# Supplementary Material (ESI) for Chemical Communications
# This journal is (c) The Royal Society of Chemistry 2007


data_global
_journal_name_full               Chem.Commun.

_journal_coden_Cambridge         0182

_publ_contact_author_name        'Cheng-Yong Su'
_publ_contact_author_address     
;
School of Chemistry and Chemical Engineering
135 Xingang West Road
Guangzhou
510275
CHINA
;

_publ_contact_author_email       CESSCY@MAIL.SYSU.EDU.CN

_publ_section_title              
;
Cocrystallization of two (6, 3) networks showing
structural diversity, Borromean topology and conformational chirality in
the same crystal
;
loop_
_publ_author_name
'Cheng-Yong Su'
'Cui-Ping Guo'
'Bei-Sheng Kang'
'Wei-Sheng Liu'
;
Wei Wang
;
'Qing-Yuan Yang'
'Xue-Li Zhang'

data_1
_database_code_depnum_ccdc_archive 'CCDC 642329'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C194 H160 Ag5 Cl6 F30 N36 O Sb5'
_chemical_formula_weight         4942.38

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'
F F 0.0171 0.0103 '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'
Sb Sb -0.5866 1.5461 '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'

_symmetry_cell_setting           Hexagonal
_symmetry_space_group_name_H-M   P6(3)22

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

_cell_length_a                   17.791(4)
_cell_length_b                   17.791(4)
_cell_length_c                   37.231(15)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_volume                     10206(5)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       Block
_exptl_crystal_colour            Colorless
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.26
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.608
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             4892
_exptl_absorpt_coefficient_mu    1.285
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_min  0.7148
_exptl_absorpt_correction_T_max  0.7311
_exptl_absorpt_process_details   'SADABS Bruker 1997'

_exptl_special_details           
;
?
;

_diffrn_ambient_temperature      173(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  'Apex II'
_diffrn_measurement_method       '\w scan'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        none
_diffrn_reflns_number            65372
_diffrn_reflns_av_R_equivalents  0.1056
_diffrn_reflns_av_sigmaI/netI    0.0552
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -44
_diffrn_reflns_limit_l_max       45
_diffrn_reflns_theta_min         2.35
_diffrn_reflns_theta_max         26.17
_reflns_number_total             6784
_reflns_number_gt                4311
_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.

Sb1 is in a site with imposed 32 symmetry, thus four F atoms are disordered
over two positions required by 32 symmetry. Sb2 and Sb3 are located in a
2-fold symmetry and Sb3 is assigned with 1/6 occupancy. Geometric restraints
were applied to all SbF~6~^-^ anions by using SADI to model it as octahedral.
ISOR in combination of SIMU was applied to all Sb and F atoms to give
isotropic approximation. The chloroform solvent molecule is also located about
a 2-fold symmetry and disordered over four positions. SADI and DIFX
restraints were used to model its C~3v~ symmetry.
;

_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^)+(0.0910P)^2^+53.6227P] 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    geom
_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   -0.03(7)
_refine_ls_number_reflns         6784
_refine_ls_number_parameters     463
_refine_ls_number_restraints     158
_refine_ls_R_factor_all          0.1193
_refine_ls_R_factor_gt           0.0721
_refine_ls_wR_factor_ref         0.2111
_refine_ls_wR_factor_gt          0.1818
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_restrained_S_all      1.047
_refine_ls_shift/su_max          0.033
_refine_ls_shift/su_mean         0.003

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 0.28773(9) 0.14386(4) 0.2500 0.0953(3) Uani 1 2 d S . .
Ag2 Ag 0.6667 0.3333 0.11906(2) 0.0483(2) Uani 1 3 d S . .
N1 N 0.2897(5) 0.1616(4) 0.30570(17) 0.074(2) Uani 1 1 d . . .
N2 N 0.3216(4) 0.2245(4) 0.35781(17) 0.0593(17) Uani 1 1 d . . .
N3 N 0.2609(3) 0.5866(3) 0.36925(14) 0.0414(14) Uani 1 1 d . . .
N4 N 0.5310(3) 0.3082(3) 0.11190(16) 0.0458(15) Uani 1 1 d . . .
N5 N 0.4131(3) 0.2913(3) 0.08339(15) 0.0424(14) Uani 1 1 d . . .
N6 N 0.2583(3) 0.5874(3) 0.04144(14) 0.0347(13) Uani 1 1 d . . .
C1 C 0.3435(6) 0.2307(5) 0.3227(2) 0.070(2) Uani 1 1 d . . .
C2 C 0.2276(5) 0.1059(6) 0.3301(2) 0.069(2) Uani 1 1 d . . .
C3 C 0.2503(4) 0.1474(4) 0.3639(2) 0.0505(19) Uani 1 1 d . . .
C4 C 0.2034(5) 0.1086(6) 0.3942(2) 0.063(2) Uani 1 1 d . . .
H4A H 0.2178 0.1382 0.4166 0.076 Uiso 1 1 calc R . .
C5 C 0.1360(5) 0.0267(6) 0.3912(3) 0.091(3) Uani 1 1 d . . .
H5A H 0.1043 -0.0025 0.4122 0.110 Uiso 1 1 calc R . .
C6 C 0.1120(5) -0.0156(6) 0.3587(3) 0.091(4) Uani 1 1 d . . .
H6A H 0.0629 -0.0723 0.3573 0.110 Uiso 1 1 calc R . .
C7 C 0.1603(6) 0.0252(6) 0.3277(3) 0.082(3) Uani 1 1 d . . .
H7A H 0.1452 -0.0043 0.3053 0.098 Uiso 1 1 calc R . .
C8 C 0.3727(5) 0.2935(4) 0.3849(2) 0.061(2) Uani 1 1 d . . .
H8A H 0.4348 0.3109 0.3830 0.073 Uiso 1 1 calc R . .
H8B H 0.3526 0.2704 0.4093 0.073 Uiso 1 1 calc R . .
C9 C 0.3620(4) 0.3721(4) 0.37869(18) 0.0484(18) Uani 1 1 d . . .
C10 C 0.4329(4) 0.4516(4) 0.3752(2) 0.060(2) Uani 1 1 d . . .
H10A H 0.4885 0.4563 0.3747 0.072 Uiso 1 1 calc R . .
C11 C 0.4280(4) 0.5248(4) 0.3723(2) 0.0475(19) Uani 1 1 d . . .
H11A H 0.4796 0.5798 0.3711 0.057 Uiso 1 1 calc R . .
C12 C 0.3479(4) 0.5198(4) 0.37100(17) 0.0429(17) Uani 1 1 d . . .
C13 C 0.2745(4) 0.4377(4) 0.3741(2) 0.053(2) Uani 1 1 d . . .
H13A H 0.2186 0.4324 0.3737 0.064 Uiso 1 1 calc R . .
C14 C 0.2811(4) 0.3640(5) 0.3778(2) 0.059(2) Uani 1 1 d . . .
H14A H 0.2304 0.3085 0.3796 0.071 Uiso 1 1 calc R . .
C15 C 0.3401(4) 0.5970(4) 0.36939(17) 0.0414(17) Uani 1 1 d . . .
C16 C 0.4892(4) 0.2891(4) 0.08069(19) 0.0426(17) Uani 1 1 d . . .
C17 C 0.4069(4) 0.3142(4) 0.11791(19) 0.0418(17) Uani 1 1 d . . .
C18 C 0.4811(4) 0.3245(4) 0.13563(18) 0.0424(17) Uani 1 1 d . . .
C19 C 0.4942(5) 0.3466(5) 0.1711(2) 0.059(2) Uani 1 1 d . . .
H19A H 0.5438 0.3531 0.1835 0.071 Uiso 1 1 calc R . .
C20 C 0.4328(6) 0.3592(5) 0.1884(2) 0.070(3) Uani 1 1 d . . .
H20A H 0.4413 0.3754 0.2130 0.084 Uiso 1 1 calc R . .
C21 C 0.3600(6) 0.3492(6) 0.1714(2) 0.074(3) Uani 1 1 d . . .
H21A H 0.3189 0.3579 0.1843 0.089 Uiso 1 1 calc R . .
C22 C 0.3464(4) 0.3263(4) 0.1351(2) 0.052(2) Uani 1 1 d . . .
H22A H 0.2964 0.3193 0.1229 0.063 Uiso 1 1 calc R . .
C23 C 0.5186(4) 0.2648(5) 0.04770(17) 0.0547(19) Uani 1 1 d . . .
H23A H 0.5744 0.2680 0.0523 0.082 Uiso 1 1 calc R . .
H23B H 0.5252 0.3047 0.0282 0.082 Uiso 1 1 calc R . .
H23C H 0.4754 0.2054 0.0408 0.082 Uiso 1 1 calc R . .
C24 C 0.3556(4) 0.2828(4) 0.05350(19) 0.0423(18) Uani 1 1 d . . .
H24A H 0.2968 0.2332 0.0582 0.051 Uiso 1 1 calc R . .
H24B H 0.3775 0.2705 0.0311 0.051 Uiso 1 1 calc R . .
C25 C 0.3506(4) 0.3652(4) 0.04875(17) 0.0388(16) Uani 1 1 d . . .
C26 C 0.2713(4) 0.3604(4) 0.0480(2) 0.0462(19) Uani 1 1 d . . .
H26A H 0.2196 0.3057 0.0498 0.055 Uiso 1 1 calc R . .
C27 C 0.2669(4) 0.4351(4) 0.04481(19) 0.0454(18) Uani 1 1 d . . .
H27A H 0.2119 0.4315 0.0441 0.054 Uiso 1 1 calc R . .
C28 C 0.3419(4) 0.5156(3) 0.04261(16) 0.0353(15) Uani 1 1 d . . .
C29 C 0.4223(4) 0.5188(4) 0.04274(18) 0.0410(17) Uani 1 1 d . . .
H29A H 0.4745 0.5732 0.0411 0.049 Uiso 1 1 calc R . .
C30 C 0.4258(4) 0.4431(4) 0.04534(19) 0.0451(19) Uani 1 1 d . . .
H30A H 0.4802 0.4451 0.0447 0.054 Uiso 1 1 calc R . .
C31 C 0.3373(4) 0.5953(4) 0.04199(17) 0.0354(15) Uani 1 1 d . . .
C32 C 0.4225(6) 0.3047(6) 0.3075(3) 0.091(3) Uani 1 1 d . . .
H32A H 0.4247 0.2962 0.2816 0.137 Uiso 1 1 calc R . .
H32B H 0.4739 0.3087 0.3190 0.137 Uiso 1 1 calc R . .
H32C H 0.4213 0.3585 0.3118 0.137 Uiso 1 1 calc R . .
Sb1 Sb 0.6667 0.3333 0.2500 0.0465(3) Uani 1 6 d SDU . .
F1 F 0.6667 0.3333 0.30026(15) 0.0616(18) Uani 1 3 d SDU . .
F2 F 0.6066(3) 0.3934(3) 0.2500 0.106(5) Uani 0.50 2 d SPDU . .
F3 F 0.5480(6) 0.2537(8) 0.2506(8) 0.061(6) Uani 0.25 1 d PDU . .
F4 F 0.7737(8) 0.4348(9) 0.2526(6) 0.031(5) Uani 0.17 1 d PDU . .
Sb2 Sb 0.72682(5) 0.72682(5) 0.0000 0.06428(16) Uani 1 2 d SDU . .
F7 F 0.6789(4) 0.7803(4) -0.02474(19) 0.133(2) Uani 1 1 d DU . .
F5 F 0.7672(6) 0.8113(5) 0.0347(3) 0.193(3) Uani 1 1 d DU . .
F6 F 0.6871(5) 0.6401(5) -0.0338(2) 0.161(3) Uani 1 1 d DU . .
Sb3 Sb 1.15427(15) 0.3085(3) 0.2500 0.1803(16) Uani 0.33 2 d SPDU . .
F8 F 1.2083(4) 0.4167(7) 0.2500 0.210(7) Uani 0.33 2 d SPDU . .
F9 F 1.1661(9) 0.3102(7) 0.2941(3) 0.192(7) Uani 0.33 1 d PDU . .
F10 F 1.0614(6) 0.3078(8) 0.2542(5) 0.179(7) Uani 0.33 1 d PDU . .
F11 F 1.1005(4) 0.2011(8) 0.2500 0.198(7) Uani 0.33 2 d SPDU . .
C33 C 1.4110(3) 0.5890(3) 0.2500 0.24(2) Uiso 0.67 2 d SPD A 1
Cl3 Cl 1.3263(6) 0.5055(6) 0.2246(6) 0.250 Uiso 0.17 1 d PD . 1
Cl2 Cl 1.4945(5) 0.5857(7) 0.2280(6) 0.160(10) Uiso 0.17 1 d PD A 1
Cl1 Cl 1.4132(8) 0.6736(6) 0.2253(7) 0.250 Uiso 0.17 1 d PD . 1
Cl5 Cl 1.3572(9) 0.5534(12) 0.2104(3) 0.250 Uiso 0.33 1 d PD B 2
Cl4 Cl 1.4672(4) 0.5328(4) 0.2500 0.268(14) Uiso 0.33 2 d SPD C 2
O2 O 1.0000 1.0000 0.0000 0.20(2) Uiso 0.50 6 d SP . .
O1 O 1.0000 0.0000 0.2500 0.172(19) Uiso 0.50 6 d SP . .

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 0.1339(10) 0.0941(5) 0.0711(5) -0.0226(5) 0.000 0.0669(5)
Ag2 0.0471(3) 0.0471(3) 0.0507(4) 0.000 0.000 0.02354(13)
N1 0.109(4) 0.074(4) 0.052(4) -0.009(3) 0.000(3) 0.055(3)
N2 0.080(3) 0.056(3) 0.059(4) -0.001(3) 0.008(3) 0.047(2)
N3 0.039(2) 0.049(2) 0.041(3) 0.001(2) 0.000(2) 0.0260(19)
N4 0.037(2) 0.041(3) 0.057(3) -0.006(2) -0.010(2) 0.017(2)
N5 0.043(2) 0.034(2) 0.056(3) 0.005(2) -0.003(2) 0.0233(18)
N6 0.029(2) 0.032(2) 0.039(3) 0.000(2) 0.000(2) 0.0131(17)
C1 0.097(4) 0.060(3) 0.070(5) 0.008(4) 0.014(5) 0.052(3)
C2 0.079(4) 0.061(4) 0.082(5) -0.009(4) -0.015(4) 0.046(3)
C3 0.050(3) 0.053(3) 0.065(5) -0.001(3) 0.000(3) 0.039(2)
C4 0.063(4) 0.063(4) 0.069(5) 0.003(4) 0.002(4) 0.035(3)
C5 0.069(4) 0.111(6) 0.111(8) 0.024(6) 0.014(5) 0.058(4)
C6 0.056(4) 0.070(5) 0.145(9) -0.028(6) -0.020(5) 0.028(4)
C7 0.079(5) 0.080(5) 0.096(7) -0.021(5) -0.023(5) 0.047(4)
C8 0.065(4) 0.051(3) 0.078(6) 0.006(4) 0.001(4) 0.036(3)
C9 0.054(3) 0.032(3) 0.055(4) 0.003(3) 0.007(3) 0.019(2)
C10 0.044(3) 0.057(3) 0.091(6) -0.018(4) -0.007(4) 0.035(3)
C11 0.033(3) 0.039(3) 0.070(5) 0.005(3) 0.000(3) 0.017(2)
C12 0.045(3) 0.048(3) 0.036(3) -0.001(3) -0.003(3) 0.024(2)
C13 0.040(3) 0.043(3) 0.075(5) -0.002(3) -0.003(3) 0.020(3)
C14 0.043(3) 0.043(3) 0.087(6) 0.011(4) 0.002(4) 0.018(3)
C15 0.042(3) 0.046(3) 0.035(3) 0.002(3) 0.004(3) 0.021(2)
C16 0.046(3) 0.034(3) 0.049(4) 0.000(3) -0.001(3) 0.021(2)
C17 0.048(3) 0.030(3) 0.044(3) 0.000(3) 0.002(3) 0.017(2)
C18 0.045(3) 0.031(3) 0.048(4) 0.002(3) 0.003(3) 0.017(2)
C19 0.051(4) 0.054(4) 0.063(5) 0.009(3) 0.003(4) 0.019(3)
C20 0.091(5) 0.070(4) 0.053(5) 0.000(4) 0.004(4) 0.043(4)
C21 0.090(5) 0.092(5) 0.059(4) 0.001(4) 0.006(4) 0.059(4)
C22 0.035(3) 0.041(3) 0.075(5) -0.002(3) -0.005(3) 0.014(3)
C23 0.055(3) 0.068(4) 0.042(3) -0.007(4) -0.001(3) 0.031(3)
C24 0.036(3) 0.031(3) 0.059(4) -0.004(3) -0.015(3) 0.015(2)
C25 0.033(3) 0.031(3) 0.050(3) 0.000(3) -0.008(3) 0.014(2)
C26 0.032(3) 0.033(3) 0.074(5) 0.007(3) 0.005(3) 0.017(2)
C27 0.035(3) 0.037(3) 0.059(4) -0.002(3) -0.002(3) 0.014(2)
C28 0.039(3) 0.031(2) 0.039(3) 0.000(2) -0.005(3) 0.019(2)
C29 0.038(3) 0.030(3) 0.054(4) 0.005(3) 0.002(3) 0.015(2)
C30 0.039(3) 0.043(3) 0.060(4) -0.007(3) 0.000(3) 0.026(2)
C31 0.035(3) 0.035(3) 0.036(3) 0.002(2) 0.006(3) 0.017(2)
C32 0.104(5) 0.073(5) 0.106(8) 0.014(5) 0.036(6) 0.052(4)
Sb1 0.0550(4) 0.0550(4) 0.0295(4) 0.000 0.000 0.02752(18)
F1 0.077(3) 0.077(3) 0.031(3) 0.000 0.000 0.0385(13)
F2 0.129(5) 0.129(5) 0.082(8) -0.009(8) -0.009(8) 0.081(6)
F3 0.062(7) 0.056(10) 0.054(7) 0.003(10) 0.006(9) 0.023(6)
F4 0.040(8) 0.027(7) 0.021(8) 0.002(8) -0.001(8) 0.014(6)
Sb2 0.08744(16) 0.08744(16) 0.0553(4) 0.00215(18) -0.00215(18) 0.0717(2)
F7 0.167(4) 0.165(4) 0.126(5) 0.026(4) -0.005(4) 0.127(3)
F5 0.243(6) 0.170(5) 0.227(8) -0.060(5) -0.108(6) 0.150(4)
F6 0.192(6) 0.147(5) 0.168(6) -0.051(5) -0.062(5) 0.104(4)
Sb3 0.163(2) 0.154(3) 0.221(4) 0.000 0.114(2) 0.0768(17)
F8 0.203(11) 0.175(10) 0.243(11) 0.000 0.048(10) 0.087(5)
F9 0.184(10) 0.186(10) 0.202(10) -0.026(9) 0.059(9) 0.090(8)
F10 0.149(9) 0.176(10) 0.206(10) 0.005(9) 0.040(9) 0.078(7)
F11 0.204(11) 0.171(10) 0.208(11) 0.000 0.059(10) 0.085(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 N1 2.095(6) . ?
Ag1 N1 2.095(6) 12 ?
Ag2 N4 2.240(6) 2_655 ?
Ag2 N4 2.240(6) 3_665 ?
Ag2 N4 2.240(6) . ?
N1 C1 1.284(10) . ?
N1 C2 1.390(10) . ?
N2 C3 1.343(8) . ?
N2 C1 1.354(10) . ?
N2 C8 1.493(10) . ?
N3 C15 1.326(8) . ?
N3 C15 1.341(8) 3_565 ?
N4 C16 1.329(9) . ?
N4 C18 1.382(9) . ?
N5 C17 1.369(9) . ?
N5 C16 1.377(9) . ?
N5 C24 1.468(8) . ?
N6 C31 1.340(8) . ?
N6 C31 1.342(7) 3_565 ?
C1 C32 1.477(12) . ?
C2 C7 1.335(11) . ?
C2 C3 1.414(11) . ?
C3 C4 1.367(10) . ?
C4 C5 1.352(12) . ?
C4 H4A 0.9500 . ?
C5 C6 1.376(15) . ?
C5 H5A 0.9500 . ?
C6 C7 1.405(14) . ?
C6 H6A 0.9500 . ?
C7 H7A 0.9500 . ?
C8 C9 1.520(11) . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 C10 1.352(8) . ?
C9 C14 1.374(11) . ?
C10 C11 1.353(11) . ?
C10 H10A 0.9500 . ?
C11 C12 1.382(10) . ?
C11 H11A 0.9500 . ?
C12 C13 1.395(9) . ?
C12 C15 1.449(11) . ?
C13 C14 1.381(11) . ?
C13 H13A 0.9500 . ?
C14 H14A 0.9500 . ?
C15 N3 1.341(8) 2_665 ?
C16 C23 1.482(10) . ?
C17 C22 1.358(10) . ?
C17 C18 1.404(10) . ?
C18 C19 1.366(10) . ?
C19 C20 1.378(13) . ?
C19 H19A 0.9500 . ?
C20 C21 1.371(13) . ?
C20 H20A 0.9500 . ?
C21 C22 1.399(11) . ?
C21 H21A 0.9500 . ?
C22 H22A 0.9500 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C25 1.523(9) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 C30 1.368(7) . ?
C25 C26 1.371(9) . ?
C26 C27 1.375(10) . ?
C26 H26A 0.9500 . ?
C27 C28 1.389(8) . ?
C27 H27A 0.9500 . ?
C28 C29 1.402(9) . ?
C28 C31 1.462(9) . ?
C29 C30 1.384(10) . ?
C29 H29A 0.9500 . ?
C30 H30A 0.9500 . ?
C31 N6 1.342(7) 2_665 ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
Sb1 F2 1.850(10) 2_655 ?
Sb1 F2 1.850(10) 3_665 ?
Sb1 F2 1.850(10) . ?
Sb1 F4 1.859(10) 3_665 ?
Sb1 F4 1.859(10) 12 ?
Sb1 F4 1.859(10) 10_665 ?
Sb1 F4 1.859(10) . ?
Sb1 F4 1.859(10) 2_655 ?
Sb1 F4 1.859(10) 11_655 ?
Sb1 F3 1.864(9) 11_655 ?
Sb1 F3 1.864(9) 2_655 ?
Sb1 F3 1.864(9) . ?
F2 F4 0.881(19) 2_655 ?
F2 F4 0.88(2) 11_655 ?
F2 F3 1.535(15) 12 ?
F2 F3 1.535(15) 3_665 ?
F3 F4 0.70(2) 10_665 ?
F3 F3 0.72(3) 12 ?
F3 F4 1.39(3) 2_655 ?
F3 F2 1.535(15) 2_655 ?
F4 F3 0.70(2) 10_665 ?
F4 F2 0.881(19) 3_665 ?
F4 F3 1.39(3) 3_665 ?
F4 F4 1.72(4) 12 ?
Sb2 F7 1.815(6) 7 ?
Sb2 F7 1.815(6) . ?
Sb2 F5 1.834(8) . ?
Sb2 F5 1.834(8) 7 ?
Sb2 F6 1.837(7) 7 ?
Sb2 F6 1.837(7) . ?
Sb3 F10 1.653(11) . ?
Sb3 F10 1.653(11) 11_755 ?
Sb3 F9 1.654(11) . ?
Sb3 F9 1.654(11) 11_755 ?
Sb3 F11 1.656(12) . ?
Sb3 F8 1.666(11) . ?
F8 Cl3 2.116(16) . ?
F8 Cl3 2.116(16) 11_755 ?
C33 Cl2 1.725(12) 10_775 ?
C33 Cl2 1.725(12) . ?
C33 Cl1 1.746(13) 10_775 ?
C33 Cl1 1.746(13) . ?
C33 Cl3 1.770(12) 10_775 ?
C33 Cl3 1.770(12) . ?
Cl3 Cl1 2.271(19) 3_775 ?
Cl3 Cl1 2.36(3) 10_775 ?
Cl3 Cl2 2.36(3) 10_775 ?
Cl2 Cl2 2.17(3) 10_775 ?
Cl2 Cl3 2.36(3) 10_775 ?
Cl1 Cl1 2.18(5) 12 ?
Cl1 Cl3 2.271(19) 2_755 ?
Cl1 Cl3 2.36(3) 10_775 ?
Cl1 Cl1 2.36(2) 3_775 ?
Cl1 Cl1 2.36(2) 2_755 ?
Cl1 Cl1 2.40(4) 10_775 ?

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 N1 178.4(4) . 12 ?
N4 Ag2 N4 118.61(6) 2_655 3_665 ?
N4 Ag2 N4 118.61(6) 2_655 . ?
N4 Ag2 N4 118.61(6) 3_665 . ?
C1 N1 C2 107.9(7) . . ?
C1 N1 Ag1 125.4(6) . . ?
C2 N1 Ag1 126.3(5) . . ?
C3 N2 C1 109.5(6) . . ?
C3 N2 C8 126.9(6) . . ?
C1 N2 C8 123.6(6) . . ?
C15 N3 C15 115.7(7) . 3_565 ?
C16 N4 C18 106.1(6) . . ?
C16 N4 Ag2 124.3(5) . . ?
C18 N4 Ag2 128.5(4) . . ?
C17 N5 C16 107.8(5) . . ?
C17 N5 C24 125.9(6) . . ?
C16 N5 C24 125.9(6) . . ?
C31 N6 C31 115.0(6) . 3_565 ?
N1 C1 N2 110.6(7) . . ?
N1 C1 C32 125.9(8) . . ?
N2 C1 C32 123.3(7) . . ?
C7 C2 N1 133.6(9) . . ?
C7 C2 C3 119.2(8) . . ?
N1 C2 C3 107.0(6) . . ?
N2 C3 C4 133.1(7) . . ?
N2 C3 C2 105.0(6) . . ?
C4 C3 C2 121.9(6) . . ?
C5 C4 C3 117.7(8) . . ?
C5 C4 H4A 121.1 . . ?
C3 C4 H4A 121.1 . . ?
C4 C5 C6 121.8(9) . . ?
C4 C5 H5A 119.1 . . ?
C6 C5 H5A 119.1 . . ?
C5 C6 C7 119.9(8) . . ?
C5 C6 H6A 120.1 . . ?
C7 C6 H6A 120.1 . . ?
C2 C7 C6 119.3(9) . . ?
C2 C7 H7A 120.3 . . ?
C6 C7 H7A 120.3 . . ?
N2 C8 C9 110.4(7) . . ?
N2 C8 H8A 109.6 . . ?
C9 C8 H8A 109.6 . . ?
N2 C8 H8B 109.6 . . ?
C9 C8 H8B 109.6 . . ?
H8A C8 H8B 108.1 . . ?
C10 C9 C14 119.2(7) . . ?
C10 C9 C8 119.8(7) . . ?
C14 C9 C8 120.9(6) . . ?
C9 C10 C11 122.7(7) . . ?
C9 C10 H10A 118.7 . . ?
C11 C10 H10A 118.7 . . ?
C10 C11 C12 120.1(6) . . ?
C10 C11 H11A 119.9 . . ?
C12 C11 H11A 119.9 . . ?
C11 C12 C13 117.4(7) . . ?
C11 C12 C15 121.7(6) . . ?
C13 C12 C15 120.8(7) . . ?
C14 C13 C12 121.5(7) . . ?
C14 C13 H13A 119.2 . . ?
C12 C13 H13A 119.2 . . ?
C9 C14 C13 119.0(6) . . ?
C9 C14 H14A 120.5 . . ?
C13 C14 H14A 120.5 . . ?
N3 C15 N3 124.3(7) . 2_665 ?
N3 C15 C12 117.9(6) . . ?
N3 C15 C12 117.8(6) 2_665 . ?
N4 C16 N5 111.1(6) . . ?
N4 C16 C23 124.5(6) . . ?
N5 C16 C23 124.3(6) . . ?
C22 C17 N5 132.7(7) . . ?
C22 C17 C18 121.7(7) . . ?
N5 C17 C18 105.6(6) . . ?
C19 C18 N4 130.2(7) . . ?
C19 C18 C17 120.4(7) . . ?
N4 C18 C17 109.5(6) . . ?
C18 C19 C20 117.6(8) . . ?
C18 C19 H19A 121.2 . . ?
C20 C19 H19A 121.2 . . ?
C21 C20 C19 122.6(8) . . ?
C21 C20 H20A 118.7 . . ?
C19 C20 H20A 118.7 . . ?
C20 C21 C22 119.9(9) . . ?
C20 C21 H21A 120.1 . . ?
C22 C21 H21A 120.1 . . ?
C17 C22 C21 117.8(7) . . ?
C17 C22 H22A 121.1 . . ?
C21 C22 H22A 121.1 . . ?
C16 C23 H23A 109.5 . . ?
C16 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C16 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
N5 C24 C25 111.2(5) . . ?
N5 C24 H24A 109.4 . . ?
C25 C24 H24A 109.4 . . ?
N5 C24 H24B 109.4 . . ?
C25 C24 H24B 109.4 . . ?
H24A C24 H24B 108.0 . . ?
C30 C25 C26 121.1(6) . . ?
C30 C25 C24 119.2(6) . . ?
C26 C25 C24 119.7(5) . . ?
C25 C26 C27 119.7(5) . . ?
C25 C26 H26A 120.2 . . ?
C27 C26 H26A 120.2 . . ?
C26 C27 C28 120.9(7) . . ?
C26 C27 H27A 119.6 . . ?
C28 C27 H27A 119.6 . . ?
C27 C28 C29 118.5(6) . . ?
C27 C28 C31 120.7(6) . . ?
C29 C28 C31 120.7(5) . . ?
C30 C29 C28 120.1(5) . . ?
C30 C29 H29A 119.9 . . ?
C28 C29 H29A 119.9 . . ?
C25 C30 C29 119.7(6) . . ?
C25 C30 H30A 120.1 . . ?
C29 C30 H30A 120.2 . . ?
N6 C31 N6 125.0(6) . 2_665 ?
N6 C31 C28 117.6(5) . . ?
N6 C31 C28 117.4(6) 2_665 . ?
C1 C32 H32A 109.5 . . ?
C1 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C1 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
F2 Sb1 F2 120.0 2_655 3_665 ?
F2 Sb1 F2 120.0 2_655 . ?
F2 Sb1 F2 120.000(1) 3_665 . ?
F2 Sb1 F4 27.5(6) 2_655 3_665 ?
F2 Sb1 F4 92.7(6) 3_665 3_665 ?
F2 Sb1 F4 147.2(6) . 3_665 ?
F2 Sb1 F4 92.7(6) 2_655 12 ?
F2 Sb1 F4 27.5(6) 3_665 12 ?
F2 Sb1 F4 147.2(6) . 12 ?
F4 Sb1 F4 65.6(12) 3_665 12 ?
F2 Sb1 F4 27.5(6) 2_655 10_665 ?
F2 Sb1 F4 147.2(6) 3_665 10_665 ?
F2 Sb1 F4 92.7(6) . 10_665 ?
F4 Sb1 F4 55.0(12) 3_665 10_665 ?
F4 Sb1 F4 119.73(13) 12 10_665 ?
F2 Sb1 F4 147.2(6) 2_655 . ?
F2 Sb1 F4 27.5(6) 3_665 . ?
F2 Sb1 F4 92.7(6) . . ?
F4 Sb1 F4 119.73(13) 3_665 . ?
F4 Sb1 F4 55.0(12) 12 . ?
F4 Sb1 F4 174.7(12) 10_665 . ?
F2 Sb1 F4 92.7(6) 2_655 2_655 ?
F2 Sb1 F4 147.2(6) 3_665 2_655 ?
F2 Sb1 F4 27.5(6) . 2_655 ?
F4 Sb1 F4 119.73(13) 3_665 2_655 ?
F4 Sb1 F4 174.7(12) 12 2_655 ?
F4 Sb1 F4 65.6(12) 10_665 2_655 ?
F4 Sb1 F4 119.73(13) . 2_655 ?
F2 Sb1 F4 147.2(6) 2_655 11_655 ?
F2 Sb1 F4 92.7(6) 3_665 11_655 ?
F2 Sb1 F4 27.5(6) . 11_655 ?
F4 Sb1 F4 174.7(12) 3_665 11_655 ?
F4 Sb1 F4 119.73(13) 12 11_655 ?
F4 Sb1 F4 119.73(13) 10_665 11_655 ?
F4 Sb1 F4 65.6(12) . 11_655 ?
F4 Sb1 F4 55.0(12) 2_655 11_655 ?
F2 Sb1 F3 48.8(5) 2_655 11_655 ?
F2 Sb1 F3 71.2(5) 3_665 11_655 ?
F2 Sb1 F3 168.8(5) . 11_655 ?
F4 Sb1 F3 21.8(7) 3_665 11_655 ?
F4 Sb1 F3 43.9(8) 12 11_655 ?
F4 Sb1 F3 76.1(8) 10_665 11_655 ?
F4 Sb1 F3 98.6(7) . 11_655 ?
F4 Sb1 F3 141.4(7) 2_655 11_655 ?
F4 Sb1 F3 163.4(9) 11_655 11_655 ?
F2 Sb1 F3 71.2(5) 2_655 2_655 ?
F2 Sb1 F3 48.8(5) 3_665 2_655 ?
F2 Sb1 F3 168.8(5) . 2_655 ?
F4 Sb1 F3 43.9(8) 3_665 2_655 ?
F4 Sb1 F3 21.8(7) 12 2_655 ?
F4 Sb1 F3 98.6(7) 10_665 2_655 ?
F4 Sb1 F3 76.1(8) . 2_655 ?
F4 Sb1 F3 163.4(9) 2_655 2_655 ?
F4 Sb1 F3 141.4(7) 11_655 2_655 ?
F3 Sb1 F3 22.4(10) 11_655 2_655 ?
F2 Sb1 F3 48.8(5) 2_655 . ?
F2 Sb1 F3 168.8(5) 3_665 . ?
F2 Sb1 F3 71.2(5) . . ?
F4 Sb1 F3 76.1(8) 3_665 . ?
F4 Sb1 F3 141.4(7) 12 . ?
F4 Sb1 F3 21.8(7) 10_665 . ?
F4 Sb1 F3 163.4(9) . . ?
F4 Sb1 F3 43.9(8) 2_655 . ?
F4 Sb1 F3 98.6(7) 11_655 . ?
F3 Sb1 F3 97.6(10) 11_655 . ?
F3 Sb1 F3 119.99(4) 2_655 . ?
F4 F2 F4 153.7(19) 2_655 11_655 ?
F4 F2 F3 12.8(13) 2_655 12 ?
F4 F2 F3 142.2(13) 11_655 12 ?
F4 F2 F3 142.2(13) 2_655 3_665 ?
F4 F2 F3 12.8(13) 11_655 3_665 ?
F3 F2 F3 132.2(10) 12 3_665 ?
F4 F2 Sb1 76.8(9) 2_655 . ?
F4 F2 Sb1 76.8(9) 11_655 . ?
F3 F2 Sb1 66.1(5) 12 . ?
F3 F2 Sb1 66.1(5) 3_665 . ?
F4 F3 F3 154(4) 10_665 12 ?
F4 F3 F4 146.0(18) 10_665 2_655 ?
F3 F3 F4 12.8(19) 12 2_655 ?
F4 F3 F2 16.2(16) 10_665 2_655 ?
F3 F3 F2 143.7(8) 12 2_655 ?
F4 F3 F2 132.9(9) 2_655 2_655 ?
F4 F3 Sb1 78.7(11) 10_665 . ?
F3 F3 Sb1 78.8(5) 12 . ?
F4 F3 Sb1 67.9(6) 2_655 . ?
F2 F3 Sb1 65.1(5) 2_655 . ?
F3 F4 F2 151(3) 10_665 3_665 ?
F3 F4 F3 13(2) 10_665 3_665 ?
F2 F4 F3 143.1(14) 3_665 3_665 ?
F3 F4 F4 139.3(19) 10_665 12 ?
F2 F4 F4 13.2(9) 3_665 12 ?
F3 F4 F4 130.2(8) 3_665 12 ?
F3 F4 Sb1 79.5(11) 10_665 . ?
F2 F4 Sb1 75.7(9) 3_665 . ?
F3 F4 Sb1 68.3(7) 3_665 . ?
F4 F4 Sb1 62.5(6) 12 . ?
F7 Sb2 F7 176.9(4) 7 . ?
F7 Sb2 F5 86.9(4) 7 . ?
F7 Sb2 F5 91.2(4) . . ?
F7 Sb2 F5 91.2(4) 7 7 ?
F7 Sb2 F5 86.9(4) . 7 ?
F5 Sb2 F5 105.5(6) . 7 ?
F7 Sb2 F6 90.5(4) 7 7 ?
F7 Sb2 F6 91.5(4) . 7 ?
F5 Sb2 F6 75.1(4) . 7 ?
F5 Sb2 F6 178.2(4) 7 7 ?
F7 Sb2 F6 91.5(4) 7 . ?
F7 Sb2 F6 90.5(4) . . ?
F5 Sb2 F6 178.2(4) . . ?
F5 Sb2 F6 75.1(4) 7 . ?
F6 Sb2 F6 104.5(5) 7 . ?
F10 Sb3 F10 179.2(10) . 11_755 ?
F10 Sb3 F9 91.4(7) . . ?
F10 Sb3 F9 88.7(7) 11_755 . ?
F10 Sb3 F9 88.7(7) . 11_755 ?
F10 Sb3 F9 91.4(7) 11_755 11_755 ?
F9 Sb3 F9 178.2(8) . 11_755 ?
F10 Sb3 F11 89.6(5) . . ?
F10 Sb3 F11 89.6(5) 11_755 . ?
F9 Sb3 F11 90.9(4) . . ?
F9 Sb3 F11 90.9(4) 11_755 . ?
F10 Sb3 F8 90.4(5) . . ?
F10 Sb3 F8 90.4(5) 11_755 . ?
F9 Sb3 F8 89.1(4) . . ?
F9 Sb3 F8 89.1(4) 11_755 . ?
F11 Sb3 F8 180.000(1) . . ?
Sb3 F8 Cl3 130.3(4) . . ?
Sb3 F8 Cl3 130.3(5) . 11_755 ?
Cl3 F8 Cl3 99.4(9) . 11_755 ?
Cl2 C33 Cl2 78.1(12) 10_775 . ?
Cl2 C33 Cl1 97.5(8) 10_775 10_775 ?
Cl2 C33 Cl1 175.6(11) . 10_775 ?
Cl2 C33 Cl1 175.6(11) 10_775 . ?
Cl2 C33 Cl1 97.5(7) . . ?
Cl1 C33 Cl1 86.8(14) 10_775 . ?
Cl2 C33 Cl3 96.0(7) 10_775 10_775 ?
Cl2 C33 Cl3 84.9(8) . 10_775 ?
Cl1 C33 Cl3 94.9(7) 10_775 10_775 ?
Cl1 C33 Cl3 84.2(9) . 10_775 ?
Cl2 C33 Cl3 84.9(8) 10_775 . ?
Cl2 C33 Cl3 96.0(7) . . ?
Cl1 C33 Cl3 84.2(9) 10_775 . ?
Cl1 C33 Cl3 94.9(7) . . ?
Cl3 C33 Cl3 178.9(10) 10_775 . ?
C33 Cl3 F8 119.9(11) . . ?
C33 Cl3 Cl1 87.3(7) . 3_775 ?
F8 Cl3 Cl1 80.6(6) . 3_775 ?
C33 Cl3 Cl1 47.4(5) . 10_775 ?
F8 Cl3 Cl1 78.6(8) . 10_775 ?
Cl1 Cl3 Cl1 56.1(11) 3_775 10_775 ?
C33 Cl3 Cl2 46.7(5) . 10_775 ?
F8 Cl3 Cl2 94.4(9) . 10_775 ?
Cl1 Cl3 Cl2 123.0(10) 3_775 10_775 ?
Cl1 Cl3 Cl2 67.2(8) 10_775 10_775 ?
C33 Cl2 Cl2 50.9(6) . 10_775 ?
C33 Cl2 Cl3 48.3(5) . 10_775 ?
Cl2 Cl2 Cl3 69.7(9) 10_775 10_775 ?
C33 Cl1 Cl1 90.9(14) . 12 ?
C33 Cl1 Cl3 136.6(11) . 2_755 ?
Cl1 Cl1 Cl3 64.0(7) 12 2_755 ?
C33 Cl1 Cl3 48.3(5) . 10_775 ?
Cl1 Cl1 Cl3 59.9(10) 12 10_775 ?
Cl3 Cl1 Cl3 88.4(9) 2_755 10_775 ?
C33 Cl1 Cl1 85.0(6) . 3_775 ?
Cl1 Cl1 Cl1 92.4(2) 12 3_775 ?
Cl3 Cl1 Cl1 128.0(6) 2_755 3_775 ?
Cl3 Cl1 Cl1 120.4(6) 10_775 3_775 ?
C33 Cl1 Cl1 133.6(7) . 2_755 ?
Cl1 Cl1 Cl1 63.7(6) 12 2_755 ?
Cl3 Cl1 Cl1 68.0(6) 2_755 2_755 ?
Cl3 Cl1 Cl1 123.6(6) 10_775 2_755 ?
Cl1 Cl1 Cl1 60.000(2) 3_775 2_755 ?
C33 Cl1 Cl1 46.6(7) . 10_775 ?
Cl1 Cl1 Cl1 61.9(12) 12 10_775 ?
Cl3 Cl1 Cl1 125.8(14) 2_755 10_775 ?
Cl3 Cl1 Cl1 66.0(10) 10_775 10_775 ?
Cl1 Cl1 Cl1 54.5(8) 3_775 10_775 ?
Cl1 Cl1 Cl1 87.1(3) 2_755 10_775 ?

_diffrn_measured_fraction_theta_max 0.990
_diffrn_reflns_theta_full        26.17
_diffrn_measured_fraction_theta_full 0.990
_refine_diff_density_max         2.241
_refine_diff_density_min         -1.599
_refine_diff_density_rms         0.152

#=================================#

data_2
_database_code_depnum_ccdc_archive 'CCDC 650423'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C204 H171 Ag5 F30 N24 O1.50 Sb5'
_chemical_formula_weight         4700.75

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'
F F 0.0171 0.0103 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Hexagonal
_symmetry_space_group_name_H-M   P6(3)22

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

_cell_length_a                   17.9271(6)
_cell_length_b                   17.9271(6)
_cell_length_c                   37.530(3)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_volume                     10445.5(9)
_cell_formula_units_Z            2
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       Block
_exptl_crystal_colour            Colorless
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.22
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.495
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             4670
_exptl_absorpt_coefficient_mu    1.176
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6769
_exptl_absorpt_correction_T_max  0.7819
_exptl_absorpt_process_details   SADABS

_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  'APEX II'
_diffrn_measurement_method       '\w scan'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            56368
_diffrn_reflns_av_R_equivalents  0.0643
_diffrn_reflns_av_sigmaI/netI    0.0504
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       48
_diffrn_reflns_theta_min         2.34
_diffrn_reflns_theta_max         27.49
_reflns_number_total             7772
_reflns_number_gt                6347
_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.

Sb1 is in a site with imposed 32 symmetry, thus four F atoms are disordered
over two positions required by 32 symmetry. Sb2 and Sb3 are located in a
2-fold symmetry and Sb3 is assigned with 1/6 occupancy. Geometric restraints
were applied to all SbF~6~^-^ anions by using SADI to model it as octahedral.
ISOR in combination of SIMU was applied to all Sb and F atoms to give
isotropic approximation. The central benzene rings were restrained by FLAT
to give a satisfying plane.
;

_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^)+(0.0670P)^2^+76.5000P] 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    geom
_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   0.03(6)
_refine_ls_number_reflns         7772
_refine_ls_number_parameters     458
_refine_ls_number_restraints     242
_refine_ls_R_factor_all          0.0984
_refine_ls_R_factor_gt           0.0811
_refine_ls_wR_factor_ref         0.1924
_refine_ls_wR_factor_gt          0.1836
_refine_ls_goodness_of_fit_ref   1.011
_refine_ls_restrained_S_all      1.040
_refine_ls_shift/su_max          0.003
_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 0.28888(8) 0.14444(4) 0.2500 0.0878(3) Uani 1 2 d S . .
Ag2 Ag 0.6667 0.3333 0.12188(2) 0.03926(17) Uani 1 3 d S . .
N1 N 0.2883(4) 0.1604(4) 0.30455(16) 0.0681(18) Uani 1 1 d . . .
N2 N 0.3240(3) 0.2219(3) 0.35667(15) 0.0537(13) Uani 1 1 d . . .
C34 C 0.2611(4) 0.5874(4) 0.36683(16) 0.0437(17) Uani 1 1 d D . .
H34A H 0.2111 0.5319 0.3671 0.052 Uiso 1 1 calc R . .
N4 N 0.5320(3) 0.3115(3) 0.11480(15) 0.0400(13) Uani 1 1 d . . .
N5 N 0.4151(3) 0.2907(3) 0.08590(15) 0.0411(13) Uani 1 1 d . . .
C33 C 0.2599(3) 0.5878(4) 0.03835(17) 0.0386(15) Uani 1 1 d . . .
H33A H 0.2086 0.5333 0.0382 0.046 Uiso 1 1 calc R . .
C1 C 0.3465(5) 0.2289(4) 0.3224(2) 0.066(2) Uani 1 1 d . . .
C2 C 0.2264(5) 0.1060(5) 0.3302(2) 0.060(2) Uani 1 1 d . . .
C3 C 0.2493(3) 0.1449(4) 0.36317(19) 0.0444(16) Uani 1 1 d . . .
C4 C 0.2046(4) 0.1073(6) 0.3930(2) 0.072(2) Uani 1 1 d . . .
H4A H 0.2221 0.1359 0.4153 0.086 Uiso 1 1 calc R . .
C5 C 0.1334(6) 0.0268(7) 0.3905(4) 0.109(4) Uani 1 1 d U . .
H5A H 0.1001 -0.0009 0.4111 0.130 Uiso 1 1 calc R . .
C6 C 0.1095(5) -0.0156(6) 0.3560(3) 0.090(4) Uani 1 1 d . . .
H6A H 0.0615 -0.0720 0.3534 0.108 Uiso 1 1 calc R . .
C7 C 0.1593(5) 0.0292(6) 0.3277(3) 0.089(3) Uani 1 1 d . . .
H7A H 0.1443 0.0030 0.3048 0.107 Uiso 1 1 calc R . .
C8 C 0.3737(5) 0.2901(5) 0.3838(2) 0.063(2) Uani 1 1 d . . .
H8A H 0.4353 0.3070 0.3825 0.076 Uiso 1 1 calc R . .
H8B H 0.3524 0.2669 0.4080 0.076 Uiso 1 1 calc R . .
C9 C 0.3644(5) 0.3686(4) 0.37756(18) 0.0568(17) Uani 1 1 d DU . .
C10 C 0.4295(6) 0.4428(6) 0.37711(19) 0.107(3) Uani 1 1 d DU . .
H10A H 0.4853 0.4492 0.3789 0.128 Uiso 1 1 calc R . .
C11 C 0.4212(6) 0.5152(7) 0.3740(2) 0.118(4) Uani 1 1 d DU . .
H11A H 0.4724 0.5698 0.3752 0.141 Uiso 1 1 calc R . .
C12 C 0.3486(3) 0.5144(4) 0.36958(19) 0.0432(16) Uani 1 1 d DU . .
C13 C 0.2853(5) 0.4392(6) 0.3725(3) 0.094(3) Uani 1 1 d DU . .
H13A H 0.2290 0.4317 0.3708 0.113 Uiso 1 1 calc R . .
C14 C 0.2929(6) 0.3664(6) 0.3781(4) 0.098(3) Uani 1 1 d DU . .
H14A H 0.2421 0.3128 0.3824 0.118 Uiso 1 1 calc R . .
C15 C 0.3426(4) 0.5932(4) 0.3666(2) 0.0499(18) Uani 1 1 d D . .
C16 C 0.4899(4) 0.2899(3) 0.08403(19) 0.0430(16) Uani 1 1 d . . .
C17 C 0.4088(3) 0.3149(3) 0.1203(2) 0.0420(16) Uani 1 1 d . . .
C18 C 0.4845(3) 0.3283(4) 0.13741(19) 0.0421(16) Uani 1 1 d . . .
C19 C 0.4964(4) 0.3521(4) 0.1733(2) 0.053(2) Uani 1 1 d . . .
H19A H 0.5461 0.3600 0.1857 0.064 Uiso 1 1 calc R . .
C20 C 0.4357(5) 0.3637(5) 0.1902(3) 0.073(3) Uani 1 1 d . . .
H20A H 0.4449 0.3812 0.2144 0.088 Uiso 1 1 calc R . .
C21 C 0.3594(5) 0.3507(5) 0.1732(3) 0.078(3) Uani 1 1 d . . .
H21A H 0.3178 0.3576 0.1862 0.094 Uiso 1 1 calc R . .
C22 C 0.3461(4) 0.3275(4) 0.1373(2) 0.059(2) Uani 1 1 d . . .
H22A H 0.2969 0.3207 0.1248 0.070 Uiso 1 1 calc R . .
C23 C 0.5205(4) 0.2662(4) 0.05081(17) 0.0461(16) Uani 1 1 d . . .
H23A H 0.5758 0.2696 0.0555 0.069 Uiso 1 1 calc R . .
H23B H 0.5274 0.3062 0.0316 0.069 Uiso 1 1 calc R . .
H23C H 0.4780 0.2074 0.0437 0.069 Uiso 1 1 calc R . .
C24 C 0.3563(4) 0.2795(4) 0.0550(2) 0.0501(19) Uani 1 1 d . . .
H24A H 0.3787 0.2673 0.0330 0.060 Uiso 1 1 calc R . .
H24B H 0.2982 0.2300 0.0597 0.060 Uiso 1 1 calc R . .
C25 C 0.3508(4) 0.3589(5) 0.0500(2) 0.063(2) Uani 1 1 d . . .
C26 C 0.2735(4) 0.3566(4) 0.0478(2) 0.056(2) Uani 1 1 d . . .
H26A H 0.2214 0.3030 0.0497 0.067 Uiso 1 1 calc R . .
C27 C 0.2706(3) 0.4311(4) 0.0427(2) 0.0514(19) Uani 1 1 d . . .
H27A H 0.2155 0.4263 0.0404 0.062 Uiso 1 1 calc R . .
C28 C 0.3397(4) 0.5096(4) 0.0408(2) 0.0491(18) Uani 1 1 d . . .
C29 C 0.4178(5) 0.5113(5) 0.0414(4) 0.103(3) Uani 1 1 d U . .
H29A H 0.4696 0.5645 0.0379 0.124 Uiso 1 1 calc R . .
C30 C 0.4219(5) 0.4363(5) 0.0471(4) 0.102(3) Uani 1 1 d U . .
H30A H 0.4767 0.4404 0.0489 0.123 Uiso 1 1 calc R . .
C31 C 0.3372(4) 0.5905(4) 0.03847(17) 0.0382(15) Uani 1 1 d . . .
C32 C 0.4248(7) 0.3030(6) 0.3073(3) 0.099(4) Uani 1 1 d . . .
H32A H 0.4273 0.2946 0.2816 0.148 Uiso 1 1 calc R . .
H32B H 0.4759 0.3073 0.3188 0.148 Uiso 1 1 calc R . .
H32C H 0.4231 0.3560 0.3116 0.148 Uiso 1 1 calc R . .
Sb1 Sb 0.6667 0.3333 0.2500 0.0388(2) Uani 1 6 d SDU . .
F1 F 0.6667 0.3333 0.29999(13) 0.0485(14) Uani 1 3 d SDU . .
F2 F 0.6067(3) 0.3933(3) 0.2500 0.092(4) Uani 0.50 2 d SPDU . .
F3 F 0.5493(6) 0.2530(8) 0.2515(6) 0.053(5) Uani 0.25 1 d PDU . .
F4 F 0.7735(7) 0.4329(8) 0.2545(4) 0.018(4) Uani 0.17 1 d PDU . .
Sb2 Sb 0.71563(4) 0.71563(4) 0.0000 0.04003(14) Uani 0.90 2 d SPDU A 1
F7 F 0.6855(5) 0.7760(4) -0.0306(2) 0.150(3) Uani 1 1 d DU A 1
F5 F 0.7571(5) 0.8164(4) 0.0260(3) 0.164(3) Uani 1 1 d DU A 1
F6 F 0.6792(4) 0.6200(4) -0.02760(19) 0.117(2) Uani 1 1 d DU A 1
Sb2' Sb 0.6892(5) 0.6892(5) 0.0000 0.0626(18) Uani 0.10 2 d SPU B 2
Sb3 Sb 1.14573(8) 0.29146(15) 0.2500 0.0778(6) Uani 0.33 2 d SPDU . .
F8 F 1.2035(3) 0.4070(7) 0.2500 0.147(7) Uani 0.33 2 d SPDU . .
F9 F 1.1442(8) 0.2928(6) 0.2981(2) 0.105(4) Uani 0.33 1 d PDU . .
F10 F 1.0498(6) 0.2965(7) 0.2481(4) 0.125(6) Uani 0.33 1 d PDU . .
F11 F 1.0888(4) 0.1775(7) 0.2500 0.210(8) Uani 0.33 2 d SPDU . .
O1 O 0.4363(16) 0.5579(17) 0.2838(6) 0.081(6) Uani 0.25 1 d PU . .

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 0.1324(9) 0.0819(4) 0.0660(5) -0.0283(4) 0.000 0.0662(4)
Ag2 0.0363(2) 0.0363(2) 0.0453(4) 0.000 0.000 0.01813(10)
N1 0.109(4) 0.071(3) 0.046(3) 0.001(2) 0.006(3) 0.061(3)
N2 0.087(3) 0.064(2) 0.044(3) 0.001(2) -0.002(3) 0.0624(19)
C34 0.051(3) 0.038(3) 0.033(3) 0.004(2) -0.005(3) 0.015(2)
N4 0.036(2) 0.0247(19) 0.061(3) -0.005(2) -0.017(2) 0.0164(15)
N5 0.0329(18) 0.0284(19) 0.066(3) 0.008(2) -0.015(2) 0.0185(15)
C33 0.024(2) 0.029(2) 0.057(4) 0.009(2) 0.008(2) 0.0096(18)
C1 0.091(4) 0.056(3) 0.069(5) 0.017(3) 0.025(4) 0.050(3)
C2 0.071(4) 0.053(3) 0.063(4) -0.016(3) -0.019(3) 0.036(3)
C3 0.039(2) 0.048(3) 0.060(4) 0.007(3) 0.003(3) 0.0317(19)
C4 0.052(3) 0.113(5) 0.066(4) 0.023(4) 0.001(3) 0.053(3)
C5 0.081(5) 0.124(6) 0.136(8) 0.047(6) 0.033(5) 0.063(4)
C6 0.048(3) 0.073(5) 0.149(10) 0.010(6) -0.010(5) 0.028(3)
C7 0.074(4) 0.109(6) 0.103(7) 0.001(5) -0.018(5) 0.059(4)
C8 0.056(3) 0.073(4) 0.065(5) 0.002(4) -0.010(4) 0.035(3)
C9 0.068(3) 0.040(2) 0.076(4) -0.012(3) -0.010(3) 0.037(2)
C10 0.071(4) 0.067(4) 0.200(7) -0.006(5) -0.013(5) 0.048(3)
C11 0.065(4) 0.084(5) 0.196(8) 0.004(6) -0.012(6) 0.031(4)
C12 0.036(2) 0.037(2) 0.064(4) -0.006(2) 0.001(3) 0.0231(18)
C13 0.050(3) 0.066(4) 0.170(7) 0.005(5) 0.008(5) 0.032(3)
C14 0.061(4) 0.070(4) 0.173(7) 0.021(5) 0.008(5) 0.040(3)
C15 0.038(3) 0.056(3) 0.062(4) 0.006(3) 0.007(3) 0.028(2)
C16 0.047(3) 0.023(2) 0.064(4) 0.006(2) -0.002(3) 0.021(2)
C17 0.031(2) 0.022(2) 0.073(4) -0.012(3) -0.012(3) 0.0133(17)
C18 0.033(2) 0.031(2) 0.066(4) -0.007(3) -0.014(3) 0.0184(19)
C19 0.039(3) 0.050(3) 0.068(5) -0.004(3) -0.004(3) 0.020(2)
C20 0.068(4) 0.073(4) 0.074(5) -0.020(4) 0.014(4) 0.031(3)
C21 0.050(3) 0.059(4) 0.130(8) -0.006(5) 0.001(4) 0.032(3)
C22 0.029(2) 0.039(3) 0.111(6) -0.016(3) -0.010(3) 0.020(2)
C23 0.047(3) 0.042(3) 0.049(3) -0.006(3) -0.011(3) 0.022(2)
C24 0.032(2) 0.030(3) 0.083(5) -0.001(3) -0.027(3) 0.012(2)
C25 0.042(3) 0.047(3) 0.088(5) 0.022(3) -0.016(3) 0.015(2)
C26 0.025(2) 0.037(3) 0.094(5) 0.009(3) -0.017(3) 0.007(2)
C27 0.029(2) 0.036(3) 0.093(5) 0.007(3) -0.023(3) 0.0185(19)
C28 0.036(2) 0.033(2) 0.081(5) 0.021(3) 0.000(3) 0.019(2)
C29 0.047(3) 0.039(3) 0.224(9) 0.050(5) 0.020(5) 0.022(3)
C30 0.041(3) 0.055(3) 0.222(8) 0.043(5) 0.006(5) 0.032(3)
C31 0.031(2) 0.035(2) 0.046(3) 0.011(2) -0.002(3) 0.014(2)
C32 0.123(7) 0.058(4) 0.116(8) 0.025(5) 0.034(7) 0.045(4)
Sb1 0.0446(3) 0.0446(3) 0.0274(4) 0.000 0.000 0.02229(15)
F1 0.057(2) 0.057(2) 0.031(2) 0.000 0.000 0.0286(10)
F2 0.118(4) 0.118(4) 0.075(8) -0.020(7) -0.020(7) 0.086(5)
F3 0.040(6) 0.055(10) 0.046(6) -0.006(9) 0.001(8) 0.010(5)
F4 0.017(6) 0.020(6) 0.011(7) 0.000(6) -0.012(6) 0.004(5)
Sb2 0.04679(12) 0.04679(12) 0.0441(3) 0.00066(15) -0.00066(15) 0.03663(16)
F7 0.187(5) 0.155(4) 0.148(5) 0.048(4) 0.004(4) 0.116(3)
F5 0.175(5) 0.127(4) 0.218(6) -0.070(4) -0.013(5) 0.096(3)
F6 0.105(3) 0.097(3) 0.145(4) -0.056(3) -0.001(3) 0.048(2)
Sb2' 0.0627(17) 0.0627(17) 0.083(4) -0.0059(18) 0.0059(18) 0.047(2)
Sb3 0.0640(8) 0.0636(13) 0.1058(15) 0.000 0.0541(10) 0.0318(7)
F8 0.155(10) 0.136(9) 0.144(11) 0.000 -0.006(8) 0.068(4)
F9 0.115(6) 0.119(7) 0.094(7) -0.027(6) 0.035(6) 0.068(5)
F10 0.107(8) 0.144(8) 0.106(8) -0.006(8) -0.019(7) 0.050(6)
F11 0.216(11) 0.207(9) 0.203(12) 0.000 0.004(9) 0.103(5)
O1 0.077(8) 0.094(9) 0.056(8) 0.008(7) -0.012(7) 0.030(6)

_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 2.068(6) 12 ?
Ag1 N1 2.068(6) . ?
Ag2 N4 2.260(5) 2_655 ?
Ag2 N4 2.260(5) 3_665 ?
Ag2 N4 2.260(5) . ?
N1 C1 1.328(9) . ?
N1 C2 1.425(9) . ?
N2 C1 1.335(10) . ?
N2 C3 1.382(7) . ?
N2 C8 1.496(9) . ?
C34 C15 1.358(9) 3_565 ?
C34 C15 1.413(10) . ?
C34 H34A 0.9500 . ?
N4 C16 1.327(9) . ?
N4 C18 1.339(9) . ?
N5 C16 1.350(8) . ?
N5 C17 1.386(9) . ?
N5 C24 1.510(8) . ?
C33 C31 1.361(8) . ?
C33 C31 1.408(8) 3_565 ?
C33 H33A 0.9500 . ?
C1 C32 1.479(11) . ?
C2 C7 1.302(11) . ?
C2 C3 1.377(10) . ?
C3 C4 1.345(10) . ?
C4 C5 1.370(13) . ?
C4 H4A 0.9500 . ?
C5 C6 1.453(17) . ?
C5 H5A 0.9500 . ?
C6 C7 1.363(15) . ?
C6 H6A 0.9500 . ?
C7 H7A 0.9500 . ?
C8 C9 1.515(12) . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 C10 1.257(10) . ?
C9 C14 1.263(12) . ?
C10 C11 1.384(16) . ?
C10 H10A 0.9500 . ?
C11 C12 1.305(13) . ?
C11 H11A 0.9500 . ?
C12 C13 1.260(10) . ?
C12 C15 1.474(10) . ?
C13 C14 1.394(14) . ?
C13 H13A 0.9500 . ?
C14 H14A 0.9500 . ?
C15 C34 1.358(9) 2_665 ?
C16 C23 1.506(10) . ?
C17 C22 1.405(10) . ?
C17 C18 1.407(9) . ?
C18 C19 1.396(10) . ?
C19 C20 1.363(12) . ?
C19 H19A 0.9500 . ?
C20 C21 1.418(13) . ?
C20 H20A 0.9500 . ?
C21 C22 1.397(13) . ?
C21 H21A 0.9500 . ?
C22 H22A 0.9500 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C25 1.486(11) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 C30 1.339(9) . ?
C25 C26 1.368(11) . ?
C26 C27 1.377(10) . ?
C26 H26A 0.9500 . ?
C27 C28 1.333(7) . ?
C27 H27A 0.9500 . ?
C28 C29 1.383(11) . ?
C28 C31 1.477(9) . ?
C29 C30 1.401(12) . ?
C29 H29A 0.9500 . ?
C30 H30A 0.9500 . ?
C31 C33 1.408(8) 2_665 ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
Sb1 F4 1.861(9) 12 ?
Sb1 F4 1.861(9) 3_665 ?
Sb1 F4 1.861(9) 10_665 ?
Sb1 F4 1.861(9) . ?
Sb1 F4 1.861(9) 2_655 ?
Sb1 F4 1.861(9) 11_655 ?
Sb1 F2 1.863(9) 2_655 ?
Sb1 F2 1.863(9) 3_665 ?
Sb1 F2 1.863(9) . ?
Sb1 F3 1.863(8) 11_655 ?
Sb1 F3 1.863(8) 2_655 ?
Sb1 F3 1.863(8) . ?
F2 F4 0.869(17) 2_655 ?
F2 F4 0.869(17) 11_655 ?
F2 F3 1.516(15) 12 ?
F2 F3 1.516(15) 3_665 ?
F3 F4 0.73(2) 10_665 ?
F3 F3 0.78(3) 12 ?
F3 F4 1.44(2) 2_655 ?
F3 F2 1.516(15) 2_655 ?
F4 F3 0.73(2) 10_665 ?
F4 F2 0.869(17) 3_665 ?
F4 F3 1.44(2) 3_665 ?
F4 F4 1.69(3) 12 ?
Sb2 F6 1.822(5) . ?
Sb2 F6 1.822(5) 7 ?
Sb2 F7 1.834(7) 7 ?
Sb2 F7 1.834(7) . ?
Sb2 F5 1.851(7) . ?
Sb2 F5 1.851(7) 7 ?
Sb3 F11 1.768(11) . ?
Sb3 F10 1.769(10) . ?
Sb3 F10 1.769(10) 11_755 ?
Sb3 F8 1.794(11) . ?
Sb3 F9 1.807(9) . ?
Sb3 F9 1.807(9) 11_755 ?

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 N1 179.5(4) 12 . ?
N4 Ag2 N4 118.64(6) 2_655 3_665 ?
N4 Ag2 N4 118.64(6) 2_655 . ?
N4 Ag2 N4 118.64(6) 3_665 . ?
C1 N1 C2 106.0(6) . . ?
C1 N1 Ag1 124.8(5) . . ?
C2 N1 Ag1 129.2(5) . . ?
C1 N2 C3 111.1(6) . . ?
C1 N2 C8 123.4(6) . . ?
C3 N2 C8 125.4(6) . . ?
C15 C34 C15 123.3(7) 3_565 . ?
C15 C34 H34A 118.4 3_565 . ?
C15 C34 H34A 118.4 . . ?
C16 N4 C18 106.5(5) . . ?
C16 N4 Ag2 123.7(5) . . ?
C18 N4 Ag2 129.1(4) . . ?
C16 N5 C17 106.8(5) . . ?
C16 N5 C24 126.1(6) . . ?
C17 N5 C24 126.6(5) . . ?
C31 C33 C31 122.4(6) . 3_565 ?
C31 C33 H33A 118.8 . . ?
C31 C33 H33A 118.8 3_565 . ?
N1 C1 N2 109.7(6) . . ?
N1 C1 C32 126.3(8) . . ?
N2 C1 C32 123.9(7) . . ?
C7 C2 C3 119.1(8) . . ?
C7 C2 N1 131.7(8) . . ?
C3 C2 N1 109.1(6) . . ?
C4 C3 C2 122.7(6) . . ?
C4 C3 N2 133.2(7) . . ?
C2 C3 N2 104.0(6) . . ?
C3 C4 C5 118.7(9) . . ?
C3 C4 H4A 120.7 . . ?
C5 C4 H4A 120.7 . . ?
C4 C5 C6 119.1(10) . . ?
C4 C5 H5A 120.4 . . ?
C6 C5 H5A 120.4 . . ?
C7 C6 C5 116.9(8) . . ?
C7 C6 H6A 121.5 . . ?
C5 C6 H6A 121.5 . . ?
C2 C7 C6 123.5(10) . . ?
C2 C7 H7A 118.3 . . ?
C6 C7 H7A 118.3 . . ?
N2 C8 C9 110.9(6) . . ?
N2 C8 H8A 109.5 . . ?
C9 C8 H8A 109.5 . . ?
N2 C8 H8B 109.5 . . ?
C9 C8 H8B 109.5 . . ?
H8A C8 H8B 108.0 . . ?
C10 C9 C14 115.1(9) . . ?
C10 C9 C8 120.6(8) . . ?
C14 C9 C8 123.4(7) . . ?
C9 C10 C11 121.1(10) . . ?
C9 C10 H10A 119.5 . . ?
C11 C10 H10A 119.5 . . ?
C12 C11 C10 125.1(9) . . ?
C12 C11 H11A 117.5 . . ?
C10 C11 H11A 117.5 . . ?
C13 C12 C11 111.2(9) . . ?
C13 C12 C15 125.0(7) . . ?
C11 C12 C15 123.3(7) . . ?
C12 C13 C14 123.8(9) . . ?
C12 C13 H13A 118.1 . . ?
C14 C13 H13A 118.1 . . ?
C9 C14 C13 122.8(8) . . ?
C9 C14 H14A 118.6 . . ?
C13 C14 H14A 118.6 . . ?
C34 C15 C34 116.7(7) 2_665 . ?
C34 C15 C12 123.1(6) 2_665 . ?
C34 C15 C12 119.9(6) . . ?
N4 C16 N5 112.0(6) . . ?
N4 C16 C23 124.7(6) . . ?
N5 C16 C23 123.3(6) . . ?
N5 C17 C22 132.0(6) . . ?
N5 C17 C18 104.8(5) . . ?
C22 C17 C18 123.2(7) . . ?
N4 C18 C19 131.4(6) . . ?
N4 C18 C17 109.9(6) . . ?
C19 C18 C17 118.7(6) . . ?
C20 C19 C18 118.9(7) . . ?
C20 C19 H19A 120.6 . . ?
C18 C19 H19A 120.6 . . ?
C19 C20 C21 123.0(9) . . ?
C19 C20 H20A 118.5 . . ?
C21 C20 H20A 118.5 . . ?
C22 C21 C20 119.3(8) . . ?
C22 C21 H21A 120.3 . . ?
C20 C21 H21A 120.3 . . ?
C21 C22 C17 116.9(7) . . ?
C21 C22 H22A 121.5 . . ?
C17 C22 H22A 121.5 . . ?
C16 C23 H23A 109.5 . . ?
C16 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C16 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C25 C24 N5 110.3(5) . . ?
C25 C24 H24A 109.6 . . ?
N5 C24 H24A 109.6 . . ?
C25 C24 H24B 109.6 . . ?
N5 C24 H24B 109.6 . . ?
H24A C24 H24B 108.1 . . ?
C30 C25 C26 116.8(8) . . ?
C30 C25 C24 121.2(7) . . ?
C26 C25 C24 122.0(5) . . ?
C25 C26 C27 120.6(6) . . ?
C25 C26 H26A 119.7 . . ?
C27 C26 H26A 119.7 . . ?
C28 C27 C26 124.4(6) . . ?
C28 C27 H27A 117.8 . . ?
C26 C27 H27A 117.8 . . ?
C27 C28 C29 114.8(6) . . ?
C27 C28 C31 124.8(6) . . ?
C29 C28 C31 120.4(5) . . ?
C28 C29 C30 121.2(6) . . ?
C28 C29 H29A 119.4 . . ?
C30 C29 H29A 119.4 . . ?
C25 C30 C29 121.9(8) . . ?
C25 C30 H30A 119.0 . . ?
C29 C30 H30A 119.0 . . ?
C33 C31 C33 117.6(6) . 2_665 ?
C33 C31 C28 119.7(5) . . ?
C33 C31 C28 122.6(6) 2_665 . ?
C1 C32 H32A 109.5 . . ?
C1 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C1 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
F4 Sb1 F4 67.6(10) 12 3_665 ?
F4 Sb1 F4 119.18(15) 12 10_665 ?
F4 Sb1 F4 54.0(11) 3_665 10_665 ?
F4 Sb1 F4 54.0(11) 12 . ?
F4 Sb1 F4 119.18(15) 3_665 . ?
F4 Sb1 F4 173.1(11) 10_665 . ?
F4 Sb1 F4 173.1(11) 12 2_655 ?
F4 Sb1 F4 119.18(15) 3_665 2_655 ?
F4 Sb1 F4 67.6(10) 10_665 2_655 ?
F4 Sb1 F4 119.18(15) . 2_655 ?
F4 Sb1 F4 119.18(16) 12 11_655 ?
F4 Sb1 F4 173.1(11) 3_665 11_655 ?
F4 Sb1 F4 119.18(15) 10_665 11_655 ?
F4 Sb1 F4 67.6(10) . 11_655 ?
F4 Sb1 F4 54.0(11) 2_655 11_655 ?
F4 Sb1 F2 93.5(5) 12 2_655 ?
F4 Sb1 F2 27.0(5) 3_665 2_655 ?
F4 Sb1 F2 27.0(5) 10_665 2_655 ?
F4 Sb1 F2 146.2(5) . 2_655 ?
F4 Sb1 F2 93.5(5) 2_655 2_655 ?
F4 Sb1 F2 146.2(5) 11_655 2_655 ?
F4 Sb1 F2 27.0(5) 12 3_665 ?
F4 Sb1 F2 93.5(5) 3_665 3_665 ?
F4 Sb1 F2 146.2(5) 10_665 3_665 ?
F4 Sb1 F2 27.0(5) . 3_665 ?
F4 Sb1 F2 146.2(5) 2_655 3_665 ?
F4 Sb1 F2 93.5(5) 11_655 3_665 ?
F2 Sb1 F2 120.0 2_655 3_665 ?
F4 Sb1 F2 146.2(5) 12 . ?
F4 Sb1 F2 146.2(5) 3_665 . ?
F4 Sb1 F2 93.5(5) 10_665 . ?
F4 Sb1 F2 93.5(5) . . ?
F4 Sb1 F2 27.0(5) 2_655 . ?
F4 Sb1 F2 27.0(5) 11_655 . ?
F2 Sb1 F2 120.0 2_655 . ?
F2 Sb1 F2 120.000(1) 3_665 . ?
F4 Sb1 F3 45.5(7) 12 11_655 ?
F4 Sb1 F3 22.5(6) 3_665 11_655 ?
F4 Sb1 F3 74.4(7) 10_665 11_655 ?
F4 Sb1 F3 98.7(7) . 11_655 ?
F4 Sb1 F3 141.4(7) 2_655 11_655 ?
F4 Sb1 F3 163.9(8) 11_655 11_655 ?
F2 Sb1 F3 48.0(5) 2_655 11_655 ?
F2 Sb1 F3 72.0(5) 3_665 11_655 ?
F2 Sb1 F3 167.9(5) . 11_655 ?
F4 Sb1 F3 22.5(6) 12 2_655 ?
F4 Sb1 F3 45.5(7) 3_665 2_655 ?
F4 Sb1 F3 98.7(7) 10_665 2_655 ?
F4 Sb1 F3 74.4(7) . 2_655 ?
F4 Sb1 F3 163.9(8) 2_655 2_655 ?
F4 Sb1 F3 141.4(7) 11_655 2_655 ?
F2 Sb1 F3 72.0(5) 2_655 2_655 ?
F2 Sb1 F3 48.0(5) 3_665 2_655 ?
F2 Sb1 F3 167.9(5) . 2_655 ?
F3 Sb1 F3 24.3(9) 11_655 2_655 ?
F4 Sb1 F3 141.4(7) 12 . ?
F4 Sb1 F3 74.4(7) 3_665 . ?
F4 Sb1 F3 22.5(6) 10_665 . ?
F4 Sb1 F3 163.9(8) . . ?
F4 Sb1 F3 45.5(8) 2_655 . ?
F4 Sb1 F3 98.7(7) 11_655 . ?
F2 Sb1 F3 48.0(5) 2_655 . ?
F2 Sb1 F3 167.9(5) 3_665 . ?
F2 Sb1 F3 72.0(5) . . ?
F3 Sb1 F3 96.0(9) 11_655 . ?
F3 Sb1 F3 119.91(7) 2_655 . ?
F4 F2 F4 152.7(17) 2_655 11_655 ?
F4 F2 F3 16.7(12) 2_655 12 ?
F4 F2 F3 140.0(12) 11_655 12 ?
F4 F2 F3 140.0(12) 2_655 3_665 ?
F4 F2 F3 16.7(12) 11_655 3_665 ?
F3 F2 F3 132.0(9) 12 3_665 ?
F4 F2 Sb1 76.3(9) 2_655 . ?
F4 F2 Sb1 76.3(9) 11_655 . ?
F3 F2 Sb1 66.0(5) 12 . ?
F3 F2 Sb1 66.0(5) 3_665 . ?
F4 F3 F3 145(4) 10_665 12 ?
F4 F3 F4 143.6(16) 10_665 2_655 ?
F3 F3 F4 16.8(19) 12 2_655 ?
F4 F3 F2 20.1(14) 10_665 2_655 ?
F3 F3 F2 142.7(12) 12 2_655 ?
F4 F3 F2 133.0(8) 2_655 2_655 ?
F4 F3 Sb1 78.5(10) 10_665 . ?
F3 F3 Sb1 77.9(5) 12 . ?
F4 F3 Sb1 67.1(6) 2_655 . ?
F2 F3 Sb1 66.0(5) 2_655 . ?
F3 F4 F2 143(2) 10_665 3_665 ?
F3 F4 F3 18(2) 10_665 3_665 ?
F2 F4 F3 141.8(13) 3_665 3_665 ?
F3 F4 F4 133.4(19) 10_665 12 ?
F2 F4 F4 13.7(9) 3_665 12 ?
F3 F4 F4 128.8(8) 3_665 12 ?
F3 F4 Sb1 79.0(10) 10_665 . ?
F2 F4 Sb1 76.7(9) 3_665 . ?
F3 F4 Sb1 67.3(6) 3_665 . ?
F4 F4 Sb1 63.0(5) 12 . ?
F6 Sb2 F6 98.9(4) . 7 ?
F6 Sb2 F7 93.8(4) . 7 ?
F6 Sb2 F7 97.3(4) 7 7 ?
F6 Sb2 F7 97.3(4) . . ?
F6 Sb2 F7 93.8(4) 7 . ?
F7 Sb2 F7 163.0(4) 7 . ?
F6 Sb2 F5 176.7(4) . . ?
F6 Sb2 F5 84.1(3) 7 . ?
F7 Sb2 F5 87.1(4) 7 . ?
F7 Sb2 F5 81.2(4) . . ?
F6 Sb2 F5 84.1(3) . 7 ?
F6 Sb2 F5 176.7(4) 7 7 ?
F7 Sb2 F5 81.2(4) 7 7 ?
F7 Sb2 F5 87.1(4) . 7 ?
F5 Sb2 F5 92.9(5) . 7 ?
F11 Sb3 F10 92.5(4) . . ?
F11 Sb3 F10 92.5(4) . 11_755 ?
F10 Sb3 F10 175.0(7) . 11_755 ?
F11 Sb3 F8 180.00(18) . . ?
F10 Sb3 F8 87.5(4) . . ?
F10 Sb3 F8 87.5(4) 11_755 . ?
F11 Sb3 F9 90.7(3) . . ?
F10 Sb3 F9 91.0(6) . . ?
F10 Sb3 F9 89.0(6) 11_755 . ?
F8 Sb3 F9 89.3(3) . . ?
F11 Sb3 F9 90.7(3) . 11_755 ?
F10 Sb3 F9 89.0(6) . 11_755 ?
F10 Sb3 F9 91.0(6) 11_755 11_755 ?
F8 Sb3 F9 89.3(3) . 11_755 ?
F9 Sb3 F9 178.7(6) . 11_755 ?

_diffrn_measured_fraction_theta_max 0.977
_diffrn_reflns_theta_full        27.49
_diffrn_measured_fraction_theta_full 0.977
_refine_diff_density_max         3.072
_refine_diff_density_min         -0.907
_refine_diff_density_rms         0.132

#=====================================END