# Electronic Supplementary Material (ESI) for Dalton Transactions
# This journal is © The Royal Society of Chemistry 2012


data_global
_journal_name_full               'Dalton Trans.'
_journal_coden_cambridge         0222
_journal_year                    ?
_journal_volume                  ?
_journal_page_first              ?
_publ_contact_author_email       brian.skelton@uwa.edu.au
_publ_contact_author_name        'Brian Skelton'
loop_
_publ_author_name
G.Bowmaker
J.Hanna
B.Skelton
A.H.White

data_gban02
_database_code_depnum_ccdc_archive 'CCDC 763388'
#TrackingRef 'web_deposit_cif_file_0_BrianSkelton_1308022368.gban02.cif'

_audit_creation_date             2011-06-13T13:01:33-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'

#----------------------------------------------------------------------------#
# CHEMICAL INFORMATION #
#----------------------------------------------------------------------------#

_chemical_name_systematic        
;
?
;
_chemical_formula_sum            'C78 H66 Ag2 O7 P4'
_chemical_formula_moiety         'C78 H66 Ag2 O7 P4'
_chemical_formula_weight         1454.93

#----------------------------------------------------------------------------#
# UNIT CELL INFORMATION #
#----------------------------------------------------------------------------#

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_symmetry_space_group_name_Hall  -P_2ybc

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

_cell_length_a                   24.568(2)
_cell_length_b                   12.4749(7)
_cell_length_c                   23.1076(10)
_cell_angle_alpha                90
_cell_angle_beta                 106.704(6)
_cell_angle_gamma                90
_cell_volume                     6783.2(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    5052
_cell_measurement_theta_min      3.1061
_cell_measurement_theta_max      62.3915

#----------------------------------------------------------------------------#
# CRYSTAL INFORMATION #
#----------------------------------------------------------------------------#

_exptl_crystal_description       plate
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.13
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.04
_exptl_crystal_density_diffrn    1.425
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2976
_exptl_special_details           
;
?
;

#----------------------------------------------------------------------------#
# ABSORPTION CORRECTION #
#----------------------------------------------------------------------------#

_exptl_absorpt_coefficient_mu    5.962
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_correction_T_min  0.74943
_exptl_absorpt_correction_T_max  1

#----------------------------------------------------------------------------#
# DATA COLLECTION #
#----------------------------------------------------------------------------#

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     1.54184
_diffrn_radiation_type           CuK\a
_diffrn_radiation_monochromator  graphite
_diffrn_detector_area_resol_mean 10.4738
_diffrn_orient_matrix_ub_11      0.0414916488
_diffrn_orient_matrix_ub_12      0.0313337205
_diffrn_orient_matrix_ub_13      0.0586292532
_diffrn_orient_matrix_ub_21      -0.0487008306
_diffrn_orient_matrix_ub_22      -0.0355018429
_diffrn_orient_matrix_ub_23      0.0272991076
_diffrn_orient_matrix_ub_31      0.0265998294
_diffrn_orient_matrix_ub_32      -0.1135970312
_diffrn_orient_matrix_ub_33      0.0076661876
_diffrn_reflns_av_R_equivalents  0.0609
_diffrn_reflns_av_unetI/netI     0.1347
_diffrn_reflns_number            25768
_diffrn_reflns_limit_h_min       -27
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         3.76
_diffrn_reflns_theta_max         62.81
_diffrn_reflns_theta_full        62.81
_diffrn_measured_fraction_theta_full 0.956
_diffrn_measured_fraction_theta_max 0.956
_diffrn_measurement_device_type  
;
Oxford Diffraction Gemini diffractometer
;
_diffrn_measurement_method       '\f and \w scans'

_reflns_number_total             10450
_reflns_number_gt                5353
_reflns_threshold_expression     I>2\s(I)

#----------------------------------------------------------------------------#
# COMPUTER PROGRAMS USED #
#----------------------------------------------------------------------------#

_computing_data_collection       
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;
_computing_cell_refinement       
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;
_computing_data_reduction        
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'OrtepII (Johnson, C. K. (1976)'
_computing_publication_material  'WinGX Farrugia, L. J. (1999)'

#----------------------------------------------------------------------------#
# STRUCTURE SOLUTION
#----------------------------------------------------------------------------#

_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom

#----------------------------------------------------------------------------#
# REFINEMENT INFORMATION #
#----------------------------------------------------------------------------#

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

One phenyl ring on P3 and three on P4 were modelled as being disordered
over two sets of sites with occupancies constrained to 0.5 after trial
refinement. Disordered atoms were refined with isotropic displacement
parameters after trial refinement with anisotropic parameters resulted
in unacceptable values even with reasonable restraints.
Geometries of the disordered atoms were constrained to ideal values.
Displacement parameters and P-C geometries for C32n and C34n were
restrained to realistic values.

;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.2000P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_number_reflns         10450
_refine_ls_number_parameters     697
_refine_ls_number_restraints     71
_refine_ls_R_factor_all          0.1776
_refine_ls_R_factor_gt           0.1271
_refine_ls_wR_factor_ref         0.3519
_refine_ls_wR_factor_gt          0.3289
_refine_ls_goodness_of_fit_ref   1.112
_refine_ls_restrained_S_all      1.113
_refine_ls_shift/su_max          0.039
_refine_ls_shift/su_mean         0.007
_refine_diff_density_max         7.714
_refine_diff_density_min         -1.622
_refine_diff_density_rms         0.227

#----------------------------------------------------------------------------#
# ATOMIC TYPES, COORDINATES AND THERMAL PARAMETERS #
#----------------------------------------------------------------------------#

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.282 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

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 0.87446(4) 0.17116(9) 0.50621(4) 0.0362(4) Uani 1 1 d . . .
Ag2 Ag 0.64060(8) 0.11486(12) 0.62606(7) 0.0789(6) Uani 1 1 d . A .
C1 C 0.7666(7) 0.0798(13) 0.4722(7) 0.048(4) Uani 1 1 d . . .
O11 O 0.7703(5) 0.1808(9) 0.4782(5) 0.057(3) Uani 1 1 d . . .
O12 O 0.8114(5) 0.0194(9) 0.4827(5) 0.057(3) Uani 1 1 d . . .
C2 C 0.7076(7) 0.0349(15) 0.4428(7) 0.055(4) Uani 1 1 d . . .
H2A H 0.7068 0.0052 0.4028 0.066 Uiso 1 1 calc R . .
H2B H 0.68 0.0947 0.4357 0.066 Uiso 1 1 calc R . .
C3 C 0.6876(8) -0.0539(16) 0.4794(10) 0.068(5) Uani 1 1 d . . .
O3 O 0.6361(6) -0.0919(14) 0.4400(7) 0.100(5) Uani 1 1 d . . .
H3 H 0.6224 -0.1394 0.4575 0.15 Uiso 1 1 calc R . .
C31 C 0.6726(9) 0.0051(16) 0.5340(9) 0.063(5) Uani 1 1 d . . .
O31 O 0.7114(6) 0.0507(9) 0.5730(6) 0.062(3) Uani 1 1 d . . .
O32 O 0.6226(6) 0.0022(12) 0.5329(7) 0.086(4) Uani 1 1 d . . .
C4 C 0.7290(11) -0.1414(15) 0.5066(11) 0.093(8) Uani 1 1 d . . .
H4A H 0.7107 -0.1916 0.5285 0.112 Uiso 1 1 calc R . .
H4B H 0.7622 -0.1094 0.5365 0.112 Uiso 1 1 calc R . .
C5 C 0.7496(12) -0.2043(18) 0.4607(13) 0.100(8) Uani 1 1 d . . .
O51 O 0.7878(5) -0.1662(10) 0.4377(6) 0.066(3) Uani 1 1 d . . .
H51 H 0.7979 -0.1052 0.4522 0.099 Uiso 1 1 calc R . .
O52 O 0.7276(7) -0.2913(14) 0.4409(10) 0.124(7) Uani 1 1 d . . .
P1 P 0.89314(15) 0.2440(3) 0.41670(14) 0.0305(8) Uani 1 1 d . . .
C111 C 0.8415(6) 0.2071(10) 0.3454(5) 0.027(3) Uani 1 1 d . . .
C112 C 0.8111(6) 0.1104(11) 0.3445(5) 0.033(3) Uani 1 1 d . . .
H112 H 0.8164 0.0691 0.3803 0.039 Uiso 1 1 calc R . .
C113 C 0.7737(6) 0.0774(11) 0.2910(6) 0.038(4) Uani 1 1 d . . .
H113 H 0.7538 0.0116 0.2897 0.046 Uiso 1 1 calc R . .
C114 C 0.7644(6) 0.1384(13) 0.2386(6) 0.043(4) Uani 1 1 d . . .
H114 H 0.7381 0.1146 0.2022 0.052 Uiso 1 1 calc R . .
C115 C 0.7927(6) 0.2310(13) 0.2396(6) 0.042(4) Uani 1 1 d . . .
H115 H 0.7862 0.2716 0.2035 0.051 Uiso 1 1 calc R . .
C116 C 0.8322(6) 0.2697(12) 0.2934(6) 0.038(4) Uani 1 1 d . . .
H116 H 0.8515 0.3358 0.2938 0.046 Uiso 1 1 calc R . .
C121 C 0.9636(6) 0.2166(10) 0.4070(6) 0.030(3) Uani 1 1 d . . .
C122 C 1.0090(6) 0.2029(12) 0.4592(6) 0.040(4) Uani 1 1 d . . .
H122 H 1.0036 0.2115 0.498 0.048 Uiso 1 1 calc R . .
C123 C 1.0625(6) 0.1763(13) 0.4535(7) 0.046(4) Uani 1 1 d . . .
H123 H 1.0937 0.1683 0.4887 0.055 Uiso 1 1 calc R . .
C124 C 1.0703(6) 0.1622(11) 0.3997(7) 0.039(4) Uani 1 1 d . . .
H124 H 1.1071 0.1441 0.397 0.047 Uiso 1 1 calc R . .
C125 C 1.0254(6) 0.1733(12) 0.3465(7) 0.044(4) Uani 1 1 d . . .
H125 H 1.0312 0.1628 0.308 0.053 Uiso 1 1 calc R . .
C126 C 0.9722(7) 0.2003(13) 0.3518(6) 0.048(4) Uani 1 1 d . . .
H126 H 0.9412 0.2076 0.3163 0.058 Uiso 1 1 calc R . .
C131 C 0.8894(6) 0.3878(11) 0.4188(5) 0.032(3) Uani 1 1 d U . .
C132 C 0.9345(7) 0.4556(13) 0.4224(6) 0.047(4) Uani 1 1 d . . .
H132 H 0.9703 0.4269 0.4223 0.056 Uiso 1 1 calc R . .
C133 C 0.9278(8) 0.5682(13) 0.4264(7) 0.053(4) Uani 1 1 d . . .
H133 H 0.9596 0.614 0.4304 0.064 Uiso 1 1 calc R . .
C134 C 0.8781(9) 0.6102(13) 0.4246(6) 0.053(5) Uani 1 1 d . . .
H134 H 0.8742 0.6859 0.4259 0.063 Uiso 1 1 calc R . .
C135 C 0.8320(8) 0.5463(13) 0.4211(7) 0.055(5) Uani 1 1 d . . .
H135 H 0.7967 0.5784 0.4203 0.066 Uiso 1 1 calc R . .
C136 C 0.8358(6) 0.4364(13) 0.4187(6) 0.044(4) Uani 1 1 d . . .
H136 H 0.8036 0.3929 0.417 0.052 Uiso 1 1 calc R . .
P2 P 0.92241(15) 0.1929(3) 0.61193(13) 0.0282(8) Uani 1 1 d . . .
C211 C 0.9008(7) 0.1056(11) 0.6667(6) 0.038(4) Uani 1 1 d . . .
C212 C 0.8457(7) 0.0695(12) 0.6489(7) 0.042(4) Uani 1 1 d . . .
H212 H 0.8206 0.0906 0.611 0.05 Uiso 1 1 calc R . .
C213 C 0.8269(8) 0.0017(12) 0.6870(9) 0.057(5) Uani 1 1 d . . .
H213 H 0.7891 -0.0249 0.6757 0.068 Uiso 1 1 calc R . .
C214 C 0.8650(9) -0.0261(12) 0.7417(8) 0.056(5) Uani 1 1 d . . .
H214 H 0.8527 -0.072 0.7683 0.067 Uiso 1 1 calc R . .
C215 C 0.9195(8) 0.0108(12) 0.7585(7) 0.052(5) Uani 1 1 d . . .
H215 H 0.9442 -0.0102 0.7966 0.062 Uiso 1 1 calc R . .
C216 C 0.9402(7) 0.0785(12) 0.7214(6) 0.045(4) Uani 1 1 d . . .
H216 H 0.9783 0.1041 0.7327 0.054 Uiso 1 1 calc R . .
C221 C 0.9998(6) 0.1698(11) 0.6303(5) 0.037(4) Uani 1 1 d . . .
C222 C 1.0410(6) 0.2232(11) 0.6743(6) 0.034(3) Uani 1 1 d . . .
H222 H 1.0295 0.2762 0.6978 0.041 Uiso 1 1 calc R . .
C223 C 1.0945(6) 0.2039(12) 0.6846(7) 0.042(4) Uani 1 1 d . . .
H223 H 1.1212 0.244 0.7147 0.05 Uiso 1 1 calc R . .
C224 C 1.1134(6) 0.1266(11) 0.6531(7) 0.037(4) Uani 1 1 d . . .
H224 H 1.153 0.1133 0.6612 0.045 Uiso 1 1 calc R . .
C225 C 1.0756(6) 0.0694(13) 0.6102(6) 0.040(4) Uani 1 1 d . . .
H225 H 1.0888 0.0163 0.588 0.049 Uiso 1 1 calc R . .
C226 C 1.0188(7) 0.0870(11) 0.5986(6) 0.038(4) Uani 1 1 d . . .
H226 H 0.9923 0.0445 0.5698 0.045 Uiso 1 1 calc R . .
C231 C 0.9173(6) 0.3336(10) 0.6350(6) 0.030(3) Uani 1 1 d . . .
C232 C 0.9090(6) 0.3585(11) 0.6890(6) 0.036(4) Uani 1 1 d . . .
H232 H 0.9066 0.3026 0.7161 0.043 Uiso 1 1 calc R . .
C233 C 0.9039(7) 0.4626(12) 0.7048(6) 0.047(4) Uani 1 1 d . . .
H233 H 0.8979 0.4792 0.7427 0.056 Uiso 1 1 calc R . .
C234 C 0.9075(7) 0.5440(12) 0.6653(7) 0.048(4) Uani 1 1 d . . .
H234 H 0.904 0.6167 0.6759 0.057 Uiso 1 1 calc R . .
C235 C 0.9161(6) 0.5193(10) 0.6111(6) 0.035(3) Uani 1 1 d . . .
H235 H 0.9194 0.5756 0.5846 0.042 Uiso 1 1 calc R . .
C236 C 0.9201(6) 0.4139(11) 0.5938(5) 0.032(3) Uani 1 1 d . . .
H236 H 0.9245 0.3969 0.5553 0.038 Uiso 1 1 calc R . .
P3 P 0.6325(2) -0.0093(4) 0.7039(2) 0.0603(13) Uani 1 1 d D . .
C311 C 0.6819(7) -0.1210(15) 0.7191(8) 0.054(4) Uani 1 1 d . A .
C312 C 0.6909(8) -0.1728(15) 0.6668(8) 0.066(5) Uani 1 1 d . . .
H312 H 0.671 -0.1487 0.6274 0.079 Uiso 1 1 calc R A .
C313 C 0.7277(8) -0.2560(13) 0.6741(8) 0.061(5) Uani 1 1 d . A .
H313 H 0.7345 -0.2881 0.6395 0.073 Uiso 1 1 calc R . .
C314 C 0.7551(8) -0.2944(16) 0.7300(9) 0.068(5) Uani 1 1 d . . .
H314 H 0.7784 -0.3563 0.7341 0.081 Uiso 1 1 calc R A .
C315 C 0.7492(9) -0.2452(17) 0.7794(9) 0.080(6) Uani 1 1 d . A .
H315 H 0.7709 -0.2688 0.8183 0.096 Uiso 1 1 calc R . .
C316 C 0.7115(8) -0.1594(15) 0.7741(10) 0.070(6) Uani 1 1 d . . .
H316 H 0.7065 -0.1274 0.8096 0.084 Uiso 1 1 calc R A .
C321 C 0.5604(8) -0.063(2) 0.6764(16) 0.098(12) Uiso 0.5 1 d PGDU A 1
C322 C 0.5209(10) -0.010(3) 0.6303(18) 0.134(15) Uiso 0.5 1 d PGDU A 1
H322 H 0.5306 0.0569 0.6158 0.161 Uiso 0.5 1 calc PR A 1
C323 C 0.4671(10) -0.053(4) 0.605(2) 0.162(15) Uiso 0.5 1 d PGU A 1
H323 H 0.4401 -0.0162 0.5739 0.194 Uiso 0.5 1 calc PR A 1
C324 C 0.4529(11) -0.150(4) 0.627(2) 0.171(16) Uiso 0.5 1 d PGU A 1
H324 H 0.4162 -0.1799 0.6095 0.205 Uiso 0.5 1 calc PR A 1
C325 C 0.4924(13) -0.204(3) 0.673(2) 0.151(14) Uiso 0.5 1 d PGU A 1
H325 H 0.4827 -0.2706 0.6871 0.181 Uiso 0.5 1 calc PR A 1
C326 C 0.5462(11) -0.161(2) 0.6975(16) 0.086(10) Uiso 0.5 1 d PGDU A 1
H326 H 0.5732 -0.1975 0.729 0.104 Uiso 0.5 1 calc PR A 1
C341 C 0.5656(9) -0.089(2) 0.6890(14) 0.050(8) Uiso 0.5 1 d PGDU A 2
C342 C 0.5206(14) -0.060(3) 0.6395(15) 0.127(12) Uiso 0.5 1 d PGU A 2
H342 H 0.525 -0.0028 0.614 0.153 Uiso 0.5 1 calc PR A 2
C343 C 0.4692(12) -0.114(4) 0.6274(19) 0.175(14) Uiso 0.5 1 d PGU A 2
H343 H 0.4384 -0.0943 0.5936 0.21 Uiso 0.5 1 calc PR A 2
C344 C 0.4627(12) -0.198(4) 0.665(2) 0.167(15) Uiso 0.5 1 d PGU A 2
H344 H 0.4275 -0.2347 0.6565 0.201 Uiso 0.5 1 calc PR A 2
C345 C 0.5077(15) -0.227(3) 0.7142(18) 0.121(13) Uiso 0.5 1 d PGU A 2
H345 H 0.5032 -0.2835 0.7398 0.145 Uiso 0.5 1 calc PR A 2
C346 C 0.5591(11) -0.172(2) 0.7263(12) 0.067(9) Uiso 0.5 1 d PGU A 2
H346 H 0.5898 -0.192 0.7601 0.081 Uiso 0.5 1 calc PR A 2
C331 C 0.6421(8) 0.0498(16) 0.7793(8) 0.068(5) Uani 1 1 d U A .
C332 C 0.6092(10) 0.027(2) 0.8161(9) 0.094(6) Uani 1 1 d U . .
H332 H 0.579 -0.0236 0.804 0.112 Uiso 1 1 calc R A .
C333 C 0.6204(13) 0.078(2) 0.8722(12) 0.119(7) Uani 1 1 d U A .
H333 H 0.5961 0.0649 0.8967 0.143 Uiso 1 1 calc R . .
C334 C 0.6630(11) 0.144(2) 0.8922(12) 0.098(6) Uani 1 1 d U . .
H334 H 0.6741 0.1669 0.9331 0.117 Uiso 1 1 calc R A .
C335 C 0.6916(10) 0.179(2) 0.8523(11) 0.092(6) Uani 1 1 d U A .
H335 H 0.7166 0.2391 0.8621 0.11 Uiso 1 1 calc R . .
C336 C 0.6830(8) 0.1267(17) 0.7982(10) 0.074(5) Uani 1 1 d U . .
H336 H 0.7062 0.1442 0.773 0.089 Uiso 1 1 calc R A .
P4 P 0.6131(2) 0.2974(4) 0.5977(2) 0.0535(11) Uani 1 1 d . . .
C411 C 0.6656(9) 0.3704(17) 0.5733(12) 0.034(9) Uiso 0.5 1 d PG A 1
C412 C 0.7124(10) 0.3133(14) 0.5676(12) 0.048(10) Uiso 0.5 1 d PG A 1
H412 H 0.7135 0.2375 0.5716 0.057 Uiso 0.5 1 calc PR A 1
C413 C 0.7577(8) 0.3672(18) 0.5560(12) 0.070(12) Uiso 0.5 1 d PG A 1
H413 H 0.7897 0.3283 0.5521 0.083 Uiso 0.5 1 calc PR A 1
C414 C 0.7562(8) 0.4782(18) 0.5501(11) 0.058(9) Uiso 0.5 1 d PG A 1
H414 H 0.7871 0.515 0.5421 0.07 Uiso 0.5 1 calc PR A 1
C415 C 0.7094(10) 0.5352(14) 0.5558(11) 0.061(9) Uiso 0.5 1 d PG A 1
H415 H 0.7083 0.611 0.5517 0.073 Uiso 0.5 1 calc PR A 1
C416 C 0.6641(8) 0.4813(17) 0.5674(11) 0.070(11) Uiso 0.5 1 d PG A 1
H416 H 0.6321 0.5203 0.5713 0.084 Uiso 0.5 1 calc PR A 1
C441 C 0.6566(10) 0.378(2) 0.5596(13) 0.079(18) Uiso 0.5 1 d PG A 2
C442 C 0.7129(11) 0.3469(19) 0.5691(13) 0.049(10) Uiso 0.5 1 d PG A 2
H442 H 0.7264 0.2827 0.5906 0.059 Uiso 0.5 1 calc PR A 2
C443 C 0.7493(8) 0.410(2) 0.5472(12) 0.062(10) Uiso 0.5 1 d PG A 2
H443 H 0.7877 0.3885 0.5537 0.074 Uiso 0.5 1 calc PR A 2
C444 C 0.7295(9) 0.504(2) 0.5159(12) 0.080(12) Uiso 0.5 1 d PG A 2
H444 H 0.7544 0.5466 0.5009 0.096 Uiso 0.5 1 calc PR A 2
C445 C 0.6733(10) 0.5347(16) 0.5064(10) 0.063(10) Uiso 0.5 1 d PG A 2
H445 H 0.6598 0.5989 0.4849 0.075 Uiso 0.5 1 calc PR A 2
C446 C 0.6369(8) 0.4719(19) 0.5282(11) 0.048(8) Uiso 0.5 1 d PG A 2
H446 H 0.5984 0.4931 0.5218 0.057 Uiso 0.5 1 calc PR A 2
C421 C 0.5477(10) 0.302(2) 0.5301(12) 0.057(9) Uiso 0.5 1 d PG A 1
C422 C 0.5060(12) 0.225(2) 0.5268(12) 0.106(16) Uiso 0.5 1 d PG A 1
H422 H 0.5115 0.1719 0.5572 0.127 Uiso 0.5 1 calc PR A 1
C423 C 0.4563(10) 0.227(2) 0.4792(12) 0.080(12) Uiso 0.5 1 d PG A 1
H423 H 0.4278 0.1743 0.4769 0.096 Uiso 0.5 1 calc PR A 1
C424 C 0.4483(10) 0.305(2) 0.4347(10) 0.059(9) Uiso 0.5 1 d PG A 1
H424 H 0.4143 0.3063 0.4022 0.071 Uiso 0.5 1 calc PR A 1
C425 C 0.4900(12) 0.382(2) 0.4380(12) 0.105(11) Uiso 0.5 1 d PG A 1
H425 H 0.4845 0.4358 0.4076 0.126 Uiso 0.5 1 calc PR A 1
C426 C 0.5397(11) 0.381(2) 0.4857(14) 0.100(11) Uiso 0.5 1 d PG A 1
H426 H 0.5682 0.4333 0.4879 0.12 Uiso 0.5 1 calc PR A 1
C451 C 0.5447(9) 0.306(2) 0.5551(13) 0.066(11) Uiso 0.5 1 d PG A 2
C452 C 0.4991(13) 0.325(2) 0.5780(11) 0.078(12) Uiso 0.5 1 d PG A 2
H452 H 0.5057 0.3436 0.6193 0.094 Uiso 0.5 1 calc PR A 2
C453 C 0.4438(11) 0.318(3) 0.5403(15) 0.122(19) Uiso 0.5 1 d PG A 2
H453 H 0.4126 0.3314 0.5559 0.146 Uiso 0.5 1 calc PR A 2
C454 C 0.4341(11) 0.291(3) 0.4798(14) 0.108(16) Uiso 0.5 1 d PG A 2
H454 H 0.3963 0.2863 0.454 0.129 Uiso 0.5 1 calc PR A 2
C455 C 0.4796(15) 0.272(3) 0.4569(11) 0.105(11) Uiso 0.5 1 d PG A 2
H455 H 0.473 0.2534 0.4156 0.126 Uiso 0.5 1 calc PR A 2
C456 C 0.5349(12) 0.279(3) 0.4946(14) 0.100(11) Uiso 0.5 1 d PG A 2
H456 H 0.5661 0.2656 0.479 0.12 Uiso 0.5 1 calc PR A 2
C431 C 0.5882(12) 0.3786(19) 0.6496(11) 0.065(11) Uiso 0.5 1 d PG A 1
C432 C 0.6203(12) 0.367(2) 0.7095(12) 0.077(12) Uiso 0.5 1 d PG A 1
H432 H 0.645 0.3069 0.7211 0.093 Uiso 0.5 1 calc PR A 1
C433 C 0.6162(13) 0.442(3) 0.7523(9) 0.137(15) Uiso 0.5 1 d PG A 1
H433 H 0.6381 0.434 0.7932 0.164 Uiso 0.5 1 calc PR A 1
C434 C 0.5800(13) 0.529(2) 0.7352(11) 0.078(12) Uiso 0.5 1 d PG A 1
H434 H 0.5772 0.5811 0.7645 0.093 Uiso 0.5 1 calc PR A 1
C435 C 0.5479(11) 0.5414(19) 0.6753(13) 0.108(16) Uiso 0.5 1 d PG A 1
H435 H 0.5232 0.6011 0.6636 0.129 Uiso 0.5 1 calc PR A 1
C436 C 0.5520(10) 0.466(2) 0.6325(9) 0.059(9) Uiso 0.5 1 d PG A 1
H436 H 0.53 0.4741 0.5916 0.071 Uiso 0.5 1 calc PR A 1
C461 C 0.6134(11) 0.3908(17) 0.6650(10) 0.051(9) Uiso 0.5 1 d PG A 2
C462 C 0.5995(13) 0.3444(17) 0.7136(13) 0.12(2) Uiso 0.5 1 d PG A 2
H462 H 0.589 0.2709 0.7121 0.143 Uiso 0.5 1 calc PR A 2
C463 C 0.6009(14) 0.405(2) 0.7643(11) 0.137(15) Uiso 0.5 1 d PG A 2
H463 H 0.5914 0.3737 0.7975 0.164 Uiso 0.5 1 calc PR A 2
C464 C 0.6163(12) 0.513(2) 0.7665(9) 0.084(13) Uiso 0.5 1 d PG A 2
H464 H 0.6173 0.5546 0.8012 0.101 Uiso 0.5 1 calc PR A 2
C465 C 0.6302(10) 0.5593(16) 0.7180(11) 0.064(10) Uiso 0.5 1 d PG A 2
H465 H 0.6408 0.6328 0.7195 0.077 Uiso 0.5 1 calc PR A 2
C466 C 0.6288(10) 0.4983(18) 0.6672(9) 0.049(8) Uiso 0.5 1 d PG A 2
H466 H 0.6383 0.53 0.6341 0.059 Uiso 0.5 1 calc PR A 2

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.0481(6) 0.0426(7) 0.0192(5) -0.0069(5) 0.0119(4) 0.0018(5)
Ag2 0.1266(14) 0.0595(10) 0.0634(9) 0.0269(7) 0.0478(9) 0.0376(9)
C1 0.067(12) 0.028(10) 0.059(10) 0.011(8) 0.035(9) 0.013(9)
O11 0.060(7) 0.046(8) 0.069(7) 0.008(6) 0.024(6) 0.017(6)
O12 0.079(8) 0.050(7) 0.045(6) 0.000(5) 0.023(6) -0.012(7)
C2 0.052(10) 0.060(12) 0.052(9) -0.003(9) 0.014(8) 0.004(9)
C3 0.055(11) 0.063(13) 0.094(14) -0.016(11) 0.033(11) 0.003(10)
O3 0.093(11) 0.124(14) 0.092(11) -0.047(10) 0.042(9) -0.040(10)
C31 0.067(14) 0.055(12) 0.069(12) 0.003(10) 0.020(10) -0.001(11)
O31 0.084(9) 0.047(7) 0.068(8) 0.007(6) 0.042(7) -0.001(7)
O32 0.059(9) 0.098(11) 0.109(12) -0.008(9) 0.039(8) -0.006(8)
C4 0.16(2) 0.043(12) 0.112(18) 0.024(12) 0.101(18) 0.025(13)
C5 0.13(2) 0.040(13) 0.14(2) -0.012(14) 0.066(18) -0.031(14)
O51 0.082(9) 0.051(8) 0.070(8) -0.008(6) 0.032(7) 0.001(7)
O52 0.105(13) 0.075(12) 0.21(2) -0.028(13) 0.081(14) 0.003(10)
P1 0.042(2) 0.029(2) 0.0201(15) -0.0055(15) 0.0078(14) -0.0008(16)
C111 0.045(8) 0.021(7) 0.014(6) 0.004(5) 0.005(5) 0.012(6)
C112 0.039(8) 0.033(8) 0.020(6) -0.002(6) -0.003(6) 0.014(7)
C113 0.059(10) 0.017(7) 0.049(9) -0.002(7) 0.030(8) -0.010(7)
C114 0.050(9) 0.060(11) 0.015(6) -0.013(7) 0.003(6) -0.013(8)
C115 0.060(10) 0.051(10) 0.014(6) 0.000(7) 0.005(6) -0.002(9)
C116 0.042(8) 0.041(9) 0.040(8) -0.008(7) 0.025(7) -0.016(7)
C121 0.043(8) 0.018(7) 0.029(7) -0.008(6) 0.012(6) 0.001(6)
C122 0.044(9) 0.049(10) 0.024(7) -0.007(7) 0.005(6) 0.000(8)
C123 0.034(8) 0.050(10) 0.045(9) -0.004(8) -0.003(7) 0.013(8)
C124 0.051(9) 0.031(8) 0.050(9) -0.014(7) 0.037(8) -0.004(7)
C125 0.043(9) 0.046(10) 0.043(8) -0.009(8) 0.013(7) 0.002(8)
C126 0.067(11) 0.051(10) 0.028(8) 0.000(7) 0.016(7) -0.007(9)
C131 0.053(7) 0.024(6) 0.019(5) -0.013(5) 0.009(5) -0.005(6)
C132 0.056(10) 0.052(11) 0.036(8) -0.008(8) 0.017(7) -0.008(9)
C133 0.072(13) 0.036(10) 0.049(10) -0.011(8) 0.014(9) -0.014(9)
C134 0.110(16) 0.020(9) 0.033(8) -0.003(7) 0.028(9) -0.001(10)
C135 0.089(14) 0.033(10) 0.045(9) -0.008(8) 0.022(9) 0.014(10)
C136 0.033(8) 0.043(10) 0.044(8) -0.006(7) -0.006(7) 0.012(7)
P2 0.048(2) 0.0201(18) 0.0179(15) -0.0015(14) 0.0115(14) -0.0018(16)
C211 0.076(12) 0.017(7) 0.029(7) -0.003(6) 0.029(7) 0.000(8)
C212 0.057(10) 0.035(9) 0.039(8) -0.010(7) 0.023(7) -0.001(8)
C213 0.071(12) 0.017(8) 0.099(15) -0.012(9) 0.051(11) -0.001(8)
C214 0.093(15) 0.024(9) 0.070(12) 0.019(8) 0.053(11) 0.010(10)
C215 0.093(14) 0.034(9) 0.039(8) 0.023(7) 0.036(9) 0.022(10)
C216 0.078(11) 0.039(9) 0.032(8) 0.006(7) 0.036(8) -0.001(8)
C221 0.065(10) 0.031(8) 0.020(6) 0.017(6) 0.020(6) 0.012(8)
C222 0.042(9) 0.026(8) 0.028(7) -0.002(6) -0.002(6) -0.007(7)
C223 0.028(8) 0.034(9) 0.055(9) -0.003(7) -0.002(7) -0.010(7)
C224 0.031(8) 0.023(8) 0.054(9) 0.020(7) 0.006(7) 0.002(7)
C225 0.043(9) 0.043(9) 0.040(8) 0.017(7) 0.019(7) 0.021(8)
C226 0.058(10) 0.029(8) 0.027(7) 0.005(6) 0.013(7) -0.001(7)
C231 0.037(8) 0.017(7) 0.036(7) -0.007(6) 0.008(6) -0.010(6)
C232 0.070(10) 0.025(8) 0.020(6) 0.003(6) 0.023(7) 0.008(7)
C233 0.080(12) 0.032(9) 0.032(8) -0.004(7) 0.024(8) -0.005(8)
C234 0.076(12) 0.021(8) 0.043(9) -0.005(7) 0.013(8) -0.001(8)
C235 0.072(10) 0.014(7) 0.024(7) 0.009(6) 0.018(7) -0.005(7)
C236 0.051(9) 0.032(8) 0.018(6) -0.001(6) 0.018(6) 0.006(7)
P3 0.067(3) 0.058(3) 0.056(3) 0.022(2) 0.017(2) 0.017(3)
C311 0.051(10) 0.059(11) 0.050(10) 0.003(9) 0.011(8) -0.002(9)
C312 0.065(12) 0.058(12) 0.058(11) -0.001(10) -0.007(9) -0.013(10)
C313 0.083(13) 0.034(10) 0.069(12) 0.020(9) 0.028(10) 0.018(10)
C314 0.071(13) 0.059(12) 0.063(12) 0.009(10) 0.003(10) 0.012(10)
C315 0.094(16) 0.070(14) 0.063(12) 0.018(12) 0.001(11) 0.007(13)
C316 0.059(11) 0.046(11) 0.090(14) 0.023(11) -0.001(10) 0.013(10)
C331 0.072(10) 0.073(11) 0.062(9) -0.002(9) 0.026(8) -0.022(9)
C332 0.116(12) 0.116(13) 0.057(10) -0.009(10) 0.038(9) -0.037(11)
C333 0.135(14) 0.129(15) 0.105(13) -0.023(12) 0.054(12) -0.029(13)
C334 0.108(14) 0.084(13) 0.101(13) -0.011(11) 0.029(11) -0.004(11)
C335 0.082(11) 0.085(12) 0.099(12) 0.010(11) 0.011(10) -0.009(10)
C336 0.061(10) 0.077(11) 0.081(11) 0.012(9) 0.015(9) -0.005(9)
P4 0.075(3) 0.039(2) 0.052(2) 0.011(2) 0.028(2) 0.013(2)

#----------------------------------------------------------------------------#
# MOLECULAR GEOMETRY #
#----------------------------------------------------------------------------#

_geom_special_details            
;
All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell s.u.'s are taken
into account individually in the estimation of s.u.'s in distances, angles
and torsion angles; correlations between s.u.'s in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell s.u.'s is used for estimating s.u.'s 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 P2 2.403(3) . ?
Ag1 O12 2.409(11) . ?
Ag1 P1 2.421(3) . ?
Ag1 O11 2.455(11) . ?
Ag2 P4 2.413(4) . ?
Ag2 P3 2.424(5) . ?
Ag2 O32 2.501(15) . ?
Ag2 O31 2.528(11) . ?
C1 O11 1.269(19) . ?
C1 O12 1.297(18) . ?
C1 C2 1.52(2) . ?
C2 C3 1.56(3) . ?
C2 H2A 0.99 . ?
C2 H2B 0.99 . ?
C3 O3 1.41(2) . ?
C3 C4 1.50(3) . ?
C3 C31 1.59(3) . ?
O3 H3 0.84 . ?
C31 O32 1.22(2) . ?
C31 O31 1.24(2) . ?
C4 C5 1.52(3) . ?
C4 H4A 0.99 . ?
C4 H4B 0.99 . ?
C5 O52 1.24(3) . ?
C5 O51 1.30(3) . ?
O51 H51 0.84 . ?
P1 C131 1.798(14) . ?
P1 C111 1.825(12) . ?
P1 C121 1.839(14) . ?
C111 C116 1.397(19) . ?
C111 C112 1.417(19) . ?
C112 C113 1.376(19) . ?
C112 H112 0.95 . ?
C113 C114 1.39(2) . ?
C113 H113 0.95 . ?
C114 C115 1.34(2) . ?
C114 H114 0.95 . ?
C115 C116 1.422(19) . ?
C115 H115 0.95 . ?
C116 H116 0.95 . ?
C121 C126 1.367(19) . ?
C121 C122 1.399(18) . ?
C122 C123 1.40(2) . ?
C122 H122 0.95 . ?
C123 C124 1.32(2) . ?
C123 H123 0.95 . ?
C124 C125 1.40(2) . ?
C124 H124 0.95 . ?
C125 C126 1.39(2) . ?
C125 H125 0.95 . ?
C126 H126 0.95 . ?
C131 C132 1.38(2) . ?
C131 C136 1.45(2) . ?
C132 C133 1.42(2) . ?
C132 H132 0.95 . ?
C133 C134 1.32(2) . ?
C133 H133 0.95 . ?
C134 C135 1.37(2) . ?
C134 H134 0.95 . ?
C135 C136 1.38(2) . ?
C135 H135 0.95 . ?
C136 H136 0.95 . ?
P2 C221 1.848(15) . ?
P2 C231 1.850(13) . ?
P2 C211 1.859(14) . ?
C211 C212 1.37(2) . ?
C211 C216 1.40(2) . ?
C212 C213 1.39(2) . ?
C212 H212 0.95 . ?
C213 C214 1.38(2) . ?
C213 H213 0.95 . ?
C214 C215 1.36(2) . ?
C214 H214 0.95 . ?
C215 C216 1.40(2) . ?
C215 H215 0.95 . ?
C216 H216 0.95 . ?
C221 C222 1.383(19) . ?
C221 C226 1.42(2) . ?
C222 C223 1.29(2) . ?
C222 H222 0.95 . ?
C223 C224 1.37(2) . ?
C223 H223 0.95 . ?
C224 C225 1.35(2) . ?
C224 H224 0.95 . ?
C225 C226 1.36(2) . ?
C225 H225 0.95 . ?
C226 H226 0.95 . ?
C231 C232 1.356(18) . ?
C231 C236 1.398(19) . ?
C232 C233 1.37(2) . ?
C232 H232 0.95 . ?
C233 C234 1.39(2) . ?
C233 H233 0.95 . ?
C234 C235 1.36(2) . ?
C234 H234 0.95 . ?
C235 C236 1.386(19) . ?
C235 H235 0.95 . ?
C236 H236 0.95 . ?
P3 C311 1.814(18) . ?
P3 C321 1.831(12) . ?
P3 C331 1.845(19) . ?
P3 C341 1.866(16) . ?
C311 C316 1.36(2) . ?
C311 C312 1.44(3) . ?
C312 C313 1.36(2) . ?
C312 H312 0.95 . ?
C313 C314 1.36(2) . ?
C313 H313 0.95 . ?
C314 C315 1.34(3) . ?
C314 H314 0.95 . ?
C315 C316 1.40(3) . ?
C315 H315 0.95 . ?
C316 H316 0.95 . ?
C321 C322 1.39 . ?
C321 C326 1.39 . ?
C322 C323 1.39 . ?
C322 H322 0.95 . ?
C323 C324 1.39 . ?
C323 H323 0.95 . ?
C324 C325 1.39 . ?
C324 H324 0.95 . ?
C325 C326 1.39 . ?
C325 H325 0.95 . ?
C326 H326 0.95 . ?
C341 C342 1.39 . ?
C341 C346 1.39 . ?
C342 C343 1.39 . ?
C342 H342 0.95 . ?
C343 C344 1.39 . ?
C343 H343 0.95 . ?
C344 C345 1.39 . ?
C344 H344 0.95 . ?
C345 C346 1.39 . ?
C345 H345 0.95 . ?
C346 H346 0.95 . ?
C331 C332 1.36(3) . ?
C331 C336 1.37(3) . ?
C332 C333 1.40(3) . ?
C332 H332 0.95 . ?
C333 C334 1.30(3) . ?
C333 H333 0.95 . ?
C334 C335 1.38(3) . ?
C334 H334 0.95 . ?
C335 C336 1.38(3) . ?
C335 H335 0.95 . ?
C336 H336 0.95 . ?
P4 C451 1.69(2) . ?
P4 C411 1.798(17) . ?
P4 C431 1.81(2) . ?
P4 C441 1.862(18) . ?
P4 C421 1.89(2) . ?
P4 C461 1.942(19) . ?
C411 C412 1.39 . ?
C411 C416 1.39 . ?
C412 C413 1.39 . ?
C412 H412 0.95 . ?
C413 C414 1.39 . ?
C413 H413 0.95 . ?
C414 C415 1.39 . ?
C414 H414 0.95 . ?
C415 C416 1.39 . ?
C415 H415 0.95 . ?
C416 H416 0.95 . ?
C441 C442 1.39 . ?
C441 C446 1.39 . ?
C442 C443 1.39 . ?
C442 H442 0.95 . ?
C443 C444 1.39 . ?
C443 H443 0.95 . ?
C444 C445 1.39 . ?
C444 H444 0.95 . ?
C445 C446 1.39 . ?
C445 H445 0.95 . ?
C446 H446 0.95 . ?
C421 C422 1.39 . ?
C421 C426 1.39 . ?
C422 C423 1.39 . ?
C422 H422 0.95 . ?
C423 C424 1.39 . ?
C423 H423 0.95 . ?
C424 C425 1.39 . ?
C424 H424 0.95 . ?
C425 C426 1.39 . ?
C425 H425 0.95 . ?
C426 H426 0.95 . ?
C451 C452 1.39 . ?
C451 C456 1.39 . ?
C452 C453 1.39 . ?
C452 H452 0.95 . ?
C453 C454 1.39 . ?
C453 H453 0.95 . ?
C454 C455 1.39 . ?
C454 H454 0.95 . ?
C455 C456 1.39 . ?
C455 H455 0.95 . ?
C456 H456 0.95 . ?
C431 C432 1.39 . ?
C431 C436 1.39 . ?
C432 C433 1.39 . ?
C432 H432 0.95 . ?
C433 C434 1.39 . ?
C433 H433 0.95 . ?
C434 C435 1.39 . ?
C434 H434 0.95 . ?
C435 C436 1.39 . ?
C435 H435 0.95 . ?
C436 H436 0.95 . ?
C461 C462 1.39 . ?
C461 C466 1.39 . ?
C462 C463 1.39 . ?
C462 H462 0.95 . ?
C463 C464 1.39 . ?
C463 H463 0.95 . ?
C464 C465 1.39 . ?
C464 H464 0.95 . ?
C465 C466 1.39 . ?
C465 H465 0.95 . ?
C466 H466 0.95 . ?

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
P2 Ag1 O12 114.4(3) . . ?
P2 Ag1 P1 131.95(12) . . ?
O12 Ag1 P1 111.7(3) . . ?
P2 Ag1 O11 115.6(3) . . ?
O12 Ag1 O11 54.9(4) . . ?
P1 Ag1 O11 101.3(3) . . ?
P4 Ag2 P3 136.78(17) . . ?
P4 Ag2 O32 109.3(4) . . ?
P3 Ag2 O32 104.3(4) . . ?
P4 Ag2 O31 110.2(3) . . ?
P3 Ag2 O31 111.8(3) . . ?
O32 Ag2 O31 51.8(4) . . ?
O11 C1 O12 121.8(16) . . ?
O11 C1 C2 116.4(15) . . ?
O12 C1 C2 121.2(15) . . ?
C1 O11 Ag1 91.0(10) . . ?
C1 O12 Ag1 92.4(10) . . ?
C1 C2 C3 115.3(14) . . ?
C1 C2 H2A 108.5 . . ?
C3 C2 H2A 108.5 . . ?
C1 C2 H2B 108.4 . . ?
C3 C2 H2B 108.4 . . ?
H2A C2 H2B 107.5 . . ?
O3 C3 C4 113.5(18) . . ?
O3 C3 C2 104.6(16) . . ?
C4 C3 C2 117.6(15) . . ?
O3 C3 C31 107.3(14) . . ?
C4 C3 C31 106.8(17) . . ?
C2 C3 C31 106.5(15) . . ?
C3 O3 H3 109.4 . . ?
O32 C31 O31 125.7(19) . . ?
O32 C31 C3 115.5(18) . . ?
O31 C31 C3 118.8(17) . . ?
C31 O31 Ag2 90.4(11) . . ?
C31 O32 Ag2 92.1(12) . . ?
C3 C4 C5 114(2) . . ?
C3 C4 H4A 108.8 . . ?
C5 C4 H4A 108.8 . . ?
C3 C4 H4B 108.8 . . ?
C5 C4 H4B 108.8 . . ?
H4A C4 H4B 107.7 . . ?
O52 C5 O51 117(2) . . ?
O52 C5 C4 121(2) . . ?
O51 C5 C4 121.6(19) . . ?
C5 O51 H51 109.5 . . ?
C131 P1 C111 104.4(6) . . ?
C131 P1 C121 104.3(6) . . ?
C111 P1 C121 106.1(6) . . ?
C131 P1 Ag1 109.1(4) . . ?
C111 P1 Ag1 115.0(4) . . ?
C121 P1 Ag1 116.8(4) . . ?
C116 C111 C112 120.5(12) . . ?
C116 C111 P1 122.4(11) . . ?
C112 C111 P1 117.0(9) . . ?
C113 C112 C111 118.8(12) . . ?
C113 C112 H112 120.6 . . ?
C111 C112 H112 120.6 . . ?
C112 C113 C114 121.2(13) . . ?
C112 C113 H113 119.4 . . ?
C114 C113 H113 119.4 . . ?
C115 C114 C113 120.0(13) . . ?
C115 C114 H114 120 . . ?
C113 C114 H114 120 . . ?
C114 C115 C116 121.7(13) . . ?
C114 C115 H115 119.1 . . ?
C116 C115 H115 119.2 . . ?
C111 C116 C115 117.7(13) . . ?
C111 C116 H116 121.1 . . ?
C115 C116 H116 121.1 . . ?
C126 C121 C122 119.1(14) . . ?
C126 C121 P1 123.0(11) . . ?
C122 C121 P1 117.6(10) . . ?
C123 C122 C121 119.1(13) . . ?
C123 C122 H122 120.4 . . ?
C121 C122 H122 120.4 . . ?
C124 C123 C122 121.0(14) . . ?
C124 C123 H123 119.5 . . ?
C122 C123 H123 119.5 . . ?
C123 C124 C125 121.2(14) . . ?
C123 C124 H124 119.4 . . ?
C125 C124 H124 119.4 . . ?
C126 C125 C124 118.1(14) . . ?
C126 C125 H125 121 . . ?
C124 C125 H125 121 . . ?
C121 C126 C125 121.4(15) . . ?
C121 C126 H126 119.3 . . ?
C125 C126 H126 119.3 . . ?
C132 C131 C136 117.3(13) . . ?
C132 C131 P1 124.6(12) . . ?
C136 C131 P1 118.1(11) . . ?
C131 C132 C133 120.3(16) . . ?
C131 C132 H132 119.9 . . ?
C133 C132 H132 119.8 . . ?
C134 C133 C132 120.9(17) . . ?
C134 C133 H133 119.5 . . ?
C132 C133 H133 119.5 . . ?
C133 C134 C135 120.9(16) . . ?
C133 C134 H134 119.5 . . ?
C135 C134 H134 119.5 . . ?
C134 C135 C136 121.3(17) . . ?
C134 C135 H135 119.4 . . ?
C136 C135 H135 119.4 . . ?
C135 C136 C131 119.2(16) . . ?
C135 C136 H136 120.4 . . ?
C131 C136 H136 120.4 . . ?
C221 P2 C231 103.4(6) . . ?
C221 P2 C211 103.3(6) . . ?
C231 P2 C211 107.7(6) . . ?
C221 P2 Ag1 112.8(4) . . ?
C231 P2 Ag1 110.3(4) . . ?
C211 P2 Ag1 118.2(5) . . ?
C212 C211 C216 124.1(13) . . ?
C212 C211 P2 116.0(11) . . ?
C216 C211 P2 119.9(12) . . ?
C211 C212 C213 119.1(15) . . ?
C211 C212 H212 120.4 . . ?
C213 C212 H212 120.4 . . ?
C214 C213 C212 118.1(16) . . ?
C214 C213 H213 120.9 . . ?
C212 C213 H213 120.9 . . ?
C215 C214 C213 121.8(15) . . ?
C215 C214 H214 119.1 . . ?
C213 C214 H214 119.1 . . ?
C214 C215 C216 122.0(15) . . ?
C214 C215 H215 119 . . ?
C216 C215 H215 119 . . ?
C211 C216 C215 114.9(16) . . ?
C211 C216 H216 122.5 . . ?
C215 C216 H216 122.5 . . ?
C222 C221 C226 116.7(13) . . ?
C222 C221 P2 125.6(11) . . ?
C226 C221 P2 117.7(11) . . ?
C223 C222 C221 122.6(14) . . ?
C223 C222 H222 118.7 . . ?
C221 C222 H222 118.7 . . ?
C222 C223 C224 121.2(14) . . ?
C222 C223 H223 119.4 . . ?
C224 C223 H223 119.4 . . ?
C225 C224 C223 119.7(13) . . ?
C225 C224 H224 120.1 . . ?
C223 C224 H224 120.1 . . ?
C224 C225 C226 120.6(14) . . ?
C224 C225 H225 119.7 . . ?
C226 C225 H225 119.7 . . ?
C225 C226 C221 119.1(14) . . ?
C225 C226 H226 120.4 . . ?
C221 C226 H226 120.4 . . ?
C232 C231 C236 120.8(12) . . ?
C232 C231 P2 121.5(10) . . ?
C236 C231 P2 117.6(10) . . ?
C231 C232 C233 120.9(13) . . ?
C231 C232 H232 119.5 . . ?
C233 C232 H232 119.6 . . ?
C232 C233 C234 119.5(13) . . ?
C232 C233 H233 120.2 . . ?
C234 C233 H233 120.2 . . ?
C235 C234 C233 119.8(13) . . ?
C235 C234 H234 120.1 . . ?
C233 C234 H234 120.1 . . ?
C234 C235 C236 121.4(12) . . ?
C234 C235 H235 119.3 . . ?
C236 C235 H235 119.3 . . ?
C235 C236 C231 117.5(11) . . ?
C235 C236 H236 121.3 . . ?
C231 C236 H236 121.2 . . ?
C311 P3 C321 108.1(12) . . ?
C311 P3 C331 103.1(9) . . ?
C321 P3 C331 108.8(15) . . ?
C311 P3 C341 97.6(12) . . ?
C331 P3 C341 104.6(12) . . ?
C311 P3 Ag2 116.2(6) . . ?
C321 P3 Ag2 104.8(9) . . ?
C331 P3 Ag2 115.5(7) . . ?
C341 P3 Ag2 117.3(9) . . ?
C316 C311 C312 117.2(18) . . ?
C316 C311 P3 126.9(15) . . ?
C312 C311 P3 115.9(13) . . ?
C313 C312 C311 119.8(17) . . ?
C313 C312 H312 120.1 . . ?
C311 C312 H312 120.1 . . ?
C312 C313 C314 121.1(19) . . ?
C312 C313 H313 119.4 . . ?
C314 C313 H313 119.4 . . ?
C315 C314 C313 120.2(19) . . ?
C315 C314 H314 119.9 . . ?
C313 C314 H314 119.9 . . ?
C314 C315 C316 120.5(19) . . ?
C314 C315 H315 119.7 . . ?
C316 C315 H315 119.7 . . ?
C311 C316 C315 121(2) . . ?
C311 C316 H316 119.5 . . ?
C315 C316 H316 119.5 . . ?
C322 C321 C326 120 . . ?
C322 C321 P3 118.7(10) . . ?
C326 C321 P3 121.1(10) . . ?
C323 C322 C321 120 . . ?
C323 C322 H322 120 . . ?
C321 C322 H322 120 . . ?
C324 C323 C322 120 . . ?
C324 C323 H323 120 . . ?
C322 C323 H323 120 . . ?
C323 C324 C325 120 . . ?
C323 C324 H324 120 . . ?
C325 C324 H324 120 . . ?
C324 C325 C326 120 . . ?
C324 C325 H325 120 . . ?
C326 C325 H325 120 . . ?
C325 C326 C321 120 . . ?
C325 C326 H326 120 . . ?
C321 C326 H326 120 . . ?
C342 C341 C346 120 . . ?
C342 C341 P3 117.6(18) . . ?
C346 C341 P3 122.4(18) . . ?
C343 C342 C341 120 . . ?
C343 C342 H342 120 . . ?
C341 C342 H342 120 . . ?
C344 C343 C342 120 . . ?
C344 C343 H343 120 . . ?
C342 C343 H343 120 . . ?
C343 C344 C345 120 . . ?
C343 C344 H344 120 . . ?
C345 C344 H344 120 . . ?
C346 C345 C344 120 . . ?
C346 C345 H345 120 . . ?
C344 C345 H345 120 . . ?
C345 C346 C341 120 . . ?
C345 C346 H346 120 . . ?
C341 C346 H346 120 . . ?
C332 C331 C336 117.6(19) . . ?
C332 C331 P3 124.7(16) . . ?
C336 C331 P3 117.6(15) . . ?
C331 C332 C333 119(2) . . ?
C331 C332 H332 120.5 . . ?
C333 C332 H332 120.5 . . ?
C334 C333 C332 123(3) . . ?
C334 C333 H333 118.6 . . ?
C332 C333 H333 118.6 . . ?
C333 C334 C335 118(3) . . ?
C333 C334 H334 120.8 . . ?
C335 C334 H334 120.9 . . ?
C336 C335 C334 119(2) . . ?
C336 C335 H335 120.7 . . ?
C334 C335 H335 120.7 . . ?
C331 C336 C335 122(2) . . ?
C331 C336 H336 118.9 . . ?
C335 C336 H336 118.9 . . ?
C411 P4 C431 109.6(12) . . ?
C451 P4 C441 107.6(13) . . ?
C411 P4 C421 103.9(13) . . ?
C431 P4 C421 99.3(13) . . ?
C451 P4 C461 101.8(13) . . ?
C441 P4 C461 100.6(12) . . ?
C451 P4 Ag2 111.8(10) . . ?
C411 P4 Ag2 113.1(8) . . ?
C431 P4 Ag2 118.1(9) . . ?
C441 P4 Ag2 118.9(8) . . ?
C421 P4 Ag2 111.1(9) . . ?
C461 P4 Ag2 114.3(8) . . ?
C412 C411 C416 120 . . ?
C412 C411 P4 117.3(13) . . ?
C416 C411 P4 122.2(13) . . ?
C411 C412 C413 120 . . ?
C411 C412 H412 120 . . ?
C413 C412 H412 120 . . ?
C414 C413 C412 120 . . ?
C414 C413 H413 120 . . ?
C412 C413 H413 120 . . ?
C413 C414 C415 120 . . ?
C413 C414 H414 120 . . ?
C415 C414 H414 120 . . ?
C416 C415 C414 120 . . ?
C416 C415 H415 120 . . ?
C414 C415 H415 120 . . ?
C415 C416 C411 120 . . ?
C415 C416 H416 120 . . ?
C411 C416 H416 120 . . ?
C442 C441 C446 120 . . ?
C442 C441 P4 117.1(14) . . ?
C446 C441 P4 122.6(14) . . ?
C441 C442 C443 120 . . ?
C441 C442 H442 120 . . ?
C443 C442 H442 120 . . ?
C442 C443 C444 120 . . ?
C442 C443 H443 120 . . ?
C444 C443 H443 120 . . ?
C445 C444 C443 120 . . ?
C445 C444 H444 120 . . ?
C443 C444 H444 120 . . ?
C446 C445 C444 120 . . ?
C446 C445 H445 120 . . ?
C444 C445 H445 120 . . ?
C445 C446 C441 120 . . ?
C445 C446 H446 120 . . ?
C441 C446 H446 120 . . ?
C422 C421 C426 120 . . ?
C422 C421 P4 117.4(16) . . ?
C426 C421 P4 122.6(16) . . ?
C421 C422 C423 120 . . ?
C421 C422 H422 120 . . ?
C423 C422 H422 120 . . ?
C424 C423 C422 120 . . ?
C424 C423 H423 120 . . ?
C422 C423 H423 120 . . ?
C425 C424 C423 120 . . ?
C425 C424 H424 120 . . ?
C423 C424 H424 120 . . ?
C426 C425 C424 120 . . ?
C426 C425 H425 120 . . ?
C424 C425 H425 120 . . ?
C425 C426 C421 120 . . ?
C425 C426 H426 120 . . ?
C421 C426 H426 120 . . ?
C452 C451 C456 120 . . ?
C452 C451 P4 124.4(19) . . ?
C456 C451 P4 115.2(19) . . ?
C451 C452 C453 120 . . ?
C451 C452 H452 120 . . ?
C453 C452 H452 120 . . ?
C454 C453 C452 120 . . ?
C454 C453 H453 120 . . ?
C452 C453 H453 120 . . ?
C453 C454 C455 120 . . ?
C453 C454 H454 120 . . ?
C455 C454 H454 120 . . ?
C456 C455 C454 120 . . ?
C456 C455 H455 120 . . ?
C454 C455 H455 120 . . ?
C455 C456 C451 120 . . ?
C455 C456 H456 120 . . ?
C451 C456 H456 120 . . ?
C432 C431 C436 120 . . ?
C432 C431 P4 113.4(16) . . ?
C436 C431 P4 124.2(16) . . ?
C433 C432 C431 120 . . ?
C433 C432 H432 120 . . ?
C431 C432 H432 120 . . ?
C432 C433 C434 120 . . ?
C432 C433 H433 120 . . ?
C434 C433 H433 120 . . ?
C435 C434 C433 120 . . ?
C435 C434 H434 120 . . ?
C433 C434 H434 120 . . ?
C434 C435 C436 120 . . ?
C434 C435 H435 120 . . ?
C436 C435 H435 120 . . ?
C435 C436 C431 120 . . ?
C435 C436 H436 120 . . ?
C431 C436 H436 120 . . ?
C462 C461 C466 120 . . ?
C462 C461 P4 116.8(14) . . ?
C466 C461 P4 123.1(15) . . ?
C461 C462 C463 120 . . ?
C461 C462 H462 120 . . ?
C463 C462 H462 120 . . ?
C464 C463 C462 120 . . ?
C464 C463 H463 120 . . ?
C462 C463 H463 120 . . ?
C463 C464 C465 120 . . ?
C463 C464 H464 120 . . ?
C465 C464 H464 120 . . ?
C466 C465 C464 120 . . ?
C466 C465 H465 120 . . ?
C464 C465 H465 120 . . ?
C465 C466 C461 120 . . ?
C465 C466 H466 120 . . ?
C461 C466 H466 120 . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O51 H51 O12 0.84 1.7 2.536(16) 174 .
#===END

# Attachment 'web_deposit_cif_file_1_BrianSkelton_1308022368.gban03.cif'

data_gban03
_database_code_depnum_ccdc_archive 'CCDC 763389'
#TrackingRef 'web_deposit_cif_file_1_BrianSkelton_1308022368.gban03.cif'

_audit_creation_date             2011-06-13T16:45:21-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'

#----------------------------------------------------------------------------#
# CHEMICAL INFORMATION #
#----------------------------------------------------------------------------#

_chemical_name_systematic        
;
?
;
_chemical_formula_sum            'C44 H43 Ag O8 P2'
_chemical_formula_moiety         'C42 H37 Ag O7 P2, C2 H6 O'
_chemical_formula_weight         869.59

#----------------------------------------------------------------------------#
# UNIT CELL INFORMATION #
#----------------------------------------------------------------------------#

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-p 1'
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.2314(5)
_cell_length_b                   12.8542(5)
_cell_length_c                   14.4510(4)
_cell_angle_alpha                82.679(2)
_cell_angle_beta                 87.727(3)
_cell_angle_gamma                64.362(4)
_cell_volume                     2031.36(15)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    14089
_cell_measurement_theta_min      2.8347
_cell_measurement_theta_max      33.2387

#----------------------------------------------------------------------------#
# CRYSTAL INFORMATION #
#----------------------------------------------------------------------------#

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.41
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.25
_exptl_crystal_density_diffrn    1.422
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             896
_exptl_special_details           
;
?
;

#----------------------------------------------------------------------------#
# ABSORPTION CORRECTION #
#----------------------------------------------------------------------------#

_exptl_absorpt_coefficient_mu    0.627
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_correction_T_min  0.99241
_exptl_absorpt_correction_T_max  1

#----------------------------------------------------------------------------#
# DATA COLLECTION #
#----------------------------------------------------------------------------#

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_monochromator  graphite
_diffrn_detector_area_resol_mean 16.0009
_diffrn_orient_matrix_ub_11      0.0530216971
_diffrn_orient_matrix_ub_12      0.0095855383
_diffrn_orient_matrix_ub_13      -0.0025661248
_diffrn_orient_matrix_ub_21      -0.0289340583
_diffrn_orient_matrix_ub_22      0.0480990504
_diffrn_orient_matrix_ub_23      0.0256373012
_diffrn_orient_matrix_ub_31      0.0221035717
_diffrn_orient_matrix_ub_32      -0.0374424632
_diffrn_orient_matrix_ub_33      0.0422462281
_diffrn_measurement_device_type  'Oxford Diffraction Xcalibur diffractometer'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_reflns_av_R_equivalents  0.0386
_diffrn_reflns_av_unetI/netI     0.099
_diffrn_reflns_number            37387
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         2.84
_diffrn_reflns_theta_max         33.35
_diffrn_reflns_theta_full        32.25
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.94
_reflns_number_total             14800
_reflns_number_gt                9552
_reflns_threshold_expression     I>2\s(I)

#----------------------------------------------------------------------------#
# COMPUTER PROGRAMS USED #
#----------------------------------------------------------------------------#

_computing_data_collection       
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;
_computing_cell_refinement       
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;
_computing_data_reduction        
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.5 (release 08-05-2007 CrysAlis171 .NET)
(compiled May 8 2007,13:10:02)
;

_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    'OrtepII (Johnson, C. K. (1976)'
_computing_publication_material  'WinGX Farrugia, L. J. (1999)'

#----------------------------------------------------------------------------#
# STRUCTURE SOLUTION
#----------------------------------------------------------------------------#

_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom

#----------------------------------------------------------------------------#
# REFINEMENT INFORMATION #
#----------------------------------------------------------------------------#

_refine_special_details          
;
Refinement of F^2^ against ALL reflections. The weighted R-factor wR and
goodness of fit S are based on F^2^, conventional R-factors R are based
on F, with F set to zero for negative F^2^. The threshold expression of
F^2^ > 2\s(F^2^) is used only for calculating R-factors(gt) etc. and is
not relevant to the choice of reflections for refinement. R-factors based
on F^2^ are statistically about twice as large as those based on F, and R-
factors based on ALL data will be even larger.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.0301P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_number_reflns         14800
_refine_ls_number_parameters     502
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0647
_refine_ls_R_factor_gt           0.0359
_refine_ls_wR_factor_ref         0.0733
_refine_ls_wR_factor_gt          0.0687
_refine_ls_goodness_of_fit_ref   0.904
_refine_ls_restrained_S_all      0.904
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_diff_density_max         1.155
_refine_diff_density_min         -0.58
_refine_diff_density_rms         0.087

#----------------------------------------------------------------------------#
# ATOMIC TYPES, COORDINATES AND THERMAL PARAMETERS #
#----------------------------------------------------------------------------#

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 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.006 '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'

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 0.308955(12) 0.623504(12) 0.215314(9) 0.01613(4) Uani 1 1 d . . .
P1 P 0.17501(4) 0.56628(4) 0.13557(3) 0.01449(9) Uani 1 1 d . . .
C111 C 0.17619(15) 0.42624(15) 0.17799(12) 0.0160(4) Uani 1 1 d . . .
C112 C 0.16809(17) 0.39960(17) 0.27408(13) 0.0246(4) Uani 1 1 d . . .
H112 H 0.166 0.4523 0.3154 0.029 Uiso 1 1 calc R . .
C113 C 0.16313(19) 0.29595(19) 0.30929(15) 0.0307(5) Uani 1 1 d . . .
H113 H 0.1562 0.2786 0.3745 0.037 Uiso 1 1 calc R . .
C114 C 0.16822(18) 0.21814(17) 0.24990(15) 0.0284(5) Uani 1 1 d . . .
H114 H 0.1636 0.1479 0.2742 0.034 Uiso 1 1 calc R . .
C115 C 0.18005(17) 0.24218(17) 0.15561(14) 0.0255(4) Uani 1 1 d . . .
H115 H 0.1855 0.1877 0.1149 0.031 Uiso 1 1 calc R . .
C116 C 0.18406(16) 0.34609(16) 0.11958(13) 0.0203(4) Uani 1 1 d . . .
H116 H 0.1923 0.3621 0.0543 0.024 Uiso 1 1 calc R . .
C121 C 0.21558(16) 0.55607(15) 0.01365(12) 0.0157(3) Uani 1 1 d . . .
C122 C 0.33820(17) 0.49439(16) -0.00721(13) 0.0209(4) Uani 1 1 d . . .
H122 H 0.3962 0.4545 0.0419 0.025 Uiso 1 1 calc R . .
C123 C 0.37505(18) 0.49136(17) -0.09888(13) 0.0243(4) Uani 1 1 d . . .
H123 H 0.4583 0.4489 -0.1123 0.029 Uiso 1 1 calc R . .
C124 C 0.29197(18) 0.54957(17) -0.17135(13) 0.0231(4) Uani 1 1 d . . .
H124 H 0.3181 0.5483 -0.2342 0.028 Uiso 1 1 calc R . .
C125 C 0.17076(18) 0.60955(16) -0.15148(13) 0.0218(4) Uani 1 1 d . . .
H125 H 0.1133 0.6485 -0.2011 0.026 Uiso 1 1 calc R . .
C126 C 0.13211(17) 0.61355(15) -0.05992(12) 0.0186(4) Uani 1 1 d . . .
H126 H 0.0486 0.6555 -0.0472 0.022 Uiso 1 1 calc R . .
C131 C 0.01505(16) 0.66823(15) 0.13337(12) 0.0159(3) Uani 1 1 d . . .
C132 C -0.07820(16) 0.63381(17) 0.12955(13) 0.0209(4) Uani 1 1 d . . .
H132 H -0.0591 0.554 0.1285 0.025 Uiso 1 1 calc R . .
C133 C -0.19795(17) 0.71462(17) 0.12726(13) 0.0239(4) Uani 1 1 d . . .
H133 H -0.2608 0.6903 0.1248 0.029 Uiso 1 1 calc R . .
C134 C -0.22668(17) 0.83070(17) 0.12855(13) 0.0244(4) Uani 1 1 d . . .
H134 H -0.3092 0.8861 0.127 0.029 Uiso 1 1 calc R . .
C135 C -0.13589(17) 0.86634(17) 0.13207(14) 0.0248(4) Uani 1 1 d . . .
H135 H -0.1559 0.9464 0.1321 0.03 Uiso 1 1 calc R . .
C136 C -0.01534(17) 0.78544(16) 0.13555(13) 0.0210(4) Uani 1 1 d . . .
H136 H 0.0469 0.8102 0.1394 0.025 Uiso 1 1 calc R . .
P2 P 0.34098(4) 0.79523(4) 0.18323(3) 0.01337(9) Uani 1 1 d . . .
C211 C 0.44745(16) 0.81957(16) 0.25145(11) 0.0158(4) Uani 1 1 d . . .
C212 C 0.54665(16) 0.72285(17) 0.29399(12) 0.0196(4) Uani 1 1 d . . .
H212 H 0.5553 0.6467 0.2892 0.024 Uiso 1 1 calc R . .
C213 C 0.63261(17) 0.7384(2) 0.34332(13) 0.0272(5) Uani 1 1 d . . .
H213 H 0.7008 0.6726 0.3711 0.033 Uiso 1 1 calc R . .
C214 C 0.61951(18) 0.8491(2) 0.35217(13) 0.0284(5) Uani 1 1 d . . .
H214 H 0.6782 0.859 0.3866 0.034 Uiso 1 1 calc R . .
C215 C 0.52132(19) 0.94523(19) 0.31108(13) 0.0277(5) Uani 1 1 d . . .
H215 H 0.5125 1.0212 0.3171 0.033 Uiso 1 1 calc R . .
C216 C 0.43544(18) 0.93049(17) 0.26090(12) 0.0215(4) Uani 1 1 d . . .
H216 H 0.3679 0.9967 0.2328 0.026 Uiso 1 1 calc R . .
C221 C 0.38201(15) 0.81692(15) 0.06248(11) 0.0144(3) Uani 1 1 d . . .
C222 C 0.46936(16) 0.85611(16) 0.03563(12) 0.0198(4) Uani 1 1 d . . .
H222 H 0.5059 0.8791 0.081 0.024 Uiso 1 1 calc R . .
C223 C 0.50384(18) 0.86206(17) -0.05677(13) 0.0251(4) Uani 1 1 d . . .
H223 H 0.5646 0.8879 -0.074 0.03 Uiso 1 1 calc R . .
C224 C 0.45023(19) 0.83064(17) -0.12398(13) 0.0265(4) Uani 1 1 d . . .
H224 H 0.4739 0.8349 -0.1873 0.032 Uiso 1 1 calc R . .
C225 C 0.36186(19) 0.79295(17) -0.09815(13) 0.0251(4) Uani 1 1 d . . .
H225 H 0.3238 0.7723 -0.1441 0.03 Uiso 1 1 calc R . .
C226 C 0.32878(17) 0.78521(16) -0.00598(12) 0.0208(4) Uani 1 1 d . . .
H226 H 0.2691 0.758 0.0111 0.025 Uiso 1 1 calc R . .
C231 C 0.19470(15) 0.91613(15) 0.19817(12) 0.0158(4) Uani 1 1 d . . .
C232 C 0.14635(17) 0.91973(17) 0.28768(12) 0.0206(4) Uani 1 1 d . . .
H232 H 0.194 0.8658 0.3379 0.025 Uiso 1 1 calc R . .
C233 C 0.03041(18) 1.00042(17) 0.30413(14) 0.0252(4) Uani 1 1 d . . .
H233 H -0.0007 1.0028 0.3655 0.03 Uiso 1 1 calc R . .
C234 C -0.04022(18) 1.07767(17) 0.23118(15) 0.0259(4) Uani 1 1 d . . .
H234 H -0.1204 1.1326 0.2422 0.031 Uiso 1 1 calc R . .
C235 C 0.00600(17) 1.07493(16) 0.14180(14) 0.0243(4) Uani 1 1 d . . .
H235 H -0.0428 1.1282 0.0918 0.029 Uiso 1 1 calc R . .
C236 C 0.12360(16) 0.99454(16) 0.12475(13) 0.0190(4) Uani 1 1 d . . .
H236 H 0.1549 0.9933 0.0635 0.023 Uiso 1 1 calc R . .
C1 C 0.41238(17) 0.43198(16) 0.34985(12) 0.0194(4) Uani 1 1 d . . .
O11 O 0.32338(12) 0.52032(11) 0.37328(8) 0.0222(3) Uani 1 1 d . . .
O12 O 0.46215(12) 0.43017(12) 0.27203(9) 0.0283(3) Uani 1 1 d . . .
C2 C 0.45784(16) 0.32092(16) 0.41808(12) 0.0193(4) Uani 1 1 d . . .
H2A H 0.4178 0.2727 0.4027 0.023 Uiso 1 1 calc R . .
H2B H 0.4335 0.3417 0.4818 0.023 Uiso 1 1 calc R . .
C3 C 0.59596(16) 0.24815(15) 0.41772(12) 0.0170(4) Uani 1 1 d . . .
O3 O 0.63696(12) 0.22045(11) 0.32741(8) 0.0231(3) Uani 1 1 d . . .
H3 H 0.603 0.2797 0.2884 0.035 Uiso 1 1 calc R . .
C31 C 0.65294(16) 0.32191(16) 0.45279(12) 0.0186(4) Uani 1 1 d . . .
O31 O 0.63800(13) 0.32657(12) 0.54440(8) 0.0236(3) Uani 1 1 d . . .
H31 H 0.6541 0.3794 0.5597 0.035 Uiso 1 1 calc R . .
O32 O 0.69827(13) 0.37478(13) 0.40324(9) 0.0305(3) Uani 1 1 d . . .
C4 C 0.62907(16) 0.13382(16) 0.48027(12) 0.0189(4) Uani 1 1 d . . .
H4A H 0.601 0.1507 0.5442 0.023 Uiso 1 1 calc R . .
H4B H 0.5857 0.0924 0.4573 0.023 Uiso 1 1 calc R . .
C5 C 0.76233(17) 0.05589(16) 0.48418(12) 0.0196(4) Uani 1 1 d . . .
O51 O 0.78517(12) -0.05544(12) 0.49451(11) 0.0327(3) Uani 1 1 d . . .
H51 H 0.8605 -0.0964 0.4988 0.049 Uiso 1 1 calc R . .
O52 O 0.84039(11) 0.09074(11) 0.48009(9) 0.0225(3) Uani 1 1 d . . .
O10 O 1.01038(15) -0.20470(14) 0.50447(13) 0.0463(4) Uani 1 1 d . . .
H10 H 1.0682 -0.196 0.526 0.17(2) Uiso 1 1 calc RD . .
C101 C 1.0572(2) -0.3017(2) 0.4516(2) 0.0585(8) Uani 1 1 d . . .
H10A H 1.1086 -0.3729 0.4928 0.07 Uiso 1 1 calc R . .
H10B H 1.1088 -0.2884 0.4013 0.07 Uiso 1 1 calc R . .
C102 C 0.9580(2) -0.3192(3) 0.4097(2) 0.0711(10) Uani 1 1 d . . .
H10C H 0.9062 -0.2484 0.3697 0.107 Uiso 1 1 calc R . .
H10D H 0.9095 -0.3365 0.4595 0.107 Uiso 1 1 calc R . .
H10E H 0.9931 -0.3843 0.3724 0.107 Uiso 1 1 calc R . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Ag1 0.01812(7) 0.01444(7) 0.01669(7) -0.00040(5) -0.00136(5) -0.00809(5)
P1 0.0152(2) 0.0129(2) 0.0164(2) -0.00167(17) 0.00000(18) -0.00701(19)
C111 0.0139(8) 0.0137(9) 0.0213(9) 0.0006(7) -0.0019(7) -0.0074(7)
C112 0.0307(11) 0.0241(11) 0.0229(10) -0.0022(8) 0.0019(8) -0.0158(9)
C113 0.0374(12) 0.0300(12) 0.0278(11) 0.0045(9) 0.0034(9) -0.0199(11)
C114 0.0249(10) 0.0141(10) 0.0460(13) 0.0042(9) 0.0007(9) -0.0104(9)
C115 0.0221(10) 0.0169(10) 0.0390(12) -0.0053(8) 0.0013(9) -0.0096(8)
C116 0.0212(9) 0.0164(10) 0.0240(10) -0.0038(7) 0.0001(8) -0.0084(8)
C121 0.0172(9) 0.0144(9) 0.0185(9) -0.0021(7) 0.0030(7) -0.0098(7)
C122 0.0187(9) 0.0198(10) 0.0228(10) -0.0020(7) -0.0015(8) -0.0070(8)
C123 0.0218(10) 0.0201(10) 0.0293(11) -0.0078(8) 0.0068(8) -0.0067(8)
C124 0.0331(11) 0.0207(10) 0.0193(9) -0.0037(7) 0.0068(8) -0.0152(9)
C125 0.0295(11) 0.0178(10) 0.0190(9) -0.0012(7) -0.0026(8) -0.0110(8)
C126 0.0180(9) 0.0163(9) 0.0209(9) -0.0024(7) -0.0013(7) -0.0067(8)
C131 0.0173(9) 0.0160(9) 0.0155(8) -0.0034(7) -0.0002(7) -0.0079(7)
C132 0.0204(9) 0.0194(10) 0.0254(10) -0.0074(7) 0.0034(8) -0.0100(8)
C133 0.0185(9) 0.0288(11) 0.0283(11) -0.0098(8) 0.0045(8) -0.0124(9)
C134 0.0172(9) 0.0237(11) 0.0283(11) -0.0068(8) 0.0019(8) -0.0042(8)
C135 0.0218(10) 0.0169(10) 0.0341(11) -0.0057(8) -0.0015(8) -0.0061(8)
C136 0.0186(9) 0.0184(10) 0.0296(10) -0.0025(8) -0.0027(8) -0.0112(8)
P2 0.0144(2) 0.0136(2) 0.0130(2) -0.00154(16) 0.00000(17) -0.00685(19)
C211 0.0166(9) 0.0208(10) 0.0114(8) -0.0031(7) 0.0020(7) -0.0092(8)
C212 0.0194(9) 0.0247(10) 0.0143(9) -0.0033(7) 0.0011(7) -0.0088(8)
C213 0.0168(9) 0.0435(14) 0.0192(10) -0.0024(9) -0.0007(8) -0.0113(9)
C214 0.0267(11) 0.0510(15) 0.0190(10) -0.0063(9) 0.0014(8) -0.0271(11)
C215 0.0416(13) 0.0350(12) 0.0198(10) -0.0054(8) 0.0010(9) -0.0283(11)
C216 0.0283(10) 0.0211(10) 0.0177(9) -0.0016(7) 0.0006(8) -0.0133(9)
C221 0.0159(8) 0.0118(8) 0.0139(8) -0.0012(6) -0.0003(7) -0.0046(7)
C222 0.0211(9) 0.0235(10) 0.0179(9) -0.0033(7) -0.0003(7) -0.0121(8)
C223 0.0280(11) 0.0272(11) 0.0247(10) -0.0041(8) 0.0069(8) -0.0166(9)
C224 0.0393(12) 0.0246(11) 0.0143(9) -0.0027(7) 0.0068(8) -0.0131(10)
C225 0.0369(12) 0.0269(11) 0.0149(9) -0.0045(8) -0.0010(8) -0.0163(10)
C226 0.0248(10) 0.0213(10) 0.0198(9) -0.0039(7) -0.0012(8) -0.0128(8)
C231 0.0154(8) 0.0152(9) 0.0190(9) -0.0032(7) -0.0001(7) -0.0083(7)
C232 0.0214(9) 0.0203(10) 0.0179(9) -0.0019(7) 0.0004(7) -0.0071(8)
C233 0.0254(10) 0.0234(11) 0.0269(11) -0.0074(8) 0.0085(8) -0.0101(9)
C234 0.0181(9) 0.0156(10) 0.0421(12) -0.0075(8) 0.0044(9) -0.0046(8)
C235 0.0211(10) 0.0142(10) 0.0343(11) 0.0006(8) -0.0097(8) -0.0045(8)
C236 0.0216(9) 0.0159(9) 0.0205(9) 0.0006(7) -0.0024(7) -0.0096(8)
C1 0.0196(9) 0.0199(10) 0.0202(9) 0.0007(7) -0.0054(7) -0.0101(8)
O11 0.0251(7) 0.0175(7) 0.0206(7) -0.0026(5) -0.0052(5) -0.0055(6)
O12 0.0247(7) 0.0269(8) 0.0242(7) 0.0069(6) 0.0007(6) -0.0055(6)
C2 0.0196(9) 0.0188(10) 0.0165(9) -0.0008(7) 0.0010(7) -0.0059(8)
C3 0.0196(9) 0.0170(9) 0.0120(8) -0.0029(7) 0.0009(7) -0.0053(8)
O3 0.0294(7) 0.0224(7) 0.0117(6) -0.0031(5) -0.0012(5) -0.0053(6)
C31 0.0168(9) 0.0184(10) 0.0159(9) -0.0014(7) -0.0008(7) -0.0032(8)
O31 0.0324(8) 0.0254(8) 0.0170(7) -0.0086(5) 0.0026(6) -0.0147(7)
O32 0.0411(9) 0.0404(9) 0.0206(7) 0.0001(6) -0.0001(6) -0.0285(8)
C4 0.0196(9) 0.0176(10) 0.0176(9) -0.0025(7) -0.0003(7) -0.0062(8)
C5 0.0238(10) 0.0167(10) 0.0154(9) -0.0020(7) -0.0005(7) -0.0059(8)
O51 0.0211(7) 0.0155(8) 0.0574(10) -0.0027(7) -0.0009(7) -0.0044(6)
O52 0.0207(7) 0.0215(7) 0.0232(7) -0.0034(5) 0.0013(5) -0.0072(6)
O10 0.0258(8) 0.0264(9) 0.0847(13) -0.0116(8) 0.0028(9) -0.0080(7)
C101 0.0349(14) 0.0465(18) 0.092(2) -0.0310(15) 0.0008(14) -0.0095(13)
C102 0.0376(16) 0.082(2) 0.100(2) -0.0507(19) -0.0038(16) -0.0206(16)

#----------------------------------------------------------------------------#
# MOLECULAR GEOMETRY #
#----------------------------------------------------------------------------#

_geom_special_details            
;
All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell s.u.'s are taken
into account individually in the estimation of s.u.'s in distances, angles
and torsion angles; correlations between s.u.'s in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell s.u.'s is used for estimating s.u.'s 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 P2 2.3904(5) . ?
Ag1 O12 2.4355(13) . ?
Ag1 P1 2.4417(5) . ?
Ag1 O11 2.4615(12) . ?
P1 C121 1.8169(18) . ?
P1 C111 1.8202(18) . ?
P1 C131 1.8226(18) . ?
C111 C116 1.383(2) . ?
C111 C112 1.397(2) . ?
C112 C113 1.390(3) . ?
C112 H112 0.95 . ?
C113 C114 1.379(3) . ?
C113 H113 0.95 . ?
C114 C115 1.374(3) . ?
C114 H114 0.95 . ?
C115 C116 1.391(3) . ?
C115 H115 0.95 . ?
C116 H116 0.95 . ?
C121 C126 1.397(2) . ?
C121 C122 1.402(2) . ?
C122 C123 1.382(3) . ?
C122 H122 0.95 . ?
C123 C124 1.384(3) . ?
C123 H123 0.95 . ?
C124 C125 1.381(3) . ?
C124 H124 0.95 . ?
C125 C126 1.387(2) . ?
C125 H125 0.95 . ?
C126 H126 0.95 . ?
C131 C136 1.391(2) . ?
C131 C132 1.396(2) . ?
C132 C133 1.380(3) . ?
C132 H132 0.95 . ?
C133 C134 1.380(3) . ?
C133 H133 0.95 . ?
C134 C135 1.377(3) . ?
C134 H134 0.95 . ?
C135 C136 1.387(3) . ?
C135 H135 0.95 . ?
C136 H136 0.95 . ?
P2 C211 1.8161(18) . ?
P2 C221 1.8173(17) . ?
P2 C231 1.8199(18) . ?
C211 C216 1.393(3) . ?
C211 C212 1.398(2) . ?
C212 C213 1.390(3) . ?
C212 H212 0.95 . ?
C213 C214 1.383(3) . ?
C213 H213 0.95 . ?
C214 C215 1.381(3) . ?
C214 H214 0.95 . ?
C215 C216 1.390(3) . ?
C215 H215 0.95 . ?
C216 H216 0.95 . ?
C221 C222 1.389(2) . ?
C221 C226 1.397(2) . ?
C222 C223 1.387(2) . ?
C222 H222 0.95 . ?
C223 C224 1.384(3) . ?
C223 H223 0.95 . ?
C224 C225 1.385(3) . ?
C224 H224 0.95 . ?
C225 C226 1.381(2) . ?
C225 H225 0.95 . ?
C226 H226 0.95 . ?
C231 C236 1.393(2) . ?
C231 C232 1.399(2) . ?
C232 C233 1.381(3) . ?
C232 H232 0.95 . ?
C233 C234 1.381(3) . ?
C233 H233 0.95 . ?
C234 C235 1.388(3) . ?
C234 H234 0.95 . ?
C235 C236 1.396(3) . ?
C235 H235 0.95 . ?
C236 H236 0.95 . ?
C1 O12 1.255(2) . ?
C1 O11 1.260(2) . ?
C1 C2 1.522(2) . ?
C2 C3 1.537(2) . ?
C2 H2A 0.99 . ?
C2 H2B 0.99 . ?
C3 O3 1.412(2) . ?
C3 C4 1.522(2) . ?
C3 C31 1.537(3) . ?
O3 H3 0.84 . ?
C31 O32 1.205(2) . ?
C31 O31 1.335(2) . ?
O31 H31 0.84 . ?
C4 C5 1.498(3) . ?
C4 H4A 0.99 . ?
C4 H4B 0.99 . ?
C5 O52 1.214(2) . ?
C5 O51 1.323(2) . ?
O51 H51 0.84 . ?
O10 C101 1.435(3) . ?
O10 H10 0.84 . ?
C101 C102 1.489(4) . ?
C101 H10A 0.99 . ?
C101 H10B 0.99 . ?
C102 H10C 0.98 . ?
C102 H10D 0.98 . ?
C102 H10E 0.98 . ?

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
P2 Ag1 O12 125.82(4) . . ?
P2 Ag1 P1 129.203(16) . . ?
O12 Ag1 P1 98.43(4) . . ?
P2 Ag1 O11 123.19(3) . . ?
O12 Ag1 O11 53.73(4) . . ?
P1 Ag1 O11 101.86(3) . . ?
C121 P1 C111 104.34(8) . . ?
C121 P1 C131 104.91(8) . . ?
C111 P1 C131 104.18(8) . . ?
C121 P1 Ag1 110.11(6) . . ?
C111 P1 Ag1 117.21(6) . . ?
C131 P1 Ag1 114.91(6) . . ?
C116 C111 C112 118.96(17) . . ?
C116 C111 P1 123.03(14) . . ?
C112 C111 P1 118.01(14) . . ?
C113 C112 C111 120.02(18) . . ?
C113 C112 H112 120 . . ?
C111 C112 H112 120 . . ?
C114 C113 C112 120.28(19) . . ?
C114 C113 H113 119.9 . . ?
C112 C113 H113 119.9 . . ?
C115 C114 C113 119.97(18) . . ?
C115 C114 H114 120 . . ?
C113 C114 H114 120 . . ?
C114 C115 C116 120.19(18) . . ?
C114 C115 H115 119.9 . . ?
C116 C115 H115 119.9 . . ?
C111 C116 C115 120.53(17) . . ?
C111 C116 H116 119.7 . . ?
C115 C116 H116 119.7 . . ?
C126 C121 C122 118.64(16) . . ?
C126 C121 P1 123.17(14) . . ?
C122 C121 P1 118.02(13) . . ?
C123 C122 C121 120.30(17) . . ?
C123 C122 H122 119.8 . . ?
C121 C122 H122 119.8 . . ?
C122 C123 C124 120.70(18) . . ?
C122 C123 H123 119.7 . . ?
C124 C123 H123 119.7 . . ?
C125 C124 C123 119.39(17) . . ?
C125 C124 H124 120.3 . . ?
C123 C124 H124 120.3 . . ?
C124 C125 C126 120.71(17) . . ?
C124 C125 H125 119.6 . . ?
C126 C125 H125 119.6 . . ?
C125 C126 C121 120.24(17) . . ?
C125 C126 H126 119.9 . . ?
C121 C126 H126 119.9 . . ?
C136 C131 C132 118.61(17) . . ?
C136 C131 P1 118.54(13) . . ?
C132 C131 P1 122.85(14) . . ?
C133 C132 C131 120.59(17) . . ?
C133 C132 H132 119.7 . . ?
C131 C132 H132 119.7 . . ?
C134 C133 C132 120.14(18) . . ?
C134 C133 H133 119.9 . . ?
C132 C133 H133 119.9 . . ?
C135 C134 C133 120.10(18) . . ?
C135 C134 H134 120 . . ?
C133 C134 H134 120 . . ?
C134 C135 C136 120.09(18) . . ?
C134 C135 H135 120 . . ?
C136 C135 H135 120 . . ?
C135 C136 C131 120.45(17) . . ?
C135 C136 H136 119.8 . . ?
C131 C136 H136 119.8 . . ?
C211 P2 C221 105.09(8) . . ?
C211 P2 C231 104.94(8) . . ?
C221 P2 C231 106.32(8) . . ?
C211 P2 Ag1 121.85(6) . . ?
C221 P2 Ag1 111.67(6) . . ?
C231 P2 Ag1 105.86(6) . . ?
C216 C211 C212 119.07(17) . . ?
C216 C211 P2 122.49(14) . . ?
C212 C211 P2 118.41(14) . . ?
C213 C212 C211 119.86(18) . . ?
C213 C212 H212 120.1 . . ?
C211 C212 H212 120.1 . . ?
C214 C213 C212 120.43(19) . . ?
C214 C213 H213 119.8 . . ?
C212 C213 H213 119.8 . . ?
C215 C214 C213 120.16(18) . . ?
C215 C214 H214 119.9 . . ?
C213 C214 H214 119.9 . . ?
C214 C215 C216 119.80(19) . . ?
C214 C215 H215 120.1 . . ?
C216 C215 H215 120.1 . . ?
C215 C216 C211 120.66(18) . . ?
C215 C216 H216 119.7 . . ?
C211 C216 H216 119.7 . . ?
C222 C221 C226 118.39(16) . . ?
C222 C221 P2 123.27(13) . . ?
C226 C221 P2 118.20(13) . . ?
C223 C222 C221 120.64(17) . . ?
C223 C222 H222 119.7 . . ?
C221 C222 H222 119.7 . . ?
C224 C223 C222 120.41(18) . . ?
C224 C223 H223 119.8 . . ?
C222 C223 H223 119.8 . . ?
C223 C224 C225 119.40(17) . . ?
C223 C224 H224 120.3 . . ?
C225 C224 H224 120.3 . . ?
C226 C225 C224 120.28(18) . . ?
C226 C225 H225 119.9 . . ?
C224 C225 H225 119.9 . . ?
C225 C226 C221 120.86(17) . . ?
C225 C226 H226 119.6 . . ?
C221 C226 H226 119.6 . . ?
C236 C231 C232 119.08(17) . . ?
C236 C231 P2 123.90(14) . . ?
C232 C231 P2 116.52(13) . . ?
C233 C232 C231 120.99(17) . . ?
C233 C232 H232 119.5 . . ?
C231 C232 H232 119.5 . . ?
C232 C233 C234 119.87(18) . . ?
C232 C233 H233 120.1 . . ?
C234 C233 H233 120.1 . . ?
C233 C234 C235 119.93(18) . . ?
C233 C234 H234 120 . . ?
C235 C234 H234 120 . . ?
C234 C235 C236 120.58(17) . . ?
C234 C235 H235 119.7 . . ?
C236 C235 H235 119.7 . . ?
C231 C236 C235 119.55(17) . . ?
C231 C236 H236 120.2 . . ?
C235 C236 H236 120.2 . . ?
O12 C1 O11 123.23(16) . . ?
O12 C1 C2 118.72(17) . . ?
O11 C1 C2 118.01(16) . . ?
C1 O11 Ag1 90.68(10) . . ?
C1 O12 Ag1 92.00(11) . . ?
C1 C2 C3 113.97(15) . . ?
C1 C2 H2A 108.8 . . ?
C3 C2 H2A 108.8 . . ?
C1 C2 H2B 108.8 . . ?
C3 C2 H2B 108.8 . . ?
H2A C2 H2B 107.7 . . ?
O3 C3 C4 107.16(14) . . ?
O3 C3 C2 111.40(14) . . ?
C4 C3 C2 109.22(14) . . ?
O3 C3 C31 110.43(14) . . ?
C4 C3 C31 112.16(14) . . ?
C2 C3 C31 106.52(14) . . ?
C3 O3 H3 109.5 . . ?
O32 C31 O31 124.20(17) . . ?
O32 C31 C3 124.49(16) . . ?
O31 C31 C3 111.15(15) . . ?
C31 O31 H31 109.5 . . ?
C5 C4 C3 113.39(15) . . ?
C5 C4 H4A 108.9 . . ?
C3 C4 H4A 108.9 . . ?
C5 C4 H4B 108.9 . . ?
C3 C4 H4B 108.9 . . ?
H4A C4 H4B 107.7 . . ?
O52 C5 O51 123.89(17) . . ?
O52 C5 C4 123.93(17) . . ?
O51 C5 C4 112.17(16) . . ?
C5 O51 H51 109.5 . . ?
C101 O10 H10 109.5 . . ?
O10 C101 C102 111.6(2) . . ?
O10 C101 H10A 109.3 . . ?
C102 C101 H10A 109.3 . . ?
O10 C101 H10B 109.3 . . ?
C102 C101 H10B 109.3 . . ?
H10A C101 H10B 108 . . ?
C101 C102 H10C 109.5 . . ?
C101 C102 H10D 109.5 . . ?
H10C C102 H10D 109.5 . . ?
C101 C102 H10E 109.5 . . ?
H10C C102 H10E 109.5 . . ?
H10D C102 H10E 109.5 . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O3 H3 O12 0.84 1.95 2.6604(18) 141.8 .
O31 H31 O11 0.84 1.82 2.6378(18) 163 2_666
O51 H51 O10 0.84 1.76 2.584(2) 168.5 .
O10 H10 O52 0.84 2.09 2.821(2) 145.6 2_756
#===END