#------------------------------------------------------------------------------
#$Date: 2016-02-20 02:53:41 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176768 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/57/2105772.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_2105772
loop_
_publ_author_name
'Hau, Sam C. K.'
'Tam, Dennis Y. S.'
'Mak, Thomas C. W.'
_publ_section_title
;
 Organosilver(I) framework assembly with trifluoroacetate and
 enediyne-functionalized alicycles
;
_journal_coeditor_code           BI5014
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              37
_journal_page_last               46
_journal_paper_doi               10.1107/S2052520614000171
_journal_volume                  70
_journal_year                    2014
_chemical_formula_moiety
;
 11(Ag +), (C6 Br2 2-), 9(C2 F3 O2-), C2 H3 N, 3(H2 O)
;
_chemical_formula_sum            'C26 H9 Ag11 Br2 F27 N O21'
_chemical_formula_weight         2530.73
_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   16.861(6)
_cell_length_b                   24.431(9)
_cell_length_c                   26.723(10)
_cell_measurement_temperature    173(2)
_cell_volume                     11008(7)
_computing_cell_refinement       'SAINT (Bruker, 2003)'
_computing_data_collection       'APEX2 (Bruker, 2003)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'DIAMOND (Brandenburg, 2009)'
_computing_publication_material  SHELXL-2013
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD diffractometer'
_diffrn_measurement_method       'φ and ω scan'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1352
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       29
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            179417
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.248
_diffrn_reflns_theta_min         1.654
_exptl_absorpt_coefficient_mu    5.433
_exptl_absorpt_correction_T_max  0.1720
_exptl_absorpt_correction_T_min  0.1720
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2003)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    3.054
_exptl_crystal_description       block
_exptl_crystal_F_000             9360
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.500
_exptl_crystal_size_min          0.500
_refine_diff_density_max         1.772
_refine_diff_density_min         -1.331
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.084
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     794
_refine_ls_number_reflns         9961
_refine_ls_number_restraints     216
_refine_ls_restrained_S_all      1.132
_refine_ls_R_factor_all          0.0764
_refine_ls_R_factor_gt           0.0546
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0723P)²+137.2121P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1369
_refine_ls_wR_factor_ref         0.1537
_reflns_number_gt                7690
_reflns_number_total             9961
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            bi5014sup1.cif
_cod_data_source_block           VIII
_cod_database_code               2105772
#BEGIN Tags that were not found in dictionaries:
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.172
_shelx_estimated_absorpt_t_max   0.172
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'-x-1/2, y-1/2, z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
Ag Ag1 0.32376(5) 0.47119(3) 0.46985(3) 0.0398(2) Uani d 1
Ag Ag2 0.46852(5) 0.31308(3) 0.44930(3) 0.0386(2) Uani d 1
Ag Ag3 0.45057(5) 0.40470(3) 0.38494(3) 0.03210(19) Uani d 1
Ag Ag4 0.04632(5) 0.39233(4) 0.39154(3) 0.0381(2) Uani d 1
Ag Ag5 0.49165(5) 0.42136(3) 0.48859(3) 0.0329(2) Uani d 1
Ag Ag6 0.02865(6) 0.30072(3) 0.46609(4) 0.0438(2) Uani d 1
Ag Ag7 -0.01120(5) 0.40942(3) 0.49546(3) 0.0363(2) Uani d 1
Ag Ag8 0.12831(5) 0.47403(3) 0.45809(4) 0.0400(2) Uani d 1
Ag Ag9 -0.01148(6) 0.38375(4) 0.25786(3) 0.0463(2) Uani d 1
Ag Ag10 0.12776(6) 0.44062(4) 0.19143(3) 0.0491(3) Uani d 1
Ag Ag11 0.08649(7) 0.51336(5) 0.30636(4) 0.0566(3) Uani d 1
Br Br1 0.16484(7) 0.28225(5) 0.56301(5) 0.0456(3) Uani d 1
Br Br2 0.34978(7) 0.28691(5) 0.55508(5) 0.0452(3) Uani d 1
C C1 0.1052(6) 0.3822(4) 0.4638(4) 0.026(2) Uani d 1
C C2 0.1709(6) 0.3692(4) 0.4775(3) 0.024(2) Uani d 1
C C3 0.2472(5) 0.3500(4) 0.4943(4) 0.024(2) Uani d 1
C C4 0.3172(5) 0.3728(4) 0.4709(4) 0.026(2) Uani d 1
C C5 0.3799(5) 0.3860(4) 0.4521(4) 0.026(2) Uani d 1
C C6 0.2529(6) 0.3124(4) 0.5311(4) 0.029(2) Uani d 1
O O1 0.5543(5) 0.2961(3) 0.5185(3) 0.0400(18) Uani d 1
O O2 0.5853(5) 0.3825(3) 0.5397(3) 0.0421(19) Uani d 1
C C7 0.5924(6) 0.3314(4) 0.5408(4) 0.033(2) Uani d 1
C C8 0.6628(6) 0.3116(4) 0.5732(4) 0.054(3) Uani d 1
F F1 0.6701(6) 0.2589(3) 0.5739(4) 0.105(4) Uani d 1
F F2 0.6561(7) 0.3279(4) 0.6184(3) 0.119(4) Uani d 1
F F3 0.7295(5) 0.3312(5) 0.5565(4) 0.131(5) Uani d 1
O O3 0.5584(5) 0.2952(4) 0.3830(3) 0.051(2) Uani d 1
O O4 0.5249(4) 0.3563(3) 0.3245(3) 0.0381(18) Uani d 1
C C9 0.5608(6) 0.3149(5) 0.3417(4) 0.035(2) Uani d 1
C C10 0.6220(6) 0.2869(4) 0.3057(4) 0.059(4) Uani d 1
F F4 0.6139(5) 0.3011(3) 0.2593(3) 0.076(3) Uani d 1
F F5 0.6174(6) 0.2343(3) 0.3084(3) 0.102(4) Uani d 1
F F6 0.6934(5) 0.2998(5) 0.3193(4) 0.109(4) Uani d 1
O O5 0.5561(4) 0.5024(3) 0.4569(3) 0.0346(17) Uani d 1
O O6 0.5847(5) 0.4572(3) 0.3876(3) 0.0424(19) Uani d 1
C C11 0.5845(6) 0.4985(4) 0.4139(4) 0.030(2) Uani d 1
C C12 0.6238(6) 0.5503(5) 0.3926(3) 0.048(3) Uani d 1
F F7 0.6729(6) 0.5731(4) 0.4233(3) 0.091(3) Uani d 1
F F8 0.6624(8) 0.5415(5) 0.3519(3) 0.140(5) Uani d 1
F F9 0.5697(6) 0.5861(5) 0.3829(5) 0.164(6) Uani d 1
O O7 0.2713(5) 0.5349(4) 0.5202(4) 0.056(2) Uani d 1
O O8 0.1406(4) 0.5471(3) 0.5131(3) 0.0421(19) Uani d 1
C C13 0.2080(6) 0.5580(4) 0.5287(4) 0.033(2) Uani d 1
C C14 0.2146(5) 0.6058(4) 0.5675(4) 0.052(3) Uani d 1
F F10 0.2774(6) 0.6352(5) 0.5609(5) 0.131(5) Uani d 1
F F11 0.1542(6) 0.6373(5) 0.5672(5) 0.154(6) Uani d 1
F F12 0.2217(9) 0.5866(5) 0.6128(4) 0.149(6) Uani d 1
O O9 -0.0447(5) 0.2845(3) 0.5426(3) 0.0380(18) Uani d 1
O O10 -0.0786(5) 0.3700(3) 0.5638(3) 0.046(2) Uani d 1
C C15 -0.0748(6) 0.3201(4) 0.5704(4) 0.033(2) Uani d 1
C C16 -0.1064(5) 0.2998(4) 0.6220(4) 0.046(3) Uani d 1
F F13 -0.1606(5) 0.3321(3) 0.6395(3) 0.072(2) Uani d 1
F F14 -0.1365(6) 0.2511(3) 0.6193(4) 0.106(4) Uani d 1
F F15 -0.0493(5) 0.2979(5) 0.6541(3) 0.105(4) Uani d 1
O O11 -0.0216(6) 0.2661(4) 0.3905(3) 0.055(2) Uani d 1
O O12 -0.0082(6) 0.3344(4) 0.3361(3) 0.052(2) Uani d 1
C C17 -0.0266(8) 0.2876(6) 0.3487(4) 0.047(3) Uani d 1
C C18 -0.0694(8) 0.2530(5) 0.3093(4) 0.091(7) Uani d 1
F F16 -0.0519(12) 0.2021(5) 0.3146(5) 0.192(7) Uani d 1
F F17 -0.0567(9) 0.2664(5) 0.2640(3) 0.144(5) Uani d 1
F F18 -0.1460(8) 0.2556(8) 0.3162(7) 0.235(10) Uani d 1
O O13 -0.0053(4) 0.5167(3) 0.4407(3) 0.0375(17) Uani d 1
O O14 -0.0149(5) 0.4787(3) 0.3639(3) 0.045(2) Uani d 1
C C19 -0.0328(6) 0.5116(4) 0.3982(4) 0.029(2) Uani d 1
C C20 -0.1017(6) 0.5526(4) 0.3844(3) 0.051(3) Uani d 1
F F19 -0.1394(5) 0.5699(4) 0.4231(3) 0.093(3) Uani d 1
F F20 -0.1522(5) 0.5306(4) 0.3541(4) 0.105(4) Uani d 1
F F21 -0.0714(7) 0.5943(4) 0.3619(4) 0.116(4) Uani d 1
O O15 0.1215(5) 0.4153(3) 0.3085(3) 0.0421(19) Uani d 1
O O16 0.2136(5) 0.4135(4) 0.2482(3) 0.051(2) Uani d 1
C C21 0.1878(6) 0.4039(5) 0.2912(4) 0.035(2) Uani d 1
C C22 0.2451(6) 0.3783(5) 0.3285(4) 0.072(5) Uani d 1
F F22 0.3115(5) 0.3637(5) 0.3095(4) 0.121(4) Uani d 1
F F23 0.2139(6) 0.3373(4) 0.3514(4) 0.123(5) Uani d 1
F F24 0.2612(7) 0.4143(5) 0.3636(4) 0.146(6) Uani d 1
O O17 0.0087(5) 0.4827(4) 0.2269(3) 0.050(2) Uani d 1
O O18 -0.0772(5) 0.4840(3) 0.1631(3) 0.045(2) Uani d 1
C C23 -0.0445(7) 0.5026(5) 0.2009(4) 0.036(2) Uani d 1
C C24 -0.0781(7) 0.5591(5) 0.2179(4) 0.066(4) Uani d 1
F F25 -0.0811(10) 0.5934(4) 0.1817(4) 0.144(5) Uani d 1
F F26 -0.0389(8) 0.5812(5) 0.2536(4) 0.139(5) Uani d 1
F F27 -0.1503(7) 0.5528(6) 0.2335(6) 0.198(8) Uani d 1
N N1 0.1583(9) 0.5764(7) 0.2670(5) 0.080(4) Uani d 1
C C25 0.1953(10) 0.6082(8) 0.2542(8) 0.084(6) Uani d 1
C C26 0.2451(13) 0.6508(11) 0.2299(14) 0.180(17) Uani d 1
H H26A 0.2994 0.6390 0.2295 0.270 Uiso calc 1
H H26B 0.2409 0.6844 0.2484 0.270 Uiso calc 1
H H26C 0.2271 0.6565 0.1963 0.270 Uiso calc 1
O O1W 0.3311(5) 0.5379(3) 0.4077(3) 0.0419(19) Uani d 1
H H1W 0.3584 0.5258 0.3833 0.063 Uiso d 1
H H2W 0.3527 0.5666 0.4195 0.063 Uiso d 1
O O2W 0.1637(5) 0.5390(3) 0.3941(3) 0.0407(18) Uani d 1
H H3W 0.2138 0.5429 0.3936 0.061 Uiso d 1
H H4W 0.1417 0.5696 0.4001 0.061 Uiso d 1
O O3W -0.1267(6) 0.4242(6) 0.2854(4) 0.094(4) Uani d 1
H H5W -0.1656 0.4123 0.2683 0.141 Uiso d 1
H H6W -0.1228 0.4587 0.2818 0.141 Uiso d 1
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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Br Br -0.2901 2.4595 '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'
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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
O7 Ag1 O1W . . 87.9(3)
O7 Ag1 C5 . . 154.3(4)
O1W Ag1 C5 . . 117.2(3)
O7 Ag1 C4 . . 132.0(4)
O1W Ag1 C4 . . 135.1(3)
C5 Ag1 C4 . . 29.6(3)
O7 Ag1 Ag5 . . 122.2(2)
O1W Ag1 Ag5 . . 109.8(2)
C5 Ag1 Ag5 . . 47.0(2)
C4 Ag1 Ag5 . . 69.5(2)
O7 Ag1 Ag8 . . 69.5(2)
O1W Ag1 Ag8 . . 88.3(2)
C5 Ag1 Ag8 . . 113.8(2)
C4 Ag1 Ag8 . . 88.7(2)
Ag5 Ag1 Ag8 . . 157.80(4)
C5 Ag2 O3 . . 125.2(3)
C5 Ag2 O1 . . 119.8(3)
O3 Ag2 O1 . . 99.2(3)
C5 Ag2 O9 . 3_556 134.2(3)
O3 Ag2 O9 . 3_556 86.8(3)
O1 Ag2 O9 . 3_556 79.3(2)
C5 Ag2 Ag3 . . 49.3(2)
O3 Ag2 Ag3 . . 76.2(2)
O1 Ag2 Ag3 . . 132.19(18)
O9 Ag2 Ag3 3_556 . 145.70(18)
C5 Ag2 Ag5 . . 51.0(2)
O3 Ag2 Ag5 . . 110.9(2)
O1 Ag2 Ag5 . . 78.11(17)
O9 Ag2 Ag5 3_556 . 153.26(18)
Ag3 Ag2 Ag5 . . 60.65(4)
C5 Ag3 O4 . . 137.8(3)
C5 Ag3 O18 . 6_656 120.3(3)
O4 Ag3 O18 . 6_656 98.3(3)
C5 Ag3 O6 . . 123.4(3)
O4 Ag3 O6 . . 78.7(3)
O18 Ag3 O6 6_656 . 77.5(3)
C5 Ag3 Ag2 . . 53.1(2)
O4 Ag3 Ag2 . . 87.86(19)
O18 Ag3 Ag2 6_656 . 173.4(2)
O6 Ag3 Ag2 . . 106.2(2)
C5 Ag3 Ag5 . . 51.4(2)
O4 Ag3 Ag5 . . 126.87(18)
O18 Ag3 Ag5 6_656 . 116.9(2)
O6 Ag3 Ag5 . . 72.27(17)
Ag2 Ag3 Ag5 . . 60.25(3)
C1 Ag4 O12 . . 134.2(3)
C1 Ag4 O14 . . 123.5(3)
O12 Ag4 O14 . . 99.8(3)
C1 Ag4 Ag7 . . 48.6(3)
O12 Ag4 Ag7 . . 124.8(2)
O14 Ag4 Ag7 . . 91.33(19)
C1 Ag4 Ag8 . . 49.0(3)
O12 Ag4 Ag8 . . 174.8(2)
O14 Ag4 Ag8 . . 78.6(2)
Ag7 Ag4 Ag8 . . 60.29(3)
C1 Ag4 Ag6 . . 51.4(3)
O12 Ag4 Ag6 . . 85.8(2)
O14 Ag4 Ag6 . . 142.6(2)
Ag7 Ag4 Ag6 . . 56.88(3)
Ag8 Ag4 Ag6 . . 98.48(4)
C5 Ag5 O2 . . 131.6(3)
C5 Ag5 O5 . . 122.1(3)
O2 Ag5 O5 . . 103.8(3)
C5 Ag5 O5 . 5_666 105.3(3)
O2 Ag5 O5 . 5_666 100.6(3)
O5 Ag5 O5 . 5_666 74.8(3)
C5 Ag5 Ag2 . . 52.1(2)
O2 Ag5 Ag2 . . 86.00(19)
O5 Ag5 Ag2 . . 133.56(17)
O5 Ag5 Ag2 5_666 . 148.87(17)
C5 Ag5 Ag3 . . 48.8(2)
O2 Ag5 Ag3 . . 132.8(2)
O5 Ag5 Ag3 . . 83.53(17)
O5 Ag5 Ag3 5_666 . 126.00(18)
Ag2 Ag5 Ag3 . . 59.09(3)
C5 Ag5 Ag1 . . 48.2(2)
O2 Ag5 Ag1 . . 151.8(2)
O5 Ag5 Ag1 . . 91.84(19)
O5 Ag5 Ag1 5_666 . 60.68(18)
Ag2 Ag5 Ag1 . . 100.21(4)
Ag3 Ag5 Ag1 . . 71.53(3)
O11 Ag6 C1 . . 118.5(3)
O11 Ag6 O9 . . 118.9(3)
C1 Ag6 O9 . . 115.9(3)
O11 Ag6 O1 . 3_456 81.9(3)
C1 Ag6 O1 . 3_456 136.2(3)
O9 Ag6 O1 . 3_456 77.9(3)
O11 Ag6 Ag7 . . 119.2(3)
C1 Ag6 Ag7 . . 49.7(2)
O9 Ag6 Ag7 . . 78.42(18)
O1 Ag6 Ag7 3_456 . 154.01(19)
O11 Ag6 Ag4 . . 74.6(2)
C1 Ag6 Ag4 . . 46.0(2)
O9 Ag6 Ag4 . . 136.92(18)
O1 Ag6 Ag4 3_456 . 144.57(19)
Ag7 Ag6 Ag4 . . 60.85(4)
C1 Ag7 O10 . . 126.5(3)
C1 Ag7 O8 . 5_566 151.5(3)
O10 Ag7 O8 . 5_566 79.5(3)
C1 Ag7 O13 . 5_566 112.0(3)
O10 Ag7 O13 . 5_566 79.6(3)
O8 Ag7 O13 5_566 5_566 81.3(3)
C1 Ag7 Ag6 . . 54.0(2)
O10 Ag7 Ag6 . . 86.91(18)
O8 Ag7 Ag6 5_566 . 126.26(18)
O13 Ag7 Ag6 5_566 . 146.61(19)
C1 Ag7 Ag4 . . 47.1(2)
O10 Ag7 Ag4 . . 145.5(2)
O8 Ag7 Ag4 5_566 . 105.4(2)
O13 Ag7 Ag4 5_566 . 134.68(18)
Ag6 Ag7 Ag4 . . 62.27(3)
C1 Ag7 Ag8 . . 49.0(2)
O10 Ag7 Ag8 . . 148.2(2)
O8 Ag7 Ag8 5_566 . 116.2(2)
O13 Ag7 Ag8 5_566 . 76.12(18)
Ag6 Ag7 Ag8 . . 102.33(4)
Ag4 Ag7 Ag8 . . 60.49(3)
C1 Ag8 O8 . . 136.8(3)
C1 Ag8 O2W . . 137.6(3)
O8 Ag8 O2W . . 85.4(3)
C1 Ag8 O13 . . 105.4(3)
O8 Ag8 O13 . . 83.0(2)
O2W Ag8 O13 . . 79.5(3)
C1 Ag8 C2 . . 26.3(3)
O8 Ag8 C2 . . 125.6(3)
O2W Ag8 C2 . . 133.9(3)
O13 Ag8 C2 . . 131.4(3)
C1 Ag8 Ag7 . . 47.7(3)
O8 Ag8 Ag7 . . 105.3(2)
O2W Ag8 Ag7 . . 140.9(2)
O13 Ag8 Ag7 . . 65.13(18)
C2 Ag8 Ag7 . . 69.3(2)
C1 Ag8 Ag4 . . 46.3(2)
O8 Ag8 Ag4 . . 157.67(19)
O2W Ag8 Ag4 . . 97.6(2)
O13 Ag8 Ag4 . . 75.84(17)
C2 Ag8 Ag4 . . 66.9(2)
Ag7 Ag8 Ag4 . . 59.22(3)
C1 Ag8 Ag1 . . 98.2(3)
O8 Ag8 Ag1 . . 82.38(19)
O2W Ag8 Ag1 . . 80.48(19)
O13 Ag8 Ag1 . . 156.06(18)
C2 Ag8 Ag1 . . 72.4(2)
Ag7 Ag8 Ag1 . . 137.46(4)
Ag4 Ag8 Ag1 . . 119.95(4)
O3W Ag9 O4 . 6_556 129.4(3)
O3W Ag9 O12 . . 87.5(4)
O4 Ag9 O12 6_556 . 130.8(3)
O3W Ag9 O17 . . 79.1(4)
O4 Ag9 O17 6_556 . 86.2(3)
O12 Ag9 O17 . . 138.1(3)
O3W Ag9 Ag10 . . 126.9(4)
O4 Ag9 Ag10 6_556 . 55.3(2)
O12 Ag9 Ag10 . . 132.0(2)
O17 Ag9 Ag10 . . 47.9(2)
O16 Ag10 O6 . 6_556 155.0(3)
O16 Ag10 O17 . . 113.6(3)
O6 Ag10 O17 6_556 . 91.3(3)
O16 Ag10 Ag9 . . 88.3(2)
O6 Ag10 Ag9 6_556 . 110.6(2)
O17 Ag10 Ag9 . . 51.4(2)
N1 Ag11 O14 . . 156.4(5)
N1 Ag11 O15 . . 123.6(5)
O14 Ag11 O15 . . 79.5(3)
C2 C1 Ag4 . . 135.4(8)
C2 C1 Ag7 . . 140.1(8)
Ag4 C1 Ag7 . . 84.4(4)
C2 C1 Ag8 . . 97.0(7)
Ag4 C1 Ag8 . . 84.7(3)
Ag7 C1 Ag8 . . 83.3(3)
C2 C1 Ag6 . . 105.6(7)
Ag4 C1 Ag6 . . 82.6(3)
Ag7 C1 Ag6 . . 76.3(3)
Ag8 C1 Ag6 . . 156.8(5)
C1 C2 C3 . . 176.2(10)
C1 C2 Ag8 . . 56.7(6)
C3 C2 Ag8 . . 127.1(6)
C6 C3 C2 . . 120.7(8)
C6 C3 C4 . . 121.3(8)
C2 C3 C4 . . 118.0(8)
C5 C4 C3 . . 172.5(10)
C5 C4 Ag1 . . 71.9(6)
C3 C4 Ag1 . . 115.2(7)
C4 C5 Ag3 . . 149.6(8)
C4 C5 Ag5 . . 129.9(8)
Ag3 C5 Ag5 . . 79.8(3)
C4 C5 Ag2 . . 111.7(8)
Ag3 C5 Ag2 . . 77.6(3)
Ag5 C5 Ag2 . . 77.0(3)
C4 C5 Ag1 . . 78.5(7)
Ag3 C5 Ag1 . . 101.5(4)
Ag5 C5 Ag1 . . 84.9(3)
Ag2 C5 Ag1 . . 161.7(5)
C3 C6 Br2 . . 122.7(7)
C3 C6 Br1 . . 123.2(7)
Br2 C6 Br1 . . 114.1(5)
C7 O1 Ag2 . . 124.8(7)
C7 O1 Ag6 . 3_556 133.7(7)
Ag2 O1 Ag6 . 3_556 101.1(3)
C7 O2 Ag5 . . 119.4(7)
O1 C7 O2 . . 129.6(10)
O1 C7 C8 . . 116.9(9)
O2 C7 C8 . . 113.4(9)
F2 C8 F1 . . 107.8(8)
F2 C8 F3 . . 106.7(9)
F1 C8 F3 . . 106.8(8)
F2 C8 C7 . . 111.4(9)
F1 C8 C7 . . 113.1(9)
F3 C8 C7 . . 110.8(9)
C9 O3 Ag2 . . 129.2(7)
C9 O4 Ag3 . . 113.9(7)
C9 O4 Ag9 . 6_656 133.2(7)
Ag3 O4 Ag9 . 6_656 110.7(3)
O3 C9 O4 . . 129.5(10)
O3 C9 C10 . . 114.2(9)
O4 C9 C10 . . 116.1(9)
F5 C10 F4 . . 108.3(8)
F5 C10 F6 . . 106.5(8)
F4 C10 F6 . . 107.4(8)
F5 C10 C9 . . 111.2(9)
F4 C10 C9 . . 113.7(8)
F6 C10 C9 . . 109.4(9)
C11 O5 Ag5 . . 115.6(6)
C11 O5 Ag5 . 5_666 135.9(7)
Ag5 O5 Ag5 . 5_666 105.2(3)
C11 O6 Ag10 . 6_656 132.7(7)
C11 O6 Ag3 . . 114.7(6)
Ag10 O6 Ag3 6_656 . 99.5(3)
O6 C11 O5 . . 126.2(10)
O6 C11 C12 . . 117.6(9)
O5 C11 C12 . . 116.2(9)
F8 C12 F9 . . 107.5(9)
F8 C12 F7 . . 106.5(8)
F9 C12 F7 . . 106.8(9)
F8 C12 C11 . . 113.2(9)
F9 C12 C11 . . 109.1(9)
F7 C12 C11 . . 113.3(8)
C13 O7 Ag1 . . 140.7(8)
C13 O8 Ag8 . . 117.4(7)
C13 O8 Ag7 . 5_566 139.3(7)
Ag8 O8 Ag7 . 5_566 101.3(3)
O7 C13 O8 . . 129.5(10)
O7 C13 C14 . . 113.8(9)
O8 C13 C14 . . 116.6(9)
F11 C14 F10 . . 108.5(9)
F11 C14 F12 . . 107.3(9)
F10 C14 F12 . . 104.6(8)
F11 C14 C13 . . 112.9(9)
F10 C14 C13 . . 112.5(9)
F12 C14 C13 . . 110.7(9)
C15 O9 Ag2 . 3_456 132.4(7)
C15 O9 Ag6 . . 126.4(7)
Ag2 O9 Ag6 3_456 . 101.0(3)
C15 O10 Ag7 . . 119.3(7)
O10 C15 O9 . . 128.6(10)
O10 C15 C16 . . 115.0(9)
O9 C15 C16 . . 116.2(9)
F15 C16 F13 . . 108.0(8)
F15 C16 F14 . . 107.3(8)
F13 C16 F14 . . 107.6(8)
F15 C16 C15 . . 110.2(8)
F13 C16 C15 . . 111.5(8)
F14 C16 C15 . . 112.1(8)
C17 O11 Ag6 . . 130.4(8)
C17 O12 Ag4 . . 120.5(8)
C17 O12 Ag9 . . 134.1(8)
Ag4 O12 Ag9 . . 105.4(3)
O12 C17 O11 . . 128.7(11)
O12 C17 C18 . . 116.2(11)
O11 C17 C18 . . 114.7(11)
F17 C18 F16 . . 108.2(10)
F17 C18 F18 . . 106.6(10)
F16 C18 F18 . . 105.0(9)
F17 C18 C17 . . 115.7(10)
F16 C18 C17 . . 110.6(12)
F18 C18 C17 . . 110.1(12)
C19 O13 Ag7 . 5_566 138.0(7)
C19 O13 Ag8 . . 117.6(7)
Ag7 O13 Ag8 5_566 . 94.2(3)
C19 O14 Ag11 . . 113.8(7)
C19 O14 Ag4 . . 115.5(7)
Ag11 O14 Ag4 . . 101.1(3)
O13 C19 O14 . . 130.2(10)
O13 C19 C20 . . 115.3(8)
O14 C19 C20 . . 114.4(8)
F21 C20 F19 . . 108.2(8)
F21 C20 F20 . . 107.3(8)
F19 C20 F20 . . 108.3(8)
F21 C20 C19 . . 108.6(9)
F19 C20 C19 . . 112.6(8)
F20 C20 C19 . . 111.5(8)
C21 O15 Ag11 . . 115.2(7)
C21 O16 Ag10 . . 117.5(7)
O15 C21 O16 . . 127.8(10)
O15 C21 C22 . . 114.9(9)
O16 C21 C22 . . 117.2(9)
F22 C22 F23 . . 109.3(9)
F22 C22 F24 . . 106.8(9)
F23 C22 F24 . . 105.4(8)
F22 C22 C21 . . 114.2(9)
F23 C22 C21 . . 111.7(9)
F24 C22 C21 . . 108.9(10)
C23 O17 Ag10 . . 123.0(8)
C23 O17 Ag9 . . 117.1(8)
Ag10 O17 Ag9 . . 80.7(3)
C23 O18 Ag3 . 6_556 130.8(7)
O17 C23 O18 . . 129.6(11)
O17 C23 C24 . . 116.7(10)
O18 C23 C24 . . 113.6(9)
F25 C24 F26 . . 107.8(9)
F25 C24 F27 . . 106.5(9)
F26 C24 F27 . . 107.2(9)
F25 C24 C23 . . 111.8(9)
F26 C24 C23 . . 113.8(10)
F27 C24 C23 . . 109.3(10)
C25 N1 Ag11 . . 170.8(17)
N1 C25 C26 . . 173(3)
C25 C26 H26A . . 109.5
C25 C26 H26B . . 109.5
H26A C26 H26B . . 109.5
C25 C26 H26C . . 109.5
H26A C26 H26C . . 109.5
H26B C26 H26C . . 109.5
Ag1 O1W H1W . . 109.4
Ag1 O1W H2W . . 109.6
H1W O1W H2W . . 109.8
Ag8 O2W H3W . . 109.3
Ag8 O2W H4W . . 109.7
H3W O2W H4W . . 109.8
Ag9 O3W H5W . . 109.4
Ag9 O3W H6W . . 108.9
H5W O3W H6W . . 109.7
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Ag1 O7 . 2.241(8)
Ag1 O1W . 2.330(8)
Ag1 C5 . 2.335(10)
Ag1 C4 . 2.407(10)
Ag1 Ag5 . 3.1220(15)
Ag1 Ag8 . 3.3111(17)
Ag2 C5 . 2.326(9)
Ag2 O3 . 2.371(8)
Ag2 O1 . 2.384(8)
Ag2 O9 3_556 2.405(7)
Ag2 Ag3 . 2.8390(14)
Ag2 Ag5 . 2.8728(15)
Ag3 C5 . 2.203(10)
Ag3 O4 . 2.362(7)
Ag3 O18 6_656 2.371(8)
Ag3 O6 . 2.600(8)
Ag3 Ag5 . 2.8842(15)
Ag4 C1 . 2.185(10)
Ag4 O12 . 2.246(8)
Ag4 O14 . 2.462(8)
Ag4 Ag7 . 2.9711(15)
Ag4 Ag8 . 3.0097(14)
Ag4 Ag6 . 3.0112(15)
Ag5 C5 . 2.291(9)
Ag5 O2 . 2.294(7)
Ag5 O5 . 2.412(7)
Ag5 O5 5_666 2.496(7)
Ag6 O11 . 2.348(9)
Ag6 C1 . 2.374(10)
Ag6 O9 . 2.424(7)
Ag6 O1 3_456 2.441(7)
Ag6 Ag7 . 2.8494(15)
Ag7 C1 . 2.238(10)
Ag7 O10 . 2.356(8)
Ag7 O8 5_566 2.437(8)
Ag7 O13 5_566 2.499(7)
Ag7 Ag8 . 3.0039(14)
Ag8 C1 . 2.281(10)
Ag8 O8 . 2.322(8)
Ag8 O2W . 2.408(7)
Ag8 O13 . 2.525(8)
Ag8 C2 . 2.710(10)
Ag9 O3W . 2.300(10)
Ag9 O4 6_556 2.381(7)
Ag9 O12 . 2.415(8)
Ag9 O17 . 2.577(9)
Ag9 Ag10 . 3.2547(16)
Ag10 O16 . 2.198(8)
Ag10 O6 6_556 2.269(7)
Ag10 O17 . 2.446(9)
Ag11 N1 . 2.224(14)
Ag11 O14 . 2.450(9)
Ag11 O15 . 2.468(8)
Br1 C6 . 1.864(10)
Br2 C6 . 1.863(10)
C1 C2 . 1.209(14)
C2 C3 . 1.442(13)
C3 C6 . 1.350(14)
C3 C4 . 1.446(13)
C4 C5 . 1.213(14)
O1 C7 . 1.229(13)
O1 Ag6 3_556 2.441(7)
O2 C7 . 1.254(13)
C7 C8 . 1.547(14)
C8 F2 . 1.278(9)
C8 F1 . 1.292(8)
C8 F3 . 1.302(9)
O3 C9 . 1.205(13)
O4 C9 . 1.265(13)
O4 Ag9 6_656 2.381(7)
C9 C10 . 1.568(15)
C10 F5 . 1.288(9)
C10 F4 . 1.294(9)
C10 F6 . 1.297(9)
O5 C11 . 1.249(12)
O5 Ag5 5_666 2.496(7)
O6 C11 . 1.231(13)
O6 Ag10 6_656 2.269(7)
C11 C12 . 1.538(14)
C12 F8 . 1.285(8)
C12 F9 . 1.289(9)
C12 F7 . 1.292(8)
O7 C13 . 1.227(13)
O8 C13 . 1.240(13)
O8 Ag7 5_566 2.437(8)
C13 C14 . 1.566(14)
C14 F11 . 1.276(9)
C14 F10 . 1.291(9)
C14 F12 . 1.304(9)
O9 C15 . 1.250(13)
O9 Ag2 3_456 2.405(7)
O10 C15 . 1.232(13)
C15 C16 . 1.560(15)
C16 F15 . 1.290(9)
C16 F13 . 1.294(8)
C16 F14 . 1.296(9)
O11 C17 . 1.237(15)
O12 C17 . 1.231(15)
C17 C18 . 1.531(17)
C18 F17 . 1.274(9)
C18 F16 . 1.287(9)
C18 F18 . 1.307(10)
O13 C19 . 1.234(12)
O13 Ag7 5_566 2.499(7)
O14 C19 . 1.256(13)
C19 C20 . 1.578(15)
C20 F21 . 1.286(9)
C20 F19 . 1.287(8)
C20 F20 . 1.292(9)
O15 C21 . 1.240(13)
O16 C21 . 1.253(13)
C21 C22 . 1.523(15)
C22 F22 . 1.279(9)
C22 F23 . 1.287(9)
C22 F24 . 1.312(9)
O17 C23 . 1.234(14)
O18 C23 . 1.238(13)
O18 Ag3 6_556 2.371(8)
C23 C24 . 1.558(15)
C24 F25 . 1.282(9)
C24 F26 . 1.282(9)
C24 F27 . 1.295(9)
N1 C25 . 1.05(2)
C25 C26 . 1.49(3)
C26 H26A . 0.9600
C26 H26B . 0.9600
C26 H26C . 0.9600
O1W H1W . 0.8511
O1W H2W . 0.8507
O2W H3W . 0.8502
O2W H4W . 0.8498
O3W H5W . 0.8506
O3W H6W . 0.8509
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
O1W H2W O2 5_666 0.85 1.96 2.783(11) 163.6
O1W H1W O18 6_656 0.85 1.94 2.774(11) 167.4
O2W H4W O10 5_566 0.85 2.06 2.875(11) 160.8
O2W H3W O1W . 0.85 2.02 2.846(12) 164.7
O3W H5W O16 6_556 0.85 2.08 2.851(13) 149.6
O3W H6W F20 . 0.85 2.66 3.212(14) 123.9
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion
Ag4 C1 C2 Ag8 . 89.6(10)
Ag7 C1 C2 Ag8 . -88.0(11)
Ag6 C1 C2 Ag8 . -175.1(7)
Ag8 C2 C3 C6 . 136.0(9)
Ag8 C2 C3 C4 . -43.3(12)
C6 C3 C4 Ag1 . -126.9(9)
C2 C3 C4 Ag1 . 52.4(11)
Ag1 C4 C5 Ag3 . -93.2(15)
Ag1 C4 C5 Ag5 . 73.2(8)
Ag1 C4 C5 Ag2 . 164.1(6)
C2 C3 C6 Br2 . -178.9(7)
C4 C3 C6 Br2 . 0.4(14)
C2 C3 C6 Br1 . 0.0(14)
C4 C3 C6 Br1 . 179.3(8)
Ag2 O1 C7 O2 . 14.7(18)
Ag6 O1 C7 O2 3_556 -156.6(9)
Ag2 O1 C7 C8 . -161.9(7)
Ag6 O1 C7 C8 3_556 26.9(15)
Ag5 O2 C7 O1 . -1.9(17)
Ag5 O2 C7 C8 . 174.7(6)
O1 C7 C8 F2 . -124.1(11)
O2 C7 C8 F2 . 58.8(13)
O1 C7 C8 F1 . -2.5(14)
O2 C7 C8 F1 . -179.6(10)
O1 C7 C8 F3 . 117.3(11)
O2 C7 C8 F3 . -59.7(12)
Ag2 O3 C9 O4 . 12.4(19)
Ag2 O3 C9 C10 . -172.1(7)
Ag3 O4 C9 O3 . 5.2(16)
Ag9 O4 C9 O3 6_656 -156.3(10)
Ag3 O4 C9 C10 . -170.2(7)
Ag9 O4 C9 C10 6_656 28.3(15)
O3 C9 C10 F5 . 45.2(13)
O4 C9 C10 F5 . -138.7(10)
O3 C9 C10 F4 . 167.7(10)
O4 C9 C10 F4 . -16.1(14)
O3 C9 C10 F6 . -72.2(12)
O4 C9 C10 F6 . 104.0(11)
Ag10 O6 C11 O5 6_656 177.5(8)
Ag3 O6 C11 O5 . 45.2(14)
Ag10 O6 C11 C12 6_656 -3.4(15)
Ag3 O6 C11 C12 . -135.8(7)
Ag5 O5 C11 O6 . -2.5(14)
Ag5 O5 C11 O6 5_666 -158.3(8)
Ag5 O5 C11 C12 . 178.4(6)
Ag5 O5 C11 C12 5_666 22.6(14)
O6 C11 C12 F8 . -9.4(14)
O5 C11 C12 F8 . 169.8(10)
O6 C11 C12 F9 . 110.3(11)
O5 C11 C12 F9 . -70.5(12)
O6 C11 C12 F7 . -130.8(10)
O5 C11 C12 F7 . 48.4(13)
Ag1 O7 C13 O8 . 11(2)
Ag1 O7 C13 C14 . -173.5(9)
Ag8 O8 C13 O7 . -1.6(17)
Ag7 O8 C13 O7 5_566 -162.1(10)
Ag8 O8 C13 C14 . -177.4(7)
Ag7 O8 C13 C14 5_566 22.0(17)
O7 C13 C14 F11 . 164.4(11)
O8 C13 C14 F11 . -19.1(14)
O7 C13 C14 F10 . 41.2(14)
O8 C13 C14 F10 . -142.3(11)
O7 C13 C14 F12 . -75.4(13)
O8 C13 C14 F12 . 101.2(12)
Ag7 O10 C15 O9 . -7.2(16)
Ag7 O10 C15 C16 . 168.0(6)
Ag2 O9 C15 O10 3_456 179.2(8)
Ag6 O9 C15 O10 . 5.3(17)
Ag2 O9 C15 C16 3_456 4.0(14)
Ag6 O9 C15 C16 . -169.9(6)
O10 C15 C16 F15 . -91.6(11)
O9 C15 C16 F15 . 84.3(11)
O10 C15 C16 F13 . 28.3(13)
O9 C15 C16 F13 . -155.9(9)
O10 C15 C16 F14 . 149.0(10)
O9 C15 C16 F14 . -35.2(12)
Ag4 O12 C17 O11 . 2(2)
Ag9 O12 C17 O11 . 179.2(10)
Ag4 O12 C17 C18 . 175.2(9)
Ag9 O12 C17 C18 . -8.0(19)
Ag6 O11 C17 O12 . -3(2)
Ag6 O11 C17 C18 . -175.4(9)
O12 C17 C18 F17 . 24.9(18)
O11 C17 C18 F17 . -161.3(13)
O12 C17 C18 F16 . 148.3(14)
O11 C17 C18 F16 . -37.9(16)
O12 C17 C18 F18 . -96.1(15)
O11 C17 C18 F18 . 77.6(16)
Ag7 O13 C19 O14 5_566 152.6(9)
Ag8 O13 C19 O14 . 17.8(15)
Ag7 O13 C19 C20 5_566 -27.6(14)
Ag8 O13 C19 C20 . -162.4(6)
Ag11 O14 C19 O13 . -91.6(12)
Ag4 O14 C19 O13 . 24.7(15)
Ag11 O14 C19 C20 . 88.6(9)
Ag4 O14 C19 C20 . -155.0(6)
O13 C19 C20 F21 . 94.3(11)
O14 C19 C20 F21 . -85.9(11)
O13 C19 C20 F19 . -25.5(13)
O14 C19 C20 F19 . 154.3(10)
O13 C19 C20 F20 . -147.6(10)
O14 C19 C20 F20 . 32.2(12)
Ag11 O15 C21 O16 . -58.0(15)
Ag11 O15 C21 C22 . 118.0(9)
Ag10 O16 C21 O15 . -11.6(17)
Ag10 O16 C21 C22 . 172.5(8)
O15 C21 C22 F22 . 176.0(10)
O16 C21 C22 F22 . -7.6(15)
O15 C21 C22 F23 . 51.3(14)
O16 C21 C22 F23 . -132.2(11)
O15 C21 C22 F24 . -64.7(13)
O16 C21 C22 F24 . 111.7(12)
Ag10 O17 C23 O18 . 45.7(17)
Ag9 O17 C23 O18 . -51.0(16)
Ag10 O17 C23 C24 . -136.0(8)
Ag9 O17 C23 C24 . 127.4(9)
Ag3 O18 C23 O17 6_556 -6.4(19)
Ag3 O18 C23 C24 6_556 175.2(7)
O17 C23 C24 F25 . 131.0(12)
O18 C23 C24 F25 . -50.3(14)
O17 C23 C24 F26 . 8.5(15)
O18 C23 C24 F26 . -172.8(11)
O17 C23 C24 F27 . -111.2(13)
O18 C23 C24 F27 . 67.4(13)
