# Supplementary Material (ESI) for ChemComm
# This journal is © The Royal Society of Chemistry 1999
# CCDC Number: 182/1403

data_quinag

_audit_creation_method            SHELXL

_chemical_name_systematic
;
 ?
;
_chemical_name_common             ?

_chemical_formula_moiety          ?
_chemical_formula_structural      ?

_chemical_formula_analytical      ?
_chemical_formula_sum  'C45.50 H36.75 Ag F6 N4.25 P'
_chemical_formula_weight      895.88

_chemical_melting_point           ?
_chemical_compound_source         ?


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'
 'F' 'F'   0.0171   0.0103
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'P'  'P'   0.1023   0.0942
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Ag'  'Ag'  -0.8971   1.1015
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting   Triclinic
_symmetry_space_group_name_H-M    P-1

loop_

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

_cell_length_a
13.351(3)
_cell_length_b                    15.931(3)

_cell_length_c                    20.478(3)
_cell_angle_alpha
86.741(5)
_cell_angle_beta                  83.700(5)

_cell_angle_gamma                 73.329(5)
_cell_volume
4145.8(14)
_cell_formula_units_Z             4

_cell_measurement_temperature     180(2)
_cell_measurement_reflns_used
5622
_cell_measurement_theta_min       3
_cell_measurement_theta_max
15

_exptl_crystal_description        platesd
_exptl_crystal_colour
brown
_exptl_crystal_size_max           0.3
_exptl_crystal_size_mid
0.2
_exptl_crystal_size_min
0.1
_exptl_crystal_density_meas       ?
_exptl_crystal_density_diffrn
1.435
_exptl_crystal_density_method     ?
_exptl_crystal_F_000
1822
_exptl_absorpt_coefficient_mu     0.589

_exptl_absorpt_correction_type    psi-scan
_exptl_absorpt_correction_T_min
0.73
_exptl_absorpt_correction_T_max   0.93

_exptl_special_details
;

?
;

_diffrn_ambient_temperature       180(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
?
_diffrn_measurement_method        ?
_diffrn_standards_number
?
_diffrn_standards_interval_count  ?
_diffrn_standards_interval_time
?
_diffrn_standards_decay_%         ?
_diffrn_reflns_number
16667
_diffrn_reflns_av_R_equivalents   0.0539

_diffrn_reflns_av_sigmaI/netI     0.1388
_diffrn_reflns_limit_h_min
-17
_diffrn_reflns_limit_h_max        17
_diffrn_reflns_limit_k_min
-21
_diffrn_reflns_limit_k_max        18
_diffrn_reflns_limit_l_min
-21
_diffrn_reflns_limit_l_max        27
_diffrn_reflns_theta_min
1.65
_diffrn_reflns_theta_max          22.50
_reflns_number_total
10674
_reflns_number_observed           5837

_reflns_observed_criterion        >2sigma(I)

_computing_data_collection
?
_computing_cell_refinement        ?
_computing_data_reduction
?
_computing_structure_solution     'SHELXS-96 (Sheldrick, 1990)'

_computing_structure_refinement   'SHELXL-96 (Sheldrick, 1996)'

_computing_molecular_graphics     ?
_computing_publication_material   ?


_refine_special_details
;
 Refinement of F^2^ against ALL reflections.
Weighted R-factors wR and all
 goodnesses 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 observed criterion
 of F^2^ > 2sigma(F^2^) is used only for
calculating _R_factor_obs 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.

 Three fully occpuied (as shown by test refinement) but
highly mobile
benzene molecules and one 50% occupied acetonitrile molecule
were located.
The PF6 groups also have very high thermal parameters.

;


_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type
full
_refine_ls_weighting_scheme
 'calc w=1/[\s^2^(Fo^2^)+(0.1000P)^2^+1.4000P] 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     ?
_refine_ls_extinction_method
none
_refine_ls_extinction_coef        ?
_refine_ls_number_reflns
10674
_refine_ls_number_parameters      992
_refine_ls_number_restraints
36
_refine_ls_R_factor_all           0.1488
_refine_ls_R_factor_obs
0.0744
_refine_ls_wR_factor_all          0.2093

_refine_ls_wR_factor_obs          0.1736
_refine_ls_goodness_of_fit_all
0.997
_refine_ls_goodness_of_fit_obs    1.156

_refine_ls_restrained_S_all       0.997
_refine_ls_restrained_S_obs
1.156
_refine_ls_shift/esd_max          0.532
_refine_ls_shift/esd_mean
0.024

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_thermal_displace_type

_atom_site_occupancy
 _atom_site_calc_flag
 _atom_site_refinement_flags

_atom_site_disorder_group
Ag1 Ag 0.03610(7) 0.16565(5) 0.35880(4)
0.0480(3) Uani 1 d . .
Ag2 Ag 0.84935(7) 0.18443(5) 0.12868(4) 0.0514(3)
Uani 1 d . .
P1 P -0.4143(3) -0.2329(2) 0.2356(2) 0.0743(11) Uani 1 d D .

F11 F -0.4157(7) -0.3293(4) 0.2545(4) 0.121(3) Uani 1 d D .
F12 F
-0.4124(8) -0.1372(4) 0.2172(4) 0.143(4) Uani 1 d D .
F13 F -0.5370(6)
-0.2043(5) 0.2488(5) 0.136(4) Uani 1 d D .
F14 F -0.2937(6) -0.2630(6)
0.2266(6) 0.188(6) Uani 1 d D .
F15 F -0.4220(9) -0.2477(6) 0.1641(4)
0.162(5) Uani 1 d D .
F16 F -0.4108(8) -0.2158(6) 0.3100(4) 0.153(4) Uani
1 d D .
P2 P 0.0939(3) -0.2925(2) 0.2413(2) 0.0758(11) Uani 1 d D .
F21 F
-0.0160(7) -0.2952(8) 0.2254(5) 0.190(5) Uani 1 d D .
F22 F 0.1996(8)
-0.2889(9) 0.2580(6) 0.225(7) Uani 1 d D .
F23 F 0.0926(9) -0.2158(5)
0.1919(5) 0.175(5) Uani 1 d D .
F24 F 0.0944(8) -0.3689(5) 0.2919(5)
0.148(4) Uani 1 d D .
F25 F 0.0400(10) -0.2277(6) 0.2961(5) 0.199(6) Uani
1 d D .
F26 F 0.1431(9) -0.3572(6) 0.1869(5) 0.183(5) Uani 1 d D .
C011 C
0.0586(8) 0.3164(6) 0.5611(5) 0.086(5) Uani 1 d G .
H01A H -0.0021 0.2967
0.5712 0.103 Uiso 1 d G .
C012 C 0.0608(8) 0.3770(6) 0.5129(5) 0.086(5)
Uani 1 d G .
H01B H 0.0006 0.3998 0.4896 0.104 Uiso 1 d G .
C013 C
0.1493(11) 0.4078(5) 0.4957(4) 0.089(5) Uani 1 d G .
H01C H 0.1491 0.4503
0.4611 0.107 Uiso 1 d G .
C014 C 0.2350(8) 0.3757(7) 0.5295(6) 0.088(5)
Uani 1 d G .
H01D H 0.2953 0.3961 0.5192 0.106 Uiso 1 d G .
C015 C
0.2339(8) 0.3116(7) 0.5800(5) 0.086(5) Uani 1 d G .
H01E H 0.2940 0.2879
0.6032 0.104 Uiso 1 d G .
C016 C 0.1445(10) 0.2832(5) 0.5957(4) 0.092(5)
Uani 1 d G .
H01F H 0.1430 0.2410 0.6301 0.110 Uiso 1 d G .
C021 C
0.4429(8) 0.2899(9) 0.2828(8) 0.165(13) Uani 1 d G .
H02A H 0.4874 0.2453
0.3077 0.198 Uiso 1 d G .
C022 C 0.3974(11) 0.2755(6) 0.2293(8) 0.128(10)
Uani 1 d G .
H02B H 0.4117 0.2165 0.2163 0.153 Uiso 1 d G .
C023 C
0.3375(10) 0.3349(13) 0.1955(5) 0.128(8) Uani 1 d G .
H02C H 0.3100 0.3190
0.1587 0.154 Uiso 1 d G .
C024 C 0.3132(8) 0.4179(10) 0.2110(7) 0.114(6)
Uani 1 d G .
H02D H 0.2668 0.4599 0.1853 0.137 Uiso 1 d G .
C025 C
0.3501(11) 0.4460(6) 0.2605(8) 0.098(5) Uani 1 d G .
H02E H 0.3324 0.5066
0.2697 0.118 Uiso 1 d G .
C026 C 0.4128(10) 0.3858(12) 0.2968(5) 0.125(7)
Uani 1 d G .
H02F H 0.4396 0.4042 0.3329 0.150 Uiso 1 d G .
C031 C
1.219(3) 0.5317(10) 0.0325(7) 0.164(11) Uani 1 d G .
H03A H 1.1919 0.5907
0.0461 0.197 Uiso 1 d G .
C032 C 1.325(3) 0.505(3) 0.0308(10) 0.220(15)
Uani 1 d G .
H03B H 1.3655 0.5387 0.0455 0.264 Uiso 1 d G .
C033 C
1.3659(13) 0.423(3) 0.0053(11) 0.26(2) Uani 1 d G .
H03C H 1.4396 0.3994
-0.0042 0.309 Uiso 1 d G .
C034 C 1.304(3) 0.3793(10) -0.0054(9) 0.34(3)
Uani 1 d G .
H03D H 1.3374 0.3227 -0.0221 0.409 Uiso 1 d G .
C035 C
1.187(3) 0.401(3) 0.0037(10) 0.28(3) Uani 1 d G .
H03E H 1.1461 0.3620
-0.0004 0.336 Uiso 1 d G .
C036 C 1.1430(15) 0.500(3) 0.0210(10) 0.233(18)
Uani 1 d G .
H03F H 1.0710 0.5331 0.0228 0.279 Uiso 1 d G .
C041 C
-0.3114(19) 0.4183(9) 0.5191(15) 0.23(2) Uani 1 d G .
H04A H -0.2687
0.4432 0.4883 0.270 Uiso 1 d G .
C042 C -0.385(2) 0.3952(12) 0.5000(6)
0.219(18) Uani 1 d G .
H04B H -0.3953 0.4138 0.4557 0.263 Uiso 1 d G .

C043 C -0.4554(16) 0.3514(16) 0.5243(18) 0.238(16) Uani 1 d G .
H04C H
-0.4969 0.3243 0.5027 0.286 Uiso 1 d G .
C044 C -0.4471(15) 0.3587(9)
0.5937(14) 0.169(11) Uani 1 d G .
H04D H -0.5044 0.3474 0.6208 0.203 Uiso
1 d G .
C045 C -0.382(3) 0.3767(11) 0.6263(6) 0.143(10) Uani 1 d G .
H04E
H -0.3865 0.3717 0.6729 0.172 Uiso 1 d G .
C046 C -0.2909(16) 0.4079(13)
0.5855(18) 0.210(14) Uani 1 d G .
H04F H -0.2323 0.4179 0.6029 0.252 Uiso
1 d G .
N001 N 0.7138(17) 0.2608(13) -0.0451(11) 0.077(6) Uiso 0.50 d P .

C051 C 0.6678(18) 0.2845(13) -0.0887(11) 0.049(6) Uiso 0.50 d P .
C052 C
0.6206(19) 0.3200(15) -0.1357(11) 0.065(7) Uiso 0.50 d P .
H05A H 0.5913
0.2784 -0.1550 0.097 Uiso 0.50 calc PR .
H05B H 0.6693 0.3386 -0.1687
0.097 Uiso 0.50 calc PR .
H05C H 0.5635 0.3712 -0.1208 0.097 Uiso 0.50
calc PR .
N11 N -0.0425(6) 0.0670(5) 0.4114(4) 0.039(2) Uani 1 d . .
C12
C -0.1145(8) 0.0824(7) 0.4660(5) 0.039(3) Uani 1 d . .
C13 C -0.1413(9)
0.1644(7) 0.4957(6) 0.056(3) Uani 1 d . .
H13A H -0.1095 0.2080 0.4778
0.067 Uiso 1 calc R .
C14 C -0.2124(10) 0.1823(8) 0.5501(7) 0.075(4) Uani
1 d . .
H14A H -0.2282 0.2373 0.5706 0.090 Uiso 1 calc R .
C15 C
-0.2619(10) 0.1189(10) 0.5754(6) 0.076(4) Uani 1 d . .
H15A H -0.3132
0.1326 0.6122 0.091 Uiso 1 calc R .
C16 C -0.2385(9) 0.0380(9) 0.5487(6)
0.065(4) Uani 1 d . .
H16A H -0.2722 -0.0039 0.5675 0.078 Uiso 1 calc R .

C17 C -0.1636(9) 0.0167(7) 0.4929(6) 0.049(3) Uani 1 d . .
C18 C
-0.1329(10) -0.0644(7) 0.4629(6) 0.058(3) Uani 1 d . .
H18A H -0.1600
-0.1106 0.4810 0.069 Uiso 1 calc R .
C19 C -0.0635(9) -0.0777(7) 0.4072(6)
0.049(3) Uani 1 d . .
H19A H -0.0450 -0.1320 0.3856 0.059 Uiso 1 calc R .

C110 C -0.0199(8) -0.0104(6) 0.3824(5) 0.041(3) Uani 1 d . .
C111 C
0.0516(8) -0.0246(7) 0.3234(5) 0.040(3) Uani 1 d . .
H11A H 0.0750 -0.0806
0.3042 0.048 Uiso 1 calc R .
N112 N 0.0836(6) 0.0404(5) 0.2968(4) 0.038(2)
Uani 1 d . .
C113 C 0.1582(8) 0.0292(6) 0.2397(5) 0.036(2) Uani 1 d . .

C114 C 0.2351(8) -0.0487(7) 0.2251(5) 0.047(3) Uani 1 d . .
H11B H 0.2365
-0.1003 0.2511 0.056 Uiso 1 calc R .
C115 C 0.3100(8) -0.0504(7) 0.1718(6)
0.053(3) Uani 1 d . .
H11C H 0.3639 -0.1033 0.1626 0.063 Uiso 1 calc R .

C116 C 0.3079(8) 0.0223(7) 0.1324(5) 0.045(3) Uani 1 d . .
C117 C
0.2309(8) 0.0992(7) 0.1471(5) 0.045(3) Uani 1 d . .
H11D H 0.2279 0.1496
0.1194 0.054 Uiso 1 calc R .
C118 C 0.1580(8) 0.1046(6) 0.2012(5) 0.040(3)
Uani 1 d . .
H11F H 0.1081 0.1590 0.2122 0.048 Uiso 1 calc R .
C119 C
0.3916(9) 0.0192(8) 0.0760(6) 0.062(3) Uani 1 d . .
H11G H 0.3573 0.0411
0.0355 0.075 Uiso 1 calc R .
H11H H 0.4333 -0.0425 0.0693 0.075 Uiso 1
calc R .
C120 C 0.4658(8) 0.0734(8) 0.0869(5) 0.048(3) Uani 1 d . .
C121
C 0.5305(8) 0.0516(7) 0.1368(6) 0.054(3) Uani 1 d . .
H12A H 0.5309 0.0006
0.1633 0.065 Uiso 1 calc R .
C122 C 0.5941(9) 0.1009(7) 0.1494(6) 0.052(3)
Uani 1 d . .
H12C H 0.6374 0.0847 0.1845 0.063 Uiso 1 calc R .
C123 C
0.5953(8) 0.1767(7) 0.1096(6) 0.048(3) Uani 1 d . .
C124 C 0.5302(9)
0.1991(7) 0.0600(5) 0.053(3) Uani 1 d . .
H12B H 0.5290 0.2501 0.0333
0.063 Uiso 1 calc R .
C125 C 0.4668(9) 0.1477(8) 0.0488(6) 0.064(4) Uani 1
d . .
H12F H 0.4227 0.1638 0.0140 0.077 Uiso 1 calc R .
N126 N 0.6626(6)
0.2282(6) 0.1227(4) 0.045(2) Uani 1 d . .
C127 C 0.6247(8) 0.3103(7)
0.1264(5) 0.050(3) Uani 1 d . .
H12G H 0.5523 0.3358 0.1213 0.060 Uiso 1
calc R .
C128 C 0.6899(9) 0.3674(6) 0.1383(5) 0.047(3) Uani 1 d . .
N129
N 0.7927(7) 0.3311(5) 0.1411(4) 0.046(2) Uani 1 d . .
C130 C 0.8538(9)
0.3840(7) 0.1505(5) 0.041(3) Uani 1 d . .
C131 C 0.9625(10) 0.3459(8)
0.1542(5) 0.064(4) Uani 1 d . .
H13B H 0.9917 0.2843 0.1504 0.077 Uiso 1
calc R .
C132 C 1.0266(11) 0.3980(10) 0.1632(6) 0.082(4) Uani 1 d . .

H13D H 1.0995 0.3720 0.1664 0.099 Uiso 1 calc R .
C133 C 0.9839(15)
0.4895(10) 0.1676(6) 0.085(5) Uani 1 d . .
H13E H 1.0290 0.5247 0.1728
0.102 Uiso 1 calc R .
C134 C 0.8796(14) 0.5286(9) 0.1646(6) 0.077(4) Uani
1 d . .
H13F H 0.8521 0.5902 0.1689 0.092 Uiso 1 calc R .
C135 C
0.8119(12) 0.4773(8) 0.1552(5) 0.061(3) Uani 1 d . .
C136 C 0.7044(12)
0.5115(7) 0.1516(6) 0.068(4) Uani 1 d . .
H13G H 0.6727 0.5728 0.1552
0.081 Uiso 1 calc R .
C137 C 0.6447(10) 0.4582(7) 0.1431(6) 0.067(4) Uani
1 d . .
H13H H 0.5714 0.4825 0.1403 0.080 Uiso 1 calc R .
N21 N 0.9937(6)
0.0940(6) 0.0725(4) 0.046(2) Uani 1 d . .
C22 C 1.0515(8) 0.1185(7)
0.0180(5) 0.044(3) Uani 1 d . .
C23 C 1.0145(10) 0.2036(8) -0.0093(6)
0.060(3) Uani 1 d . .
H23A H 0.9522 0.2428 0.0104 0.072 Uiso 1 calc R .

C24 C 1.0664(12) 0.2298(9) -0.0628(6) 0.074(4) Uani 1 d . .
H24A H 1.0396
0.2870 -0.0810 0.089 Uiso 1 calc R .
C25 C 1.1604(12) 0.1732(11)
-0.0926(7) 0.082(4) Uani 1 d . .
H25A H 1.1977 0.1934 -0.1295 0.099 Uiso 1
calc R .
C26 C 1.1977(10) 0.0896(10) -0.0682(6) 0.066(4) Uani 1 d . .

H26A H 1.2605 0.0515 -0.0883 0.079 Uiso 1 calc R .
C27 C 1.1410(8)
0.0592(7) -0.0116(5) 0.046(3) Uani 1 d . .
C28 C 1.1719(8) -0.0257(8)
0.0164(6) 0.053(3) Uani 1 d . .
H28A H 1.2336 -0.0667 -0.0023 0.064 Uiso 1
calc R .
C29 C 1.1164(8) -0.0507(7) 0.0691(6) 0.051(3) Uani 1 d . .
H29A
H 1.1360 -0.1090 0.0866 0.061 Uiso 1 calc R .
C210 C 1.0273(8) 0.0137(7)
0.0974(5) 0.042(3) Uani 1 d . .
C211 C 0.9659(8) -0.0081(6) 0.1567(5)
0.039(3) Uani 1 d . .
H21A H 0.9819 -0.0669 0.1732 0.047 Uiso 1 calc R .

N212 N 0.8918(6) 0.0503(5) 0.1864(4) 0.038(2) Uani 1 d . .
C213 C
0.8270(7) 0.0301(6) 0.2424(5) 0.035(2) Uani 1 d . .
C214 C 0.7770(8)
0.0973(6) 0.2833(5) 0.042(3) Uani 1 d . .
H21B H 0.7898 0.1529 0.2754
0.050 Uiso 1 calc R .
C215 C 0.7073(8) 0.0853(7) 0.3366(5) 0.047(3) Uani 1
d . .
H21D H 0.6742 0.1324 0.3651 0.057 Uiso 1 calc R .
C216 C 0.6862(8)
0.0058(7) 0.3481(5) 0.042(3) Uani 1 d . .
C217 C 0.7361(9) -0.0599(7)
0.3057(6) 0.050(3) Uani 1 d . .
H21E H 0.7215 -0.1149 0.3128 0.060 Uiso 1
calc R .
C218 C 0.8063(8) -0.0504(6) 0.2533(5) 0.044(3) Uani 1 d . .
H21F
H 0.8398 -0.0979 0.2252 0.052 Uiso 1 calc R .
C219 C 0.6048(8) -0.0055(7)
0.4033(6) 0.056(3) Uani 1 d . .
H21G H 0.6044 -0.0677 0.4066 0.067 Uiso 1
calc R .
H21H H 0.6244 0.0095 0.4455 0.067 Uiso 1 calc R .
C220 C
0.4959(8) 0.0516(6) 0.3923(5) 0.040(3) Uani 1 d . .
C221 C 0.4452(8)
0.0376(6) 0.3400(5) 0.044(3) Uani 1 d . .
H22A H 0.4799 -0.0083 0.3108
0.052 Uiso 1 calc R .
C222 C 0.3449(8) 0.0893(6) 0.3297(5) 0.041(3) Uani 1
d . .
H22B H 0.3094 0.0767 0.2954 0.049 Uiso 1 calc R .
C223 C 0.2966(8)
0.1603(6) 0.3706(5) 0.037(3) Uani 1 d . .
C224 C 0.3478(9) 0.1745(6)
0.4236(5) 0.044(3) Uani 1 d . .
H22C H 0.3149 0.2215 0.4522 0.053 Uiso 1
calc R .
C225 C 0.4451(8) 0.1203(7) 0.4338(5) 0.049(3) Uani 1 d . .
H22D
H 0.4787 0.1298 0.4701 0.058 Uiso 1 calc R .
N226 N 0.1919(6) 0.2118(5)
0.3599(4) 0.039(2) Uani 1 d . .
C227 C 0.1735(8) 0.2952(6) 0.3526(5)
0.041(3) Uani 1 d . .
H22E H 0.2295 0.3209 0.3528 0.049 Uiso 1 calc R .

C228 C 0.0677(8) 0.3513(6) 0.3439(5) 0.038(3) Uani 1 d . .
N229 N
-0.0092(6) 0.3120(5) 0.3442(4) 0.037(2) Uani 1 d . .
C230 C -0.1076(9)
0.3635(6) 0.3355(5) 0.043(3) Uani 1 d . .
C231 C -0.1900(8) 0.3235(7)
0.3323(5) 0.050(3) Uani 1 d . .
H23B H -0.1745 0.2616 0.3375 0.059 Uiso 1
calc R .
C232 C -0.2886(9) 0.3699(8) 0.3220(6) 0.062(3) Uani 1 d . .
H23D
H -0.3412 0.3413 0.3190 0.075 Uiso 1 calc R .
C233 C -0.3126(10) 0.4632(8)
0.3159(6) 0.066(4) Uani 1 d . .
H23E H -0.3817 0.4969 0.3082 0.079 Uiso 1
calc R .
C234 C -0.2389(10) 0.5035(7) 0.3207(5) 0.056(3) Uani 1 d . .

H23C H -0.2581 0.5658 0.3188 0.067 Uiso 1 calc R .
C235 C -0.1326(9)
0.4565(6) 0.3286(5) 0.046(3) Uani 1 d . .
C236 C -0.0501(9) 0.4939(7)
0.3293(5) 0.051(3) Uani 1 d . .
H23H H -0.0635 0.5556 0.3243 0.061 Uiso 1
calc R .
C237 C 0.0489(9) 0.4434(6) 0.3372(5) 0.041(3) Uani 1 d . .
H23I
H 0.1045 0.4694 0.3381 0.049 Uiso 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 0.0450(6) 0.0289(4) 0.0700(7) -0.0044(4)
0.0035(5) -0.0129(4)
Ag2 0.0396(6) 0.0391(5) 0.0693(7) 0.0009(5) 0.0004(5)
-0.0039(4)
P1 0.076(3) 0.047(2) 0.098(3) 0.013(2) -0.025(2) -0.0109(19)

F11 0.130(8) 0.049(4) 0.167(8) -0.004(5) 0.042(6) -0.018(5)
F12 0.254(13)
0.051(5) 0.143(8) 0.026(5) -0.070(8) -0.060(6)
F13 0.075(7) 0.117(7)
0.176(9) 0.012(7) -0.013(6) 0.035(5)
F14 0.065(7) 0.155(9) 0.320(16)
0.123(10) -0.011(8) -0.019(6)
F15 0.279(15) 0.176(10) 0.074(7) -0.019(6)
-0.010(8) -0.133(10)
F16 0.205(12) 0.184(10) 0.117(8) 0.031(7) -0.062(8)
-0.121(9)
P2 0.085(3) 0.0352(18) 0.105(3) -0.007(2) -0.007(2) -0.0125(18)

F21 0.089(9) 0.286(15) 0.185(11) -0.008(11) -0.024(8) -0.033(9)
F22
0.166(12) 0.330(18) 0.247(14) 0.117(14) -0.111(12) -0.167(13)
F23
0.237(13) 0.073(6) 0.189(11) 0.067(7) -0.013(9) -0.019(7)
F24 0.185(11)
0.078(6) 0.177(10) 0.049(6) -0.004(8) -0.044(6)
F25 0.299(17) 0.104(7)
0.191(11) -0.075(8) 0.110(11) -0.089(9)
F26 0.228(14) 0.126(8) 0.195(11)
-0.075(8) 0.102(10) -0.082(9)
C011 0.117(14) 0.051(8) 0.088(11) 0.001(8)
-0.029(10) -0.015(8)
C012 0.130(15) 0.055(9) 0.070(10) 0.002(8) -0.032(10)
-0.011(9)
C013 0.130(15) 0.060(9) 0.077(11) -0.009(8) -0.015(11)
-0.025(10)
C014 0.110(14) 0.063(9) 0.094(12) -0.010(9) -0.012(10)
-0.027(9)
C015 0.104(14) 0.057(9) 0.088(12) -0.036(9) -0.037(10) 0.011(8)

C016 0.119(15) 0.049(8) 0.107(13) -0.001(8) -0.027(12) -0.019(10)
C021
0.041(10) 0.19(2) 0.20(2) 0.16(2) 0.039(13) 0.018(13)
C022 0.110(19)
0.034(8) 0.19(2) 0.019(11) 0.093(16) 0.013(9)
C023 0.099(17) 0.177(19)
0.113(15) -0.069(18) 0.061(13) -0.061(17)
C024 0.067(12) 0.117(16)
0.143(19) 0.000(13) 0.009(12) -0.011(12)
C025 0.095(14) 0.061(9) 0.144(17)
-0.001(11) -0.022(11) -0.028(9)
C026 0.079(14) 0.21(2) 0.113(14) 0.048(16)
-0.033(11) -0.085(15)
C031 0.19(3) 0.18(2) 0.098(17) -0.015(15) 0.00(2)
-0.02(2)
C032 0.27(5) 0.21(4) 0.13(2) 0.00(2) -0.02(3) 0.02(3)
C033
0.28(4) 0.25(4) 0.15(3) 0.04(3) -0.02(3) 0.08(4)
C034 0.56(10) 0.20(3)
0.25(4) 0.12(3) -0.17(6) -0.07(4)
C035 0.57(9) 0.27(5) 0.072(18) 0.04(3)
-0.01(3) -0.25(5)
C036 0.23(4) 0.34(6) 0.11(2) 0.03(3) 0.00(2) -0.08(4)

C041 0.29(5) 0.076(15) 0.28(5) 0.00(3) 0.09(3) -0.05(2)
C042 0.20(4)
0.19(3) 0.17(2) 0.12(2) 0.03(2) 0.05(2)
C043 0.12(2) 0.29(4) 0.26(4)
0.01(4) -0.01(3) 0.00(2)
C044 0.098(19) 0.18(2) 0.16(2) -0.06(2) 0.056(18)
0.043(15)
C045 0.24(3) 0.066(11) 0.083(13) -0.028(10) 0.016(19) 0.020(15)

C046 0.24(4) 0.13(2) 0.24(4) -0.07(3) 0.01(4) -0.03(2)
N11 0.033(5)
0.033(5) 0.050(6) 0.000(4) -0.014(5) -0.006(4)
C12 0.026(6) 0.049(7)
0.040(7) 0.004(6) -0.007(5) -0.005(5)
C13 0.050(8) 0.040(7) 0.065(9)
-0.001(6) 0.007(7) 0.000(6)
C14 0.072(10) 0.055(8) 0.085(11) -0.001(8)
0.018(8) -0.006(7)
C15 0.055(9) 0.090(11) 0.058(9) 0.012(9) 0.013(7)
0.008(8)
C16 0.043(8) 0.077(9) 0.064(9) 0.020(8) 0.005(7) -0.005(7)
C17
0.041(7) 0.052(7) 0.055(8) 0.020(6) -0.016(6) -0.015(6)
C18 0.072(9)
0.040(7) 0.066(9) 0.023(7) -0.017(8) -0.024(6)
C19 0.060(8) 0.036(6)
0.056(8) 0.009(6) -0.017(7) -0.020(6)
C110 0.047(7) 0.034(6) 0.045(7)
0.010(6) -0.023(6) -0.011(5)
C111 0.039(7) 0.038(6) 0.043(7) -0.005(5)
-0.006(6) -0.010(5)
N112 0.025(5) 0.042(5) 0.047(6) 0.002(5) -0.019(4)
-0.007(4)
C113 0.030(6) 0.038(6) 0.043(7) -0.005(5) -0.010(5) -0.013(5)

C114 0.040(7) 0.041(6) 0.056(8) -0.008(6) -0.008(6) -0.003(6)
C115
0.028(7) 0.053(7) 0.069(9) -0.020(7) -0.006(6) 0.006(6)
C116 0.031(7)
0.059(7) 0.046(7) -0.020(6) -0.001(6) -0.014(6)
C117 0.039(7) 0.048(7)
0.050(7) 0.001(6) 0.003(6) -0.015(6)
C118 0.033(7) 0.040(6) 0.044(7)
-0.006(6) -0.006(6) -0.006(5)
C119 0.050(8) 0.080(8) 0.066(9) -0.035(7)
0.006(7) -0.030(7)
C120 0.043(8) 0.066(8) 0.037(7) -0.011(6) -0.001(6)
-0.016(6)
C121 0.038(7) 0.056(7) 0.068(9) -0.019(6) -0.006(7) -0.011(6)

C122 0.047(8) 0.054(7) 0.055(8) -0.003(6) -0.012(6) -0.010(6)
C123
0.023(6) 0.047(7) 0.074(9) -0.019(6) -0.007(6) -0.005(5)
C124 0.050(8)
0.056(7) 0.053(8) -0.001(6) -0.018(7) -0.009(6)
C125 0.053(9) 0.082(9)
0.054(8) -0.021(8) -0.022(7) -0.004(7)
N126 0.036(6) 0.051(6) 0.048(6)
0.002(5) -0.009(4) -0.011(5)
C127 0.032(7) 0.047(7) 0.065(8) -0.008(6)
-0.001(6) 0.000(6)
C128 0.055(8) 0.032(6) 0.052(8) 0.002(5) -0.007(6)
-0.008(6)
N129 0.043(6) 0.046(5) 0.051(6) -0.001(5) -0.005(5) -0.016(5)

C130 0.049(8) 0.052(7) 0.027(6) 0.009(5) 0.000(5) -0.024(6)
C131
0.070(10) 0.080(9) 0.054(8) -0.013(7) -0.004(7) -0.038(8)
C132 0.063(10)
0.115(12) 0.086(11) -0.003(9) -0.008(8) -0.050(10)
C133 0.136(16)
0.084(11) 0.061(10) -0.010(8) 0.011(10) -0.078(11)
C134 0.116(14) 0.064(9)
0.068(10) -0.010(7) -0.004(10) -0.055(10)
C135 0.093(11) 0.061(8) 0.041(8)
0.004(6) -0.013(7) -0.040(8)
C136 0.097(12) 0.040(7) 0.065(9) -0.003(6)
-0.018(8) -0.014(8)
C137 0.067(9) 0.055(8) 0.071(9) 0.001(7) -0.026(7)
0.001(7)
N21 0.034(6) 0.054(6) 0.050(6) -0.016(5) -0.006(5) -0.011(5)
C22
0.030(7) 0.066(8) 0.039(7) -0.004(6) -0.003(6) -0.020(6)
C23 0.059(9)
0.074(9) 0.044(8) -0.008(7) 0.008(7) -0.018(7)
C24 0.089(11) 0.067(9)
0.062(9) -0.004(8) 0.022(8) -0.026(8)
C25 0.095(13) 0.111(12) 0.055(9)
0.003(9) 0.004(9) -0.059(11)
C26 0.052(9) 0.100(11) 0.050(8) -0.019(8)
0.014(7) -0.033(8)
C27 0.038(7) 0.059(7) 0.042(7) -0.020(6) 0.002(6)
-0.014(6)
C28 0.024(7) 0.083(9) 0.054(8) -0.035(7) 0.005(6) -0.013(6)
C29
0.035(7) 0.049(7) 0.070(9) -0.017(6) 0.001(7) -0.012(6)
C210 0.037(7)
0.043(7) 0.050(7) -0.005(6) -0.018(6) -0.014(6)
C211 0.033(7) 0.036(6)
0.049(7) 0.000(6) -0.006(6) -0.012(5)
N212 0.021(5) 0.042(5) 0.049(6)
-0.005(5) -0.002(4) -0.003(4)
C213 0.026(6) 0.040(6) 0.039(7) -0.014(5)
-0.008(5) -0.006(5)
C214 0.039(7) 0.037(6) 0.051(7) -0.009(6) 0.001(6)
-0.014(5)
C215 0.040(7) 0.046(7) 0.056(8) -0.011(6) -0.003(6) -0.011(6)

C216 0.032(7) 0.053(7) 0.040(7) 0.007(6) -0.012(5) -0.011(6)
C217
0.043(8) 0.044(7) 0.066(9) 0.009(6) -0.017(7) -0.014(6)
C218 0.045(7)
0.032(6) 0.050(7) -0.007(5) -0.005(6) -0.003(5)
C219 0.032(7) 0.063(7)
0.066(8) 0.010(6) -0.003(6) -0.007(6)
C220 0.040(7) 0.042(6) 0.031(6)
0.001(5) 0.008(6) -0.006(5)
C221 0.034(7) 0.045(6) 0.041(7) 0.000(5)
0.007(6) 0.000(5)
C222 0.033(7) 0.032(5) 0.053(7) -0.010(5) 0.001(5)
-0.002(5)
C223 0.035(7) 0.040(6) 0.035(7) 0.002(5) 0.001(5) -0.013(5)

C224 0.046(8) 0.040(6) 0.047(7) -0.001(5) 0.010(6) -0.021(6)
C225
0.037(7) 0.063(7) 0.049(7) 0.008(6) -0.013(6) -0.019(6)
N226 0.028(5)
0.036(5) 0.050(6) -0.007(4) 0.003(4) -0.009(4)
C227 0.035(7) 0.043(7)
0.050(7) 0.003(5) -0.003(5) -0.022(5)
C228 0.045(7) 0.025(5) 0.048(7)
-0.003(5) -0.003(6) -0.016(5)
N229 0.031(5) 0.037(5) 0.037(5) -0.002(4)
0.005(4) -0.003(4)
C230 0.045(8) 0.045(7) 0.039(7) -0.012(5) 0.000(6)
-0.013(6)
C231 0.037(7) 0.046(6) 0.067(8) -0.007(6) -0.007(6) -0.012(6)

C232 0.041(8) 0.073(9) 0.070(9) -0.011(7) -0.011(7) -0.008(7)
C233
0.043(8) 0.072(9) 0.073(9) -0.012(7) -0.010(7) 0.002(7)
C234 0.059(9)
0.042(6) 0.056(8) -0.009(6) -0.014(7) 0.006(6)
C235 0.055(8) 0.033(6)
0.042(7) -0.006(5) -0.010(6) 0.002(6)
C236 0.065(9) 0.035(6) 0.053(8)
0.006(6) -0.014(7) -0.014(6)
C237 0.052(8) 0.028(6) 0.050(7) 0.007(5)
-0.016(6) -0.020(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 N229 2.246(7) . Y
Ag1 N11 2.289(8) . Y
Ag1 N112 2.319(8) . Y
Ag1
N226 2.398(8) . Y
Ag2 N129 2.261(8) . Y
Ag2 N21 2.285(8) . Y
Ag2 N212
2.334(8) . Y
Ag2 N126 2.403(8) . Y
P1 F15 1.515(8) . ?
P1 F14 1.535(8) .
?
P1 F12 1.555(7) . ?
P1 F11 1.568(7) . ?
P1 F13 1.567(8) . ?
P1 F16
1.572(8) . ?
P2 F22 1.506(9) . ?
P2 F26 1.522(8) . ?
P2 F23 1.539(8) . ?

P2 F25 1.540(8) . ?
P2 F24 1.552(8) . ? 
P2 F21 1.551(9) . ?
C011 C012
1.3454 . ?
C011 C016 1.3723 . ?
C012 C013 1.4079 . ?
C013 C014 1.3603 .
?
C014 C015 1.4128 . ?
C015 C016 1.3937 . ?
C021 C022 1.3708 . ?
C021
C026 1.4996 . ?
C022 C023 1.2760 . ?
C023 C024 1.3165 . ?
C024 C025
1.3266 . ?
C025 C026 1.3290 . ?
C031 C036 1.2962 . ?
C031 C032 1.3521 .
?
C032 C033 1.3720 . ?
C033 C034 1.2704 . ?
C034 C035 1.4894 . ?
C035
C036 1.5669 . ?
C041 C042 1.2538 . ?
C041 C046 1.4090 . ?
C042 C043
1.3574 . ?
C043 C044 1.4508 . ?
C044 C045 1.2591 . ?
C045 C046 1.5764 .
?
N001 C051 1.12(2) . ?
C051 C052 1.23(3) . ?
N11 C110 1.339(12) . ?

N11 C12 1.377(12) . ?
C12 C13 1.407(14) . ?
C12 C17 1.441(13) . ?
C13
C14 1.367(15) . ?
C14 C15 1.406(16) . ?
C15 C16 1.367(16) . ?
C16 C17
1.421(15) . ?
C17 C18 1.395(15) . ?
C18 C19 1.373(15) . ?
C19 C110
1.406(13) . ?
C110 C111 1.442(14) . ?
C111 N112 1.300(11) . ?
N112 C113
1.435(12) . ?
C113 C114 1.388(13) . ?
C113 C118 1.397(12) . ?
C114 C115
1.393(15) . ?
C115 C116 1.368(14) . ?
C116 C117 1.379(14) . ?
C116 C119
1.509(14) . ?
C117 C118 1.383(14) . ?
C119 C120 1.528(14) . ?
C120 C121
1.376(14) . ?
C120 C125 1.384(15) . ?
C121 C122 1.363(14) . ?
C122 C123
1.421(14) . ?
C123 C124 1.374(14) . ?
C123 N126 1.433(12) . ?
C124 C125
1.379(15) . ?
N126 C127 1.263(12) . ?
C127 C128 1.474(14) . ?
C128 N129
1.334(13) . ?
C128 C137 1.404(14) . ?
N129 C130 1.363(12) . ?
C130 C131
1.412(15) . ?
C130 C135 1.435(15) . ?
C131 C132 1.384(15) . ?
C132 C133
1.409(19) . ?
C133 C134 1.360(19) . ?
C134 C135 1.415(16) . ?
C135 C136
1.390(17) . ?
C136 C137 1.349(15) . ?
N21 C210 1.321(12) . ?
N21 C22
1.389(13) . ?
C22 C27 1.394(14) . ?
C22 C23 1.408(15) . ?
C23 C24
1.343(15) . ?
C24 C25 1.416(18) . ?
C25 C26 1.368(17) . ?
C26 C27
1.451(15) . ?
C27 C28 1.405(15) . ?
C28 C29 1.348(14) . ?
C29 C210
1.422(14) . ?
C210 C211 1.472(14) . ?
C211 N212 1.271(11) . ?
N212 C213
1.438(12) . ?
C213 C214 1.365(13) . ?
C213 C218 1.390(13) . ?
C214 C215
1.396(14) . ?
C215 C216 1.377(13) . ?
C216 C217 1.367(14) . ?
C216 C219
1.521(14) . ?
C217 C218 1.376(14) . ?
C219 C220 1.511(13) . ?
C220 C221
1.387(13) . ?
C220 C225 1.390(14) . ?
C221 C222 1.388(13) . ?
C222 C223
1.403(13) . ?
C223 C224 1.404(13) . ?
C223 N226 1.438(12) . ?
C224 C225
1.368(14) . ?
N226 C227 1.284(11) . ?
C227 C228 1.462(13) . ?
C228 N229
1.347(11) . ?
C228 C237 1.417(12) . ?
N229 C230 1.359(12) . ?
C230 C235
1.425(13) . ?
C230 C231 1.430(13) . ?
C231 C232 1.344(14) . ?
C232 C233
1.430(15) . ?
C233 C234 1.334(15) . ?
C234 C235 1.424(14) . ?
C235 C236
1.395(14) . ?
C236 C237 1.357(13) . ?

_refine_diff_density_max    1.070
_refine_diff_density_min   -0.618
_refine_diff_density_rms    0.093