120.21(5) . . ?
S6 Ag8 S9 117.08(5) . . ?
S1 Ag8 Ag2 95.65(4) . . ?
S6 Ag8 Ag2 139.44(4) . . ?
S9 Ag8 Ag2 51.10(4) . . ?
S1 Ag8 Ag5 138.66(4) . . ?
S6 Ag8 Ag5 50.29(4) . . ?
S9 Ag8 Ag5 94.74(4) . . ?
Ag2 Ag8 Ag5 89.72(2) . . ?
S1 Ag8 Ag7 49.31(3) . . ?
S6 Ag8 Ag7 94.72(4) . . ?
S9 Ag8 Ag7 141.77(4) . . ?
Ag2 Ag8 Ag7 91.07(2) . . ?
Ag5 Ag8 Ag7 89.74(2) . . ?
S4 Ag9 S2 93.78(5) . . ?
S4 Ag9 I4 136.55(4) . . ?
S2 Ag9 I4 124.13(4) . . ?
S4 Ag9 I1 100.20(4) . . ?
S2 Ag9 I1 89.73(3) . . ?
I4 Ag9 I1 100.32(2) . . ?
S4 Ag9 Ag7 161.27(4) . . ?
S2 Ag9 Ag7 85.89(3) . . ?
I4 Ag9 Ag7 54.539(17) . . ?
I1 Ag9 Ag7 61.084(17) . . ?
S3 Ag10 S7 132.00(6) . . ?
S3 Ag10 S12 113.19(5) . . ?
S7 Ag10 S12 101.82(6) . . ?
S3 Ag10 Ag4 155.57(5) . . ?
S7 Ag10 Ag4 49.83(4) . . ?
S12 Ag10 Ag4 86.95(4) . . ?
S3 Ag10 Ag1 92.50(4) . . ?
S7 Ag10 Ag1 135.48(5) . . ?
S12 Ag10 Ag1 48.45(4) . . ?
Ag4 Ag10 Ag1 91.07(2) . . ?
Ag5 I1 Ag3 70.791(16) . . ?
Ag5 I1 Ag9 147.539(19) . . ?
Ag3 I1 Ag9 120.028(18) . . ?
Ag5 I1 Ag6 61.452(15) . . ?
Ag3 I1 Ag6 118.626(17) . . ?
Ag9 I1 Ag6 121.057(18) . . ?
Ag5 I1 Ag7 92.975(17) . . ?
Ag3 I1 Ag7 143.063(18) . . ?
Ag9 I1 Ag7 59.459(15) . . ?
Ag6 I1 Ag7 77.348(15) . . ?
Ag5 I1 Ag1 131.696(18) . . ?
Ag3 I1 Ag1 60.925(15) . . ?
Ag9 I1 Ag1 68.005(15) . . ?
Ag6 I1 Ag1 143.941(17) . . ?
Ag7 I1 Ag1 126.583(17) . . ?
Ag5 I1 Ag4 70.349(16) . . ?
Ag3 I1 Ag4 70.321(15) . . ?
Ag9 I1 Ag4 141.199(18) . . ?
Ag6 I1 Ag4 59.161(14) . . ?
Ag7 I1 Ag4 136.375(17) . . ?
Ag1 I1 Ag4 91.428(16) . . ?
Ag5 I2 Ag4 81.85(2) . . ?
Ag5 I2 Ag6 69.938(19) . . ?
Ag4 I2 Ag6 68.578(18) . . ?
Ag3 I3 Ag2 68.755(19) . . ?
Ag3 I3 Ag1 71.251(19) . . ?
Ag2 I3 Ag1 81.56(2) . . ?
Ag9 I4 Ag7 71.38(2) . . ?
C1 O1 P1 123.9(4) . . ?
C4 O2 P1 122.6(3) . . ?
C7 O3 P2 125.3(4) . . ?
C10 O4 P2 122.3(4) . . ?
C13 O5 P3 121.6(4) . . ?
C16 O6 P3 122.1(3) . . ?
C19 O7 P4 127.1(4) . . ?
C22 O8 P4 124.3(4) . . ?
C25 O9 P5 128.4(6) . . ?
C28 O10 P5 126.5(4) . . ?
C31 O11 P6 123.6(4) . . ?
C34 O12 P6 123.8(4) . . ?
O2 P1 O1 101.7(2) . . ?
O2 P1 S2 111.59(15) . . ?
O1 P1 S2 109.11(16) . . ?
O2 P1 S1 104.50(15) . . ?
O1 P1 S1 109.73(16) . . ?
S2 P1 S1 118.80(8) . . ?
O3 P2 O4 101.3(2) . . ?
O3 P2 S3 109.48(18) . . ?
O4 P2 S3 113.82(17) . . ?
O3 P2 S4 108.34(18) . . ?
O4 P2 S4 104.39(16) . . ?
S3 P2 S4 118.09(9) . . ?
O5 P3 O6 102.3(2) . . ?
O5 P3 S5 105.24(16) . . ?
O6 P3 S5 111.14(17) . . ?
O5 P3 S6 110.22(17) . . ?
O6 P3 S6 107.51(18) . . ?
S5 P3 S6 119.15(9) . . ?
O7 P4 O8 106.2(2) . . ?
O7 P4 S8 107.53(16) . . ?
O8 P4 S8 111.45(19) . . ?
O7 P4 S7 110.26(16) . . ?
O8 P4 S7 102.55(17) . . ?
S8 P4 S7 118.26(10) . . ?
O10 P5 O9 111.3(3) . . ?
O10 P5 S10 110.07(18) . . ?
O9 P5 S10 101.3(2) . . ?
O10 P5 S9 102.8(2) . . ?
O9 P5 S9 110.1(2) . . ?
S10 P5 S9 121.45(9) . . ?
O11 P6 O12 108.5(2) . . ?
O11 P6 S12 103.82(16) . . ?
O12 P6 S12 110.62(18) . . ?
O11 P6 S11 110.31(17) . . ?
O12 P6 S11 102.05(16) . . ?
S12 P6 S11 121.22(9) . . ?
P1 S1 Ag8 103.06(7) . . ?
P1 S1 Ag7 108.79(7) . . ?
Ag8 S1 Ag7 82.64(4) . . ?
P1 S2 Ag2 104.69(7) . . ?
P1 S2 Ag9 111.49(7) . . ?
Ag2 S2 Ag9 100.41(5) . . ?
P2 S3 Ag10 106.63(8) . . ?
P2 S4 Ag1 105.14(7) . . ?
P2 S4 Ag9 100.26(7) . . ?
Ag1 S4 Ag9 90.99(5) . . ?
P3 S5 Ag7 107.18(7) . . ?
P3 S5 Ag6 111.08(7) . . ?
Ag7 S5 Ag6 102.16(5) . . ?
P3 S6 Ag8 105.63(7) . . ?
P3 S6 Ag5 107.78(7) . . ?
Ag8 S6 Ag5 79.74(5) . . ?
P4 S7 Ag4 103.38(7) . . ?
P4 S7 Ag10 111.27(9) . . ?
Ag4 S7 Ag10 79.46(5) . . ?
P4 S8 Ag6 103.29(8) . . ?
P5 S9 Ag2 106.95(7) . . ?
P5 S9 Ag8 107.55(8) . . ?
Ag2 S9 Ag8 77.79(4) . . ?
P5 S10 Ag5 109.54(8) . . ?
P5 S10 Ag3 104.42(8) . . ?
Ag5 S10 Ag3 92.47(5) . . ?
P6 S11 Ag4 105.08(7) . . ?
P6 S11 Ag3 103.30(7) . . ?
Ag4 S11 Ag3 94.65(5) . . ?
P6 S12 Ag1 107.31(7) . . ?
P6 S12 Ag10 114.57(7) . . ?
Ag1 S12 Ag10 79.96(5) . . ?
O1 C1 C3 107.5(6) . . ?
O1 C1 C2 107.9(7) . . ?
C3 C1 C2 111.8(7) . . ?
O1 C1 H1 109.9 . . ?
C3 C1 H1 109.9 . . ?
C2 C1 H1 109.9 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C3 H3A 109.5 . . ?
C1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C5 C4 O2 108.2(6) . . ?
C5 C4 C6 112.3(6) . . ?
O2 C4 C6 106.2(5) . . ?
C5 C4 H4 110.0 . . ?
O2 C4 H4 110.0 . . ?
C6 C4 H4 110.0 . . ?
C4 C5 H5A 109.5 . . ?
C4 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
C4 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
C4 C6 H6A 109.5 . . ?
C4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C9 C7 O3 118.6(16) . . ?
C9 C7 C8' 92.5(14) . . ?
O3 C7 C8' 116.6(14) . . ?
C9 C7 C8 115.6(14) . . ?
O3 C7 C8 100.7(11) . . ?
C8' C7 C8 23.2(12) . . ?
C9 C7 C9' 18.7(12) . . ?
O3 C7 C9' 103.0(12) . . ?
C8' C7 C9' 109.8(14) . . ?
C8 C7 C9' 132.2(16) . . ?
C9 C7 H7 107.1 . . ?
O3 C7 H7 107.1 . . ?
C8' C7 H7 114.5 . . ?
C8 C7 H7 107.1 . . ?
C9' C7 H7 104.6 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
C7 C8' H8D 109.5 . . ?
C7 C8' H8E 109.5 . . ?
H8D C8' H8E 109.5 . . ?
C7 C8' H8F 109.5 . . ?
H8D C8' H8F 109.5 . . ?
H8E C8' H8F 109.5 . . ?
C7 C9' H9D 109.5 . . ?
C7 C9' H9E 109.5 . . ?
H9D C9' H9E 109.5 . . ?
C7 C9' H9F 109.5 . . ?
H9D C9' H9F 109.5 . . ?
H9E C9' H9F 109.5 . . ?
C11' C10 O4 118.1(11) . . ?
C11' C10 C12' 113.7(14) . . ?
O4 C10 C12' 109.7(15) . . ?
C11' C10 C12 124.0(14) . . ?
O4 C10 C12 104.7(13) . . ?
C12' C10 C12 11(2) . . ?
C11' C10 C11 33.2(13) . . ?
O4 C10 C11 103.0(8) . . ?
C12' C10 C11 95.5(17) . . ?
C12 C10 C11 106.3(13) . . ?
C11' C10 H10 80.7 . . ?
O4 C10 H10 113.9 . . ?
C12' C10 H10 118.5 . . ?
C12 C10 H10 113.9 . . ?
C11 C10 H10 113.9 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
C10 C11' H11D 109.5 . . ?
C10 C11' H11E 109.5 . . ?
H11D C11' H11E 109.5 . . ?
C10 C11' H11F 109.5 . . ?
H11D C11' H11F 109.5 . . ?
H11E C11' H11F 109.5 . . ?
C10 C12' H12D 109.5 . . ?
C10 C12' H12E 109.5 . . ?
H12D C12' H12E 109.5 . . ?
C10 C12' H12F 109.5 . . ?
H12D C12' H12F 109.5 . . ?
H12E C12' H12F 109.5 . . ?
C14 C13 C15 115.1(8) . . ?
C14 C13 O5 106.9(6) . . ?
C15 C13 O5 108.5(5) . . ?
C14 C13 H13 108.7 . . ?
C15 C13 H13 108.7 . . ?
O5 C13 H13 108.7 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
O6 C16 C17 108.3(6) . . ?
O6 C16 C18 106.8(6) . . ?
C17 C16 C18 115.2(6) . . ?
O6 C16 H16 108.8 . . ?
C17 C16 H16 108.8 . . ?
C18 C16 H16 108.8 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
O7 C19 C21 112.6(6) . . ?
O7 C19 C20 105.6(5) . . ?
C21 C19 C20 113.2(6) . . ?
O7 C19 H19 108.4 . . ?
C21 C19 H19 108.4 . . ?
C20 C19 H19 108.4 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 C24 113.2(8) . . ?
C23 C22 O8 109.4(7) . . ?
C24 C22 O8 106.9(6) . . ?
C23 C22 H22 109.1 . . ?
C24 C22 H22 109.1 . . ?
O8 C22 H22 109.1 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C26 C25 O9 112.9(11) . . ?
C26 C25 C27 112.9(10) . . ?
O9 C25 C27 107.6(9) . . ?
C26 C25 H25 107.7 . . ?
O9 C25 H25 107.7 . . ?
C27 C25 H25 107.7 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C25 C27 H27A 109.5 . . ?
C25 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C25 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
O10 C28 C30 109.6(8) . . ?
O10 C28 C29 106.4(7) . . ?
C30 C28 C29 114.5(8) . . ?
O10 C28 H28 108.7 . . ?
C30 C28 H28 108.7 . . ?
C29 C28 H28 108.7 . . ?
C28 C29 H29A 109.5 . . ?
C28 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C28 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C28 C30 H30A 109.5 . . ?
C28 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C28 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
O11 C31 C32 105.5(5) . . ?
O11 C31 C33 109.6(5) . . ?
C32 C31 C33 112.4(6) . . ?
O11 C31 H31 109.7 . . ?
C32 C31 H31 109.7 . . ?
C33 C31 H31 109.7 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C31 C33 H33A 109.5 . . ?
C31 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C31 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
O12 C34 C35 109.1(6) . . ?
O12 C34 C36 105.9(6) . . ?
C35 C34 C36 112.2(7) . . ?
O12 C34 H34 109.9 . . ?
C35 C34 H34 109.9 . . ?
C36 C34 H34 109.9 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?

_diffrn_measured_fraction_theta_max 1.000
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 1.000
_refine_diff_density_max         2.292
_refine_diff_density_min         -1.734
_refine_diff_density_rms         0.117



#===END
_database_code_depnum_ccdc_archive 'CCDC 977331'
