#------------------------------------------------------------------------------
#$Date: 2016-03-26 14:15:18 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180254 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/40/7114065.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7114065
loop_
_publ_author_name
'Wang, Quan-Ming'
'Mak, Thomas C. W.'
_publ_section_title
;
 A novel organometallic columnar complex containing endohedral
 silver(i)???ethynediyl binding and exterior silver(i)???aromatic
 interactionIn memory of Dr. Daniel Y. Chang.
;
_journal_issue                   22
_journal_name_full               'Chemical Communications'
_journal_page_first              2682
_journal_paper_doi               10.1039/b208298e
_journal_year                    2002
_chemical_formula_sum            'C24 H16 Ag7 F18 N O12'
_chemical_formula_weight         1607.47
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 100.049(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.6465(16)
_cell_length_b                   18.708(3)
_cell_length_c                   23.258(4)
_cell_measurement_temperature    293(2)
_cell_volume                     3704.5(11)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0360
_diffrn_reflns_av_sigmaI/netI    0.0375
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            24840
_diffrn_reflns_theta_full        28.04
_diffrn_reflns_theta_max         28.04
_diffrn_reflns_theta_min         1.41
_exptl_absorpt_coefficient_mu    3.773
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.568
_exptl_absorpt_correction_type   SADABS
_exptl_crystal_colour            'pale yellow'
_exptl_crystal_density_diffrn    2.882
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             3016
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.24
_refine_diff_density_max         2.841
_refine_diff_density_min         -3.016
_refine_diff_density_rms         0.286
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     586
_refine_ls_number_reflns         8964
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.020
_refine_ls_R_factor_all          0.0600
_refine_ls_R_factor_gt           0.0429
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0728P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1143
_refine_ls_wR_factor_ref         0.1210
_reflns_number_gt                6599
_reflns_number_total             8964
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b208298e.txt
_cod_data_source_block           p97
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_cell_volume        3704.4(12)
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7114065
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Ag1 Ag 0.50800(4) -0.07431(2) 0.008386(19) 0.03589(11) Uani 1 1 d .
Ag2 Ag 0.20201(5) -0.12992(2) 0.033913(19) 0.04025(12) Uani 1 1 d .
Ag3 Ag -0.03465(7) -0.03266(4) -0.06086(2) 0.06644(18) Uani 1 1 d .
Ag4 Ag 0.22223(6) 0.03050(3) -0.11037(2) 0.05523(15) Uani 1 1 d .
Ag5 Ag 0.36668(6) -0.02825(2) 0.11468(2) 0.04543(13) Uani 1 1 d .
Ag6 Ag 0.15773(5) 0.13918(2) -0.02377(2) 0.04743(13) Uani 1 1 d .
Ag7 Ag 0.38322(6) -0.25741(3) -0.02228(3) 0.05779(15) Uani 1 1 d .
C1 C 0.2726(6) -0.0207(3) 0.0159(2) 0.0377(12) Uani 1 1 d .
C2 C 0.2231(6) 0.0314(3) -0.0117(3) 0.0389(12) Uani 1 1 d .
C11 C 0.0303(7) -0.2750(3) 0.0498(3) 0.0418(13) Uani 1 1 d .
C12 C 0.0289(8) -0.3539(4) 0.0660(4) 0.061(2) Uani 1 1 d .
C21 C 0.1584(7) -0.1252(3) 0.1688(3) 0.0437(13) Uani 1 1 d .
C22 C 0.1026(8) -0.1745(4) 0.2138(3) 0.0589(18) Uani 1 1 d .
C31 C 0.5752(6) -0.1788(3) 0.1141(2) 0.0377(12) Uani 1 1 d .
C32 C 0.5722(8) -0.2474(3) 0.1510(3) 0.0478(14) Uani 1 1 d .
C41 C 0.5559(6) 0.1245(3) 0.1227(3) 0.0361(12) Uani 1 1 d .
C42 C 0.6003(8) 0.1762(3) 0.1738(3) 0.0482(14) Uani 1 1 d .
C51 C 0.0541(7) -0.2182(3) -0.0861(3) 0.0446(13) Uani 1 1 d .
C52 C -0.0997(8) -0.2314(4) -0.1282(3) 0.0553(16) Uani 1 1 d .
C61 C -0.0451(7) -0.0366(3) -0.1965(3) 0.0431(13) Uani 1 1 d .
C62 C -0.1226(8) -0.0604(4) -0.2589(3) 0.0515(15) Uani 1 1 d .
O11 O 0.1592(5) -0.2465(2) 0.0543(2) 0.0471(10) Uani 1 1 d .
O12 O -0.1021(5) -0.2498(2) 0.0329(2) 0.0576(12) Uani 1 1 d .
O21 O 0.0670(5) -0.1180(3) 0.12250(19) 0.0529(11) Uani 1 1 d .
O22 O 0.2912(5) -0.0984(3) 0.1848(2) 0.0563(12) Uani 1 1 d .
O31 O 0.5348(5) -0.1859(2) 0.06010(17) 0.0467(10) Uani 1 1 d .
O32 O 0.6163(5) -0.1235(2) 0.14115(19) 0.0479(10) Uani 1 1 d .
O41 O 0.5269(5) 0.1507(2) 0.07262(18) 0.0450(9) Uani 1 1 d .
O42 O 0.5566(5) 0.0603(2) 0.1366(2) 0.0500(10) Uani 1 1 d .
O51 O 0.0748(6) -0.1582(3) -0.0646(2) 0.0637(13) Uani 1 1 d .
O52 O 0.1447(5) -0.2698(3) -0.0800(2) 0.0557(11) Uani 1 1 d .
O61 O 0.0840(5) -0.0079(3) -0.1950(2) 0.0577(12) Uani 1 1 d .
O62 O -0.1219(5) -0.0489(2) -0.15760(19) 0.0522(11) Uani 1 1 d .
F11 F 0.0029(10) -0.3947(3) 0.0188(3) 0.138(3) Uani 1 1 d .
F12 F -0.0780(7) -0.3710(3) 0.0954(4) 0.135(3) Uani 1 1 d .
F13 F 0.1597(6) -0.3772(3) 0.0970(3) 0.111(2) Uani 1 1 d .
F21 F 0.1422(12) -0.2381(3) 0.2083(4) 0.176(4) Uani 1 1 d .
F22 F -0.0433(7) -0.1726(5) 0.2126(4) 0.150(3) Uani 1 1 d .
F23 F 0.1564(10) -0.1582(5) 0.2672(3) 0.157(3) Uani 1 1 d .
F31 F 0.4556(19) -0.2889(8) 0.1303(6) 0.091(4) Uani 0.60 1 d P
F32 F 0.568(4) -0.2376(9) 0.2040(7) 0.112(9) Uani 0.60 1 d P
F33 F 0.7001(13) -0.2846(7) 0.1489(8) 0.099(5) Uani 0.60 1 d P
F31' F 0.432(3) -0.2515(14) 0.1634(19) 0.132(9) Uani 0.40 1 d P
F32' F 0.643(5) -0.2402(18) 0.2015(10) 0.129(16) Uani 0.40 1 d P
F33' F 0.590(6) -0.3047(8) 0.1266(10) 0.136(11) Uani 0.40 1 d P
F41 F 0.5275(7) 0.1624(3) 0.2167(2) 0.0992(18) Uani 1 1 d .
F42 F 0.5670(7) 0.2433(2) 0.1592(2) 0.0873(15) Uani 1 1 d .
F43 F 0.7512(6) 0.1734(3) 0.1931(3) 0.110(2) Uani 1 1 d .
F51 F -0.1471(5) -0.2988(2) -0.1258(2) 0.0840(14) Uani 1 1 d .
F52 F -0.0875(6) -0.2149(3) -0.1822(2) 0.0963(17) Uani 1 1 d .
F53 F -0.2156(5) -0.1913(3) -0.1142(3) 0.0865(15) Uani 1 1 d .
F61 F -0.0286(6) -0.0995(3) -0.2836(2) 0.0959(17) Uani 1 1 d .
F62 F -0.1560(7) -0.0039(3) -0.2936(2) 0.0905(16) Uani 1 1 d .
F63 F -0.2541(6) -0.0944(4) -0.2604(2) 0.106(2) Uani 1 1 d .
N1 N 0.1538(7) -0.4531(3) -0.1801(2) 0.0527(13) Uani 1 1 d .
C01 C 0.5054(8) -0.3991(4) -0.1001(4) 0.066(2) Uani 1 1 d .
H01A H 0.5371 -0.3969 -0.1363 0.079 Uiso 1 1 calc R
C02 C 0.5861(10) -0.3604(5) -0.0533(5) 0.079(2) Uani 1 1 d .
H02A H 0.6684 -0.3308 -0.0591 0.095 Uiso 1 1 calc R
C03 C 0.5475(9) -0.3650(4) 0.0007(4) 0.067(2) Uani 1 1 d .
H03A H 0.6052 -0.3405 0.0321 0.081 Uiso 1 1 calc R
C04 C 0.4224(9) -0.4063(5) 0.0079(3) 0.067(2) Uani 1 1 d .
H04A H 0.3928 -0.4091 0.0444 0.081 Uiso 1 1 calc R
C05 C 0.3386(8) -0.4444(4) -0.0388(3) 0.0538(16) Uani 1 1 d .
H05A H 0.2543 -0.4727 -0.0330 0.065 Uiso 1 1 calc R
C06 C 0.3784(7) -0.4407(3) -0.0931(3) 0.0441(13) Uani 1 1 d .
C07 C 0.2971(8) -0.4856(4) -0.1426(3) 0.0557(17) Uani 1 1 d .
H07A H 0.2659 -0.5302 -0.1266 0.067 Uiso 1 1 calc R
H07B H 0.3723 -0.4972 -0.1676 0.067 Uiso 1 1 calc R
C08 C 0.0943(11) -0.5059(5) -0.2269(4) 0.084(3) Uani 1 1 d .
H08A H 0.0012 -0.4875 -0.2509 0.126 Uiso 1 1 calc R
H08B H 0.0701 -0.5501 -0.2095 0.126 Uiso 1 1 calc R
H08C H 0.1733 -0.5141 -0.2505 0.126 Uiso 1 1 calc R
C09 C 0.0276(9) -0.4411(4) -0.1450(4) 0.0663(19) Uani 1 1 d .
H09A H -0.0620 -0.4201 -0.1693 0.099 Uiso 1 1 calc R
H09B H 0.0653 -0.4096 -0.1131 0.099 Uiso 1 1 calc R
H09C H -0.0020 -0.4860 -0.1301 0.099 Uiso 1 1 calc R
C010 C 0.1898(14) -0.3841(5) -0.2071(4) 0.106(4) Uani 1 1 d .
H01B H 0.0948 -0.3643 -0.2288 0.158 Uiso 1 1 calc R
H01C H 0.2634 -0.3924 -0.2329 0.158 Uiso 1 1 calc R
H01D H 0.2342 -0.3512 -0.1770 0.158 Uiso 1 1 calc R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
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
C1 Ag1 O41 109.61(18) . 3_655
C1 Ag1 O31 110.51(17) . .
O41 Ag1 O31 81.94(14) 3_655 .
C1 Ag1 C2 134.6(2) . 3_655
O41 Ag1 C2 102.34(17) 3_655 3_655
O31 Ag1 C2 105.16(17) . 3_655
C1 Ag1 Ag1 63.66(14) . 3_655
O41 Ag1 Ag1 119.76(10) 3_655 3_655
O31 Ag1 Ag1 158.28(10) . 3_655
C2 Ag1 Ag1 72.72(13) 3_655 3_655
C1 Ag1 Ag2 46.67(14) . .
O41 Ag1 Ag2 87.32(10) 3_655 .
O31 Ag1 Ag2 67.07(10) . .
C2 Ag1 Ag2 166.90(14) 3_655 .
Ag1 Ag1 Ag2 110.33(2) 3_655 .
C1 Ag1 Ag5 48.28(14) . .
O41 Ag1 Ag5 143.76(10) 3_655 .
O31 Ag1 Ag5 81.82(10) . .
C2 Ag1 Ag5 113.11(14) 3_655 .
Ag1 Ag1 Ag5 79.45(2) 3_655 .
Ag2 Ag1 Ag5 56.501(15) . .
C1 Ag1 Ag6 168.85(14) . 3_655
O41 Ag1 Ag6 80.82(10) 3_655 3_655
O31 Ag1 Ag6 66.09(10) . 3_655
C2 Ag1 Ag6 42.53(14) 3_655 3_655
Ag1 Ag1 Ag6 115.24(2) 3_655 3_655
Ag2 Ag1 Ag6 132.79(2) . 3_655
Ag5 Ag1 Ag6 120.80(2) . 3_655
C1 Ag1 Ag4 112.32(14) . 3_655
O41 Ag1 Ag4 138.01(10) 3_655 3_655
O31 Ag1 Ag4 81.60(10) . 3_655
C2 Ag1 Ag4 46.59(14) 3_655 3_655
Ag1 Ag1 Ag4 81.85(2) 3_655 3_655
Ag2 Ag1 Ag4 120.49(2) . 3_655
Ag5 Ag1 Ag4 70.41(2) . 3_655
Ag6 Ag1 Ag4 57.204(18) 3_655 3_655
C1 Ag2 O11 173.30(18) . .
C1 Ag2 O51 96.80(19) . .
O11 Ag2 O51 85.65(16) . .
C1 Ag2 O21 104.77(19) . .
O11 Ag2 O21 78.53(15) . .
O51 Ag2 O21 125.99(17) . .
C1 Ag2 Ag5 52.04(15) . .
O11 Ag2 Ag5 125.37(12) . .
O51 Ag2 Ag5 148.84(12) . .
O21 Ag2 Ag5 70.00(11) . .
C1 Ag2 Ag1 49.77(15) . .
O11 Ag2 Ag1 123.73(10) . .
O51 Ag2 Ag1 99.17(13) . .
O21 Ag2 Ag1 132.41(10) . .
Ag5 Ag2 Ag1 62.963(17) . .
C1 Ag2 Ag6 110.39(15) . 3
O11 Ag2 Ag6 76.31(10) . 3
O51 Ag2 Ag6 68.26(13) . 3
O21 Ag2 Ag6 57.89(10) . 3
Ag5 Ag2 Ag6 117.77(2) . 3
Ag1 Ag2 Ag6 156.65(2) . 3
C1 Ag2 Ag7 115.91(15) . .
O11 Ag2 Ag7 59.21(11) . .
O51 Ag2 Ag7 68.31(13) . .
O21 Ag2 Ag7 135.23(11) . .
Ag5 Ag2 Ag7 122.03(2) . .
Ag1 Ag2 Ag7 70.788(19) . .
Ag6 Ag2 Ag7 118.599(19) 3 .
C1 Ag2 Ag3 61.14(15) . .
O11 Ag2 Ag3 124.46(11) . .
O51 Ag2 Ag3 50.11(12) . .
O21 Ag2 Ag3 100.05(10) . .
Ag5 Ag2 Ag3 104.59(2) . .
Ag1 Ag2 Ag3 98.22(2) . .
Ag6 Ag2 Ag3 58.501(17) 3 .
Ag7 Ag2 Ag3 115.11(2) . .
O62 Ag3 O51 84.44(16) . .
O62 Ag3 C2 121.29(17) . 3
O51 Ag3 C2 108.52(18) . 3
O62 Ag3 C2 127.42(17) . .
O51 Ag3 C2 98.32(17) . .
C2 Ag3 C2 107.56(14) 3 .
O62 Ag3 C1 107.11(17) . 3
O51 Ag3 C1 132.78(17) . 3
C2 Ag3 C1 26.62(17) 3 3
C2 Ag3 C1 108.38(18) . 3
O62 Ag3 Ag4 78.90(12) . .
O51 Ag3 Ag4 92.69(13) . .
C2 Ag3 Ag4 151.23(13) 3 .
C2 Ag3 Ag4 48.58(13) . .
C1 Ag3 Ag4 134.13(12) 3 .
O62 Ag3 Ag3 162.66(13) . 3
O51 Ag3 Ag3 112.90(11) . 3
C2 Ag3 Ag3 54.84(13) 3 3
C2 Ag3 Ag3 52.72(13) . 3
C1 Ag3 Ag3 61.60(12) 3 3
Ag4 Ag3 Ag3 99.45(3) . 3
O62 Ag3 Ag6 116.76(12) . 3
O51 Ag3 Ag6 66.47(13) . 3
C2 Ag3 Ag6 42.07(13) 3 3
C2 Ag3 Ag6 112.09(13) . 3
C1 Ag3 Ag6 67.58(12) 3 3
Ag4 Ag3 Ag6 150.92(3) . 3
Ag3 Ag3 Ag6 72.72(3) 3 3
O62 Ag3 Ag5 61.94(12) . 3
O51 Ag3 Ag5 129.97(11) . 3
C2 Ag3 Ag5 67.27(13) 3 3
C2 Ag3 Ag5 131.25(13) . 3
C1 Ag3 Ag5 45.90(12) 3 3
Ag4 Ag3 Ag5 113.64(3) . 3
Ag3 Ag3 Ag5 104.06(3) 3 3
Ag6 Ag3 Ag5 95.43(2) 3 3
O62 Ag3 Ag2 130.76(12) . .
O51 Ag3 Ag2 47.03(10) . .
C2 Ag3 Ag2 87.50(13) 3 .
C2 Ag3 Ag2 64.90(13) . .
C1 Ag3 Ag2 112.23(12) 3 .
Ag4 Ag3 Ag2 93.50(2) . .
Ag3 Ag3 Ag2 66.41(3) 3 .
Ag6 Ag3 Ag2 57.530(19) 3 .
Ag5 Ag3 Ag2 152.66(2) 3 .
O61 Ag4 C2 142.29(18) . .
O61 Ag4 O32 102.60(17) . 3_655
C2 Ag4 O32 112.97(17) . 3_655
O61 Ag4 Ag3 83.73(12) . .
C2 Ag4 Ag3 58.59(14) . .
O32 Ag4 Ag3 157.78(11) 3_655 .
O61 Ag4 Ag6 132.78(13) . .
C2 Ag4 Ag6 44.58(15) . .
O32 Ag4 Ag6 83.98(10) 3_655 .
Ag3 Ag4 Ag6 76.41(2) . .
O61 Ag4 Ag1 164.60(12) . 3_655
C2 Ag4 Ag1 50.83(13) . 3_655
O32 Ag4 Ag1 69.11(11) 3_655 3_655
Ag3 Ag4 Ag1 108.91(2) . 3_655
Ag6 Ag4 Ag1 60.817(18) . 3_655
O22 Ag5 C1 130.91(18) . .
O22 Ag5 O42 122.22(17) . .
C1 Ag5 O42 106.72(18) . .
O22 Ag5 Ag2 85.16(13) . .
C1 Ag5 Ag2 48.68(14) . .
O42 Ag5 Ag2 150.00(12) . .
O22 Ag5 Ag1 128.34(14) . .
C1 Ag5 Ag1 48.26(14) . .
O42 Ag5 Ag1 90.65(12) . .
Ag2 Ag5 Ag1 60.536(18) . .
O22 Ag5 Ag3 97.96(11) . 3
C1 Ag5 Ag3 56.00(14) . 3
O42 Ag5 Ag3 113.00(11) . 3
Ag2 Ag5 Ag3 70.42(2) . 3
Ag1 Ag5 Ag3 104.23(2) . 3
C2 Ag6 O12 177.0(2) . 3
C2 Ag6 Ag4 50.07(16) . .
O12 Ag6 Ag4 131.42(14) 3 .
C2 Ag6 Ag2 101.57(15) . 3
O12 Ag6 Ag2 80.77(12) 3 3
Ag4 Ag6 Ag2 102.42(2) . 3
C2 Ag6 Ag1 52.01(14) . 3_655
O12 Ag6 Ag1 125.65(12) 3 3_655
Ag4 Ag6 Ag1 61.979(16) . 3_655
Ag2 Ag6 Ag1 153.57(2) 3 3_655
C2 Ag6 Ag3 54.18(15) . 3
O12 Ag6 Ag3 126.10(13) 3 3
Ag4 Ag6 Ag3 96.63(2) . 3
Ag2 Ag6 Ag3 63.969(17) 3 3
Ag1 Ag6 Ag3 95.23(2) 3_655 3
O52 Ag7 C03 118.3(2) . .
O52 Ag7 O41 97.43(16) . 3_655
C03 Ag7 O41 122.5(2) . 3_655
O52 Ag7 O31 143.71(16) . .
C03 Ag7 O31 93.7(2) . .
O41 Ag7 O31 76.63(13) 3_655 .
O52 Ag7 Ag2 81.98(12) . .
C03 Ag7 Ag2 144.2(2) . .
O41 Ag7 Ag2 79.28(10) 3_655 .
O31 Ag7 Ag2 61.72(10) . .
C2 C1 Ag2 140.4(5) . .
C2 C1 Ag1 123.3(4) . .
Ag2 C1 Ag1 83.56(19) . .
C2 C1 Ag5 127.8(5) . .
Ag2 C1 Ag5 79.28(18) . .
Ag1 C1 Ag5 83.46(19) . .
C2 C1 Ag3 71.2(4) . 3
Ag2 C1 Ag3 90.82(19) . 3
Ag1 C1 Ag3 161.4(3) . 3
Ag5 C1 Ag3 78.10(17) . 3
C1 C2 Ag6 155.7(5) . .
C1 C2 Ag4 117.8(5) . .
Ag6 C2 Ag4 85.3(2) . .
C1 C2 Ag1 90.1(4) . 3_655
Ag6 C2 Ag1 85.46(19) . 3_655
Ag4 C2 Ag1 82.57(18) . 3_655
C1 C2 Ag3 82.2(4) . 3
Ag6 C2 Ag3 83.75(19) . 3
Ag4 C2 Ag3 140.7(2) . 3
Ag1 C2 Ag3 133.7(3) 3_655 3
C1 C2 Ag3 93.4(4) . .
Ag6 C2 Ag3 101.1(2) . .
Ag4 C2 Ag3 72.84(16) . .
Ag1 C2 Ag3 153.8(3) 3_655 .
Ag3 C2 Ag3 72.44(14) 3 .
O11 C11 O12 129.8(5) . .
O11 C11 C12 116.6(5) . .
O12 C11 C12 113.6(5) . .
F12 C12 F13 105.0(7) . .
F12 C12 F11 105.3(7) . .
F13 C12 F11 105.6(7) . .
F12 C12 C11 114.3(6) . .
F13 C12 C11 114.6(6) . .
F11 C12 C11 111.1(7) . .
O21 C21 O22 129.5(6) . .
O21 C21 C22 115.7(6) . .
O22 C21 C22 114.8(6) . .
F21 C22 F22 108.4(8) . .
F21 C22 F23 105.3(8) . .
F22 C22 F23 101.9(8) . .
F21 C22 C21 112.2(7) . .
F22 C22 C21 113.8(6) . .
F23 C22 C21 114.4(7) . .
O32 C31 O31 127.4(5) . .
O32 C31 C32 116.4(5) . .
O31 C31 C32 116.2(5) . .
F32' C32 F33' 117(2) . .
F32' C32 F32 31(2) . .
F33' C32 F32 127.4(12) . .
F32' C32 F31 130.1(17) . .
F33' C32 F31 57.2(17) . .
F32 C32 F31 107.5(12) . .
F32' C32 F31' 97(2) . .
F33' C32 F31' 104.1(18) . .
F32 C32 F31' 66.6(17) . .
F31 C32 F31' 49.5(14) . .
F32' C32 F33 79.1(19) . .
F33' C32 F33 49.7(19) . .
F32 C32 F33 106.4(13) . .
F31 C32 F33 105.8(10) . .
F31' C32 F33 143.3(10) . .
F32' C32 C31 112.6(16) . .
F33' C32 C31 116.7(9) . .
F32 C32 C31 115.5(9) . .
F31 C32 C31 112.2(6) . .
F31' C32 C31 106.2(10) . .
F33 C32 C31 108.8(7) . .
O42 C41 O41 127.9(5) . .
O42 C41 C42 114.8(5) . .
O41 C41 C42 117.3(5) . .
F41 C42 F43 108.6(6) . .
F41 C42 F42 106.0(6) . .
F43 C42 F42 106.7(6) . .
F41 C42 C41 112.5(5) . .
F43 C42 C41 110.0(5) . .
F42 C42 C41 112.8(5) . .
O51 C51 O52 128.5(6) . .
O51 C51 C52 117.2(6) . .
O52 C51 C52 114.3(6) . .
F52 C52 F51 109.8(6) . .
F52 C52 F53 106.8(6) . .
F51 C52 F53 105.8(6) . .
F52 C52 C51 111.6(6) . .
F51 C52 C51 111.5(6) . .
F53 C52 C51 111.1(6) . .
O61 C61 O62 131.4(6) . .
O61 C61 C62 113.0(5) . .
O62 C61 C62 115.5(5) . .
F63 C62 F61 108.9(7) . .
F63 C62 F62 106.1(6) . .
F61 C62 F62 105.4(6) . .
F63 C62 C61 113.5(6) . .
F61 C62 C61 111.9(5) . .
F62 C62 C61 110.6(6) . .
C11 O11 Ag2 125.4(4) . .
C11 O12 Ag6 125.6(4) . 3
C21 O21 Ag2 112.6(4) . .
C21 O22 Ag5 112.4(4) . .
C31 O31 Ag1 113.4(4) . .
C31 O31 Ag7 147.1(4) . .
Ag1 O31 Ag7 95.11(14) . .
C31 O32 Ag4 125.8(4) . 3_655
C41 O41 Ag1 119.1(4) . 3_655
C41 O41 Ag7 136.2(4) . 3_655
Ag1 O41 Ag7 96.73(15) 3_655 3_655
C41 O42 Ag5 131.3(4) . .
C51 O51 Ag2 126.5(4) . .
C51 O51 Ag3 146.1(4) . .
Ag2 O51 Ag3 82.86(15) . .
C51 O52 Ag7 118.8(4) . .
C61 O61 Ag4 120.4(4) . .
C61 O62 Ag3 125.0(4) . .
F31' F31 F33' 120.8(19) . .
F31' F31 C32 65.4(12) . .
F33' F31 C32 58.9(11) . .
F32' F32 C32 73(3) . .
F32' F32 F31' 131(4) . .
C32 F32 F31' 58.4(12) . .
F33' F33 C32 61.3(12) . .
F33' F33 F32' 100.5(17) . .
C32 F33 F32' 48.2(11) . .
F31 F31' C32 65.1(13) . .
F31 F31' F32 110.6(17) . .
C32 F31' F32 55.0(11) . .
F32 F32' C32 76(3) . .
F32 F32' F33 122(4) . .
C32 F32' F33 52.7(13) . .
F33 F33' F31 131.4(18) . .
F33 F33' C32 69.1(15) . .
F31 F33' C32 64.0(11) . .
C09 N1 C010 109.1(7) . .
C09 N1 C08 107.9(6) . .
C010 N1 C08 109.6(7) . .
C09 N1 C07 110.5(5) . .
C010 N1 C07 112.4(6) . .
C08 N1 C07 107.3(6) . .
C06 C01 C02 120.1(7) . .
C03 C02 C01 121.4(8) . .
C02 C03 C04 118.5(7) . .
C02 C03 Ag7 88.5(5) . .
C04 C03 Ag7 92.9(5) . .
C03 C04 C05 120.7(7) . .
C06 C05 C04 121.0(7) . .
C05 C06 C01 118.2(6) . .
C05 C06 C07 121.5(6) . .
C01 C06 C07 120.1(6) . .
C06 C07 N1 116.4(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 C1 2.303(6) .
Ag1 O41 2.342(4) 3_655
Ag1 O31 2.400(4) .
Ag1 C2 2.449(5) 3_655
Ag1 Ag1 2.8076(9) 3_655
Ag1 Ag2 2.9971(7) .
Ag1 Ag5 3.0662(8) .
Ag1 Ag6 3.0973(8) 3_655
Ag1 Ag4 3.1318(8) 3_655
Ag2 C1 2.194(5) .
Ag2 O11 2.275(4) .
Ag2 O51 2.421(5) .
Ag2 O21 2.549(4) .
Ag2 Ag5 2.8706(7) .
Ag2 Ag6 3.0829(8) 3
Ag2 Ag7 3.2506(8) .
Ag2 Ag3 3.2835(8) .
Ag3 O62 2.265(5) .
Ag3 O51 2.539(5) .
Ag3 C2 2.541(6) 3
Ag3 C2 2.611(6) .
Ag3 C1 2.660(6) 3
Ag3 Ag4 2.9238(8) .
Ag3 Ag3 3.0453(12) 3
Ag3 Ag6 3.1158(8) 3
Ag3 Ag5 3.1390(9) 3
Ag4 O61 2.236(4) .
Ag4 C2 2.295(6) .
Ag4 O32 2.416(4) 3_655
Ag4 Ag6 2.9822(8) .
Ag4 Ag1 3.1318(8) 3_655
Ag5 O22 2.276(4) .
Ag5 C1 2.304(6) .
Ag5 O42 2.325(4) .
Ag5 Ag3 3.1390(9) 3
Ag6 C2 2.100(6) .
Ag6 O12 2.127(4) 3
Ag6 Ag2 3.0829(8) 3
Ag6 Ag1 3.0973(8) 3_655
Ag6 Ag3 3.1158(8) 3
Ag7 O52 2.268(4) .
Ag7 C03 2.468(7) .
Ag7 O41 2.505(4) 3_655
Ag7 O31 2.511(4) .
C1 C2 1.203(8) .
C1 Ag3 2.660(6) 3
C2 Ag1 2.449(5) 3_655
C2 Ag3 2.541(6) 3
C11 O11 1.223(7) .
C11 O12 1.237(7) .
C11 C12 1.524(8) .
C12 F12 1.282(8) .
C12 F13 1.305(8) .
C12 F11 1.325(11) .
C21 O21 1.227(7) .
C21 O22 1.249(7) .
C21 C22 1.533(9) .
C22 F21 1.251(10) .
C22 F22 1.257(8) .
C22 F23 1.285(10) .
C31 O32 1.231(7) .
C31 O31 1.251(7) .
C31 C32 1.546(8) .
C32 F32' 1.23(2) .
C32 F33' 1.235(15) .
C32 F32 1.251(15) .
C32 F31 1.297(11) .
C32 F31' 1.301(17) .
C32 F33 1.316(12) .
C41 O42 1.244(7) .
C41 O41 1.248(7) .
C41 C42 1.530(8) .
C42 F41 1.294(7) .
C42 F43 1.304(8) .
C42 F42 1.319(8) .
C51 O51 1.229(8) .
C51 O52 1.235(8) .
C51 C52 1.527(9) .
C52 F52 1.317(9) .
C52 F51 1.330(8) .
C52 F53 1.336(8) .
C61 O61 1.233(7) .
C61 O62 1.234(7) .
C61 C62 1.553(9) .
C62 F63 1.299(8) .
C62 F61 1.300(8) .
C62 F62 1.330(8) .
O12 Ag6 2.127(4) 3
O32 Ag4 2.416(4) 3_655
O41 Ag1 2.342(4) 3_655
O41 Ag7 2.505(4) 3_655
F31 F31' 1.09(3) .
F31 F33' 1.21(3) .
F32 F32' 0.66(5) .
F32 F31' 1.40(3) .
F33 F33' 1.07(4) .
F33 F32' 1.62(4) .
N1 C09 1.488(10) .
N1 C010 1.492(10) .
N1 C08 1.495(9) .
N1 C07 1.513(9) .
C01 C06 1.379(9) .
C01 C02 1.390(11) .
C02 C03 1.357(12) .
C03 C04 1.363(12) .
C04 C05 1.392(10) .
C05 C06 1.365(9) .
C06 C07 1.498(9) .
