# Supplementary Material (ESI) for Chemical Communications
# This journal is (c) The Royal Society of Chemistry 2008

data_global
_journal_name_full               Chem.Commun.

_journal_coden_Cambridge         0182

_publ_contact_author_name        'Alexander Steiner'
_publ_contact_author_address     
;
Department of Chemistry
University of Liverpool
Crown Street
Liverpool
L69 7ZD
UNITED KINGDOM
;

_publ_contact_author_email       A.STEINER@LIV.AC.UK

_publ_section_title              
;
In-situ re-crystallisation of a coordination polymer
with hemilabile linkers
;
loop_
_publ_author_name
'Alexander Steiner'
'Jamie F. Bickley'
'Ramamoorthy Boomishankar'

# Attachment 'data.cif'

data_2
_database_code_depnum_ccdc_archive 'CCDC 670148'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C18 H44 Ag3 Cl3 N9 O16 P3'
_chemical_formula_weight         1165.49

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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   C2/c

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

_cell_length_a                   22.012(3)
_cell_length_b                   15.727(2)
_cell_length_c                   11.7810(18)
_cell_angle_alpha                90.00
_cell_angle_beta                 101.206(3)
_cell_angle_gamma                90.00
_cell_volume                     4000.6(11)
_cell_formula_units_Z            4
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       needle
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.935
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2320
_exptl_absorpt_coefficient_mu    1.847
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_correction_T_min  0.541
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   ?

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker Smart Apex'
_diffrn_measurement_method       omega
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            9793
_diffrn_reflns_av_R_equivalents  0.0556
_diffrn_reflns_av_sigmaI/netI    0.0664
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_theta_min         4.27
_diffrn_reflns_theta_max         25.02
_reflns_number_total             3502
_reflns_number_gt                2877
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_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^ > 2sigma(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^)+(0.0609P)^2^+5.8570P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         3502
_refine_ls_number_parameters     240
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0555
_refine_ls_R_factor_gt           0.0432
_refine_ls_wR_factor_ref         0.1181
_refine_ls_wR_factor_gt          0.1108
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_restrained_S_all      1.043
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.853462(19) 0.67711(3) 0.30529(4) 0.03338(17) Uani 1 1 d . . .
Ag2 Ag 1.0000 1.03916(3) 0.2500 0.02132(17) Uani 1 2 d S . .
P1 P 1.0000 0.68977(11) 0.2500 0.0179(4) Uani 1 2 d S . .
P2 P 0.95667(6) 0.84507(8) 0.32320(10) 0.0164(3) Uani 1 1 d . . .
N1 N 0.94586(18) 0.7476(2) 0.2848(3) 0.0194(9) Uani 1 1 d . . .
N2 N 1.0000 0.8961(3) 0.2500 0.0186(12) Uani 1 2 d S . .
N10 N 0.96422(19) 0.6248(3) 0.1520(4) 0.0272(10) Uani 1 1 d . . .
H10 H 0.9811 0.5745 0.1468 0.06(2) Uiso 1 1 calc R . .
C11 C 0.9065(3) 0.6433(4) 0.0722(5) 0.0323(13) Uani 1 1 d . . .
H11A H 0.9088 0.6197 -0.0048 0.039 Uiso 1 1 calc R . .
H11B H 0.9018 0.7057 0.0639 0.039 Uiso 1 1 calc R . .
C12 C 0.8509(3) 0.6077(4) 0.1100(5) 0.0378(14) Uani 1 1 d . . .
H12 H 0.8116 0.6289 0.0728 0.045 Uiso 1 1 calc R . .
C13 C 0.8515(3) 0.5490(4) 0.1914(6) 0.0415(15) Uani 1 1 d . . .
H13A H 0.8897 0.5261 0.2309 0.050 Uiso 1 1 calc R . .
H13B H 0.8137 0.5299 0.2101 0.050 Uiso 1 1 calc R . .
N20 N 0.88782(17) 0.8857(3) 0.3119(3) 0.0191(9) Uani 1 1 d . . .
H20 H 0.8813 0.9211 0.3661 0.06(2) Uiso 1 1 calc R . .
C21 C 0.8366(2) 0.8671(3) 0.2176(4) 0.0296(12) Uani 1 1 d . . .
H21A H 0.8530 0.8422 0.1525 0.035 Uiso 1 1 calc R . .
H21B H 0.8152 0.9208 0.1902 0.035 Uiso 1 1 calc R . .
C22 C 0.7900(3) 0.8059(4) 0.2522(6) 0.0373(14) Uani 1 1 d . . .
H22 H 0.7614 0.7798 0.1915 0.045 Uiso 1 1 calc R . .
C23 C 0.7856(3) 0.7861(4) 0.3580(6) 0.0463(17) Uani 1 1 d . . .
H23A H 0.8132 0.8108 0.4215 0.056 Uiso 1 1 calc R . .
H23B H 0.7549 0.7471 0.3714 0.056 Uiso 1 1 calc R . .
N30 N 0.98838(19) 0.8604(3) 0.4592(3) 0.0200(9) Uani 1 1 d . . .
H30 H 1.0173 0.8994 0.4771 0.12(4) Uiso 1 1 calc R . .
C31 C 0.9698(2) 0.8108(3) 0.5515(4) 0.0211(11) Uani 1 1 d . . .
H31A H 1.0075 0.7879 0.6021 0.025 Uiso 1 1 calc R . .
H31B H 0.9447 0.7618 0.5164 0.025 Uiso 1 1 calc R . .
C32 C 0.9335(2) 0.8590(3) 0.6243(4) 0.0223(11) Uani 1 1 d . . .
H32 H 0.9237 0.8309 0.6898 0.027 Uiso 1 1 calc R . .
C33 C 0.9137(2) 0.9388(3) 0.6043(4) 0.0251(11) Uani 1 1 d . . .
H33A H 0.9226 0.9690 0.5396 0.030 Uiso 1 1 calc R . .
H33B H 0.8907 0.9655 0.6548 0.030 Uiso 1 1 calc R . .
O1 O 0.8754(3) 0.6034(5) 0.4786(5) 0.106(3) Uani 1 1 d . . .
O2 O 0.7617(3) 0.5349(4) 0.4407(5) 0.0788(18) Uani 1 1 d . . .
Cl1 Cl 0.66942(5) 0.60740(8) 0.13262(10) 0.0241(3) Uani 1 1 d . . .
O11 O 0.6867(2) 0.6701(3) 0.0596(4) 0.0511(12) Uani 1 1 d . . .
O12 O 0.6939(2) 0.5264(3) 0.1085(4) 0.0493(12) Uani 1 1 d . . .
O13 O 0.60318(16) 0.5977(3) 0.1151(3) 0.0431(11) Uani 1 1 d . . .
O14 O 0.69274(18) 0.6286(3) 0.2504(3) 0.0392(10) Uani 1 1 d . . .
Cl2 Cl 1.0000 0.61328(12) 0.7500 0.0427(5) Uani 1 2 d S . .
O21 O 0.9993(3) 0.5611(3) 0.6514(4) 0.0738(18) Uani 1 1 d . . .
O22 O 0.9464(2) 0.6665(3) 0.7332(6) 0.0751(18) Uani 1 1 d . . .

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 0.0295(3) 0.0301(3) 0.0415(3) -0.00170(18) 0.00925(19) -0.00920(18)
Ag2 0.0285(3) 0.0145(3) 0.0207(3) 0.000 0.0041(2) 0.000
P1 0.0189(9) 0.0127(8) 0.0215(8) 0.000 0.0021(7) 0.000
P2 0.0172(6) 0.0141(6) 0.0180(6) -0.0008(5) 0.0034(5) -0.0001(5)
N1 0.017(2) 0.015(2) 0.025(2) -0.0025(16) 0.0028(16) -0.0038(17)
N2 0.025(3) 0.014(3) 0.018(3) 0.000 0.008(2) 0.000
N10 0.023(2) 0.020(2) 0.038(2) -0.0086(19) 0.0044(19) -0.0006(18)
C11 0.037(3) 0.029(3) 0.028(3) -0.009(2) -0.002(2) -0.001(2)
C12 0.023(3) 0.036(3) 0.051(4) -0.020(3) -0.002(3) 0.001(3)
C13 0.024(3) 0.036(3) 0.065(4) -0.015(3) 0.010(3) -0.003(3)
N20 0.015(2) 0.022(2) 0.0209(19) -0.0049(17) 0.0029(15) 0.0008(17)
C21 0.026(3) 0.031(3) 0.028(3) -0.005(2) -0.002(2) 0.005(2)
C22 0.023(3) 0.034(3) 0.051(4) -0.020(3) -0.002(3) 0.001(2)
C23 0.030(3) 0.045(4) 0.070(5) -0.018(3) 0.025(3) -0.016(3)
N30 0.021(2) 0.017(2) 0.021(2) 0.0002(16) 0.0019(17) -0.0049(17)
C31 0.027(3) 0.014(2) 0.022(2) 0.0007(19) 0.003(2) 0.001(2)
C32 0.022(3) 0.024(3) 0.019(2) 0.001(2) 0.002(2) -0.006(2)
C33 0.030(3) 0.027(3) 0.018(2) -0.005(2) 0.002(2) -0.003(2)
O1 0.086(4) 0.151(6) 0.064(3) 0.058(4) -0.028(3) -0.073(4)
O2 0.051(3) 0.104(5) 0.075(4) 0.032(3) -0.003(3) -0.008(3)
Cl1 0.0194(6) 0.0275(7) 0.0238(6) -0.0007(5) 0.0004(5) -0.0028(5)
O11 0.070(3) 0.046(3) 0.035(2) 0.009(2) 0.004(2) -0.018(2)
O12 0.036(2) 0.036(2) 0.079(3) -0.016(2) 0.017(2) 0.0018(19)
O13 0.0150(19) 0.073(3) 0.039(2) -0.010(2) -0.0012(16) 0.003(2)
O14 0.037(2) 0.055(3) 0.0220(18) -0.0008(18) -0.0040(16) -0.014(2)
Cl2 0.0548(14) 0.0189(9) 0.0462(11) 0.000 -0.0108(10) 0.000
O21 0.141(6) 0.034(3) 0.045(3) -0.007(2) 0.014(3) -0.035(3)
O22 0.043(3) 0.058(3) 0.118(5) 0.042(3) 0.000(3) 0.013(3)

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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 O1 2.315(5) . ?
Ag1 N1 2.370(4) . ?
Ag1 C13 2.416(6) . ?
Ag1 C23 2.432(6) . ?
Ag1 C22 2.472(6) . ?
Ag1 C12 2.537(6) . ?
Ag2 N2 2.250(5) . ?
Ag2 C33 2.325(5) 5_776 ?
Ag2 C33 2.325(5) 6_575 ?
Ag2 C32 2.461(5) 5_776 ?
Ag2 C32 2.461(5) 6_575 ?
P1 N1 1.614(4) 2_755 ?
P1 N1 1.614(4) . ?
P1 N10 1.627(4) . ?
P1 N10 1.627(4) 2_755 ?
P2 N1 1.603(4) . ?
P2 N2 1.618(3) . ?
P2 N20 1.627(4) . ?
P2 N30 1.636(4) . ?
N2 P2 1.618(3) 2_755 ?
N10 C11 1.455(7) . ?
C11 C12 1.491(8) . ?
C12 C13 1.330(9) . ?
N20 C21 1.451(6) . ?
C21 C22 1.518(8) . ?
C22 C23 1.306(9) . ?
N30 C31 1.459(6) . ?
C31 C32 1.488(7) . ?
C32 C33 1.335(7) . ?
C32 Ag2 2.461(5) 5_776 ?
C33 Ag2 2.325(5) 5_776 ?
O1 O2 2.682(8) . ?
O1 O21 3.143(8) . ?
O2 O14 2.860(6) . ?
O2 O12 2.865(7) 6_566 ?
Cl1 O11 1.408(4) . ?
Cl1 O14 1.422(4) . ?
Cl1 O12 1.432(4) . ?
Cl1 O13 1.440(4) . ?
Cl2 O21 1.419(5) . ?
Cl2 O21 1.419(5) 2_756 ?
Cl2 O22 1.429(5) 2_756 ?
Cl2 O22 1.429(5) . ?

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
O1 Ag1 N1 106.76(16) . . ?
O1 Ag1 C13 92.9(3) . . ?
N1 Ag1 C13 104.88(18) . . ?
O1 Ag1 C23 99.2(3) . . ?
N1 Ag1 C23 106.13(18) . . ?
C13 Ag1 C23 141.6(2) . . ?
O1 Ag1 C22 130.1(3) . . ?
N1 Ag1 C22 92.57(17) . . ?
C13 Ag1 C22 126.5(2) . . ?
C23 Ag1 C22 30.9(2) . . ?
O1 Ag1 C12 123.3(3) . . ?
N1 Ag1 C12 88.68(17) . . ?
C13 Ag1 C12 31.0(2) . . ?
C23 Ag1 C12 128.9(2) . . ?
C22 Ag1 C12 102.2(2) . . ?
N2 Ag2 C33 98.57(13) . 5_776 ?
N2 Ag2 C33 98.57(13) . 6_575 ?
C33 Ag2 C33 162.9(3) 5_776 6_575 ?
N2 Ag2 C32 130.61(12) . 5_776 ?
C33 Ag2 C32 32.23(17) 5_776 5_776 ?
C33 Ag2 C32 130.69(17) 6_575 5_776 ?
N2 Ag2 C32 130.61(12) . 6_575 ?
C33 Ag2 C32 130.69(17) 5_776 6_575 ?
C33 Ag2 C32 32.23(17) 6_575 6_575 ?
C32 Ag2 C32 98.8(2) 5_776 6_575 ?
N1 P1 N1 111.4(3) 2_755 . ?
N1 P1 N10 117.0(2) 2_755 . ?
N1 P1 N10 104.8(2) . . ?
N1 P1 N10 104.8(2) 2_755 2_755 ?
N1 P1 N10 117.0(2) . 2_755 ?
N10 P1 N10 102.1(3) . 2_755 ?
N1 P2 N2 113.2(2) . . ?
N1 P2 N20 105.6(2) . . ?
N2 P2 N20 113.4(2) . . ?
N1 P2 N30 115.4(2) . . ?
N2 P2 N30 105.41(17) . . ?
N20 P2 N30 103.6(2) . . ?
P2 N1 P1 122.3(2) . . ?
P2 N1 Ag1 120.1(2) . . ?
P1 N1 Ag1 116.9(2) . . ?
P2 N2 P2 120.5(3) . 2_755 ?
P2 N2 Ag2 119.74(17) . . ?
P2 N2 Ag2 119.74(17) 2_755 . ?
C11 N10 P1 125.0(4) . . ?
N10 C11 C12 113.3(5) . . ?
C13 C12 C11 125.6(5) . . ?
C13 C12 Ag1 69.5(3) . . ?
C11 C12 Ag1 103.6(3) . . ?
C12 C13 Ag1 79.5(3) . . ?
C21 N20 P2 123.8(3) . . ?
N20 C21 C22 112.8(4) . . ?
C23 C22 C21 125.9(5) . . ?
C23 C22 Ag1 72.9(4) . . ?
C21 C22 Ag1 102.0(3) . . ?
C22 C23 Ag1 76.2(4) . . ?
C31 N30 P2 121.5(3) . . ?
N30 C31 C32 114.6(4) . . ?
C33 C32 C31 124.8(5) . . ?
C33 C32 Ag2 68.3(3) . 5_776 ?
C31 C32 Ag2 110.8(3) . 5_776 ?
C32 C33 Ag2 79.5(3) . 5_776 ?
Ag1 O1 O2 91.5(2) . . ?
Ag1 O1 O21 133.1(2) . . ?
O2 O1 O21 133.4(3) . . ?
O1 O2 O14 105.0(2) . . ?
O1 O2 O12 128.0(3) . 6_566 ?
O14 O2 O12 116.5(2) . 6_566 ?
O11 Cl1 O14 110.0(3) . . ?
O11 Cl1 O12 110.2(3) . . ?
O14 Cl1 O12 108.9(3) . . ?
O11 Cl1 O13 111.9(3) . . ?
O14 Cl1 O13 109.2(2) . . ?
O12 Cl1 O13 106.6(3) . . ?
Cl1 O14 O2 132.8(3) . . ?
O21 Cl2 O21 109.4(4) . 2_756 ?
O21 Cl2 O22 109.2(3) . 2_756 ?
O21 Cl2 O22 110.4(4) 2_756 2_756 ?
O21 Cl2 O22 110.4(4) . . ?
O21 Cl2 O22 109.2(3) 2_756 . ?
O22 Cl2 O22 108.3(5) 2_756 . ?
Cl2 O21 O1 106.1(4) . . ?

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
N10 H10 O21 0.88 2.17 3.025(6) 163.7 6_565
N20 H20 O12 0.88 2.40 3.108(6) 137.8 4_655
N30 H30 O13 0.88 2.24 2.897(5) 131.1 8_566

_diffrn_measured_fraction_theta_max 0.992
_diffrn_reflns_theta_full        25.02
_diffrn_measured_fraction_theta_full 0.992
_refine_diff_density_max         1.821
_refine_diff_density_min         -1.235
_refine_diff_density_rms         0.138

#===END

data_3
_database_code_depnum_ccdc_archive 'CCDC 670149'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C18 H36 Ag3 Cl3 N9 O12 P3'
_chemical_formula_weight         1093.43

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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_H-M   Fdd2

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z'
'x+1/4, -y+1/4, z+1/4'
'-x+1/4, y+1/4, z+1/4'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'x+1/4, -y+3/4, z+3/4'
'-x+1/4, y+3/4, z+3/4'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'x+3/4, -y+1/4, z+3/4'
'-x+3/4, y+1/4, z+3/4'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'x+3/4, -y+3/4, z+1/4'
'-x+3/4, y+3/4, z+1/4'

_cell_length_a                   26.306(5)
_cell_length_b                   49.555(9)
_cell_length_c                   10.7101(19)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     13962(4)
_cell_formula_units_Z            16
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       prism
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.2
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.081
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             8640
_exptl_absorpt_coefficient_mu    2.102
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_correction_T_min  0.857
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   ?

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker Smart Apex'
_diffrn_measurement_method       omega
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            17949
_diffrn_reflns_av_R_equivalents  0.0520
_diffrn_reflns_av_sigmaI/netI    0.0509
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_k_min       -58
_diffrn_reflns_limit_k_max       49
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_theta_min         4.11
_diffrn_reflns_theta_max         25.02
_reflns_number_total             6082
_reflns_number_gt                5600
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_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^ > 2sigma(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^)+(0.0537P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.01(3)
_refine_ls_number_reflns         6082
_refine_ls_number_parameters     439
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0393
_refine_ls_R_factor_gt           0.0362
_refine_ls_wR_factor_ref         0.0873
_refine_ls_wR_factor_gt          0.0861
_refine_ls_goodness_of_fit_ref   0.998
_refine_ls_restrained_S_all      0.998
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.28576(2) 0.172408(10) 1.01789(5) 0.03285(14) Uani 1 1 d . . .
Ag2 Ag 0.396029(18) 0.257213(9) 0.60510(5) 0.02640(13) Uani 1 1 d . . .
Ag3 Ag 0.519003(18) 0.156209(9) 0.81402(5) 0.02575(13) Uani 1 1 d . . .
P1 P 0.34624(6) 0.21591(3) 0.81282(15) 0.0181(3) Uani 1 1 d . . .
N1 N 0.34885(18) 0.18606(9) 0.8723(5) 0.0188(11) Uani 1 1 d . . .
P2 P 0.39384(6) 0.16579(3) 0.83328(14) 0.0162(3) Uani 1 1 d . . .
N2 N 0.40042(18) 0.22522(9) 0.7513(5) 0.0180(11) Uani 1 1 d . . .
P3 P 0.45472(6) 0.21117(3) 0.78059(15) 0.0158(3) Uani 1 1 d . . .
N3 N 0.44835(18) 0.18083(9) 0.8324(5) 0.0193(11) Uani 1 1 d . . .
N10 N 0.3238(2) 0.23531(11) 0.9236(5) 0.0256(12) Uani 1 1 d . . .
H10 H 0.3026 0.2484 0.9040 0.07(3) Uiso 1 1 calc R . .
C11 C 0.3381(3) 0.23154(13) 1.0534(6) 0.0301(15) Uani 1 1 d . . .
H11A H 0.3446 0.2495 1.0909 0.036 Uiso 1 1 calc R . .
H11B H 0.3702 0.2212 1.0564 0.036 Uiso 1 1 calc R . .
C12 C 0.2992(3) 0.21717(14) 1.1315(6) 0.0311(16) Uani 1 1 d . . .
H12 H 0.3104 0.2095 1.2079 0.037 Uiso 1 1 calc R . .
C13 C 0.2517(3) 0.21448(14) 1.1030(7) 0.0344(17) Uani 1 1 d . . .
H13A H 0.2390 0.2219 1.0273 0.041 Uiso 1 1 calc R . .
H13B H 0.2294 0.2051 1.1576 0.041 Uiso 1 1 calc R . .
N20 N 0.3929(2) 0.14095(10) 0.9320(5) 0.0224(12) Uani 1 1 d . . .
H20 H 0.3918 0.1243 0.9038 0.07(3) Uiso 1 1 calc R . .
C21 C 0.3939(3) 0.14569(13) 1.0681(6) 0.0289(15) Uani 1 1 d . . .
H21A H 0.4054 0.1644 1.0843 0.035 Uiso 1 1 calc R . .
H21B H 0.4189 0.1333 1.1069 0.035 Uiso 1 1 calc R . .
C22 C 0.3427(3) 0.14146(14) 1.1284(7) 0.0357(17) Uani 1 1 d . . .
H22 H 0.3377 0.1501 1.2066 0.043 Uiso 1 1 calc R . .
C23 C 0.3046(3) 0.12752(14) 1.0869(8) 0.047(2) Uani 1 1 d . . .
H23A H 0.3072 0.1184 1.0092 0.056 Uiso 1 1 calc R . .
H23B H 0.2741 0.1264 1.1341 0.056 Uiso 1 1 calc R . .
N30 N 0.49251(19) 0.22579(10) 0.8811(5) 0.0229(12) Uani 1 1 d . . .
H30 H 0.5154 0.2372 0.8530 0.06(3) Uiso 1 1 calc R . .
C31 C 0.4902(2) 0.22079(13) 1.0145(6) 0.0233(14) Uani 1 1 d . . .
H31A H 0.4622 0.2079 1.0313 0.028 Uiso 1 1 calc R . .
H31B H 0.4818 0.2379 1.0574 0.028 Uiso 1 1 calc R . .
C32 C 0.5389(2) 0.20958(12) 1.0704(7) 0.0274(15) Uani 1 1 d . . .
H32 H 0.5394 0.2068 1.1581 0.033 Uiso 1 1 calc R . .
C33 C 0.5807(3) 0.20339(12) 1.0071(7) 0.0281(15) Uani 1 1 d . . .
H33A H 0.5818 0.2059 0.9192 0.034 Uiso 1 1 calc R . .
H33B H 0.6095 0.1965 1.0498 0.034 Uiso 1 1 calc R . .
N40 N 0.3040(2) 0.22064(11) 0.7026(5) 0.0235(12) Uani 1 1 d . . .
H40 H 0.2754 0.2290 0.7199 0.08(3) Uiso 1 1 calc R . .
C41 C 0.3136(3) 0.21104(13) 0.5753(6) 0.0281(15) Uani 1 1 d . . .
H41A H 0.2837 0.2007 0.5466 0.034 Uiso 1 1 calc R . .
H41B H 0.3430 0.1986 0.5770 0.034 Uiso 1 1 calc R . .
C42 C 0.3243(3) 0.23327(14) 0.4821(6) 0.0293(15) Uani 1 1 d . . .
H42 H 0.3412 0.2285 0.4068 0.035 Uiso 1 1 calc R . .
C43 C 0.3116(3) 0.25963(16) 0.4988(8) 0.0394(19) Uani 1 1 d . . .
H43A H 0.2947 0.2651 0.5730 0.047 Uiso 1 1 calc R . .
H43B H 0.3195 0.2725 0.4362 0.047 Uiso 1 1 calc R . .
N50 N 0.3851(2) 0.15383(10) 0.6937(5) 0.0210(11) Uani 1 1 d . . .
H50 H 0.4113 0.1534 0.6430 0.04(2) Uiso 1 1 calc R . .
C51 C 0.3359(2) 0.14371(13) 0.6464(6) 0.0256(14) Uani 1 1 d . . .
H51A H 0.3381 0.1413 0.5548 0.031 Uiso 1 1 calc R . .
H51B H 0.3091 0.1572 0.6638 0.031 Uiso 1 1 calc R . .
C52 C 0.3219(3) 0.11747(12) 0.7058(6) 0.0259(15) Uani 1 1 d . . .
H52 H 0.3457 0.1031 0.7016 0.031 Uiso 1 1 calc R . .
C53 C 0.2785(3) 0.11316(13) 0.7634(7) 0.0299(15) Uani 1 1 d . . .
H53A H 0.2540 0.1272 0.7691 0.036 Uiso 1 1 calc R . .
H53B H 0.2717 0.0960 0.7994 0.036 Uiso 1 1 calc R . .
N60 N 0.4858(2) 0.21506(10) 0.6489(5) 0.0209(12) Uani 1 1 d . . .
H60 H 0.4705 0.2233 0.5866 0.19(7) Uiso 1 1 calc R . .
C61 C 0.5382(2) 0.20527(13) 0.6307(6) 0.0242(14) Uani 1 1 d . . .
H61A H 0.5590 0.2112 0.7026 0.029 Uiso 1 1 calc R . .
H61B H 0.5523 0.2139 0.5549 0.029 Uiso 1 1 calc R . .
C62 C 0.5434(3) 0.17507(13) 0.6173(7) 0.0283(15) Uani 1 1 d . . .
H62 H 0.5165 0.1656 0.5774 0.034 Uiso 1 1 calc R . .
C63 C 0.5827(3) 0.16091(15) 0.6572(7) 0.0370(18) Uani 1 1 d . . .
H63A H 0.6103 0.1697 0.6975 0.044 Uiso 1 1 calc R . .
H63B H 0.5835 0.1419 0.6456 0.044 Uiso 1 1 calc R . .
Cl1 Cl 0.17174(7) 0.18686(4) 0.8362(2) 0.0418(5) Uani 1 1 d . . .
O11 O 0.2135(3) 0.16883(13) 0.8702(9) 0.084(3) Uani 1 1 d . . .
O12 O 0.1476(2) 0.19327(15) 0.9466(7) 0.071(2) Uani 1 1 d . . .
O13 O 0.1400(3) 0.17303(12) 0.7499(7) 0.0642(18) Uani 1 1 d . . .
O14 O 0.1938(2) 0.21057(11) 0.7826(6) 0.0618(18) Uani 1 1 d . . .
Cl2 Cl 0.44299(7) 0.19516(5) 0.33629(18) 0.0467(5) Uani 1 1 d . . .
O21 O 0.4222(2) 0.18473(17) 0.4487(5) 0.069(2) Uani 1 1 d . . .
O22 O 0.4767(4) 0.21540(14) 0.3620(7) 0.102(3) Uani 1 1 d . . .
O23 O 0.4060(3) 0.20151(17) 0.2510(6) 0.082(2) Uani 1 1 d . . .
O24 O 0.4737(3) 0.17459(14) 0.2768(7) 0.076(2) Uani 1 1 d . . .
Cl3 Cl 0.47134(6) 0.09609(3) 0.63986(15) 0.0278(4) Uani 1 1 d . . .
O31 O 0.5197(2) 0.08545(14) 0.6093(6) 0.0606(17) Uani 1 1 d . . .
O32 O 0.4580(3) 0.11762(12) 0.5520(6) 0.0615(17) Uani 1 1 d . . .
O33 O 0.4342(3) 0.07638(12) 0.6287(7) 0.0669(19) Uani 1 1 d . . .
O34 O 0.4714(2) 0.10701(13) 0.7636(6) 0.0567(16) Uani 1 1 d . . .

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 0.0314(3) 0.0309(3) 0.0363(3) 0.0016(2) 0.0106(2) -0.0030(2)
Ag2 0.0217(2) 0.0236(2) 0.0340(3) 0.0130(2) 0.0014(2) -0.0003(2)
Ag3 0.0218(2) 0.0205(2) 0.0350(3) 0.0062(2) -0.0015(2) 0.0054(2)
P1 0.0178(7) 0.0170(7) 0.0194(8) 0.0019(6) 0.0005(6) 0.0010(6)
N1 0.020(3) 0.017(2) 0.020(3) 0.006(2) 0.001(2) -0.007(2)
P2 0.0181(7) 0.0135(7) 0.0171(8) 0.0008(6) 0.0003(6) -0.0025(6)
N2 0.021(3) 0.016(2) 0.017(3) 0.007(2) -0.001(2) 0.001(2)
P3 0.0166(7) 0.0123(7) 0.0186(8) 0.0004(6) -0.0020(6) -0.0027(6)
N3 0.021(3) 0.013(2) 0.023(3) 0.001(2) -0.002(2) 0.002(2)
N10 0.031(3) 0.022(3) 0.024(3) 0.000(2) 0.002(2) 0.010(2)
C11 0.039(4) 0.024(3) 0.028(4) -0.002(3) -0.005(3) 0.004(3)
C12 0.040(4) 0.034(4) 0.019(4) -0.005(3) -0.001(3) 0.008(3)
C13 0.045(4) 0.028(4) 0.030(4) -0.001(3) 0.009(3) 0.006(3)
N20 0.032(3) 0.010(3) 0.025(3) 0.003(2) -0.002(2) -0.007(2)
C21 0.049(4) 0.017(3) 0.021(4) 0.005(3) -0.001(3) 0.002(3)
C22 0.059(5) 0.022(4) 0.026(4) 0.003(3) 0.010(3) 0.002(4)
C23 0.069(6) 0.025(4) 0.046(5) -0.001(4) 0.034(5) -0.006(4)
N30 0.022(3) 0.018(3) 0.029(3) -0.002(2) -0.002(2) -0.006(2)
C31 0.027(3) 0.022(3) 0.021(3) -0.008(3) 0.001(3) -0.004(3)
C32 0.036(4) 0.023(3) 0.024(4) 0.002(3) -0.007(3) -0.009(3)
C33 0.032(4) 0.020(3) 0.033(4) -0.007(3) -0.011(3) -0.002(3)
N40 0.018(3) 0.030(3) 0.023(3) 0.004(2) 0.001(2) 0.005(2)
C41 0.030(4) 0.028(3) 0.026(4) -0.003(3) -0.007(3) -0.004(3)
C42 0.032(4) 0.034(4) 0.022(4) 0.000(3) -0.008(3) 0.000(3)
C43 0.029(4) 0.051(5) 0.039(5) 0.019(4) -0.004(3) -0.005(3)
N50 0.023(3) 0.024(3) 0.016(3) -0.003(2) -0.003(2) -0.008(2)
C51 0.023(3) 0.026(3) 0.028(4) 0.001(3) -0.009(3) -0.002(3)
C52 0.032(4) 0.014(3) 0.032(4) 0.004(3) -0.012(3) -0.004(3)
C53 0.033(4) 0.022(3) 0.035(4) -0.003(3) 0.001(3) -0.003(3)
N60 0.023(3) 0.018(3) 0.022(3) 0.011(2) 0.001(2) 0.003(2)
C61 0.022(3) 0.027(3) 0.023(4) 0.005(3) 0.001(3) 0.001(3)
C62 0.032(4) 0.025(3) 0.028(4) 0.005(3) 0.008(3) -0.001(3)
C63 0.036(4) 0.036(4) 0.039(4) 0.009(3) 0.003(3) 0.009(3)
Cl1 0.0386(10) 0.0308(9) 0.0558(13) 0.0033(9) 0.0059(9) -0.0101(8)
O11 0.066(4) 0.051(4) 0.135(7) -0.028(4) -0.046(5) 0.023(3)
O12 0.055(4) 0.095(5) 0.063(4) 0.004(4) 0.023(4) -0.003(4)
O13 0.064(4) 0.043(3) 0.085(5) 0.004(3) -0.020(4) -0.013(3)
O14 0.070(4) 0.041(3) 0.074(5) -0.006(3) 0.029(4) -0.017(3)
Cl2 0.0364(10) 0.0749(14) 0.0289(10) -0.0020(10) -0.0023(8) -0.0032(10)
O21 0.057(4) 0.120(6) 0.028(3) -0.002(3) 0.009(3) -0.026(4)
O22 0.218(10) 0.038(3) 0.050(4) 0.009(3) -0.003(5) -0.044(5)
O23 0.089(5) 0.119(6) 0.039(4) 0.006(4) -0.027(4) 0.014(5)
O24 0.068(5) 0.079(5) 0.081(5) 0.000(4) 0.028(4) 0.018(4)
Cl3 0.0306(9) 0.0269(8) 0.0258(9) -0.0017(6) 0.0032(7) 0.0007(7)
O31 0.045(3) 0.086(5) 0.050(4) 0.006(3) 0.009(3) 0.026(3)
O32 0.079(4) 0.053(4) 0.052(4) 0.011(3) 0.015(3) 0.027(3)
O33 0.070(4) 0.053(4) 0.077(5) -0.018(3) 0.003(4) -0.019(3)
O34 0.060(4) 0.078(4) 0.032(3) -0.008(3) -0.002(3) 0.014(3)

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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 N1 2.376(5) . ?
Ag1 C23 2.396(7) . ?
Ag1 C13 2.445(7) . ?
Ag1 C22 2.448(7) . ?
Ag1 O11 2.480(7) . ?
Ag1 C12 2.555(7) . ?
Ag2 N2 2.231(5) . ?
Ag2 C33 2.299(6) 6_654 ?
Ag2 C32 2.404(6) 6_654 ?
Ag2 C43 2.499(7) . ?
Ag2 C42 2.588(7) . ?
Ag3 N3 2.232(5) . ?
Ag3 C53 2.355(7) 3 ?
Ag3 C52 2.370(6) 3 ?
Ag3 C63 2.384(8) . ?
Ag3 C62 2.393(7) . ?
P1 N1 1.612(5) . ?
P1 N2 1.637(5) . ?
P1 N10 1.637(6) . ?
P1 N40 1.638(5) . ?
N1 P2 1.607(5) . ?
P2 N3 1.616(5) . ?
P2 N20 1.623(5) . ?
P2 N50 1.624(5) . ?
N2 P3 1.620(5) . ?
P3 N3 1.612(5) . ?
P3 N30 1.635(5) . ?
P3 N60 1.641(5) . ?
N10 C11 1.451(9) . ?
C11 C12 1.501(10) . ?
C12 C13 1.293(10) . ?
N20 C21 1.478(9) . ?
C21 C22 1.510(10) . ?
C22 C23 1.295(11) . ?
N30 C31 1.451(9) . ?
C31 C32 1.519(9) . ?
C32 C33 1.328(9) . ?
C32 Ag2 2.404(6) 6_655 ?
C33 Ag2 2.299(6) 6_655 ?
N40 C41 1.465(9) . ?
C41 C42 1.513(10) . ?
C42 C43 1.361(10) . ?
N50 C51 1.476(8) . ?
C51 C52 1.493(9) . ?
C52 C53 1.315(10) . ?
C52 Ag3 2.370(6) 11_454 ?
C53 Ag3 2.355(7) 11_454 ?
N60 C61 1.474(8) . ?
C61 C62 1.510(9) . ?
C62 C63 1.322(10) . ?
Cl1 O12 1.380(7) . ?
Cl1 O13 1.421(7) . ?
Cl1 O14 1.430(6) . ?
Cl1 O11 1.461(6) . ?
Cl2 O22 1.367(8) . ?
Cl2 O23 1.372(7) . ?
Cl2 O21 1.420(6) . ?
Cl2 O24 1.449(7) . ?
Cl3 O33 1.386(6) . ?
Cl3 O31 1.416(6) . ?
Cl3 O34 1.432(6) . ?
Cl3 O32 1.465(6) . ?

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
N1 Ag1 C23 108.8(2) . . ?
N1 Ag1 C13 105.0(2) . . ?
C23 Ag1 C13 138.8(3) . . ?
N1 Ag1 C22 93.9(2) . . ?
C23 Ag1 C22 31.0(3) . . ?
C13 Ag1 C22 125.3(3) . . ?
N1 Ag1 O11 97.9(3) . . ?
C23 Ag1 O11 106.8(3) . . ?
C13 Ag1 O11 91.0(2) . . ?
C22 Ag1 O11 137.1(2) . . ?
N1 Ag1 C12 88.2(2) . . ?
C23 Ag1 C12 129.1(3) . . ?
C13 Ag1 C12 29.9(2) . . ?
C22 Ag1 C12 103.2(2) . . ?
O11 Ag1 C12 118.2(2) . . ?
N2 Ag2 C33 155.5(2) . 6_654 ?
N2 Ag2 C32 123.9(2) . 6_654 ?
C33 Ag2 C32 32.7(2) 6_654 6_654 ?
N2 Ag2 C43 113.6(2) . . ?
C33 Ag2 C43 89.3(2) 6_654 . ?
C32 Ag2 C43 122.0(2) 6_654 . ?
N2 Ag2 C42 94.0(2) . . ?
C33 Ag2 C42 110.6(2) 6_654 . ?
C32 Ag2 C42 138.9(2) 6_654 . ?
C43 Ag2 C42 31.0(2) . . ?
N3 Ag3 C53 103.4(2) . 3 ?
N3 Ag3 C52 134.7(2) . 3 ?
C53 Ag3 C52 32.3(2) 3 3 ?
N3 Ag3 C63 126.4(2) . . ?
C53 Ag3 C63 127.2(2) 3 . ?
C52 Ag3 C63 95.0(3) 3 . ?
N3 Ag3 C62 95.0(2) . . ?
C53 Ag3 C62 158.4(2) 3 . ?
C52 Ag3 C62 126.9(2) 3 . ?
C63 Ag3 C62 32.1(2) . . ?
N1 P1 N2 112.4(2) . . ?
N1 P1 N10 105.5(3) . . ?
N2 P1 N10 116.1(3) . . ?
N1 P1 N40 116.4(3) . . ?
N2 P1 N40 105.0(3) . . ?
N10 P1 N40 101.2(3) . . ?
P2 N1 P1 120.1(3) . . ?
P2 N1 Ag1 120.5(2) . . ?
P1 N1 Ag1 119.4(3) . . ?
N1 P2 N3 111.5(3) . . ?
N1 P2 N20 107.1(3) . . ?
N3 P2 N20 111.5(3) . . ?
N1 P2 N50 111.2(3) . . ?
N3 P2 N50 106.8(3) . . ?
N20 P2 N50 108.7(3) . . ?
P3 N2 P1 124.7(3) . . ?
P3 N2 Ag2 119.2(3) . . ?
P1 N2 Ag2 116.0(2) . . ?
N3 P3 N2 112.1(3) . . ?
N3 P3 N30 104.5(3) . . ?
N2 P3 N30 118.3(3) . . ?
N3 P3 N60 117.2(3) . . ?
N2 P3 N60 102.8(3) . . ?
N30 P3 N60 102.2(3) . . ?
P3 N3 P2 121.6(3) . . ?
P3 N3 Ag3 113.1(3) . . ?
P2 N3 Ag3 119.2(2) . . ?
C11 N10 P1 121.7(4) . . ?
N10 C11 C12 114.8(6) . . ?
C13 C12 C11 125.1(7) . . ?
C13 C12 Ag1 70.4(4) . . ?
C11 C12 Ag1 103.9(4) . . ?
C12 C13 Ag1 79.7(4) . . ?
C21 N20 P2 121.5(4) . . ?
N20 C21 C22 112.6(6) . . ?
C23 C22 C21 128.2(7) . . ?
C23 C22 Ag1 72.3(5) . . ?
C21 C22 Ag1 104.6(4) . . ?
C22 C23 Ag1 76.7(5) . . ?
C31 N30 P3 123.2(4) . . ?
N30 C31 C32 114.5(5) . . ?
C33 C32 C31 125.6(6) . . ?
C33 C32 Ag2 69.3(4) . 6_655 ?
C31 C32 Ag2 114.3(4) . 6_655 ?
C32 C33 Ag2 78.0(4) . 6_655 ?
C41 N40 P1 120.5(4) . . ?
N40 C41 C42 114.2(5) . . ?
C43 C42 C41 124.5(7) . . ?
C43 C42 Ag2 70.9(4) . . ?
C41 C42 Ag2 97.7(4) . . ?
C42 C43 Ag2 78.1(4) . . ?
C51 N50 P2 124.4(5) . . ?
N50 C51 C52 111.5(5) . . ?
C53 C52 C51 123.7(6) . . ?
C53 C52 Ag3 73.2(4) . 11_454 ?
C51 C52 Ag3 107.7(4) . 11_454 ?
C52 C53 Ag3 74.5(4) . 11_454 ?
C61 N60 P3 122.7(4) . . ?
N60 C61 C62 115.0(5) . . ?
C63 C62 C61 124.5(7) . . ?
C63 C62 Ag3 73.6(4) . . ?
C61 C62 Ag3 106.2(4) . . ?
C62 C63 Ag3 74.3(4) . . ?
O12 Cl1 O13 113.4(4) . . ?
O12 Cl1 O14 110.0(4) . . ?
O13 Cl1 O14 111.9(4) . . ?
O12 Cl1 O11 105.8(5) . . ?
O13 Cl1 O11 107.9(4) . . ?
O14 Cl1 O11 107.4(5) . . ?
Cl1 O11 Ag1 133.7(4) . . ?
O22 Cl2 O23 115.3(5) . . ?
O22 Cl2 O21 110.3(4) . . ?
O23 Cl2 O21 112.0(5) . . ?
O22 Cl2 O24 104.0(5) . . ?
O23 Cl2 O24 105.4(5) . . ?
O21 Cl2 O24 109.4(5) . . ?
O33 Cl3 O31 110.5(4) . . ?
O33 Cl3 O34 110.3(4) . . ?
O31 Cl3 O34 110.7(4) . . ?
O33 Cl3 O32 106.8(4) . . ?
O31 Cl3 O32 109.7(4) . . ?
O34 Cl3 O32 108.6(4) . . ?

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
N10 H10 O14 0.88 2.42 3.113(8) 136.2 14
N20 H20 O13 0.88 2.56 3.254(8) 136.2 3
N30 H30 O22 0.88 2.36 3.032(8) 133.5 6_655
N40 H40 O14 0.88 2.43 3.065(8) 129.7 .
N50 H50 O32 0.88 2.36 3.034(8) 133.0 .
N50 H50 O21 0.88 2.61 3.191(8) 124.2 .
N60 H60 O22 0.88 2.44 3.082(9) 129.9 .

_diffrn_measured_fraction_theta_max 0.994
_diffrn_reflns_theta_full        25.02
_diffrn_measured_fraction_theta_full 0.994
_refine_diff_density_max         1.860
_refine_diff_density_min         -0.842
_refine_diff_density_rms         0.123

#===END

data_5
_database_code_depnum_ccdc_archive 'CCDC 670150'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C42 H84 Ag5 Cl5 N9 O26 P3'
_chemical_formula_weight         1940.69

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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   P2(1)/c

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                   11.586(3)
_cell_length_b                   25.797(5)
_cell_length_c                   22.795(5)
_cell_angle_alpha                90.00
_cell_angle_beta                 94.236(4)
_cell_angle_gamma                90.00
_cell_volume                     6795(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       prism
_exptl_crystal_colour            colourless
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.3
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.897
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3888
_exptl_absorpt_coefficient_mu    1.765
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_correction_T_min  0.531
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   ?

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker Smart Apex'
_diffrn_measurement_method       omega
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            33427
_diffrn_reflns_av_R_equivalents  0.0285
_diffrn_reflns_av_sigmaI/netI    0.0328
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_k_max       30
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         4.08
_diffrn_reflns_theta_max         25.03
_reflns_number_total             11908
_reflns_number_gt                10758
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_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^ > 2sigma(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.
The methanol molecules were refined using
similar distance restraints for C-O bonds.
;

_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^)+(0.0504P)^2^+95.1216P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         11908
_refine_ls_number_parameters     818
_refine_ls_number_restraints     29
_refine_ls_R_factor_all          0.0606
_refine_ls_R_factor_gt           0.0541
_refine_ls_wR_factor_ref         0.1356
_refine_ls_wR_factor_gt          0.1322
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_restrained_S_all      1.030
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 1.12289(5) 0.12147(2) 0.10626(2) 0.01942(13) Uani 1 1 d . . .
Ag2 Ag 0.88855(5) 0.00297(2) 0.33924(2) 0.02366(14) Uani 1 1 d . . .
Ag3 Ag 0.93253(4) 0.253751(19) 0.34219(2) 0.01757(13) Uani 1 1 d . . .
Ag4 Ag 0.58078(5) 0.23888(2) 0.08971(2) 0.02364(14) Uani 1 1 d . . .
Ag5 Ag 0.58258(5) -0.03312(2) 0.14298(3) 0.03141(16) Uani 1 1 d . . .
P1 P 0.94745(14) 0.17932(6) 0.21820(7) 0.0109(3) Uani 1 1 d . . .
P2 P 0.92307(14) 0.07231(6) 0.21711(7) 0.0118(3) Uani 1 1 d . . .
P3 P 0.90647(14) 0.12758(6) 0.32521(7) 0.0120(3) Uani 1 1 d . . .
N1 N 0.9815(4) 0.1241(2) 0.1923(2) 0.0124(11) Uani 1 1 d . . .
N2 N 0.9037(5) 0.0757(2) 0.2865(2) 0.0137(11) Uani 1 1 d . . .
N3 N 0.9133(4) 0.1786(2) 0.2858(2) 0.0118(11) Uani 1 1 d . . .
N4 N 1.0593(4) 0.2171(2) 0.2099(2) 0.0126(11) Uani 1 1 d . . .
N5 N 0.8365(5) 0.2050(2) 0.1786(2) 0.0142(11) Uani 1 1 d . . .
N6 N 1.0090(5) 0.0242(2) 0.2021(2) 0.0151(11) Uani 1 1 d . . .
N7 N 0.7967(5) 0.0558(2) 0.1845(2) 0.0150(11) Uani 1 1 d . . .
N8 N 1.0139(5) 0.1187(2) 0.3764(2) 0.0157(11) Uani 1 1 d . . .
N9 N 0.7923(5) 0.1347(2) 0.3634(2) 0.0144(11) Uani 1 1 d . . .
C41 C 1.1772(6) 0.1966(3) 0.2208(3) 0.0185(14) Uani 1 1 d . . .
H41A H 1.1739 0.1633 0.2421 0.022 Uiso 1 1 calc R . .
H41B H 1.2233 0.2211 0.2465 0.022 Uiso 1 1 calc R . .
C42 C 1.2372(6) 0.1883(3) 0.1655(3) 0.0216(15) Uani 1 1 d . . .
H42 H 1.3060 0.1681 0.1683 0.026 Uiso 1 1 calc R . .
C43 C 1.2013(7) 0.2070(3) 0.1123(3) 0.0262(16) Uani 1 1 d . . .
H43A H 1.1329 0.2273 0.1076 0.031 Uiso 1 1 calc R . .
H43B H 1.2444 0.1999 0.0793 0.031 Uiso 1 1 calc R . .
C44 C 1.0475(6) 0.2737(2) 0.2144(3) 0.0173(14) Uani 1 1 d . . .
H44A H 0.9700 0.2835 0.1966 0.021 Uiso 1 1 calc R . .
H44B H 1.1055 0.2900 0.1904 0.021 Uiso 1 1 calc R . .
C45 C 1.0618(6) 0.2963(3) 0.2757(3) 0.0206(15) Uani 1 1 d . . .
H45 H 1.1245 0.2842 0.3013 0.025 Uiso 1 1 calc R . .
C46 C 0.9917(7) 0.3322(3) 0.2961(3) 0.0259(16) Uani 1 1 d . . .
H46A H 0.9283 0.3451 0.2716 0.031 Uiso 1 1 calc R . .
H46B H 1.0055 0.3449 0.3351 0.031 Uiso 1 1 calc R . .
C51 C 0.8479(6) 0.2074(3) 0.1143(3) 0.0165(14) Uani 1 1 d . . .
H51A H 0.9183 0.1882 0.1051 0.020 Uiso 1 1 calc R . .
H51B H 0.8581 0.2440 0.1028 0.020 Uiso 1 1 calc R . .
C52 C 0.7467(6) 0.1855(3) 0.0783(3) 0.0175(14) Uani 1 1 d . . .
H52 H 0.7071 0.1570 0.0940 0.021 Uiso 1 1 calc R . .
C53 C 0.7081(6) 0.2034(3) 0.0254(3) 0.0216(15) Uani 1 1 d . . .
H53A H 0.7458 0.2319 0.0085 0.026 Uiso 1 1 calc R . .
H53B H 0.6430 0.1877 0.0047 0.026 Uiso 1 1 calc R . .
C54 C 0.7569(6) 0.2425(2) 0.2013(3) 0.0154(13) Uani 1 1 d . . .
H54A H 0.7682 0.2763 0.1822 0.019 Uiso 1 1 calc R . .
H54B H 0.7765 0.2469 0.2440 0.019 Uiso 1 1 calc R . .
C55 C 0.6326(6) 0.2277(3) 0.1919(3) 0.0184(14) Uani 1 1 d . . .
H55 H 0.6134 0.1919 0.1900 0.022 Uiso 1 1 calc R . .
C56 C 0.5460(6) 0.2627(3) 0.1859(3) 0.0252(16) Uani 1 1 d . . .
H56A H 0.5631 0.2988 0.1876 0.030 Uiso 1 1 calc R . .
H56B H 0.4680 0.2514 0.1799 0.030 Uiso 1 1 calc R . .
C61 C 1.1357(6) 0.0336(3) 0.2032(3) 0.0189(14) Uani 1 1 d . . .
H61A H 1.1763 0.0050 0.2250 0.023 Uiso 1 1 calc R . .
H61B H 1.1539 0.0661 0.2251 0.023 Uiso 1 1 calc R . .
C62 C 1.1820(6) 0.0378(3) 0.1437(3) 0.0200(14) Uani 1 1 d . . .
H62 H 1.2612 0.0469 0.1425 0.024 Uiso 1 1 calc R . .
C63 C 1.1225(6) 0.0299(3) 0.0924(3) 0.0217(15) Uani 1 1 d . . .
H63A H 1.0429 0.0207 0.0913 0.026 Uiso 1 1 calc R . .
H63B H 1.1594 0.0335 0.0567 0.026 Uiso 1 1 calc R . .
C64 C 0.9778(6) -0.0295(3) 0.2156(3) 0.0163(13) Uani 1 1 d . . .
H64A H 1.0175 -0.0530 0.1893 0.020 Uiso 1 1 calc R . .
H64B H 0.8935 -0.0338 0.2067 0.020 Uiso 1 1 calc R . .
C65 C 1.0077(6) -0.0460(3) 0.2784(3) 0.0207(15) Uani 1 1 d . . .
H65 H 1.0748 -0.0315 0.2984 0.025 Uiso 1 1 calc R . .
C66 C 0.9458(7) -0.0800(3) 0.3077(3) 0.0244(16) Uani 1 1 d . . .
H66A H 0.8782 -0.0952 0.2889 0.029 Uiso 1 1 calc R . .
H66B H 0.9695 -0.0887 0.3472 0.029 Uiso 1 1 calc R . .
C71 C 0.7864(6) 0.0464(3) 0.1202(3) 0.0184(14) Uani 1 1 d . . .
H71A H 0.8595 0.0574 0.1040 0.022 Uiso 1 1 calc R . .
H71B H 0.7240 0.0689 0.1023 0.022 Uiso 1 1 calc R . .
C72 C 0.7616(6) -0.0081(3) 0.1013(3) 0.0232(15) Uani 1 1 d . . .
H72 H 0.8036 -0.0350 0.1218 0.028 Uiso 1 1 calc R . .
C73 C 0.6838(7) -0.0217(3) 0.0572(3) 0.0307(18) Uani 1 1 d . . .
H73A H 0.6403 0.0043 0.0359 0.037 Uiso 1 1 calc R . .
H73B H 0.6723 -0.0572 0.0475 0.037 Uiso 1 1 calc R . .
C74 C 0.6880(6) 0.0638(3) 0.2123(3) 0.0175(14) Uani 1 1 d . . .
H74A H 0.6323 0.0817 0.1841 0.021 Uiso 1 1 calc R . .
H74B H 0.7027 0.0865 0.2470 0.021 Uiso 1 1 calc R . .
C75 C 0.6346(6) 0.0139(3) 0.2314(3) 0.0235(15) Uani 1 1 d . . .
H75 H 0.6853 -0.0131 0.2452 0.028 Uiso 1 1 calc R . .
C76 C 0.5208(7) 0.0051(3) 0.2304(4) 0.036(2) Uani 1 1 d . . .
H76A H 0.4676 0.0312 0.2169 0.043 Uiso 1 1 calc R . .
H76B H 0.4931 -0.0274 0.2432 0.043 Uiso 1 1 calc R . .
C81 C 1.1170(6) 0.0905(3) 0.3628(3) 0.0218(15) Uani 1 1 d . . .
H81A H 1.1859 0.1119 0.3742 0.026 Uiso 1 1 calc R . .
H81B H 1.1147 0.0847 0.3198 0.026 Uiso 1 1 calc R . .
C82 C 1.1291(7) 0.0392(3) 0.3937(3) 0.0266(17) Uani 1 1 d . . .
H82 H 1.1910 0.0176 0.3836 0.032 Uiso 1 1 calc R . .
C83 C 1.0623(8) 0.0213(3) 0.4332(4) 0.0336(19) Uani 1 1 d . . .
H83A H 0.9992 0.0415 0.4446 0.040 Uiso 1 1 calc R . .
H83B H 1.0770 -0.0118 0.4503 0.040 Uiso 1 1 calc R . .
C84 C 1.0308(6) 0.1540(3) 0.4268(3) 0.0206(15) Uani 1 1 d . . .
H84A H 1.0789 0.1363 0.4585 0.025 Uiso 1 1 calc R . .
H84B H 0.9545 0.1613 0.4420 0.025 Uiso 1 1 calc R . .
C85 C 1.0874(6) 0.2046(3) 0.4132(3) 0.0237(16) Uani 1 1 d . . .
H85 H 1.1438 0.2044 0.3850 0.028 Uiso 1 1 calc R . .
C86 C 1.0637(7) 0.2497(3) 0.4379(3) 0.0309(18) Uani 1 1 d . . .
H86A H 1.0077 0.2514 0.4663 0.037 Uiso 1 1 calc R . .
H86B H 1.1027 0.2803 0.4272 0.037 Uiso 1 1 calc R . .
C91 C 0.7655(6) 0.0955(3) 0.4076(3) 0.0191(14) Uani 1 1 d . . .
H91A H 0.7042 0.1094 0.4312 0.023 Uiso 1 1 calc R . .
H91B H 0.8354 0.0901 0.4346 0.023 Uiso 1 1 calc R . .
C92 C 0.7266(6) 0.0439(3) 0.3831(3) 0.0216(15) Uani 1 1 d . . .
H92 H 0.6847 0.0434 0.3457 0.026 Uiso 1 1 calc R . .
C93 C 0.7472(7) -0.0018(3) 0.4106(4) 0.0281(17) Uani 1 1 d . . .
H93A H 0.7888 -0.0027 0.4481 0.034 Uiso 1 1 calc R . .
H93B H 0.7200 -0.0331 0.3925 0.034 Uiso 1 1 calc R . .
C94 C 0.7105(5) 0.1783(2) 0.3532(3) 0.0155(13) Uani 1 1 d . . .
H94A H 0.6347 0.1683 0.3671 0.019 Uiso 1 1 calc R . .
H94B H 0.6991 0.1849 0.3103 0.019 Uiso 1 1 calc R . .
C95 C 0.7509(5) 0.2278(3) 0.3838(3) 0.0163(13) Uani 1 1 d . . .
H95 H 0.7937 0.2250 0.4208 0.020 Uiso 1 1 calc R . .
C96 C 0.7299(6) 0.2751(3) 0.3620(3) 0.0216(15) Uani 1 1 d . . .
H96A H 0.6873 0.2792 0.3250 0.026 Uiso 1 1 calc R . .
H96B H 0.7577 0.3047 0.3834 0.026 Uiso 1 1 calc R . .
Cl1 Cl 0.97657(15) 0.11685(7) -0.02693(7) 0.0242(4) Uani 1 1 d . . .
O11 O 1.0161(5) 0.1502(2) 0.0218(2) 0.0369(14) Uani 1 1 d . . .
O12 O 0.9046(5) 0.1467(2) -0.0673(2) 0.0392(14) Uani 1 1 d . . .
O13 O 0.9126(6) 0.0753(3) -0.0038(3) 0.0515(18) Uani 1 1 d . . .
O14 O 1.0730(7) 0.0985(4) -0.0548(3) 0.070(2) Uani 1 1 d . . .
Cl2 Cl 0.45069(14) 0.10257(7) 0.07153(8) 0.0222(4) Uani 1 1 d . . .
O21 O 0.4817(5) 0.1391(2) 0.1169(2) 0.0344(13) Uani 1 1 d . . .
O22 O 0.5377(5) 0.1014(3) 0.0304(2) 0.0384(14) Uani 1 1 d . . .
O23 O 0.3417(5) 0.1165(3) 0.0429(3) 0.0511(19) Uani 1 1 d . . .
O24 O 0.4426(6) 0.0521(2) 0.0960(4) 0.055(2) Uani 1 1 d . . .
Cl3 Cl 0.36096(16) 0.36558(7) 0.24986(8) 0.0277(4) Uani 1 1 d . . .
O31 O 0.3073(5) 0.3180(2) 0.2314(3) 0.0382(14) Uani 1 1 d . . .
O32 O 0.4748(5) 0.3565(3) 0.2746(3) 0.0472(17) Uani 1 1 d . . .
O33 O 0.2941(5) 0.3905(2) 0.2929(3) 0.0387(14) Uani 1 1 d . . .
O34 O 0.3645(7) 0.3994(3) 0.1993(3) 0.0540(18) Uani 1 1 d . . .
Cl4 Cl 0.41458(16) 0.12304(9) 0.30811(9) 0.0348(5) Uani 1 1 d . . .
O41 O 0.3569(5) 0.1621(3) 0.3380(3) 0.0480(16) Uani 1 1 d . . .
O42 O 0.4896(7) 0.0972(3) 0.3505(5) 0.083(3) Uani 1 1 d . . .
O43 O 0.3308(5) 0.0891(3) 0.2813(3) 0.055(2) Uani 1 1 d . . .
O44 O 0.4808(8) 0.1452(5) 0.2649(4) 0.101(4) Uani 1 1 d . . .
Cl5 Cl 0.8072(2) 0.35242(7) 0.06816(8) 0.0345(5) Uani 1 1 d . . .
O51 O 0.8153(6) 0.3248(2) 0.0165(3) 0.0461(17) Uani 1 1 d . . .
O52 O 0.8060(7) 0.4067(2) 0.0568(3) 0.0561(19) Uani 1 1 d . . .
O53 O 0.6968(7) 0.3371(3) 0.0907(3) 0.0579(19) Uani 1 1 d . . .
O54 O 0.8925(8) 0.3406(3) 0.1111(4) 0.083(3) Uani 1 1 d . . .
O1 O 0.4483(6) 0.2768(3) 0.0280(3) 0.0551(19) Uani 1 1 d D . .
C1 C 0.4916(11) 0.2990(6) -0.0260(5) 0.077(4) Uani 1 1 d D . .
O2 O 0.4241(5) -0.0863(2) 0.1249(3) 0.0425(15) Uani 1 1 d D . .
C2 C 0.3324(7) -0.0731(3) 0.0836(4) 0.036(2) Uani 1 1 d D . .
O3 O 0.7291(7) 0.4136(4) 0.2762(3) 0.066(2) Uani 1 1 d D . .
C3 C 0.6996(11) 0.4053(7) 0.2167(6) 0.112(7) Uani 1 1 d D . .
O4 O 0.4718(7) 0.3320(4) 0.4219(4) 0.084(3) Uani 1 1 d D . .
C4 C 0.3649(13) 0.3088(8) 0.4064(9) 0.135(9) Uani 1 1 d D . .
O5 O 0.4066(19) 0.4285(9) 0.0135(10) 0.119(7) Uiso 0.60 1 d PD A 1
C5 C 0.510(3) 0.4351(17) 0.0505(17) 0.151(14) Uiso 0.60 1 d PD A 1
O5' O 0.580(2) 0.5209(11) 0.0795(12) 0.097(8) Uiso 0.40 1 d PD B 2
C5' C 0.559(5) 0.4692(15) 0.098(2) 0.16(2) Uiso 0.40 1 d PD B 2
O6 O 0.2842(10) 0.3437(5) 0.0306(5) 0.058(3) Uani 0.60 1 d PD C 1
O6' O 0.3295(12) 0.3541(8) 0.0848(9) 0.069(6) Uani 0.40 1 d PD C 2
C6 C 0.2052(8) 0.3487(4) 0.0744(4) 0.049(2) Uani 1 1 d D . .

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 0.0243(3) 0.0199(3) 0.0140(3) -0.0002(2) 0.0007(2) 0.0003(2)
Ag2 0.0354(3) 0.0151(3) 0.0218(3) 0.0032(2) 0.0112(2) 0.0019(2)
Ag3 0.0229(3) 0.0159(2) 0.0141(2) -0.00258(19) 0.0030(2) -0.00292(19)
Ag4 0.0240(3) 0.0271(3) 0.0189(3) -0.0001(2) -0.0048(2) 0.0061(2)
Ag5 0.0324(3) 0.0288(3) 0.0316(3) -0.0064(3) -0.0074(3) -0.0094(2)
P1 0.0131(8) 0.0129(8) 0.0068(7) -0.0011(6) 0.0019(6) -0.0007(6)
P2 0.0131(8) 0.0127(8) 0.0093(8) -0.0012(6) -0.0001(6) 0.0005(6)
P3 0.0142(8) 0.0144(8) 0.0073(7) -0.0006(6) 0.0003(6) 0.0000(6)
N1 0.012(3) 0.016(3) 0.009(3) -0.002(2) -0.001(2) 0.000(2)
N2 0.018(3) 0.013(3) 0.011(3) 0.000(2) 0.003(2) 0.000(2)
N3 0.015(3) 0.013(3) 0.008(3) -0.002(2) 0.002(2) 0.002(2)
N4 0.014(3) 0.015(3) 0.010(3) -0.004(2) 0.004(2) -0.002(2)
N5 0.015(3) 0.020(3) 0.008(3) -0.001(2) 0.002(2) 0.001(2)
N6 0.016(3) 0.014(3) 0.016(3) -0.004(2) 0.003(2) 0.001(2)
N7 0.017(3) 0.017(3) 0.011(3) -0.005(2) -0.003(2) 0.000(2)
N8 0.016(3) 0.020(3) 0.010(3) 0.001(2) 0.000(2) 0.003(2)
N9 0.021(3) 0.014(3) 0.008(3) 0.000(2) 0.003(2) 0.000(2)
C41 0.016(3) 0.023(3) 0.017(3) -0.001(3) 0.000(3) -0.002(3)
C42 0.017(3) 0.020(3) 0.027(4) -0.007(3) 0.005(3) -0.003(3)
C43 0.027(4) 0.021(4) 0.033(4) -0.005(3) 0.012(3) -0.007(3)
C44 0.022(3) 0.014(3) 0.016(3) -0.003(3) 0.003(3) -0.004(3)
C45 0.029(4) 0.016(3) 0.017(3) -0.005(3) 0.004(3) -0.006(3)
C46 0.040(4) 0.021(4) 0.019(4) 0.002(3) 0.011(3) -0.007(3)
C51 0.020(3) 0.021(3) 0.009(3) 0.001(3) 0.005(3) 0.003(3)
C52 0.026(4) 0.016(3) 0.012(3) -0.002(3) 0.006(3) 0.002(3)
C53 0.028(4) 0.028(4) 0.009(3) 0.000(3) 0.000(3) -0.005(3)
C54 0.021(3) 0.015(3) 0.011(3) -0.001(3) 0.000(3) 0.004(3)
C55 0.019(3) 0.022(3) 0.014(3) -0.001(3) 0.001(3) -0.005(3)
C56 0.021(4) 0.027(4) 0.028(4) -0.008(3) 0.004(3) 0.000(3)
C61 0.018(3) 0.019(3) 0.019(3) 0.000(3) 0.001(3) 0.004(3)
C62 0.018(3) 0.022(4) 0.021(4) 0.002(3) 0.008(3) 0.007(3)
C63 0.027(4) 0.024(4) 0.015(3) -0.001(3) 0.010(3) 0.001(3)
C64 0.020(3) 0.017(3) 0.012(3) -0.003(3) 0.001(3) 0.003(3)
C65 0.024(4) 0.018(3) 0.019(4) -0.002(3) -0.003(3) 0.007(3)
C66 0.028(4) 0.017(3) 0.028(4) -0.002(3) 0.004(3) 0.003(3)
C71 0.018(3) 0.026(4) 0.010(3) -0.002(3) -0.005(3) 0.001(3)
C72 0.025(4) 0.025(4) 0.018(4) -0.002(3) -0.005(3) 0.005(3)
C73 0.042(5) 0.023(4) 0.025(4) -0.006(3) -0.009(4) 0.000(3)
C74 0.018(3) 0.020(3) 0.015(3) -0.004(3) 0.002(3) -0.001(3)
C75 0.020(4) 0.027(4) 0.024(4) -0.003(3) 0.002(3) -0.001(3)
C76 0.029(4) 0.037(5) 0.043(5) -0.008(4) 0.010(4) -0.009(4)
C81 0.015(3) 0.032(4) 0.017(3) 0.001(3) -0.002(3) 0.002(3)
C82 0.029(4) 0.027(4) 0.022(4) -0.005(3) -0.008(3) 0.014(3)
C83 0.043(5) 0.029(4) 0.027(4) 0.005(3) -0.012(4) 0.006(4)
C84 0.020(4) 0.029(4) 0.011(3) -0.003(3) -0.008(3) 0.000(3)
C85 0.021(4) 0.029(4) 0.020(4) 0.001(3) -0.008(3) 0.000(3)
C86 0.034(4) 0.033(4) 0.023(4) 0.000(3) -0.010(3) 0.001(3)
C91 0.023(4) 0.019(3) 0.017(3) 0.002(3) 0.007(3) 0.001(3)
C92 0.024(4) 0.020(4) 0.023(4) 0.001(3) 0.014(3) -0.004(3)
C93 0.038(4) 0.020(4) 0.028(4) -0.003(3) 0.013(3) -0.001(3)
C94 0.013(3) 0.018(3) 0.016(3) -0.001(3) 0.003(3) 0.002(3)
C95 0.012(3) 0.021(3) 0.016(3) -0.004(3) 0.002(3) 0.001(3)
C96 0.023(4) 0.024(4) 0.019(4) -0.004(3) 0.005(3) 0.004(3)
Cl1 0.0272(9) 0.0296(9) 0.0152(8) -0.0024(7) -0.0033(7) 0.0058(7)
O11 0.057(4) 0.032(3) 0.021(3) -0.005(2) -0.010(3) 0.006(3)
O12 0.037(3) 0.052(4) 0.027(3) 0.019(3) -0.008(3) -0.005(3)
O13 0.064(4) 0.050(4) 0.037(4) 0.021(3) -0.019(3) -0.019(3)
O14 0.060(5) 0.110(7) 0.040(4) -0.022(4) 0.005(3) 0.040(5)
Cl2 0.0164(8) 0.0279(9) 0.0222(8) -0.0068(7) 0.0000(7) -0.0002(7)
O21 0.028(3) 0.047(3) 0.029(3) -0.015(3) 0.000(2) -0.005(3)
O22 0.036(3) 0.055(4) 0.025(3) -0.001(3) 0.009(2) 0.002(3)
O23 0.035(3) 0.069(5) 0.046(4) -0.033(3) -0.021(3) 0.022(3)
O24 0.042(4) 0.029(3) 0.097(6) 0.012(4) 0.031(4) 0.004(3)
Cl3 0.0260(9) 0.0292(9) 0.0283(10) -0.0060(8) 0.0049(7) -0.0038(7)
O31 0.031(3) 0.037(3) 0.047(4) -0.016(3) 0.010(3) -0.012(3)
O32 0.028(3) 0.073(5) 0.041(4) -0.020(3) -0.001(3) -0.001(3)
O33 0.040(3) 0.036(3) 0.042(4) -0.006(3) 0.017(3) 0.004(3)
O34 0.082(5) 0.043(4) 0.038(4) 0.001(3) 0.013(4) -0.004(4)
Cl4 0.0178(9) 0.0589(13) 0.0270(10) -0.0084(9) -0.0027(7) -0.0030(8)
O41 0.035(3) 0.053(4) 0.056(4) -0.017(3) -0.001(3) 0.002(3)
O42 0.056(5) 0.061(5) 0.125(8) -0.002(5) -0.054(5) 0.002(4)
O43 0.022(3) 0.077(5) 0.066(5) -0.040(4) 0.004(3) -0.006(3)
O44 0.071(6) 0.183(11) 0.051(5) -0.017(6) 0.024(4) -0.070(7)
Cl5 0.0601(13) 0.0232(9) 0.0188(9) 0.0019(7) -0.0066(9) -0.0073(9)
O51 0.086(5) 0.030(3) 0.024(3) -0.007(3) 0.016(3) -0.018(3)
O52 0.099(6) 0.029(3) 0.040(4) 0.003(3) 0.003(4) -0.010(4)
O53 0.070(5) 0.048(4) 0.059(5) 0.001(3) 0.029(4) -0.015(4)
O54 0.105(7) 0.052(5) 0.083(6) 0.026(4) -0.059(5) -0.034(5)
O1 0.050(4) 0.068(5) 0.045(4) 0.018(4) -0.015(3) 0.021(4)
C1 0.061(8) 0.112(11) 0.059(8) 0.028(8) 0.009(6) 0.000(7)
O2 0.038(3) 0.035(3) 0.052(4) 0.006(3) -0.013(3) -0.006(3)
C2 0.033(5) 0.041(5) 0.034(5) -0.007(4) -0.007(4) 0.001(4)
O3 0.052(4) 0.095(6) 0.052(5) -0.005(4) 0.005(4) -0.015(4)
C3 0.050(7) 0.167(16) 0.123(13) -0.106(13) 0.038(8) -0.036(9)
O4 0.071(6) 0.077(6) 0.098(7) 0.033(5) -0.039(5) -0.025(5)
C4 0.082(11) 0.151(17) 0.164(18) 0.100(15) -0.040(11) -0.062(11)
O6 0.050(7) 0.063(8) 0.062(8) 0.003(6) 0.011(6) 0.013(6)
O6' 0.074(14) 0.078(14) 0.052(11) -0.020(10) -0.017(10) 0.039(11)
C6 0.052(6) 0.053(6) 0.043(6) 0.002(5) 0.008(5) 0.007(5)

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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 O11 2.331(5) . ?
Ag1 C63 2.383(7) . ?
Ag1 C43 2.385(7) . ?
Ag1 C62 2.402(7) . ?
Ag1 C42 2.506(7) . ?
Ag1 N1 2.647(5) . ?
Ag2 N2 2.243(5) . ?
Ag2 C66 2.368(7) . ?
Ag2 C65 2.390(7) . ?
Ag2 C93 2.395(7) . ?
Ag2 C92 2.431(7) . ?
Ag2 C83 2.867(8) . ?
Ag3 N3 2.328(5) . ?
Ag3 C46 2.404(7) . ?
Ag3 C95 2.464(6) . ?
Ag3 C45 2.466(7) . ?
Ag3 C96 2.485(7) . ?
Ag3 C86 2.568(7) . ?
Ag3 C85 2.648(7) . ?
Ag4 O1 2.229(6) . ?
Ag4 C56 2.340(7) . ?
Ag4 C53 2.341(7) . ?
Ag4 C55 2.380(7) . ?
Ag4 C52 2.395(7) . ?
Ag5 O2 2.305(6) . ?
Ag5 C73 2.371(8) . ?
Ag5 C76 2.380(8) . ?
Ag5 C75 2.392(7) . ?
Ag5 C72 2.432(8) . ?
P1 N1 1.604(5) . ?
P1 N3 1.619(5) . ?
P1 N4 1.643(5) . ?
P1 N5 1.653(5) . ?
P2 N2 1.617(5) . ?
P2 N1 1.618(5) . ?
P2 N6 1.642(5) . ?
P2 N7 1.648(5) . ?
P3 N3 1.598(5) . ?
P3 N2 1.601(5) . ?
P3 N9 1.646(6) . ?
P3 N8 1.658(6) . ?
N4 C41 1.468(8) . ?
N4 C44 1.472(8) . ?
N5 C54 1.458(8) . ?
N5 C51 1.484(8) . ?
N6 C64 1.470(8) . ?
N6 C61 1.486(9) . ?
N7 C74 1.465(8) . ?
N7 C71 1.483(8) . ?
N8 C81 1.451(9) . ?
N8 C84 1.467(8) . ?
N9 C91 1.477(8) . ?
N9 C94 1.479(8) . ?
C41 C42 1.501(10) . ?
C42 C43 1.342(11) . ?
C44 C45 1.512(9) . ?
C45 C46 1.338(10) . ?
C51 C52 1.491(10) . ?
C52 C53 1.339(10) . ?
C54 C55 1.490(9) . ?
C55 C56 1.351(10) . ?
C61 C62 1.499(9) . ?
C62 C63 1.329(10) . ?
C64 C65 1.508(9) . ?
C65 C66 1.340(10) . ?
C71 C72 1.491(10) . ?
C72 C73 1.347(10) . ?
C74 C75 1.505(10) . ?
C75 C76 1.336(11) . ?
C81 C82 1.500(10) . ?
C82 C83 1.314(12) . ?
C84 C85 1.505(10) . ?
C85 C86 1.330(11) . ?
C91 C92 1.500(10) . ?
C92 C93 1.348(10) . ?
C94 C95 1.512(9) . ?
C95 C96 1.334(10) . ?
Cl1 O14 1.407(7) . ?
Cl1 O12 1.422(6) . ?
Cl1 O13 1.427(7) . ?
Cl1 O11 1.451(6) . ?
Cl2 O24 1.423(6) . ?
Cl2 O23 1.424(6) . ?
Cl2 O21 1.425(6) . ?
Cl2 O22 1.427(6) . ?
Cl3 O32 1.415(6) . ?
Cl3 O31 1.424(6) . ?
Cl3 O33 1.445(6) . ?
Cl3 O34 1.449(7) . ?
Cl4 O43 1.412(6) . ?
Cl4 O41 1.412(7) . ?
Cl4 O44 1.413(8) . ?
Cl4 O42 1.417(8) . ?
Cl5 O54 1.373(8) . ?
Cl5 O51 1.385(6) . ?
Cl5 O52 1.425(7) . ?
Cl5 O53 1.467(7) . ?
O1 C1 1.479(11) . ?
O2 C2 1.408(9) . ?
O3 C3 1.392(12) . ?
O4 C4 1.397(12) . ?
O5 C5 1.423(16) . ?
O5' C5' 1.422(16) . ?
O6 C6 1.410(12) . ?
O6' C6 1.449(14) . ?

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
O11 Ag1 C63 102.1(2) . . ?
O11 Ag1 C43 86.0(2) . . ?
C63 Ag1 C43 157.1(3) . . ?
O11 Ag1 C62 134.3(2) . . ?
C63 Ag1 C62 32.2(2) . . ?
C43 Ag1 C62 135.5(3) . . ?
O11 Ag1 C42 117.0(2) . . ?
C63 Ag1 C42 138.5(2) . . ?
C43 Ag1 C42 31.7(3) . . ?
C62 Ag1 C42 107.5(2) . . ?
O11 Ag1 N1 106.49(19) . . ?
C63 Ag1 N1 97.4(2) . . ?
C43 Ag1 N1 100.8(2) . . ?
C62 Ag1 N1 86.30(19) . . ?
C42 Ag1 N1 85.1(2) . . ?
N2 Ag2 C66 123.9(2) . . ?
N2 Ag2 C65 93.4(2) . . ?
C66 Ag2 C65 32.7(2) . . ?
N2 Ag2 C93 119.4(2) . . ?
C66 Ag2 C93 112.4(3) . . ?
C65 Ag2 C93 145.1(2) . . ?
N2 Ag2 C92 87.2(2) . . ?
C66 Ag2 C92 139.4(2) . . ?
C65 Ag2 C92 164.7(3) . . ?
C93 Ag2 C92 32.4(2) . . ?
N2 Ag2 C83 100.6(2) . . ?
C66 Ag2 C83 100.3(3) . . ?
C65 Ag2 C83 96.7(2) . . ?
C93 Ag2 C83 88.8(3) . . ?
C92 Ag2 C83 98.1(3) . . ?
N3 Ag3 C46 118.6(2) . . ?
N3 Ag3 C95 86.3(2) . . ?
C46 Ag3 C95 132.6(2) . . ?
N3 Ag3 C45 94.0(2) . . ?
C46 Ag3 C45 31.9(2) . . ?
C95 Ag3 C45 158.8(2) . . ?
N3 Ag3 C96 103.4(2) . . ?
C46 Ag3 C96 101.3(3) . . ?
C95 Ag3 C96 31.3(2) . . ?
C45 Ag3 C96 129.6(2) . . ?
N3 Ag3 C86 117.5(2) . . ?
C46 Ag3 C86 103.6(3) . . ?
C95 Ag3 C86 97.5(3) . . ?
C45 Ag3 C86 101.1(3) . . ?
C96 Ag3 C86 111.2(3) . . ?
N3 Ag3 C85 88.4(2) . . ?
C46 Ag3 C85 117.9(3) . . ?
C95 Ag3 C85 101.2(2) . . ?
C45 Ag3 C85 100.0(2) . . ?
C96 Ag3 C85 127.0(2) . . ?
C86 Ag3 C85 29.5(2) . . ?
O1 Ag4 C56 108.5(3) . . ?
O1 Ag4 C53 102.3(3) . . ?
C56 Ag4 C53 148.1(2) . . ?
O1 Ag4 C55 141.5(3) . . ?
C56 Ag4 C55 33.3(2) . . ?
C53 Ag4 C55 116.1(2) . . ?
O1 Ag4 C52 134.8(2) . . ?
C56 Ag4 C52 116.6(2) . . ?
C53 Ag4 C52 32.8(2) . . ?
C55 Ag4 C52 83.6(2) . . ?
O2 Ag5 C73 111.3(3) . . ?
O2 Ag5 C76 96.4(3) . . ?
C73 Ag5 C76 146.7(3) . . ?
O2 Ag5 C75 126.9(2) . . ?
C73 Ag5 C75 121.5(3) . . ?
C76 Ag5 C75 32.5(3) . . ?
O2 Ag5 C72 141.3(2) . . ?
C73 Ag5 C72 32.5(3) . . ?
C76 Ag5 C72 122.3(3) . . ?
C75 Ag5 C72 91.4(2) . . ?
N1 P1 N3 115.1(3) . . ?
N1 P1 N4 105.5(3) . . ?
N3 P1 N4 111.5(3) . . ?
N1 P1 N5 110.9(3) . . ?
N3 P1 N5 106.8(3) . . ?
N4 P1 N5 106.8(3) . . ?
N2 P2 N1 112.9(3) . . ?
N2 P2 N6 112.0(3) . . ?
N1 P2 N6 105.9(3) . . ?
N2 P2 N7 105.8(3) . . ?
N1 P2 N7 115.9(3) . . ?
N6 P2 N7 104.1(3) . . ?
N3 P3 N2 112.2(3) . . ?
N3 P3 N9 106.3(3) . . ?
N2 P3 N9 113.6(3) . . ?
N3 P3 N8 116.3(3) . . ?
N2 P3 N8 104.8(3) . . ?
N9 P3 N8 103.5(3) . . ?
P1 N1 P2 119.0(3) . . ?
P1 N1 Ag1 118.5(3) . . ?
P2 N1 Ag1 122.4(3) . . ?
P3 N2 P2 125.9(3) . . ?
P3 N2 Ag2 113.8(3) . . ?
P2 N2 Ag2 120.0(3) . . ?
P3 N3 P1 124.8(3) . . ?
P3 N3 Ag3 112.5(3) . . ?
P1 N3 Ag3 119.7(3) . . ?
C41 N4 C44 115.8(5) . . ?
C41 N4 P1 120.0(4) . . ?
C44 N4 P1 120.1(4) . . ?
C54 N5 C51 115.3(5) . . ?
C54 N5 P1 124.0(4) . . ?
C51 N5 P1 115.8(4) . . ?
C64 N6 C61 114.1(5) . . ?
C64 N6 P2 120.4(4) . . ?
C61 N6 P2 119.2(4) . . ?
C74 N7 C71 116.2(5) . . ?
C74 N7 P2 122.2(4) . . ?
C71 N7 P2 119.4(4) . . ?
C81 N8 C84 114.5(5) . . ?
C81 N8 P3 120.4(5) . . ?
C84 N8 P3 121.0(4) . . ?
C91 N9 C94 117.6(5) . . ?
C91 N9 P3 120.1(4) . . ?
C94 N9 P3 122.1(4) . . ?
N4 C41 C42 113.0(6) . . ?
C43 C42 C41 125.2(7) . . ?
C43 C42 Ag1 69.2(4) . . ?
C41 C42 Ag1 107.0(4) . . ?
C42 C43 Ag1 79.1(4) . . ?
N4 C44 C45 116.2(6) . . ?
C46 C45 C44 124.1(7) . . ?
C46 C45 Ag3 71.5(4) . . ?
C44 C45 Ag3 111.5(4) . . ?
C45 C46 Ag3 76.6(4) . . ?
N5 C51 C52 113.8(5) . . ?
C53 C52 C51 124.1(6) . . ?
C53 C52 Ag4 71.4(4) . . ?
C51 C52 Ag4 109.1(4) . . ?
C52 C53 Ag4 75.8(4) . . ?
N5 C54 C55 114.1(5) . . ?
C56 C55 C54 123.1(6) . . ?
C56 C55 Ag4 71.8(4) . . ?
C54 C55 Ag4 106.4(4) . . ?
C55 C56 Ag4 75.0(4) . . ?
N6 C61 C62 114.6(6) . . ?
C63 C62 C61 126.1(7) . . ?
C63 C62 Ag1 73.1(4) . . ?
C61 C62 Ag1 105.9(4) . . ?
C62 C63 Ag1 74.7(4) . . ?
N6 C64 C65 115.0(5) . . ?
C66 C65 C64 124.3(7) . . ?
C66 C65 Ag2 72.7(4) . . ?
C64 C65 Ag2 107.4(4) . . ?
C65 C66 Ag2 74.6(4) . . ?
N7 C71 C72 116.0(6) . . ?
C73 C72 C71 124.4(7) . . ?
C73 C72 Ag5 71.2(5) . . ?
C71 C72 Ag5 106.8(5) . . ?
C72 C73 Ag5 76.2(5) . . ?
N7 C74 C75 113.0(6) . . ?
C76 C75 C74 124.5(7) . . ?
C76 C75 Ag5 73.2(5) . . ?
C74 C75 Ag5 105.8(5) . . ?
C75 C76 Ag5 74.2(5) . . ?
N8 C81 C82 113.1(6) . . ?
C83 C82 C81 126.3(7) . . ?
C82 C83 Ag2 87.8(5) . . ?
N8 C84 C85 114.3(6) . . ?
C86 C85 C84 124.4(7) . . ?
C86 C85 Ag3 71.9(4) . . ?
C84 C85 Ag3 104.8(4) . . ?
C85 C86 Ag3 78.6(4) . . ?
N9 C91 C92 115.2(6) . . ?
C93 C92 C91 124.4(7) . . ?
C93 C92 Ag2 72.3(4) . . ?
C91 C92 Ag2 108.6(4) . . ?
C92 C93 Ag2 75.2(4) . . ?
N9 C94 C95 113.3(5) . . ?
C96 C95 C94 124.0(6) . . ?
C96 C95 Ag3 75.2(4) . . ?
C94 C95 Ag3 107.2(4) . . ?
C95 C96 Ag3 73.5(4) . . ?
O14 Cl1 O12 109.7(4) . . ?
O14 Cl1 O13 111.3(5) . . ?
O12 Cl1 O13 110.5(4) . . ?
O14 Cl1 O11 109.2(4) . . ?
O12 Cl1 O11 108.2(4) . . ?
O13 Cl1 O11 107.8(4) . . ?
Cl1 O11 Ag1 124.2(3) . . ?
O24 Cl2 O23 109.2(5) . . ?
O24 Cl2 O21 110.0(4) . . ?
O23 Cl2 O21 109.5(4) . . ?
O24 Cl2 O22 108.0(4) . . ?
O23 Cl2 O22 110.4(4) . . ?
O21 Cl2 O22 109.8(4) . . ?
O32 Cl3 O31 110.4(4) . . ?
O32 Cl3 O33 109.5(4) . . ?
O31 Cl3 O33 109.8(4) . . ?
O32 Cl3 O34 109.6(5) . . ?
O31 Cl3 O34 108.8(4) . . ?
O33 Cl3 O34 108.7(4) . . ?
O43 Cl4 O41 108.4(4) . . ?
O43 Cl4 O44 109.9(5) . . ?
O41 Cl4 O44 110.4(6) . . ?
O43 Cl4 O42 111.8(5) . . ?
O41 Cl4 O42 107.2(5) . . ?
O44 Cl4 O42 109.1(6) . . ?
O54 Cl5 O51 113.7(6) . . ?
O54 Cl5 O52 110.2(5) . . ?
O51 Cl5 O52 110.5(4) . . ?
O54 Cl5 O53 106.9(5) . . ?
O51 Cl5 O53 105.9(4) . . ?
O52 Cl5 O53 109.3(5) . . ?
C1 O1 Ag4 115.8(6) . . ?
C2 O2 Ag5 121.8(5) . . ?
O6 C6 O6' 55.6(10) . . ?

_diffrn_measured_fraction_theta_max 0.992
_diffrn_reflns_theta_full        25.03
_diffrn_measured_fraction_theta_full 0.992
_refine_diff_density_max         2.243
_refine_diff_density_min         -1.601
_refine_diff_density_rms         0.143

#===END