#------------------------------------------------------------------------------
#$Date: 2017-06-14 05:12:32 +0300 (Wed, 14 Jun 2017) $
#$Revision: 197787 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/84/7228459.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7228459
loop_
_publ_author_name
'Hu, Ting'
'Li, Yu-Hang'
'Kuang, Xiao-Fei'
'Lu, Can-Zhong'
_publ_section_title
;
 Synthesis and characterization of polyoxometalate-based silver(i)
 phenylethynide compounds with antibacterial and antifungal activities
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/C7CE00180K
_journal_year                    2017
_chemical_formula_sum            'C144 H132 Ag19 O50 P S8 W12'
_chemical_formula_weight         7205.68
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2017-01-23 deposited with the CCDC.
2017-05-22 downloaded from the CCDC.
;
_cell_angle_alpha                93.702(3)
_cell_angle_beta                 101.547(6)
_cell_angle_gamma                101.388(7)
_cell_formula_units_Z            1
_cell_length_a                   13.6613(15)
_cell_length_b                   18.0152(9)
_cell_length_c                   18.7774(6)
_cell_measurement_reflns_used    9926
_cell_measurement_temperature    173
_cell_measurement_theta_max      25.43
_cell_measurement_theta_min      3.33
_cell_volume                     4412.5(6)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0475
_diffrn_reflns_av_sigmaI/netI    0.0551
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            42160
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         3.04
_exptl_absorpt_coefficient_mu    10.009
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5728
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2012)'
_exptl_crystal_colour            dark-yellow
_exptl_crystal_density_diffrn    2.712
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             3320
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.14
_refine_diff_density_max         2.282
_refine_diff_density_min         -1.663
_refine_diff_density_rms         0.201
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.956
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1074
_refine_ls_number_reflns         15225
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      0.956
_refine_ls_R_factor_all          0.0712
_refine_ls_R_factor_gt           0.0364
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0333P)²+20.3828P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0707
_refine_ls_wR_factor_ref         0.0783
_reflns_number_gt                10780
_reflns_number_total             15225
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c7ce00180k2.cif
_cod_data_source_block           6
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7228459
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Ag1 Ag 0.33504(6) 0.88660(6) 0.53236(5) 0.0346(2) Uani 0.95 1 d P
Ag1' Ag 0.3660(14) 0.8598(10) 0.5067(9) 0.037(4) Uani 0.05 1 d PU
Ag2 Ag 0.55836(7) 0.85857(5) 0.55840(6) 0.0427(2) Uani 0.95 1 d P
Ag2' Ag 0.5847(10) 0.8886(10) 0.5999(8) 0.026(4) Uani 0.05 1 d P
Ag3 Ag 0.49024(7) 0.98261(4) 0.64764(4) 0.03051(19) Uani 0.95 1 d P
Ag3' Ag 0.4270(13) 0.9820(8) 0.6281(9) 0.030(4) Uani 0.05 1 d PU
Ag4 Ag 0.5000 1.0000 0.5000 0.0245(2) Uani 1 2 d S
Ag5 Ag 0.78040(6) 0.92395(4) 0.64479(4) 0.03500(19) Uani 1 1 d .
Ag6 Ag 0.70977(5) 1.07004(4) 0.62815(4) 0.03291(18) Uani 1 1 d .
Ag7 Ag 0.73042(5) 0.93742(4) 0.48484(3) 0.02711(17) Uani 1 1 d .
Ag8 Ag 0.95158(5) 0.92629(4) 0.54857(4) 0.02763(16) Uani 1 1 d .
Ag9 Ag 0.88861(5) 0.93926(4) 0.38863(4) 0.02992(17) Uani 1 1 d .
Ag10 Ag 0.89302(5) 1.08460(4) 0.55412(4) 0.0393(2) Uani 1 1 d .
W1 W 0.11386(3) 0.68711(2) -0.025689(18) 0.02494(10) Uani 1 1 d .
W2 W 0.00218(3) 0.44827(2) 0.179693(19) 0.02939(10) Uani 1 1 d .
W3 W -0.11605(3) 0.66388(2) 0.039303(19) 0.02820(10) Uani 1 1 d .
W4 W 0.11354(3) 0.63612(2) 0.153963(19) 0.02865(10) Uani 1 1 d .
W5 W 0.22822(3) 0.52307(2) -0.06652(2) 0.03064(10) Uani 1 1 d .
W6 W -0.23132(3) 0.52686(2) -0.11375(2) 0.03336(11) Uani 1 1 d .
P1 P 0.0000 0.5000 0.0000 0.0075(6) Uani 1 2 d S
S1 S 0.79236(19) 0.84641(16) 0.21460(14) 0.0427(7) Uani 1 1 d .
S2 S 0.8070(3) 0.8351(2) 0.79908(19) 0.0481(9) Uani 0.80 1 d P
S2' S 0.8443(15) 0.7734(11) 0.7667(12) 0.080(6) Uani 0.20 1 d P
S3 S 0.3871(4) 0.8065(3) 0.1435(4) 0.127(2) Uani 1 1 d .
S4 S 0.5903(5) 0.7057(4) 0.9653(3) 0.081(2) Uani 0.60 1 d P
S4' S 0.4909(11) 0.6795(10) 1.0024(13) 0.199(10) Uani 0.40 1 d P
C1 C 0.4396(7) 0.8536(5) 0.6243(5) 0.032(2) Uani 1 1 d .
C2 C 0.4322(6) 0.7914(5) 0.6471(5) 0.027(2) Uani 1 1 d .
C3 C 0.4211(7) 0.7189(5) 0.6772(5) 0.034(2) Uani 1 1 d .
C4 C 0.3515(9) 0.7031(6) 0.7193(6) 0.057(3) Uani 1 1 d .
H4A H 0.3132 0.7381 0.7296 0.068 Uiso 1 1 calc R
C5 C 0.3392(11) 0.6322(8) 0.7467(8) 0.083(5) Uani 1 1 d .
H5A H 0.2902 0.6199 0.7745 0.100 Uiso 1 1 calc R
C6 C 0.3980(11) 0.5785(7) 0.7339(8) 0.072(4) Uani 1 1 d .
H6A H 0.3898 0.5333 0.7555 0.087 Uiso 1 1 calc R
C7 C 0.4668(10) 0.5921(7) 0.6901(7) 0.068(4) Uani 1 1 d .
H7A H 0.5043 0.5567 0.6794 0.081 Uiso 1 1 calc R
C8 C 0.4772(9) 0.6622(6) 0.6628(6) 0.056(3) Uani 1 1 d .
H8A H 0.5238 0.6733 0.6330 0.067 Uiso 1 1 calc R
C9 C 0.7113(6) 0.8383(5) 0.5395(5) 0.023(2) Uani 1 1 d .
C10 C 0.7013(6) 0.7702(6) 0.5478(5) 0.028(2) Uani 1 1 d .
C11 C 0.6972(5) 0.6882(3) 0.5558(4) 0.037(3) Uani 1 1 d G
C12 C 0.7611(6) 0.6659(4) 0.6140(4) 0.063(4) Uani 1 1 d G
H12A H 0.8075 0.7024 0.6482 0.076 Uiso 1 1 calc R
C13 C 0.7557(7) 0.5890(4) 0.6211(5) 0.092(5) Uani 1 1 d G
H13A H 0.7985 0.5740 0.6600 0.110 Uiso 1 1 calc R
C14 C 0.6863(7) 0.5343(3) 0.5700(5) 0.086(5) Uani 1 1 d G
H14A H 0.6827 0.4829 0.5747 0.103 Uiso 1 1 calc R
C15 C 0.6224(6) 0.5567(3) 0.5118(4) 0.065(4) Uani 1 1 d G
H15A H 0.5760 0.5202 0.4776 0.078 Uiso 1 1 calc R
C16 C 0.6278(5) 0.6336(4) 0.5047(3) 0.044(3) Uani 1 1 d G
H16A H 0.5850 0.6486 0.4658 0.053 Uiso 1 1 calc R
C17 C 0.6768(6) 0.9919(5) 0.7031(5) 0.030(2) Uani 1 1 d .
C18 C 0.6518(7) 0.9755(6) 0.7572(5) 0.040(3) Uani 1 1 d .
C19 C 0.6308(5) 0.9586(5) 0.8280(3) 0.052(3) Uani 1 1 d G
C20 C 0.5323(4) 0.9265(6) 0.8347(3) 0.072(4) Uani 1 1 d G
H20A H 0.4791 0.9146 0.7935 0.086 Uiso 1 1 calc R
C21 C 0.5132(5) 0.9123(6) 0.9031(4) 0.105(6) Uani 1 1 d G
H21A H 0.4472 0.8909 0.9076 0.126 Uiso 1 1 calc R
C22 C 0.5926(7) 0.9301(7) 0.9648(3) 0.130(8) Uani 1 1 d G
H22A H 0.5799 0.9206 1.0105 0.156 Uiso 1 1 calc R
C23 C 0.6912(6) 0.9622(7) 0.9580(3) 0.126(8) Uani 1 1 d G
H23A H 0.7443 0.9741 0.9993 0.151 Uiso 1 1 calc R
C24 C 0.7102(4) 0.9764(6) 0.8896(4) 0.084(5) Uani 1 1 d G
H24A H 0.7762 0.9979 0.8851 0.101 Uiso 1 1 calc R
C25 C 0.5046(6) 0.9091(5) 0.4251(5) 0.023(2) Uani 1 1 d .
C26 C 0.4993(6) 0.8444(5) 0.3948(4) 0.026(2) Uani 1 1 d .
C27 C 0.4931(7) 0.7667(5) 0.3608(4) 0.026(2) Uani 1 1 d .
C28 C 0.4004(8) 0.7184(5) 0.3455(5) 0.039(3) Uani 1 1 d .
H28A H 0.3431 0.7334 0.3560 0.046 Uiso 1 1 calc R
C29 C 0.3939(8) 0.6435(6) 0.3124(6) 0.045(3) Uani 1 1 d .
H29A H 0.3304 0.6101 0.3015 0.054 Uiso 1 1 calc R
C30 C 0.4751(9) 0.6176(6) 0.2958(5) 0.046(3) Uani 1 1 d .
H30A H 0.4661 0.5685 0.2733 0.055 Uiso 1 1 calc R
C31 C 0.5683(8) 0.6647(6) 0.3126(6) 0.044(3) Uani 1 1 d .
H31A H 0.6253 0.6482 0.3031 0.053 Uiso 1 1 calc R
C32 C 0.5777(8) 0.7383(6) 0.3444(5) 0.039(3) Uani 1 1 d .
H32A H 0.6420 0.7707 0.3554 0.047 Uiso 1 1 calc R
C33 C 0.9557(6) 0.9971(5) 0.6438(5) 0.027(2) Uani 1 1 d .
C34 C 0.9564(7) 1.0186(5) 0.7074(5) 0.032(2) Uani 1 1 d .
C35 C 0.9652(7) 1.0433(6) 0.7832(5) 0.032(2) Uani 1 1 d .
C36 C 1.0109(8) 1.0043(7) 0.8364(5) 0.055(3) Uani 1 1 d .
H36A H 1.0355 0.9619 0.8235 0.066 Uiso 1 1 calc R
C37 C 1.0198(10) 1.0291(8) 0.9094(6) 0.069(4) Uani 1 1 d .
H37A H 1.0496 1.0031 0.9462 0.083 Uiso 1 1 calc R
C38 C 0.9827(12) 1.0948(9) 0.9269(6) 0.086(6) Uani 1 1 d .
H38A H 0.9919 1.1126 0.9759 0.103 Uiso 1 1 calc R
C39 C 0.9346(11) 1.1329(7) 0.8755(6) 0.073(4) Uani 1 1 d .
H39A H 0.9086 1.1743 0.8891 0.088 Uiso 1 1 calc R
C40 C 0.9251(9) 1.1092(6) 0.8036(5) 0.047(3) Uani 1 1 d .
H40A H 0.8931 1.1348 0.7676 0.056 Uiso 1 1 calc R
C41 C 0.7709(7) 1.1602(5) 0.5774(4) 0.028(2) Uani 1 1 d .
C42 C 0.7946(7) 1.2237(5) 0.5590(5) 0.030(2) Uani 1 1 d .
C43 C 0.8241(5) 1.3022(3) 0.5438(3) 0.028(2) Uani 1 1 d G
C44 C 0.8097(5) 1.3205(3) 0.4722(3) 0.046(3) Uani 1 1 d G
H44A H 0.7792 1.2826 0.4336 0.055 Uiso 1 1 calc R
C45 C 0.8409(6) 1.3953(4) 0.4581(3) 0.065(4) Uani 1 1 d G
H45A H 0.8312 1.4075 0.4102 0.079 Uiso 1 1 calc R
C46 C 0.8864(6) 1.4519(3) 0.5156(4) 0.061(4) Uani 1 1 d G
H46A H 0.9073 1.5019 0.5062 0.073 Uiso 1 1 calc R
C47 C 0.9009(5) 1.4336(3) 0.5873(3) 0.049(3) Uani 1 1 d G
H47A H 0.9314 1.4715 0.6258 0.059 Uiso 1 1 calc R
C48 C 0.8697(5) 1.3588(3) 0.6013(2) 0.034(2) Uani 1 1 d G
H48A H 0.8794 1.3466 0.6492 0.041 Uiso 1 1 calc R
C49 C 0.7757(6) 1.0256(5) 0.4244(4) 0.025(2) Uani 1 1 d .
C50 C 0.7987(6) 1.0683(5) 0.3796(5) 0.024(2) Uani 1 1 d .
C51 C 0.8251(7) 1.1202(5) 0.3290(5) 0.030(2) Uani 1 1 d .
C52 C 0.7783(9) 1.1042(7) 0.2556(6) 0.052(3) Uani 1 1 d .
H52A H 0.7295 1.0594 0.2390 0.062 Uiso 1 1 calc R
C53 C 0.8045(9) 1.1550(7) 0.2073(6) 0.058(3) Uani 1 1 d .
H53A H 0.7752 1.1436 0.1577 0.070 Uiso 1 1 calc R
C54 C 0.8728(10) 1.2216(8) 0.2319(8) 0.067(4) Uani 1 1 d .
H54A H 0.8882 1.2565 0.1993 0.081 Uiso 1 1 calc R
C55 C 0.9193(9) 1.2377(7) 0.3043(8) 0.067(4) Uani 1 1 d .
H55A H 0.9682 1.2825 0.3207 0.081 Uiso 1 1 calc R
C56 C 0.8929(8) 1.1868(6) 0.3528(6) 0.050(3) Uani 1 1 d .
H56A H 0.9222 1.1985 0.4024 0.059 Uiso 1 1 calc R
C57 C 0.9529(6) 0.8470(5) 0.4609(5) 0.026(2) Uani 1 1 d .
C58 C 0.9272(6) 0.7867(5) 0.4222(5) 0.026(2) Uani 1 1 d .
C59 C 0.8941(7) 0.7109(5) 0.3797(4) 0.027(2) Uani 1 1 d .
C60 C 0.8440(7) 0.6522(5) 0.4096(5) 0.035(2) Uani 1 1 d .
H60A H 0.8321 0.6596 0.4564 0.043 Uiso 1 1 calc R
C61 C 0.8108(8) 0.5812(6) 0.3695(5) 0.046(3) Uani 1 1 d .
H61A H 0.7758 0.5410 0.3895 0.055 Uiso 1 1 calc R
C62 C 0.8287(8) 0.5689(6) 0.2998(6) 0.046(3) Uani 1 1 d .
H62A H 0.8064 0.5209 0.2736 0.056 Uiso 1 1 calc R
C63 C 0.8790(8) 0.6274(6) 0.2707(6) 0.045(3) Uani 1 1 d .
H63A H 0.8919 0.6199 0.2243 0.054 Uiso 1 1 calc R
C64 C 0.9110(7) 0.6983(5) 0.3101(5) 0.034(2) Uani 1 1 d .
H64A H 0.9448 0.7385 0.2895 0.041 Uiso 1 1 calc R
C65 C 0.7361(9) 0.8935(7) 0.1403(5) 0.061(4) Uani 1 1 d .
H65A H 0.7762 0.9442 0.1428 0.092 Uiso 1 1 calc R
H65B H 0.6677 0.8960 0.1439 0.092 Uiso 1 1 calc R
H65C H 0.7345 0.8655 0.0947 0.092 Uiso 1 1 calc R
C66 C 0.7051(8) 0.7591(6) 0.1948(6) 0.059(3) Uani 1 1 d .
H66A H 0.7246 0.7255 0.2302 0.089 Uiso 1 1 calc R
H66B H 0.7046 0.7369 0.1469 0.089 Uiso 1 1 calc R
H66C H 0.6379 0.7667 0.1966 0.089 Uiso 1 1 calc R
C67 C 0.8957(13) 0.7833(10) 0.8514(8) 0.106(6) Uani 1 1 d .
C68 C 0.6944(12) 0.7685(11) 0.7893(11) 0.131(8) Uani 1 1 d .
C69 C 0.3944(13) 0.8425(12) 0.0710(11) 0.135(8) Uani 1 1 d .
H69A H 0.3860 0.8941 0.0762 0.203 Uiso 1 1 calc R
H69B H 0.3416 0.8137 0.0318 0.203 Uiso 1 1 calc R
H69C H 0.4601 0.8419 0.0603 0.203 Uiso 1 1 calc R
C70 C 0.4051(14) 0.7109(9) 0.1224(9) 0.125(7) Uani 1 1 d .
H70A H 0.4024 0.6833 0.1642 0.188 Uiso 1 1 calc R
H70B H 0.4705 0.7139 0.1099 0.188 Uiso 1 1 calc R
H70C H 0.3520 0.6852 0.0818 0.188 Uiso 1 1 calc R
C71 C 0.482(2) 0.7012(18) 0.8980(18) 0.229(13) Uiso 1 1 d .
C72 C 0.5578(17) 0.6104(13) 0.9939(12) 0.144(8) Uiso 1 1 d .
O1 O 0.1663(5) 0.6998(4) 0.2262(3) 0.0433(18) Uani 1 1 d .
O2 O -0.0134(5) 0.6676(5) 0.1241(3) 0.059(2) Uani 1 1 d .
O3 O 0.0493(6) 0.5556(4) 0.1974(6) 0.078(3) Uani 1 1 d .
O4 O 0.1552(5) 0.6855(5) 0.0760(4) 0.057(2) Uani 1 1 d .
O5 O 0.0031(6) 0.4230(4) 0.2636(3) 0.0442(19) Uani 1 1 d .
O6 O -0.1304(6) 0.4730(4) 0.1504(4) 0.059(2) Uani 1 1 d .
O7 O -0.0464(6) 0.3530(4) 0.1216(4) 0.055(2) Uani 1 1 d .
O8 O 0.1339(6) 0.4363(4) 0.1674(6) 0.078(3) Uani 1 1 d .
O9 O -0.1916(7) 0.5857(4) 0.0784(4) 0.075(3) Uani 1 1 d .
O10 O -0.1919(7) 0.6219(4) -0.0534(3) 0.071(3) Uani 1 1 d .
O11 O -0.1697(6) 0.7409(4) 0.0579(4) 0.0492(19) Uani 1 1 d .
O12 O -0.0137(5) 0.7050(5) -0.0073(3) 0.057(2) Uani 1 1 d .
O13 O 0.1649(5) 0.7754(4) -0.0379(4) 0.056(2) Uani 1 1 d .
O14 O 0.2149(6) 0.6269(4) -0.0387(4) 0.061(2) Uani 1 1 d .
O15 O 0.2758(7) 0.5152(4) 0.0338(3) 0.072(3) Uani 1 1 d .
O16 O -0.3389(5) 0.5401(4) -0.1672(4) 0.048(2) Uani 1 1 d .
O17 O -0.2155(6) 0.4269(4) -0.1485(5) 0.069(3) Uani 1 1 d .
O18 O 0.3351(5) 0.5333(4) -0.0987(4) 0.053(2) Uani 1 1 d .
O19 O -0.0602(8) 0.4541(6) 0.0462(6) 0.023(3) Uani 0.50 1 d P
O20 O 0.1021(8) 0.4697(6) -0.0001(5) 0.022(3) Uani 0.50 1 d P
O21 O 0.0616(8) 0.5105(6) 0.0801(5) 0.018(3) Uani 0.50 1 d PU
O22 O 0.0193(8) 0.5843(6) 0.0278(5) 0.020(3) Uani 0.50 1 d P
O23 O 0.7694(5) 0.8886(4) 0.2832(4) 0.0475(19) Uani 1 1 d .
O24 O 0.8342(6) 0.8365(4) 0.7273(4) 0.061(2) Uani 1 1 d .
O25 O 0.4903(9) 0.8453(8) 0.1895(9) 0.184(8) Uani 1 1 d .
O26 O 0.5739(9) 0.7592(6) 1.0295(6) 0.117(4) Uani 1 1 d .
O1W O 0.4100(5) 1.0413(4) 0.7316(4) 0.0478(19) Uani 1 1 d .
H1WA H 0.4164 1.0894 0.7363 0.057 Uiso 1 1 d R
H1WB H 0.3854 1.0160 0.7630 0.057 Uiso 1 1 d R
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'
S S 0.1246 0.1234 '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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.8490 6.8722 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
Ag1' Ag1 C1 81.9(11) . .
Ag1' Ag1 C41 70.6(11) . 2_676
C1 Ag1 C41 142.2(3) . 2_676
Ag1' Ag1 Ag3' 122.2(11) . .
C1 Ag1 Ag3' 61.8(5) . .
C41 Ag1 Ag3' 155.9(4) 2_676 .
Ag1' Ag1 C49 165.5(10) . 2_676
C1 Ag1 C49 112.5(3) . 2_676
C41 Ag1 C49 97.3(3) 2_676 2_676
Ag3' Ag1 C49 66.3(4) . 2_676
Ag1' Ag1 C42 67.4(11) . 2_676
C1 Ag1 C42 117.6(3) . 2_676
C41 Ag1 C42 27.4(3) 2_676 2_676
Ag3' Ag1 C42 168.9(4) . 2_676
C49 Ag1 C42 105.7(3) 2_676 2_676
Ag1' Ag1 Ag3 107.8(10) . .
C1 Ag1 Ag3 50.8(2) . .
C41 Ag1 Ag3 162.9(2) 2_676 .
Ag3' Ag1 Ag3 15.0(4) . .
C49 Ag1 Ag3 81.29(18) 2_676 .
C42 Ag1 Ag3 168.4(2) 2_676 .
Ag1' Ag1 Ag4 76.1(10) . .
C1 Ag1 Ag4 91.9(2) . .
C41 Ag1 Ag4 105.6(2) 2_676 .
Ag3' Ag1 Ag4 62.9(4) . .
C49 Ag1 Ag4 100.3(2) 2_676 .
C42 Ag1 Ag4 127.6(2) 2_676 .
Ag3 Ag1 Ag4 58.37(2) . .
Ag1' Ag1 Ag6 72.7(10) . 2_676
C1 Ag1 Ag6 149.7(3) . 2_676
C41 Ag1 Ag6 40.9(2) 2_676 2_676
Ag3' Ag1 Ag6 119.1(4) . 2_676
C49 Ag1 Ag6 92.85(18) 2_676 2_676
C42 Ag1 Ag6 67.6(2) 2_676 2_676
Ag3 Ag1 Ag6 122.02(3) . 2_676
Ag4 Ag1 Ag6 66.40(2) . 2_676
Ag1' Ag1 Ag2 47.0(10) . .
C1 Ag1 Ag2 45.0(3) . .
C41 Ag1 Ag2 117.4(2) 2_676 .
Ag3' Ag1 Ag2 76.7(4) . .
C49 Ag1 Ag2 142.96(18) 2_676 .
C42 Ag1 Ag2 111.1(2) 2_676 .
Ag3 Ag1 Ag2 61.72(3) . .
Ag4 Ag1 Ag2 59.78(2) . .
Ag6 Ag1 Ag2 104.67(4) 2_676 .
Ag1' Ag1 Ag10 116.5(10) . 2_676
C1 Ag1 Ag10 153.8(2) . 2_676
C41 Ag1 Ag10 46.4(2) 2_676 2_676
Ag3' Ag1 Ag10 114.9(4) . 2_676
C49 Ag1 Ag10 50.95(17) 2_676 2_676
C42 Ag1 Ag10 60.1(2) 2_676 2_676
Ag3 Ag1 Ag10 129.66(4) . 2_676
Ag4 Ag1 Ag10 110.01(3) . 2_676
Ag6 Ag1 Ag10 56.30(2) 2_676 2_676
Ag2 Ag1 Ag10 160.49(4) . 2_676
Ag1 Ag1' C41 86.6(13) . 2_676
Ag1 Ag1' C1 75.3(11) . .
C41 Ag1' C1 148.2(10) 2_676 .
Ag1 Ag1' C42 93.1(13) . 2_676
C41 Ag1' C42 29.9(4) 2_676 2_676
C1 Ag1' C42 124.1(7) . 2_676
Ag1 Ag1' Ag2 118.7(12) . .
C41 Ag1' Ag2 154.1(11) 2_676 .
C1 Ag1' Ag2 53.6(4) . .
C42 Ag1' Ag2 141.3(9) 2_676 .
Ag1 Ag1' Ag4 86.3(11) . .
C41 Ag1' Ag4 112.1(6) 2_676 .
C1 Ag1' Ag4 92.9(6) . .
C42 Ag1' Ag4 141.6(7) 2_676 .
Ag2 Ag1' Ag4 67.2(4) . .
Ag1 Ag1' Ag3' 43.1(9) . .
C41 Ag1' Ag3' 125.8(10) 2_676 .
C1 Ag1' Ag3' 51.9(5) . .
C42 Ag1' Ag3' 135.9(10) 2_676 .
Ag2 Ag1' Ag3' 77.1(5) . .
Ag4 Ag1' Ag3' 57.9(4) . .
Ag1 Ag1' Ag6 90.9(11) . 2_676
C41 Ag1' Ag6 43.4(4) 2_676 2_676
C1 Ag1' Ag6 158.4(8) . 2_676
C42 Ag1' Ag6 72.3(4) 2_676 2_676
Ag2 Ag1' Ag6 124.3(7) . 2_676
Ag4 Ag1' Ag6 69.3(3) . 2_676
Ag3' Ag1' Ag6 106.8(7) . 2_676
Ag1 Ag1' Ag2' 103.2(12) . .
C41 Ag1' Ag2' 167.9(10) 2_676 .
C1 Ag1' Ag2' 43.3(5) . .
C42 Ag1' Ag2' 152.7(9) 2_676 .
Ag2 Ag1' Ag2' 15.4(3) . .
Ag4 Ag1' Ag2' 62.4(4) . .
Ag3' Ag1' Ag2' 61.8(6) . .
Ag6 Ag1' Ag2' 128.2(6) 2_676 .
Ag1 Ag1' Ag3 57.3(9) . .
C41 Ag1' Ag3 140.1(10) 2_676 .
C1 Ag1' Ag3 44.0(4) . .
C42 Ag1' Ag3 148.6(9) 2_676 .
Ag2 Ag1' Ag3 62.3(3) . .
Ag4 Ag1' Ag3 54.7(3) . .
Ag3' Ag1' Ag3 14.7(3) . .
Ag6 Ag1' Ag3 114.5(5) 2_676 .
Ag2' Ag1' Ag3 47.1(4) . .
Ag2' Ag2 C1 71.1(9) . .
Ag2' Ag2 C9 95.4(10) . .
C1 Ag2 C9 152.2(3) . .
Ag2' Ag2 Ag1' 112.7(11) . .
C1 Ag2 Ag1' 54.8(5) . .
C9 Ag2 Ag1' 149.7(5) . .
Ag2' Ag2 Ag4 84.5(11) . .
C1 Ag2 Ag4 88.8(2) . .
C9 Ag2 Ag4 114.7(2) . .
Ag1' Ag2 Ag4 59.9(3) . .
Ag2' Ag2 Ag5 46.9(9) . .
C1 Ag2 Ag5 114.9(2) . .
C9 Ag2 Ag5 48.7(2) . .
Ag1' Ag2 Ag5 156.0(4) . .
Ag4 Ag2 Ag5 101.05(3) . .
Ag2' Ag2 Ag3 44.1(10) . .
C1 Ag2 Ag3 47.1(2) . .
C9 Ag2 Ag3 135.1(2) . .
Ag1' Ag2 Ag3 69.3(5) . .
Ag4 Ag2 Ag3 55.13(2) . .
Ag5 Ag2 Ag3 88.04(4) . .
Ag2' Ag2 Ag7 92.2(9) . .
C1 Ag2 Ag7 155.8(2) . .
C9 Ag2 Ag7 42.8(2) . .
Ag1' Ag2 Ag7 121.5(4) . .
Ag4 Ag2 Ag7 71.89(2) . .
Ag5 Ag2 Ag7 57.37(2) . .
Ag3 Ag2 Ag7 108.75(3) . .
Ag2' Ag2 Ag1 98.5(10) . .
C1 Ag2 Ag1 44.6(2) . .
C9 Ag2 Ag1 162.5(2) . .
Ag1' Ag2 Ag1 14.3(5) . .
Ag4 Ag2 Ag1 56.49(2) . .
Ag5 Ag2 Ag1 143.13(4) . .
Ag3 Ag2 Ag1 55.35(3) . .
Ag7 Ag2 Ag1 125.57(4) . .
Ag2 Ag2' C1 85.4(10) . .
Ag2 Ag2' C9 64.1(9) . .
C1 Ag2' C9 141.1(9) . .
Ag2 Ag2' C17 168.8(13) . .
C1 Ag2' C17 103.2(7) . .
C9 Ag2' C17 110.6(6) . .
Ag2 Ag2' Ag3 121.9(11) . .
C1 Ag2' Ag3 57.8(5) . .
C9 Ag2' Ag3 159.7(7) . .
C17 Ag2' Ag3 59.5(5) . .
Ag2 Ag2' Ag5 118.6(12) . .
C1 Ag2' Ag5 148.6(7) . .
C9 Ag2' Ag5 54.6(3) . .
C17 Ag2' Ag5 56.4(4) . .
Ag3 Ag2' Ag5 114.8(6) . .
Ag2 Ag2' Ag4 78.8(10) . .
C1 Ag2' Ag4 89.7(5) . .
C9 Ag2' Ag4 106.2(5) . .
C17 Ag2' Ag4 94.0(6) . .
Ag3 Ag2' Ag4 59.9(3) . .
Ag5 Ag2' Ag4 113.5(5) . .
Ag2 Ag2' Ag1' 51.8(9) . .
C1 Ag2' Ag1' 47.3(5) . .
C9 Ag2' Ag1' 115.0(7) . .
C17 Ag2' Ag1' 130.1(8) . .
Ag3 Ag2' Ag1' 70.8(5) . .
Ag5 Ag2' Ag1' 164.1(6) . .
Ag4 Ag2' Ag1' 55.1(4) . .
Ag2 Ag2' Ag3' 108.2(11) . .
C1 Ag2' Ag3' 49.6(5) . .
C9 Ag2' Ag3' 160.2(7) . .
C17 Ag2' Ag3' 73.3(6) . .
Ag3 Ag2' Ag3' 13.8(3) . .
Ag5 Ag2' Ag3' 128.1(7) . .
Ag4 Ag2' Ag3' 54.0(4) . .
Ag1' Ag2' Ag3' 56.9(6) . .
Ag2 Ag2' Ag7 72.1(8) . .
C1 Ag2' Ag7 151.5(7) . .
C9 Ag2' Ag7 40.3(3) . .
C17 Ag2' Ag7 97.4(5) . .
Ag3 Ag2' Ag7 120.3(6) . .
Ag5 Ag2' Ag7 60.0(3) . .
Ag4 Ag2' Ag7 69.2(3) . .
Ag1' Ag2' Ag7 104.2(5) . .
Ag3' Ag2' Ag7 120.9(6) . .
Ag2 Ag2' Ag6 129.9(11) . .
C1 Ag2' Ag6 122.2(8) . .
C9 Ag2' Ag6 96.4(5) . .
C17 Ag2' Ag6 39.2(3) . .
Ag3 Ag2' Ag6 64.5(4) . .
Ag5 Ag2' Ag6 59.2(3) . .
Ag4 Ag2' Ag6 62.3(3) . .
Ag1' Ag2' Ag6 115.0(6) . .
Ag3' Ag2' Ag6 74.2(5) . .
Ag7 Ag2' Ag6 65.6(3) . .
Ag3' Ag3 C1 84.1(10) . .
Ag3' Ag3 O1W 68.7(11) . .
C1 Ag3 O1W 115.7(3) . .
Ag3' Ag3 C25 74.5(10) . 2_676
C1 Ag3 C25 136.1(3) . 2_676
O1W Ag3 C25 91.8(3) . 2_676
Ag3' Ag3 C17 176.8(10) . .
C1 Ag3 C17 98.9(3) . .
O1W Ag3 C17 110.7(3) . .
C25 Ag3 C17 102.5(3) 2_676 .
Ag3' Ag3 Ag2' 121.6(11) . .
C1 Ag3 Ag2' 51.5(4) . .
O1W Ag3 Ag2' 157.4(4) . .
C25 Ag3 Ag2' 110.0(4) 2_676 .
C17 Ag3 Ag2' 60.1(4) . .
Ag3' Ag3 Ag4 78.5(10) . .
C1 Ag3 Ag4 92.5(2) . .
O1W Ag3 Ag4 133.05(16) . .
C25 Ag3 Ag4 46.3(2) 2_676 .
C17 Ag3 Ag4 100.2(2) . .
Ag2' Ag3 Ag4 69.3(3) . .
Ag3' Ag3 Ag1 45.1(10) . .
C1 Ag3 Ag1 48.6(2) . .
O1W Ag3 Ag1 109.62(17) . .
C25 Ag3 Ag1 91.3(2) 2_676 .
C17 Ag3 Ag1 136.7(2) . .
Ag2' Ag3 Ag1 76.6(3) . .
Ag4 Ag3 Ag1 61.14(2) . .
Ag3' Ag3 Ag2 107.8(10) . .
C1 Ag3 Ag2 45.6(2) . .
O1W Ag3 Ag2 160.85(17) . .
C25 Ag3 Ag2 105.6(2) 2_676 .
C17 Ag3 Ag2 73.8(2) . .
Ag2' Ag3 Ag2 14.0(3) . .
Ag4 Ag3 Ag2 61.01(2) . .
Ag1 Ag3 Ag2 62.93(3) . .
Ag3' Ag3 Ag6 136.2(10) . .
C1 Ag3 Ag6 121.2(2) . .
O1W Ag3 Ag6 118.36(17) . .
C25 Ag3 Ag6 62.56(19) 2_676 .
C17 Ag3 Ag6 41.0(2) . .
Ag2' Ag3 Ag6 69.8(3) . .
Ag4 Ag3 Ag6 66.35(2) . .
Ag1 Ag3 Ag6 124.69(4) . .
Ag2 Ag3 Ag6 77.74(3) . .
Ag3' Ag3 Ag1' 59.5(11) . .
C1 Ag3 Ag1' 43.4(4) . .
O1W Ag3 Ag1' 124.2(4) . .
C25 Ag3 Ag1' 93.0(3) 2_676 .
C17 Ag3 Ag1' 122.2(5) . .
Ag2' Ag3 Ag1' 62.2(5) . .
Ag4 Ag3 Ag1' 54.7(3) . .
Ag1 Ag3 Ag1' 14.9(4) . .
Ag2 Ag3 Ag1' 48.3(4) . .
Ag6 Ag3 Ag1' 112.9(4) . .
Ag3 Ag3' O1W 90.1(12) . .
Ag3 Ag3' C1 74.4(10) . .
O1W Ag3' C1 119.3(7) . .
Ag3 Ag3' Ag1 119.9(12) . .
O1W Ag3' Ag1 141.0(8) . .
C1 Ag3' Ag1 55.6(4) . .
Ag3 Ag3' C25 84.9(11) . 2_676
O1W Ag3' C25 98.2(6) . 2_676
C1 Ag3' C25 136.4(8) . 2_676
Ag1 Ag3' C25 108.1(7) . 2_676
Ag3 Ag3' Ag4 83.8(10) . .
O1W Ag3' Ag4 145.3(7) . .
C1 Ag3' Ag4 91.9(5) . .
Ag1 Ag3' Ag4 68.2(4) . .
C25 Ag3' Ag4 47.3(4) 2_676 .
Ag3 Ag3' Ag1' 105.8(12) . .
O1W Ag3' Ag1' 153.6(8) . .
C1 Ag3' Ag1' 49.0(5) . .
Ag1 Ag3' Ag1' 14.8(4) . .
C25 Ag3' Ag1' 104.0(7) 2_676 .
Ag4 Ag3' Ag1' 59.3(5) . .
Ag3 Ag3' Ag2' 44.5(9) . .
O1W Ag3' Ag2' 130.5(8) . .
C1 Ag3' Ag2' 43.0(4) . .
Ag1 Ag3' Ag2' 75.4(5) . .
C25 Ag3' Ag2' 96.2(6) 2_676 .
Ag4 Ag3' Ag2' 62.7(4) . .
Ag1' Ag3' Ag2' 61.3(6) . .
Ag3 Ag3' Ag7 145.6(12) . 2_676
O1W Ag3' Ag7 96.6(5) . 2_676
C1 Ag3' Ag7 128.6(7) . 2_676
Ag1 Ag3' Ag7 73.2(4) . 2_676
C25 Ag3' Ag7 60.8(4) 2_676 2_676
Ag4 Ag3' Ag7 71.6(4) . 2_676
Ag1' Ag3' Ag7 82.3(5) . 2_676
Ag2' Ag3' Ag7 131.4(6) . 2_676
C25 Ag4 C25 180.0(4) . 2_676
C25 Ag4 Ag3' 55.7(4) . 2_676
C25 Ag4 Ag3' 124.3(4) 2_676 2_676
C25 Ag4 Ag3' 124.3(4) . .
C25 Ag4 Ag3' 55.7(4) 2_676 .
Ag3' Ag4 Ag3' 179.999(5) 2_676 .
C25 Ag4 Ag3 57.2(2) . 2_676
C25 Ag4 Ag3 122.8(2) 2_676 2_676
Ag3' Ag4 Ag3 17.7(4) 2_676 2_676
Ag3' Ag4 Ag3 162.3(4) . 2_676
C25 Ag4 Ag3 122.8(2) . .
C25 Ag4 Ag3 57.2(2) 2_676 .
Ag3' Ag4 Ag3 162.3(4) 2_676 .
Ag3' Ag4 Ag3 17.7(4) . .
Ag3 Ag4 Ag3 179.999(3) 2_676 .
C25 Ag4 Ag1' 115.3(5) . 2_676
C25 Ag4 Ag1' 64.7(5) 2_676 2_676
Ag3' Ag4 Ag1' 62.8(5) 2_676 2_676
Ag3' Ag4 Ag1' 117.2(5) . 2_676
Ag3 Ag4 Ag1' 70.6(4) 2_676 2_676
Ag3 Ag4 Ag1' 109.4(4) . 2_676
C25 Ag4 Ag1' 64.7(5) . .
C25 Ag4 Ag1' 115.3(5) 2_676 .
Ag3' Ag4 Ag1' 117.2(5) 2_676 .
Ag3' Ag4 Ag1' 62.8(5) . .
Ag3 Ag4 Ag1' 109.4(4) 2_676 .
Ag3 Ag4 Ag1' 70.6(4) . .
Ag1' Ag4 Ag1' 180.0(7) 2_676 .
C25 Ag4 Ag1 81.8(2) . .
C25 Ag4 Ag1 98.2(2) 2_676 .
Ag3' Ag4 Ag1 131.1(3) 2_676 .
Ag3' Ag4 Ag1 48.9(3) . .
Ag3 Ag4 Ag1 119.52(2) 2_676 .
Ag3 Ag4 Ag1 60.48(2) . .
Ag1' Ag4 Ag1 162.4(5) 2_676 .
Ag1' Ag4 Ag1 17.6(5) . .
C25 Ag4 Ag1 98.2(2) . 2_676
C25 Ag4 Ag1 81.8(2) 2_676 2_676
Ag3' Ag4 Ag1 48.9(3) 2_676 2_676
Ag3' Ag4 Ag1 131.1(3) . 2_676
Ag3 Ag4 Ag1 60.48(2) 2_676 2_676
Ag3 Ag4 Ag1 119.51(2) . 2_676
Ag1' Ag4 Ag1 17.6(5) 2_676 2_676
Ag1' Ag4 Ag1 162.4(5) . 2_676
Ag1 Ag4 Ag1 179.999(1) . 2_676
C25 Ag4 Ag2 118.7(2) . 2_676
C25 Ag4 Ag2 61.3(2) 2_676 2_676
Ag3' Ag4 Ag2 73.0(3) 2_676 2_676
Ag3' Ag4 Ag2 107.0(3) . 2_676
Ag3 Ag4 Ag2 63.85(3) 2_676 2_676
Ag3 Ag4 Ag2 116.15(3) . 2_676
Ag1' Ag4 Ag2 52.9(4) 2_676 2_676
Ag1' Ag4 Ag2 127.1(4) . 2_676
Ag1 Ag4 Ag2 116.27(3) . 2_676
Ag1 Ag4 Ag2 63.73(3) 2_676 2_676
C25 Ag4 Ag2 61.3(2) . .
C25 Ag4 Ag2 118.7(2) 2_676 .
Ag3' Ag4 Ag2 107.0(3) 2_676 .
Ag3' Ag4 Ag2 73.0(3) . .
Ag3 Ag4 Ag2 116.15(3) 2_676 .
Ag3 Ag4 Ag2 63.85(3) . .
Ag1' Ag4 Ag2 127.1(4) 2_676 .
Ag1' Ag4 Ag2 52.9(4) . .
Ag1 Ag4 Ag2 63.73(3) . .
Ag1 Ag4 Ag2 116.27(3) 2_676 .
Ag2 Ag4 Ag2 179.998(14) 2_676 .
C9 Ag5 O24 98.8(3) . .
C9 Ag5 C17 122.2(3) . .
O24 Ag5 C17 106.3(3) . .
C9 Ag5 C33 111.9(3) . .
O24 Ag5 C33 96.4(3) . .
C17 Ag5 C33 115.8(3) . .
C9 Ag5 Ag2' 61.6(4) . .
O24 Ag5 Ag2' 109.7(4) . .
C17 Ag5 Ag2' 61.0(4) . .
C33 Ag5 Ag2' 153.7(4) . .
C9 Ag5 C34 138.7(3) . .
O24 Ag5 C34 86.1(3) . .
C17 Ag5 C34 94.9(3) . .
C33 Ag5 C34 27.3(3) . .
Ag2' Ag5 C34 153.6(5) . .
C9 Ag5 Ag7 44.9(2) . .
O24 Ag5 Ag7 139.9(2) . .
C17 Ag5 Ag7 108.4(2) . .
C33 Ag5 Ag7 86.2(2) . .
Ag2' Ag5 Ag7 71.7(3) . .
C34 Ag5 Ag7 110.1(2) . .
C9 Ag5 Ag6 110.7(2) . .
O24 Ag5 Ag6 146.4(2) . .
C17 Ag5 Ag6 44.2(2) . .
C33 Ag5 Ag6 87.3(2) . .
Ag2' Ag5 Ag6 73.1(4) . .
C34 Ag5 Ag6 82.1(2) . .
Ag7 Ag5 Ag6 73.51(3) . .
C9 Ag5 Ag2 47.1(2) . .
O24 Ag5 Ag2 109.9(2) . .
C17 Ag5 Ag2 75.3(2) . .
C33 Ag5 Ag2 147.6(2) . .
Ag2' Ag5 Ag2 14.6(4) . .
C34 Ag5 Ag2 162.9(2) . .
Ag7 Ag5 Ag2 61.57(3) . .
Ag6 Ag5 Ag2 81.09(3) . .
C9 Ag5 Ag8 71.2(2) . .
O24 Ag5 Ag8 98.0(2) . .
C17 Ag5 Ag8 149.0(2) . .
C33 Ag5 Ag8 40.9(2) . .
Ag2' Ag5 Ag8 127.8(3) . .
C34 Ag5 Ag8 67.5(2) . .
Ag7 Ag5 Ag8 59.15(2) . .
Ag6 Ag5 Ag8 106.15(3) . .
Ag2 Ag5 Ag8 114.33(3) . .
C41 Ag6 C17 165.3(3) . .
C41 Ag6 Ag5 127.1(3) . .
C17 Ag6 Ag5 53.2(3) . .
C41 Ag6 Ag1' 45.8(4) . 2_676
C17 Ag6 Ag1' 147.9(4) . 2_676
Ag5 Ag6 Ag1' 130.4(4) . 2_676
C41 Ag6 Ag10 52.3(3) . .
C17 Ag6 Ag10 125.1(3) . .
Ag5 Ag6 Ag10 74.79(3) . .
Ag1' Ag6 Ag10 78.6(4) 2_676 .
C41 Ag6 Ag1 46.3(2) . 2_676
C17 Ag6 Ag1 148.3(2) . 2_676
Ag5 Ag6 Ag1 115.01(3) . 2_676
Ag1' Ag6 Ag1 16.4(4) 2_676 2_676
Ag10 Ag6 Ag1 65.67(3) . 2_676
C41 Ag6 Ag3 138.8(3) . .
C17 Ag6 Ag3 51.8(2) . .
Ag5 Ag6 Ag3 88.10(3) . .
Ag1' Ag6 Ag3 96.7(4) 2_676 .
Ag10 Ag6 Ag3 151.62(3) . .
Ag1 Ag6 Ag3 103.33(3) 2_676 .
C41 Ag6 Ag4 98.4(2) . .
C17 Ag6 Ag4 96.1(2) . .
Ag5 Ag6 Ag4 96.85(2) . .
Ag1' Ag6 Ag4 53.1(3) 2_676 .
Ag10 Ag6 Ag4 107.41(3) . .
Ag1 Ag6 Ag4 53.667(19) 2_676 .
Ag3 Ag6 Ag4 51.523(18) . .
C41 Ag6 Ag2' 143.8(3) . .
C17 Ag6 Ag2' 49.6(3) . .
Ag5 Ag6 Ag2' 47.7(3) . .
Ag1' Ag6 Ag2' 105.9(4) 2_676 .
Ag10 Ag6 Ag2' 108.2(3) . .
Ag1 Ag6 Ag2' 99.6(2) 2_676 .
Ag3 Ag6 Ag2' 45.7(3) . .
Ag4 Ag6 Ag2' 55.0(2) . .
C49 Ag7 C9 167.2(3) . .
C49 Ag7 Ag5 131.4(2) . .
C9 Ag7 Ag5 51.2(2) . .
C49 Ag7 Ag8 93.0(2) . .
C9 Ag7 Ag8 77.1(2) . .
Ag5 Ag7 Ag8 64.39(2) . .
C49 Ag7 Ag9 55.1(3) . .
C9 Ag7 Ag9 112.3(2) . .
Ag5 Ag7 Ag9 122.62(3) . .
Ag8 Ag7 Ag9 58.23(2) . .
C49 Ag7 Ag2 145.3(2) . .
C9 Ag7 Ag2 47.1(2) . .
Ag5 Ag7 Ag2 61.06(3) . .
Ag8 Ag7 Ag2 118.47(3) . .
Ag9 Ag7 Ag2 154.08(4) . .
C49 Ag7 Ag10 57.4(2) . .
C9 Ag7 Ag10 121.8(2) . .
Ag5 Ag7 Ag10 74.26(2) . .
Ag8 Ag7 Ag10 60.36(2) . .
Ag9 Ag7 Ag10 78.35(3) . .
Ag2 Ag7 Ag10 124.20(3) . .
C49 Ag7 Ag2' 142.0(4) . .
C9 Ag7 Ag2' 50.5(4) . .
Ag5 Ag7 Ag2' 48.4(2) . .
Ag8 Ag7 Ag2' 110.7(2) . .
Ag9 Ag7 Ag2' 162.8(3) . .
Ag2 Ag7 Ag2' 15.7(3) . .
Ag10 Ag7 Ag2' 108.6(3) . .
C49 Ag7 Ag3' 54.8(4) . 2_676
C9 Ag7 Ag3' 134.2(4) . 2_676
Ag5 Ag7 Ag3' 136.8(3) . 2_676
Ag8 Ag7 Ag3' 147.7(3) . 2_676
Ag9 Ag7 Ag3' 95.9(3) . 2_676
Ag2 Ag7 Ag3' 93.3(3) . 2_676
Ag10 Ag7 Ag3' 98.1(3) . 2_676
Ag2' Ag7 Ag3' 98.6(4) . 2_676
C57 Ag8 C33 173.8(3) . .
C57 Ag8 Ag9 126.5(2) . 2_776
C33 Ag8 Ag9 54.6(2) . 2_776
C57 Ag8 Ag9 52.8(2) . .
C33 Ag8 Ag9 133.4(2) . .
Ag9 Ag8 Ag9 107.14(3) 2_776 .
C57 Ag8 Ag7 92.7(2) . .
C33 Ag8 Ag7 91.1(2) . .
Ag9 Ag8 Ag7 122.02(3) 2_776 .
Ag9 Ag8 Ag7 61.03(2) . .
C57 Ag8 Ag10 132.5(2) . .
C33 Ag8 Ag10 53.6(2) . .
Ag9 Ag8 Ag10 61.43(2) 2_776 .
Ag9 Ag8 Ag10 79.78(3) . .
Ag7 Ag8 Ag10 60.61(2) . .
C57 Ag8 Ag10 46.6(2) . 2_776
C33 Ag8 Ag10 134.3(2) . 2_776
Ag9 Ag8 Ag10 79.95(3) 2_776 2_776
Ag9 Ag8 Ag10 60.08(2) . 2_776
Ag7 Ag8 Ag10 120.94(3) . 2_776
Ag10 Ag8 Ag10 111.96(3) . 2_776
C57 Ag8 Ag5 128.4(2) . .
C33 Ag8 Ag5 50.8(2) . .
Ag9 Ag8 Ag5 105.12(3) 2_776 .
Ag9 Ag8 Ag5 117.49(3) . .
Ag7 Ag8 Ag5 56.46(2) . .
Ag10 Ag8 Ag5 71.07(3) . .
Ag10 Ag8 Ag5 174.92(3) 2_776 .
O23 Ag9 C57 114.8(3) . .
O23 Ag9 C33 108.8(3) . 2_776
C57 Ag9 C33 99.9(3) . 2_776
O23 Ag9 C49 91.7(3) . .
C57 Ag9 C49 125.7(3) . .
C33 Ag9 C49 115.8(3) 2_776 .
O23 Ag9 Ag8 142.03(19) . 2_776
C57 Ag9 Ag8 99.0(2) . 2_776
C33 Ag9 Ag8 45.4(2) 2_776 2_776
C49 Ag9 Ag8 81.45(19) . 2_776
O23 Ag9 Ag8 144.26(18) . .
C57 Ag9 Ag8 44.5(2) . .
C33 Ag9 Ag8 104.1(2) 2_776 .
C49 Ag9 Ag8 86.13(18) . .
Ag8 Ag9 Ag8 72.86(3) 2_776 .
O23 Ag9 Ag7 94.78(18) . .
C57 Ag9 Ag7 87.1(2) . .
C33 Ag9 Ag7 149.2(2) 2_776 .
C49 Ag9 Ag7 42.0(2) . .
Ag8 Ag9 Ag7 104.02(3) 2_776 .
Ag8 Ag9 Ag7 60.74(2) . .
O23 Ag9 Ag10 130.97(18) . 2_776
C57 Ag9 Ag10 47.6(2) . 2_776
C33 Ag9 Ag10 52.8(2) 2_776 2_776
C49 Ag9 Ag10 137.10(18) . 2_776
Ag8 Ag9 Ag10 62.31(2) 2_776 2_776
Ag8 Ag9 Ag10 62.75(2) . 2_776
Ag7 Ag9 Ag10 123.30(3) . 2_776
C57 Ag10 C41 115.4(3) 2_776 .
C57 Ag10 C33 99.9(3) 2_776 .
C41 Ag10 C33 121.4(3) . .
C57 Ag10 C49 109.7(3) 2_776 .
C41 Ag10 C49 91.7(3) . .
C33 Ag10 C49 119.4(3) . .
C57 Ag10 Ag6 149.8(2) 2_776 .
C41 Ag10 Ag6 41.8(2) . .
C33 Ag10 Ag6 85.2(2) . .
C49 Ag10 Ag6 92.96(19) . .
C57 Ag10 Ag9 50.4(2) 2_776 2_776
C41 Ag10 Ag9 143.2(2) . 2_776
C33 Ag10 Ag9 49.9(2) . 2_776
C49 Ag10 Ag9 124.5(2) . 2_776
Ag6 Ag10 Ag9 130.45(3) . 2_776
C57 Ag10 Ag8 96.1(2) 2_776 .
C41 Ag10 Ag8 148.0(2) . .
C33 Ag10 Ag8 42.5(2) . .
C49 Ag10 Ag8 81.86(19) . .
Ag6 Ag10 Ag8 106.95(3) . .
Ag9 Ag10 Ag8 56.25(2) 2_776 .
C57 Ag10 Ag7 139.5(2) 2_776 .
C41 Ag10 Ag7 96.0(2) . .
C33 Ag10 Ag7 82.9(2) . .
C49 Ag10 Ag7 41.19(19) . .
Ag6 Ag10 Ag7 70.47(3) . .
Ag9 Ag10 Ag7 115.27(3) 2_776 .
Ag8 Ag10 Ag7 59.04(2) . .
C57 Ag10 Ag8 41.9(2) 2_776 2_776
C41 Ag10 Ag8 140.4(2) . 2_776
C33 Ag10 Ag8 97.1(2) . 2_776
C49 Ag10 Ag8 75.3(2) . 2_776
Ag6 Ag10 Ag8 167.60(3) . 2_776
Ag9 Ag10 Ag8 57.17(2) 2_776 2_776
Ag8 Ag10 Ag8 68.04(3) . 2_776
Ag7 Ag10 Ag8 97.64(3) . 2_776
C57 Ag10 Ag1 123.5(2) 2_776 2_676
C41 Ag10 Ag1 42.39(19) . 2_676
C33 Ag10 Ag1 136.64(19) . 2_676
C49 Ag10 Ag1 49.3(2) . 2_676
Ag6 Ag10 Ag1 58.03(2) . 2_676
Ag9 Ag10 Ag1 171.47(4) 2_776 2_676
Ag8 Ag10 Ag1 123.23(3) . 2_676
Ag7 Ag10 Ag1 64.71(3) . 2_676
Ag8 Ag10 Ag1 114.34(3) 2_776 2_676
O13 W1 O7 101.3(3) . 2_565
O13 W1 O4 103.0(4) . .
O7 W1 O4 155.7(4) 2_565 .
O13 W1 O12 97.9(4) . .
O7 W1 O12 89.2(3) 2_565 .
O4 W1 O12 86.7(3) . .
O13 W1 O14 105.8(4) . .
O7 W1 O14 85.8(3) 2_565 .
O4 W1 O14 88.3(3) . .
O12 W1 O14 156.3(3) . .
O13 W1 O22 158.4(4) . .
O7 W1 O22 93.1(3) 2_565 .
O4 W1 O22 63.4(3) . .
O12 W1 O22 66.0(4) . .
O14 W1 O22 91.1(4) . .
O13 W1 O19 159.9(4) . 2_565
O7 W1 O19 64.7(3) 2_565 2_565
O4 W1 O19 92.0(3) . 2_565
O12 W1 O19 96.3(4) . 2_565
O14 W1 O19 60.7(4) . 2_565
O22 W1 O19 41.7(4) . 2_565
O5 W2 O7 101.8(3) . .
O5 W2 O3 102.5(4) . .
O7 W2 O3 155.7(4) . .
O5 W2 O8 101.5(4) . .
O7 W2 O8 84.8(3) . .
O3 W2 O8 90.8(3) . .
O5 W2 O6 103.4(4) . .
O7 W2 O6 90.2(3) . .
O3 W2 O6 83.8(3) . .
O8 W2 O6 155.2(4) . .
O5 W2 O21 159.3(3) . .
O7 W2 O21 92.5(4) . .
O3 W2 O21 64.2(4) . .
O8 W2 O21 64.7(4) . .
O6 W2 O21 91.3(4) . .
O5 W2 O19 159.4(3) . .
O7 W2 O19 64.3(3) . .
O3 W2 O19 92.1(4) . .
O8 W2 O19 92.7(4) . .
O6 W2 O19 63.5(4) . .
O21 W2 O19 41.3(3) . .
O11 W3 O12 103.3(3) . .
O11 W3 O9 102.8(4) . .
O12 W3 O9 153.9(4) . .
O11 W3 O10 103.1(4) . .
O12 W3 O10 86.4(3) . .
O9 W3 O10 88.6(3) . .
O11 W3 O2 103.4(4) . .
O12 W3 O2 88.0(3) . .
O9 W3 O2 85.2(3) . .
O10 W3 O2 153.5(4) . .
O11 W3 O20 160.4(3) . 2_565
O12 W3 O20 91.2(4) . 2_565
O9 W3 O20 63.7(4) . 2_565
O10 W3 O20 64.3(4) . 2_565
O2 W3 O20 90.0(4) . 2_565
O1 W4 O3 101.1(4) . .
O1 W4 O4 103.4(3) . .
O3 W4 O4 155.5(4) . .
O1 W4 O2 99.1(4) . .
O3 W4 O2 90.9(3) . .
O4 W4 O2 86.5(3) . .
O1 W4 O17 105.0(4) . 2_565
O3 W4 O17 84.6(3) . 2_565
O4 W4 O17 87.9(3) . 2_565
O2 W4 O17 155.9(4) . 2_565
O1 W4 O21 158.2(3) . .
O3 W4 O21 63.7(4) . .
O4 W4 O21 92.4(3) . .
O2 W4 O21 96.8(4) . .
O17 W4 O21 60.0(3) 2_565 .
O1 W4 O22 158.7(3) . .
O3 W4 O22 94.5(4) . .
O4 W4 O22 62.3(3) . .
O2 W4 O22 65.9(4) . .
O17 W4 O22 90.8(4) 2_565 .
O21 W4 O22 43.1(3) . .
O18 W5 O6 101.8(4) . 2_565
O18 W5 O15 102.8(4) . .
O6 W5 O15 155.4(4) 2_565 .
O18 W5 O9 98.0(4) . 2_565
O6 W5 O9 90.8(3) 2_565 2_565
O15 W5 O9 86.4(3) . 2_565
O18 W5 O14 105.5(4) . .
O6 W5 O14 85.0(3) 2_565 .
O15 W5 O14 87.9(3) . .
O9 W5 O14 156.5(4) 2_565 .
O18 W5 O20 157.9(4) . .
O6 W5 O20 93.5(4) 2_565 .
O15 W5 O20 63.2(4) . .
O9 W5 O20 65.7(4) 2_565 .
O14 W5 O20 91.5(4) . .
O18 W5 O19 159.3(4) . 2_565
O6 W5 O19 63.9(3) 2_565 2_565
O15 W5 O19 92.2(4) . 2_565
O9 W5 O19 97.2(4) 2_565 2_565
O14 W5 O19 60.2(3) . 2_565
O20 W5 O19 42.8(4) . 2_565
O16 W6 O8 101.6(4) . 2_565
O16 W6 O15 103.6(4) . 2_565
O8 W6 O15 154.9(4) 2_565 2_565
O16 W6 O10 99.2(4) . .
O8 W6 O10 89.0(4) 2_565 .
O15 W6 O10 86.4(3) 2_565 .
O16 W6 O17 105.7(4) . .
O8 W6 O17 84.9(3) 2_565 .
O15 W6 O17 88.9(4) 2_565 .
O10 W6 O17 155.0(4) . .
O16 W6 O20 157.9(4) . 2_565
O8 W6 O20 93.9(4) 2_565 2_565
O15 W6 O20 61.9(3) 2_565 2_565
O10 W6 O20 64.9(4) . 2_565
O17 W6 O20 91.3(4) . 2_565
O16 W6 O21 158.3(4) . 2_565
O8 W6 O21 63.4(3) 2_565 2_565
O15 W6 O21 92.5(4) 2_565 2_565
O10 W6 O21 96.2(4) . 2_565
O17 W6 O21 59.5(3) . 2_565
O20 W6 O21 43.8(4) 2_565 2_565
O19 P1 O19 179.998(2) 2_565 .
O19 P1 O22 109.1(6) 2_565 2_565
O19 P1 O22 70.9(6) . 2_565
O19 P1 O22 70.9(6) 2_565 .
O19 P1 O22 109.1(6) . .
O22 P1 O22 179.999(2) 2_565 .
O19 P1 O21 110.2(5) 2_565 .
O19 P1 O21 69.8(5) . .
O22 P1 O21 107.5(5) 2_565 .
O22 P1 O21 72.5(5) . .
O19 P1 O21 69.8(5) 2_565 2_565
O19 P1 O21 110.2(5) . 2_565
O22 P1 O21 72.5(5) 2_565 2_565
O22 P1 O21 107.5(5) . 2_565
O21 P1 O21 179.999(1) . 2_565
O19 P1 O20 108.9(6) 2_565 2_565
O19 P1 O20 71.1(6) . 2_565
O22 P1 O20 113.7(6) 2_565 2_565
O22 P1 O20 66.3(6) . 2_565
O21 P1 O20 107.4(5) . 2_565
O21 P1 O20 72.6(5) 2_565 2_565
O19 P1 O20 71.1(6) 2_565 .
O19 P1 O20 108.9(6) . .
O22 P1 O20 66.3(6) 2_565 .
O22 P1 O20 113.7(6) . .
O21 P1 O20 72.6(5) . .
O21 P1 O20 107.4(5) 2_565 .
O20 P1 O20 180.0(7) 2_565 .
O23 S1 C66 106.7(5) . .
O23 S1 C65 103.0(5) . .
C66 S1 C65 98.3(5) . .
S2' S2 O24 57.7(9) . .
S2' S2 C68 85.1(11) . .
O24 S2 C68 107.6(8) . .
S2' S2 C67 56.1(10) . .
O24 S2 C67 104.3(7) . .
C68 S2 C67 99.3(9) . .
O24 S2' S2 61.6(9) . .
O24 S2' C67 121.9(14) . .
S2 S2' C67 74.3(11) . .
O24 S2' C68 90.0(12) . .
S2 S2' C68 52.7(9) . .
C67 S2' C68 91.7(13) . .
O25 S3 C69 99.4(11) . .
O25 S3 C70 102.0(8) . .
C69 S3 C70 102.4(10) . .
O26 S4 S4' 60.4(7) . .
O26 S4 C71 103.0(13) . .
S4' S4 C71 73.0(13) . .
O26 S4 C72 103.4(9) . .
S4' S4 C72 58.3(9) . .
C71 S4 C72 98.8(13) . .
O26 S4' S4 57.5(8) . .
O26 S4' C72 107.1(12) . .
S4 S4' C72 66.2(10) . .
O26 S4' C71 90.0(15) . .
S4 S4' C71 55.2(13) . .
C72 S4' C71 93.0(16) . .
C2 C1 Ag2' 110.1(9) . .
C2 C1 Ag1 127.1(7) . .
Ag2' C1 Ag1 103.4(5) . .
C2 C1 Ag2 104.8(7) . .
Ag2' C1 Ag2 23.5(4) . .
Ag1 C1 Ag2 90.4(3) . .
C2 C1 Ag1' 118.5(8) . .
Ag2' C1 Ag1' 89.4(7) . .
Ag1 C1 Ag1' 22.8(6) . .
Ag2 C1 Ag1' 71.6(6) . .
C2 C1 Ag3 148.7(8) . .
Ag2' C1 Ag3 70.7(6) . .
Ag1 C1 Ag3 80.6(3) . .
Ag2 C1 Ag3 87.2(3) . .
Ag1' C1 Ag3 92.6(6) . .
C2 C1 Ag3' 154.2(9) . .
Ag2' C1 Ag3' 87.4(7) . .
Ag1 C1 Ag3' 62.5(5) . .
Ag2 C1 Ag3' 98.6(5) . .
Ag1' C1 Ag3' 79.1(7) . .
Ag3 C1 Ag3' 21.5(4) . .
C1 C2 C3 177.0(10) . .
C4 C3 C8 118.5(9) . .
C4 C3 C2 117.9(9) . .
C8 C3 C2 123.6(9) . .
C3 C4 C5 117.7(11) . .
C4 C5 C6 122.7(12) . .
C7 C6 C5 120.8(11) . .
C6 C7 C8 115.6(12) . .
C7 C8 C3 124.6(11) . .
C10 C9 Ag7 157.7(8) . .
C10 C9 Ag2 100.4(6) . .
Ag7 C9 Ag2 90.1(3) . .
C10 C9 Ag5 116.4(6) . .
Ag7 C9 Ag5 83.9(3) . .
Ag2 C9 Ag5 84.2(3) . .
C10 C9 Ag2' 107.4(7) . .
Ag7 C9 Ag2' 89.1(5) . .
Ag2 C9 Ag2' 20.5(3) . .
Ag5 C9 Ag2' 63.8(4) . .
C9 C10 C11 175.4(9) . .
C12 C11 C16 120.0 . .
C12 C11 C10 120.7(5) . .
C16 C11 C10 119.3(5) . .
C13 C12 C11 120.0 . .
C12 C13 C14 120.0 . .
C13 C14 C15 120.0 . .
C14 C15 C16 120.0 . .
C15 C16 C11 120.0 . .
C18 C17 Ag6 152.4(9) . .
C18 C17 Ag5 122.9(8) . .
Ag6 C17 Ag5 82.6(3) . .
C18 C17 Ag3 87.3(7) . .
Ag6 C17 Ag3 87.2(3) . .
Ag5 C17 Ag3 121.6(4) . .
C18 C17 Ag2' 109.3(8) . .
Ag6 C17 Ag2' 91.3(5) . .
Ag5 C17 Ag2' 62.6(4) . .
Ag3 C17 Ag2' 60.4(4) . .
C17 C18 C19 174.5(10) . .
C20 C19 C24 120.0 . .
C20 C19 C18 120.8(6) . .
C24 C19 C18 119.2(6) . .
C21 C20 C19 120.0 . .
C20 C21 C22 120.0 . .
C21 C22 C23 120.0 . .
C24 C23 C22 120.0 . .
C23 C24 C19 120.0 . .
C26 C25 Ag4 163.4(7) . .
C26 C25 Ag3' 119.5(8) . 2_676
Ag4 C25 Ag3' 77.0(5) . 2_676
C26 C25 Ag3 119.5(6) . 2_676
Ag4 C25 Ag3 76.6(3) . 2_676
Ag3' C25 Ag3 20.6(4) 2_676 2_676
C25 C26 C27 178.4(9) . .
C28 C27 C32 117.6(9) . .
C28 C27 C26 117.3(9) . .
C32 C27 C26 125.1(8) . .
C27 C28 C29 117.4(10) . .
C30 C29 C28 124.3(10) . .
C31 C30 C29 118.7(10) . .
C30 C31 C32 118.7(10) . .
C31 C32 C27 123.2(9) . .
C34 C33 Ag8 161.5(8) . .
C34 C33 Ag9 109.8(6) . 2_776
Ag8 C33 Ag9 79.9(3) . 2_776
C34 C33 Ag5 83.5(6) . .
Ag8 C33 Ag5 88.3(3) . .
Ag9 C33 Ag5 166.2(4) 2_776 .
C34 C33 Ag10 113.2(7) . .
Ag8 C33 Ag10 83.9(3) . .
Ag9 C33 Ag10 77.3(2) 2_776 .
Ag5 C33 Ag10 94.4(3) . .
C33 C34 C35 175.7(10) . .
C33 C34 Ag5 69.2(5) . .
C35 C34 Ag5 114.2(6) . .
C36 C35 C34 119.7(10) . .
C36 C35 C40 120.2(9) . .
C34 C35 C40 120.2(9) . .
C35 C36 C37 119.2(13) . .
C36 C37 C38 118.8(12) . .
C39 C38 C37 123.2(11) . .
C38 C39 C40 118.6(14) . .
C39 C40 C35 120.0(12) . .
C42 C41 Ag6 162.8(9) . .
C42 C41 Ag1' 88.8(7) . 2_676
Ag6 C41 Ag1' 90.9(5) . 2_676
C42 C41 Ag1 93.6(6) . 2_676
Ag6 C41 Ag1 92.7(3) . 2_676
Ag1' C41 Ag1 22.8(6) 2_676 2_676
C42 C41 Ag10 109.9(7) . .
Ag6 C41 Ag10 85.9(3) . .
Ag1' C41 Ag10 113.8(7) 2_676 .
Ag1 C41 Ag10 91.2(3) 2_676 .
C41 C42 C43 175.0(9) . .
C41 C42 Ag1' 61.3(6) . 2_676
C43 C42 Ag1' 121.7(6) . 2_676
C41 C42 Ag1 59.0(5) . 2_676
C43 C42 Ag1 125.3(5) . 2_676
Ag1' C42 Ag1 19.5(6) 2_676 2_676
C44 C43 C48 120.0 . .
C44 C43 C42 120.5(5) . .
C48 C43 C42 119.5(5) . .
C43 C44 C45 120.0 . .
C46 C45 C44 120.0 . .
C47 C46 C45 120.0 . .
C46 C47 C48 120.0 . .
C47 C48 C43 120.0 . .
C50 C49 Ag7 169.5(8) . .
C50 C49 Ag9 90.6(6) . .
Ag7 C49 Ag9 82.9(3) . .
C50 C49 Ag1 91.3(6) . 2_676
Ag7 C49 Ag1 95.6(3) . 2_676
Ag9 C49 Ag1 177.2(3) . 2_676
C50 C49 Ag10 107.6(6) . .
Ag7 C49 Ag10 81.4(3) . .
Ag9 C49 Ag10 97.6(3) . .
Ag1 C49 Ag10 79.8(2) 2_676 .
C49 C50 C51 178.0(10) . .
C56 C51 C52 119.6(9) . .
C56 C51 C50 120.2(9) . .
C52 C51 C50 120.2(9) . .
C53 C52 C51 119.5(11) . .
C54 C53 C52 120.2(11) . .
C53 C54 C55 120.5(10) . .
C54 C55 C56 119.3(11) . .
C51 C56 C55 120.8(11) . .
C58 C57 Ag8 156.2(7) . .
C58 C57 Ag10 111.2(7) . 2_776
Ag8 C57 Ag10 91.6(3) . 2_776
C58 C57 Ag9 106.4(7) . .
Ag8 C57 Ag9 82.7(3) . .
Ag10 C57 Ag9 82.0(3) 2_776 .
C57 C58 C59 175.9(9) . .
C60 C59 C64 119.3(8) . .
C60 C59 C58 118.7(8) . .
C64 C59 C58 122.0(8) . .
C59 C60 C61 119.1(9) . .
C60 C61 C62 121.3(9) . .
C63 C62 C61 119.2(10) . .
C62 C63 C64 119.6(10) . .
C63 C64 C59 121.5(9) . .
S2' C67 S2 49.6(8) . .
S2 C68 S2' 42.2(6) . .
S4 C71 S4' 51.8(10) . .
S4' C72 S4 55.6(10) . .
W3 O2 W4 139.8(4) . .
W4 O3 W2 139.6(6) . .
W1 O4 W4 141.0(4) . .
W5 O6 W2 140.7(4) 2_565 .
W1 O7 W2 139.9(4) 2_565 .
W6 O8 W2 139.7(5) 2_565 .
W3 O9 W5 138.9(5) . 2_565
W3 O10 W6 139.9(5) . .
W3 O12 W1 140.0(4) . .
W1 O14 W5 142.4(4) . .
W6 O15 W5 141.1(4) 2_565 .
W6 O17 W4 143.4(4) . 2_565
P1 O19 O21 56.7(5) . .
P1 O19 O22 55.5(5) . 2_565
O21 O19 O22 90.6(7) . 2_565
P1 O19 O20 57.1(5) . 2_565
O21 O19 O20 91.5(7) . 2_565
O22 O19 O20 95.0(7) 2_565 2_565
P1 O19 W1 123.1(6) . 2_565
O21 O19 W1 128.8(7) . 2_565
O22 O19 W1 67.5(5) 2_565 2_565
O20 O19 W1 134.1(6) 2_565 2_565
P1 O19 W2 124.1(6) . .
O21 O19 W2 67.5(4) . .
O22 O19 W2 128.9(7) 2_565 .
O20 O19 W2 129.3(6) 2_565 .
W1 O19 W2 90.6(3) 2_565 .
P1 O19 W5 122.9(6) . 2_565
O21 O19 W5 128.4(7) . 2_565
O22 O19 W5 134.6(6) 2_565 2_565
O20 O19 W5 65.8(5) 2_565 2_565
W1 O19 W5 96.0(4) 2_565 2_565
W2 O19 W5 91.3(4) . 2_565
P1 O20 O22 55.0(5) . 2_565
P1 O20 O19 51.8(5) . 2_565
O22 O20 O19 89.1(7) 2_565 2_565
P1 O20 W5 123.2(5) . .
O22 O20 W5 132.4(6) 2_565 .
O19 O20 W5 71.5(5) 2_565 .
P1 O20 W6 121.8(5) . 2_565
O22 O20 W6 129.9(6) 2_565 2_565
O19 O20 W6 130.5(6) 2_565 2_565
W5 O20 W6 93.3(4) . 2_565
P1 O20 W3 127.3(5) . 2_565
O22 O20 W3 72.4(5) 2_565 2_565
O19 O20 W3 135.2(6) 2_565 2_565
W5 O20 W3 91.2(4) . 2_565
W6 O20 W3 90.3(4) 2_565 2_565
P1 O21 O19 53.5(5) . .
P1 O21 W2 124.7(5) . .
O19 O21 W2 71.2(5) . .
P1 O21 W4 121.9(5) . .
O19 O21 W4 129.5(7) . .
W2 O21 W4 92.0(4) . .
P1 O21 W6 121.8(6) . 2_565
O19 O21 W6 130.0(7) . 2_565
W2 O21 W6 91.7(3) . 2_565
W4 O21 W6 96.6(3) . 2_565
P1 O22 O20 58.7(5) . 2_565
P1 O22 O19 53.6(5) . 2_565
O20 O22 O19 93.1(7) 2_565 2_565
P1 O22 W1 124.4(6) . .
O20 O22 W1 131.8(6) 2_565 .
O19 O22 W1 70.8(5) 2_565 .
P1 O22 W4 122.4(5) . .
O20 O22 W4 128.2(6) 2_565 .
O19 O22 W4 131.2(7) 2_565 .
W1 O22 W4 92.6(3) . .
S1 O23 Ag9 125.1(4) . .
S2' O24 S2 60.8(9) . .
S2' O24 Ag5 166.4(9) . .
S2 O24 Ag5 120.8(5) . .
S4 O26 S4' 62.1(9) . .
Ag3' O1W Ag3 21.2(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 Ag1' 0.88(2) .
Ag1 C1 2.203(9) .
Ag1 C41 2.270(8) 2_676
Ag1 Ag3' 2.368(17) .
Ag1 C49 2.592(9) 2_676
Ag1 C42 2.643(9) 2_676
Ag1 Ag3 2.8988(12) .
Ag1 Ag4 2.9175(9) .
Ag1 Ag6 3.1342(11) 2_676
Ag1 Ag2 3.1377(13) .
Ag1 Ag10 3.3668(12) 2_676
Ag1' C41 2.145(18) 2_676
Ag1' C1 2.255(18) .
Ag1' C42 2.444(18) 2_676
Ag1' Ag2 2.617(19) .
Ag1' Ag4 2.838(15) .
Ag1' Ag3' 2.93(3) .
Ag1' Ag6 2.994(15) 2_676
Ag1' Ag2' 3.07(2) .
Ag1' Ag3 3.278(17) .
Ag2 Ag2' 0.887(16) .
Ag2 C1 2.220(10) .
Ag2 C9 2.281(8) .
Ag2 Ag4 3.0238(9) .
Ag2 Ag5 3.0971(13) .
Ag2 Ag3 3.1032(14) .
Ag2 Ag7 3.1121(11) .
Ag2' C1 2.107(16) .
Ag2' C9 2.524(18) .
Ag2' C17 2.536(19) .
Ag2' Ag3 2.542(17) .
Ag2' Ag5 2.573(13) .
Ag2' Ag4 3.068(15) .
Ag2' Ag3' 3.09(2) .
Ag2' Ag7 3.268(14) .
Ag2' Ag6 3.330(17) .
Ag3 Ag3' 0.867(17) .
Ag3 C1 2.278(9) .
Ag3 O1W 2.396(7) .
Ag3 C25 2.450(8) 2_676
Ag3 C17 2.521(9) .
Ag3 Ag4 2.8364(7) .
Ag3 Ag6 3.2028(11) .
Ag3' O1W 2.232(17) .
Ag3' C1 2.353(17) .
Ag3' C25 2.370(17) 2_676
Ag3' Ag4 2.796(15) .
Ag3' Ag7 3.321(17) 2_676
Ag4 C25 2.108(9) .
Ag4 C25 2.108(9) 2_676
Ag4 Ag3' 2.796(16) 2_676
Ag4 Ag3 2.8364(7) 2_676
Ag4 Ag1' 2.838(15) 2_676
Ag4 Ag1 2.9175(9) 2_676
Ag4 Ag2 3.0238(9) 2_676
Ag5 C9 2.337(9) .
Ag5 O24 2.395(7) .
Ag5 C17 2.415(10) .
Ag5 C33 2.499(9) .
Ag5 C34 2.656(8) .
Ag5 Ag7 2.9805(9) .
Ag5 Ag6 2.9906(11) .
Ag5 Ag8 3.2245(11) .
Ag6 C41 2.056(9) .
Ag6 C17 2.103(9) .
Ag6 Ag1' 2.994(15) 2_676
Ag6 Ag10 3.0739(11) .
Ag6 Ag1 3.1342(11) 2_676
Ag7 C49 2.078(9) .
Ag7 C9 2.114(8) .
Ag7 Ag8 3.0698(10) .
Ag7 Ag9 3.0786(10) .
Ag7 Ag10 3.1192(10) .
Ag7 Ag3' 3.321(17) 2_676
Ag8 C57 2.114(9) .
Ag8 C33 2.114(9) .
Ag8 Ag9 2.9216(10) 2_776
Ag8 Ag9 2.9916(9) .
Ag8 Ag10 3.1114(11) .
Ag8 Ag10 3.1650(11) 2_776
Ag9 O23 2.300(6) .
Ag9 C57 2.401(9) .
Ag9 C33 2.420(9) 2_776
Ag9 C49 2.545(9) .
Ag9 Ag8 2.9216(10) 2_776
Ag9 Ag10 3.0858(10) 2_776
Ag10 C57 2.299(8) 2_776
Ag10 C41 2.438(10) .
Ag10 C33 2.520(9) .
Ag10 C49 2.657(8) .
Ag10 Ag9 3.0858(10) 2_776
Ag10 Ag8 3.1651(11) 2_776
Ag10 Ag1 3.3667(12) 2_676
W1 O13 1.655(6) .
W1 O7 1.877(6) 2_565
W1 O4 1.883(6) .
W1 O12 1.925(7) .
W1 O14 1.958(8) .
W1 O22 2.433(10) .
W1 O19 2.486(10) 2_565
W2 O5 1.666(6) .
W2 O7 1.895(7) .
W2 O3 1.898(7) .
W2 O8 1.911(8) .
W2 O6 1.932(7) .
W2 O21 2.435(9) .
W2 O19 2.496(10) .
W3 O11 1.740(7) .
W3 O12 1.853(7) .
W3 O9 1.857(7) .
W3 O10 1.864(6) .
W3 O2 1.887(6) .
W3 O20 2.526(11) 2_565
W4 O1 1.660(6) .
W4 O3 1.865(7) .
W4 O4 1.887(7) .
W4 O2 1.919(7) .
W4 O17 1.976(8) 2_565
W4 O21 2.473(11) .
W4 O22 2.482(10) .
W5 O18 1.670(7) .
W5 O6 1.865(7) 2_565
W5 O15 1.890(6) .
W5 O9 1.912(7) 2_565
W5 O14 1.962(7) .
W5 O20 2.411(10) .
W5 O19 2.507(12) 2_565
W6 O16 1.675(6) .
W6 O8 1.871(8) 2_565
W6 O15 1.878(7) 2_565
W6 O10 1.910(7) .
W6 O17 1.943(7) .
W6 O20 2.474(10) 2_565
W6 O21 2.512(11) 2_565
P1 O19 1.491(10) 2_565
P1 O19 1.491(10) .
P1 O22 1.528(10) 2_565
P1 O22 1.528(10) .
P1 O21 1.550(9) .
P1 O21 1.550(9) 2_565
P1 O20 1.594(12) 2_565
P1 O20 1.595(12) .
S1 O23 1.571(7) .
S1 C66 1.744(10) .
S1 C65 1.799(11) .
S2 S2' 1.46(2) .
S2 O24 1.468(8) .
S2 C68 1.724(14) .
S2 C67 1.841(14) .
S2' O24 1.41(2) .
S2' C67 1.59(2) .
S2' C68 2.16(3) .
S3 O25 1.507(11) .
S3 C69 1.56(2) .
S3 C70 1.816(18) .
S4 O26 1.575(13) .
S4 S4' 1.65(2) .
S4 C71 1.73(3) .
S4 C72 1.83(2) .
S4' O26 1.624(17) .
S4' C72 1.70(3) .
S4' C71 2.01(4) .
C1 C2 1.218(12) .
C2 C3 1.449(12) .
C3 C4 1.353(14) .
C3 C8 1.435(15) .
C4 C5 1.400(15) .
C5 C6 1.412(18) .
C6 C7 1.365(17) .
C7 C8 1.386(14) .
C9 C10 1.232(12) .
C10 C11 1.484(11) .
C11 C12 1.3900 .
C11 C16 1.3900 .
C12 C13 1.3900 .
C13 C14 1.3900 .
C14 C15 1.3900 .
C15 C16 1.3900 .
C17 C18 1.173(12) .
C18 C19 1.453(11) .
C19 C20 1.3900 .
C19 C24 1.3900 .
C20 C21 1.3900 .
C21 C22 1.3900 .
C22 C23 1.3900 .
C23 C24 1.3900 .
C25 C26 1.245(12) .
C25 Ag3' 2.370(17) 2_676
C25 Ag3 2.450(8) 2_676
C26 C27 1.481(12) .
C27 C28 1.352(12) .
C27 C32 1.432(13) .
C28 C29 1.427(13) .
C29 C30 1.367(15) .
C30 C31 1.349(14) .
C31 C32 1.390(13) .
C33 C34 1.227(12) .
C33 Ag9 2.420(8) 2_776
C34 C35 1.438(13) .
C35 C36 1.376(14) .
C35 C40 1.462(15) .
C36 C37 1.388(15) .
C37 C38 1.42(2) .
C38 C39 1.358(19) .
C39 C40 1.362(14) .
C41 C42 1.217(12) .
C41 Ag1' 2.145(18) 2_676
C41 Ag1 2.270(8) 2_676
C42 C43 1.456(10) .
C42 Ag1' 2.444(18) 2_676
C42 Ag1 2.643(9) 2_676
C43 C44 1.3900 .
C43 C48 1.3900 .
C44 C45 1.3900 .
C45 C46 1.3900 .
C46 C47 1.3900 .
C47 C48 1.3900 .
C49 C50 1.223(11) .
C49 Ag1 2.592(9) 2_676
C50 C51 1.423(12) .
C51 C56 1.350(13) .
C51 C52 1.384(13) .
C52 C53 1.377(14) .
C53 C54 1.355(16) .
C54 C55 1.366(17) .
C55 C56 1.382(14) .
C57 C58 1.215(12) .
C57 Ag10 2.299(8) 2_776
C58 C59 1.475(12) .
C59 C60 1.359(12) .
C59 C64 1.384(12) .
C60 C61 1.386(13) .
C61 C62 1.390(14) .
C62 C63 1.348(14) .
C63 C64 1.378(13) .
O6 W5 1.865(7) 2_565
O7 W1 1.877(6) 2_565
O8 W6 1.871(8) 2_565
O9 W5 1.912(7) 2_565
O15 W6 1.878(7) 2_565
O17 W4 1.976(8) 2_565
O19 O21 1.741(14) .
O19 O22 1.751(16) 2_565
O19 O20 1.796(15) 2_565
O19 W1 2.486(10) 2_565
O19 W5 2.507(12) 2_565
O20 O22 1.709(14) 2_565
O20 O19 1.796(15) 2_565
O20 W6 2.474(10) 2_565
O20 W3 2.526(11) 2_565
O21 W6 2.512(11) 2_565
O22 O20 1.709(14) 2_565
O22 O19 1.751(16) 2_565
