#------------------------------------------------------------------------------
#$Date: 2016-03-26 22:05:20 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180489 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/58/7215837.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_7215837
loop_
_publ_author_name
'Beeching, Lianna J.'
'Hawes, Chris S.'
'Turner, David R.'
'Batten, Stuart R.'
_publ_section_title
;
 The influence of anion, ligand geometry and stoichiometry on the
 structure and dimensionality of a series of
 AgI-bis(cyanobenzyl)piperazine coordination polymers
;
_journal_issue                   28
_journal_name_full               CrystEngComm
_journal_page_first              6459
_journal_paper_doi               10.1039/c4ce00816b
_journal_volume                  16
_journal_year                    2014
_chemical_formula_moiety
'C48 H52 Ag4 F6 N8 O8 S2, 2(C F3 O3 S), C3 H6 O'
_chemical_formula_sum            'C53 H58 Ag4 F12 N8 O15 S4'
_chemical_formula_weight         1834.79
_chemical_name_systematic
;
 ? 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_date             2013-10-01
_audit_creation_method
;
Olex2 1.2
(compiled 2013.09.17 svn.r2790 for OlexSys, GUI svn.r4601)
;
_cell_angle_alpha                90.00
_cell_angle_beta                 113.623(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   25.839(6)
_cell_length_b                   11.480(3)
_cell_length_c                   24.597(8)
_cell_measurement_reflns_used    1851
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      21.744
_cell_measurement_theta_min      2.434
_cell_volume                     6685(3)
_computing_molecular_graphics
;
O. V. Dolomanov, L. J. Bourhis, R. J. Gildea, J. A. K. Howard and H. Puschmann,
OLEX2: a complete structure solution, refinement and analysis program.
J. Appl. Cryst. (2009). 42, 339-341.
;
_computing_publication_material
;
O. V. Dolomanov, L. J. Bourhis, R. J. Gildea, J. A. K. Howard and H. Puschmann,
OLEX2: a complete structure solution, refinement and analysis program.
J. Appl. Cryst. (2009). 42, 339-341.
;
_computing_structure_refinement
;
SHELX, G.M. Sheldrick, Acta Cryst.
(2008). A64, 112-122
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      123.15
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1157
_diffrn_reflns_av_unetI/netI     0.1146
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_h_min       -34
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            29608
_diffrn_reflns_theta_full        27.99
_diffrn_reflns_theta_max         27.99
_diffrn_reflns_theta_min         2.90
_diffrn_source                   'fine-focus sealed tube'
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.381
_exptl_absorpt_correction_T_max  0.7461
_exptl_absorpt_correction_T_min  0.6153
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2008/1 (Bruker,2008) was used for absorption correction.
wR2(int) was 0.0996 before and 0.0665 after correction.
The Ratio of minimum to maximum transmission is 0.8247.
The λ/2 correction factor is 0.0015.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.823
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             3648
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.06
_refine_diff_density_max         1.066
_refine_diff_density_min         -1.404
_refine_diff_density_rms         0.166
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.984
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     480
_refine_ls_number_reflns         8054
_refine_ls_number_restraints     22
_refine_ls_restrained_S_all      0.986
_refine_ls_R_factor_all          0.1189
_refine_ls_R_factor_gt           0.0589
_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)+(0.0629P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1224
_refine_ls_wR_factor_ref         0.1506
_reflns_number_gt                4635
_reflns_number_total             8054
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4ce00816b2.cif
_cod_data_source_block           2
_cod_depositor_comments
'Adding full bibliography for 7215836--7215842.cif.'
_cod_database_code               7215837
#BEGIN Tags that were not found in dictionaries:
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All C(H,H,H,H,H,H) groups, All O(H,H,H) groups
2. Restrained distances
 C52-C51_$1
 1.5 with sigma of 0.02
 C51_$1-C52_$1
 1.5 with sigma of 0.02
 C51-C52
 1.5 with sigma of 0.02
 C51-C52_$1
 1.5 with sigma of 0.02
 C52-H52A
 0.96 with sigma of 0.02
 C52-H52C
 0.96 with sigma of 0.02
 C52-H52B
 0.96 with sigma of 0.02
 H52B-H52C
 1.56 with sigma of 0.04
 H52B-H52A
 1.56 with sigma of 0.04
 H52C-H52A
 1.56 with sigma of 0.04
3. Uiso/Uaniso restraints and constraints
Uanis(C48) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C51) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
4. Others
 Fixed Sof: O43(0.66667) H45D(0.66667) H45E(0.66667) H45F(0.66667)
 H45A(0.33333) H45B(0.33333) H45C(0.33333) C44(0.66667) C51(0.5) C46(0.66667)
 H46A(0.66667) H46B(0.66667) H46C(0.66667) O50(0.5) C49(0.33333) H49A(0.33333)
 H49B(0.33333) H49C(0.33333) C48(0.33333) O47(0.33333)
5.a Secondary CH2 refined with riding coordinates:
 C16(H16A,H16B), C14(H14A,H14B), C17(H17A,H17B), C11(H11A,H11B), C13(H13A,
 H13B), C18(H18A,H18B)
5.b Me refined with riding coordinates:
 C45(H45D,H45E,H45F), C45(H45A,H45B,H45C)
5.c Aromatic/amide H refined with riding coordinates:
 C24(H24), C23(H23), C20(H20), C21(H21), C7(H7), C6(H6), C10(H10), C9(H9)
5.d Idealised Me refined as rotating group:
 C46(H46A,H46B,H46C), C49(H49A,H49B,H49C)
;
#END Tags that were not found in dictionaries
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, y, -z+1/2'
3 'x+1/2, y+1/2, z'
4 '-x+1/2, y+1/2, -z+1/2'
5 '-x, -y, -z'
6 'x, -y, z-1/2'
7 '-x+1/2, -y+1/2, -z'
8 '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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.19025(2) 0.82719(4) 0.11286(2) 0.02440(14) Uani 1 1 d . . .
Ag2 Ag 0.14657(3) 0.71191(4) 0.32612(2) 0.03441(17) Uani 1 1 d . . .
S28 S 0.34050(7) 0.88406(14) 0.19028(7) 0.0254(4) Uani 1 1 d . . .
S36 S 0.12360(8) 1.07303(13) 0.05992(8) 0.0303(4) Uani 1 1 d . . .
N15 N 0.1995(2) 0.7787(4) 0.2773(2) 0.0188(11) Uani 1 1 d . A .
N12 N 0.1313(2) 0.7453(4) 0.1507(2) 0.0187(11) Uani 1 1 d . . .
N26 N 0.2173(2) 0.8561(5) 0.0390(2) 0.0315(14) Uani 1 1 d . . .
C5 C 0.1165(3) 0.4973(5) -0.0219(3) 0.0239(14) Uani 1 1 d . . .
N3 N 0.1417(3) 0.6299(5) 0.4056(2) 0.0324(14) Uani 1 1 d . A .
O29 O 0.3460(2) 0.8308(4) 0.1404(2) 0.0386(13) Uani 1 1 d . . .
C24 C 0.2385(3) 0.9851(5) -0.1373(3) 0.0242(15) Uani 1 1 d . . .
H24 H 0.2393 0.9482 -0.1716 0.029 Uiso 1 1 calc R . .
C16 C 0.2118(3) 0.6855(5) 0.2419(3) 0.0195(13) Uani 1 1 d . . .
H16A H 0.2291 0.6179 0.2679 0.023 Uiso 1 1 calc R A .
H16B H 0.2390 0.7150 0.2262 0.023 Uiso 1 1 calc R . .
C14 C 0.1693(3) 0.8758(5) 0.2369(3) 0.0221(14) Uani 1 1 d . . .
H14A H 0.1951 0.9128 0.2211 0.027 Uiso 1 1 calc R A .
H14B H 0.1588 0.9354 0.2597 0.027 Uiso 1 1 calc R . .
C23 C 0.2296(3) 0.9184(5) -0.0950(3) 0.0247(15) Uani 1 1 d . . .
H23 H 0.2240 0.8367 -0.1002 0.030 Uiso 1 1 calc R . .
O27 O 0.2843(2) 0.8835(4) 0.1894(2) 0.0358(12) Uani 1 1 d . . .
C22 C 0.2290(3) 0.9725(5) -0.0449(3) 0.0234(14) Uani 1 1 d . . .
O43 O 0.1028(4) 0.9169(8) 0.3227(5) 0.046(3) Uani 0.67 1 d P A 2
C17 C 0.1581(3) 0.6471(5) 0.1910(3) 0.0221(14) Uani 1 1 d . A .
H17A H 0.1671 0.5844 0.1685 0.027 Uiso 1 1 calc R . .
H17B H 0.1314 0.6153 0.2069 0.027 Uiso 1 1 calc R . .
C11 C 0.0788(3) 0.7080(5) 0.1013(3) 0.0221(14) Uani 1 1 d . . .
H11A H 0.0573 0.7779 0.0810 0.027 Uiso 1 1 calc R . .
H11B H 0.0553 0.6640 0.1176 0.027 Uiso 1 1 calc R . .
F42 F 0.02227(19) 1.1571(4) 0.0080(2) 0.0520(12) Uani 1 1 d . . .
F41 F 0.0695(2) 1.2341(4) 0.0920(2) 0.0508(12) Uani 1 1 d . . .
F40 F 0.0354(2) 1.0634(4) 0.0865(2) 0.0617(15) Uani 1 1 d . . .
O35 O 0.1587(2) 1.0511(5) 0.1211(2) 0.0527(15) Uani 1 1 d . . .
O37 O 0.1029(2) 0.9697(4) 0.0250(3) 0.0587(17) Uani 1 1 d . . .
C8 C 0.0894(3) 0.6327(5) 0.0562(3) 0.0200(13) Uani 1 1 d . . .
C13 C 0.1167(3) 0.8344(5) 0.1858(3) 0.0185(13) Uani 1 1 d . A .
H13A H 0.0900 0.8008 0.2013 0.022 Uiso 1 1 calc R . .
H13B H 0.0980 0.9012 0.1600 0.022 Uiso 1 1 calc R . .
F33 F 0.3800(2) 0.8328(4) 0.30281(19) 0.0603(14) Uani 1 1 d . . .
F34 F 0.4318(2) 0.7724(4) 0.2583(2) 0.0546(13) Uani 1 1 d . . .
F32 F 0.3543(2) 0.6827(4) 0.2453(2) 0.0649(15) Uani 1 1 d . . .
O38 O 0.1441(2) 1.1626(4) 0.0326(2) 0.0362(12) Uani 1 1 d . . .
O30 O 0.3700(2) 0.9935(4) 0.2098(2) 0.0304(11) Uani 1 1 d . . .
C19 C 0.2464(3) 1.1049(5) -0.1308(3) 0.0219(13) Uani 1 1 d . . .
C25 C 0.2219(3) 0.9061(5) 0.0010(3) 0.0252(14) Uani 1 1 d . . .
C20 C 0.2454(3) 1.1573(5) -0.0807(3) 0.0269(15) Uani 1 1 d . . .
H20 H 0.2512 1.2390 -0.0755 0.032 Uiso 1 1 calc R . .
C21 C 0.2362(3) 1.0919(6) -0.0380(3) 0.0292(16) Uani 1 1 d . . .
H21 H 0.2348 1.1290 -0.0040 0.035 Uiso 1 1 calc R . .
C39 C 0.0597(3) 1.1345(6) 0.0613(3) 0.0311(16) Uani 1 1 d . . .
C4 C 0.1307(3) 0.5738(5) 0.4372(3) 0.0283(15) Uani 1 1 d . . .
C7 C 0.0923(3) 0.5112(5) 0.0616(3) 0.0285(15) Uani 1 1 d . . .
H7 H 0.0844 0.4753 0.0922 0.034 Uiso 1 1 calc R . .
C6 C 0.1065(3) 0.4417(5) 0.0234(3) 0.0292(16) Uani 1 1 d . . .
H6 H 0.1094 0.3594 0.0280 0.035 Uiso 1 1 calc R . .
C10 C 0.1121(3) 0.6180(5) -0.0294(3) 0.0235(14) Uani 1 1 d . . .
H10 H 0.1178 0.6540 -0.0613 0.028 Uiso 1 1 calc R . .
C9 C 0.0992(3) 0.6838(5) 0.0102(3) 0.0237(14) Uani 1 1 d . . .
H9 H 0.0970 0.7661 0.0059 0.028 Uiso 1 1 calc R . .
C18 C 0.2543(3) 0.8207(5) 0.3224(3) 0.0225(14) Uani 1 1 d . . .
H18A H 0.2740 0.8668 0.3024 0.027 Uiso 1 1 calc R A .
H18B H 0.2783 0.7530 0.3416 0.027 Uiso 1 1 calc R . .
C31 C 0.3787(3) 0.7886(6) 0.2527(4) 0.0383(18) Uani 1 1 d . . .
C45 C 0.0517(4) 0.8706(7) 0.3793(4) 0.055(2) Uani 1 1 d . . .
H45D H 0.0227 0.8258 0.3478 0.082 Uiso 0.67 1 calc PR B 2
H45E H 0.0342 0.9136 0.4019 0.082 Uiso 0.67 1 calc PR B 2
H45F H 0.0803 0.8174 0.4058 0.082 Uiso 0.67 1 calc PR B 2
H45A H 0.0590 0.9287 0.4107 0.082 Uiso 0.33 1 calc PR B 1
H45B H 0.0785 0.8061 0.3943 0.082 Uiso 0.33 1 calc PR B 1
H45C H 0.0131 0.8410 0.3668 0.082 Uiso 0.33 1 calc PR B 1
C52 C 0.0082(4) 0.5241(8) 0.3032(4) 0.067(3) Uani 1 1 d D . .
C44 C 0.0782(6) 0.9526(11) 0.3530(6) 0.032(3) Uani 0.67 1 d P A 2
C51 C 0.0178(6) 0.5850(12) 0.2516(5) 0.046(4) Uani 0.50 1 d PDU . .
C46 C 0.0769(6) 1.0786(10) 0.3678(7) 0.063(4) Uani 0.67 1 d P A 2
H46A H 0.0989 1.1237 0.3506 0.094 Uiso 0.67 1 calc PR A 2
H46B H 0.0933 1.0884 0.4110 0.094 Uiso 0.67 1 calc PR A 2
H46C H 0.0378 1.1062 0.3514 0.094 Uiso 0.67 1 calc PR A 2
O50 O 0.0374(4) 0.6800(9) 0.2459(5) 0.046(3) Uani 0.50 1 d P . .
C49 C 0.0242(12) 1.022(2) 0.2986(12) 0.059(8) Uani 0.33 1 d P A 1
H49A H -0.0158 1.0012 0.2848 0.089 Uiso 0.33 1 calc PR A 1
H49B H 0.0327 1.0447 0.2645 0.089 Uiso 0.33 1 calc PR A 1
H49C H 0.0323 1.0882 0.3262 0.089 Uiso 0.33 1 calc PR A 1
C48 C 0.0585(11) 0.925(2) 0.3281(11) 0.024(6) Uani 0.33 1 d PU A 1
O47 O 0.0803(9) 0.8656(18) 0.3011(9) 0.045(5) Uani 0.33 1 d P A 1
H52A H 0.030(2) 0.454(4) 0.308(3) 0.067 Uiso 1 1 d D C -1
H52B H -0.0292(14) 0.502(6) 0.299(3) 0.067 Uiso 1 1 d D D -1
H52C H 0.023(3) 0.573(5) 0.337(2) 0.067 Uiso 1 1 d D E -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'
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'
S S 0.1246 0.1234 '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
N12 Ag1 O27 114.03(17) . .
N26 Ag1 N12 151.3(2) . .
N26 Ag1 O27 92.76(19) . .
N15 Ag2 O43 91.3(2) . .
N15 Ag2 O47 97.8(5) . .
N3 Ag2 N15 149.7(2) . .
N3 Ag2 O43 103.6(3) . .
N3 Ag2 O47 104.8(5) . .
O47 Ag2 O43 19.0(5) . .
O29 S28 O27 115.6(3) . .
O29 S28 O30 115.8(3) . .
O29 S28 C31 105.0(3) . .
O27 S28 O30 113.7(3) . .
O27 S28 C31 102.3(3) . .
O30 S28 C31 102.0(3) . .
O35 S36 O37 114.2(4) . .
O35 S36 O38 114.8(3) . .
O35 S36 C39 104.3(3) . .
O37 S36 O38 115.4(3) . .
O37 S36 C39 102.1(3) . .
O38 S36 C39 103.8(3) . .
C16 N15 Ag2 112.2(3) . .
C14 N15 Ag2 109.8(3) . .
C14 N15 C16 108.9(4) . .
C18 N15 Ag2 108.0(3) . .
C18 N15 C16 107.9(5) . .
C18 N15 C14 110.0(5) . .
C17 N12 Ag1 112.2(4) . .
C17 N12 C13 107.3(4) . .
C11 N12 Ag1 109.1(3) . .
C11 N12 C17 111.1(5) . .
C11 N12 C13 108.4(5) . .
C13 N12 Ag1 108.7(3) . .
C25 N26 Ag1 156.3(5) . .
C6 C5 C4 118.4(5) . 6_565
C6 C5 C10 122.0(6) . .
C10 C5 C4 119.6(6) . 6_565
C4 N3 Ag2 165.2(6) . .
C23 C24 C19 121.4(6) . .
N15 C16 C17 110.8(5) . .
N15 C14 C13 112.1(5) . .
C22 C23 C24 119.0(6) . .
S28 O27 Ag1 133.1(3) . .
C23 C22 C25 120.8(5) . .
C23 C22 C21 120.3(6) . .
C21 C22 C25 118.9(5) . .
C44 O43 Ag2 127.4(8) . .
N12 C17 C16 111.1(5) . .
N12 C11 C8 113.1(5) . .
C7 C8 C11 121.3(5) . .
C9 C8 C11 120.1(5) . .
C9 C8 C7 118.5(5) . .
N12 C13 C14 110.4(5) . .
C24 C19 C18 121.9(5) . 6_575
C20 C19 C24 118.8(6) . .
C20 C19 C18 119.4(5) . 6_575
N26 C25 C22 177.5(8) . .
C19 C20 C21 120.7(6) . .
C22 C21 C20 119.8(6) . .
F42 C39 S36 111.9(5) . .
F42 C39 F41 107.1(6) . .
F42 C39 F40 107.1(6) . .
F41 C39 S36 112.1(5) . .
F40 C39 S36 112.0(5) . .
F40 C39 F41 106.3(5) . .
N3 C4 C5 179.4(7) . 6_566
C6 C7 C8 121.9(6) . .
C7 C6 C5 117.4(6) . .
C9 C10 C5 118.7(6) . .
C10 C9 C8 121.5(6) . .
N15 C18 C19 111.9(5) . 6_576
F33 C31 S28 111.0(5) . .
F33 C31 F34 108.4(7) . .
F33 C31 F32 107.9(6) . .
F34 C31 S28 111.0(5) . .
F34 C31 F32 107.1(6) . .
F32 C31 S28 111.2(6) . .
C44 C45 C48 27.4(9) . .
C51 C52 C51 34.4(11) 2 .
O43 C44 C45 120.3(11) . .
O43 C44 C46 122.5(12) . .
C45 C44 C46 117.1(10) . .
C52 C51 C52 112.5(11) 2 .
C52 C51 O50 104.4(9) 2 2
C52 C51 O50 81.9(7) . 2
C51 C51 C52 80.6(13) 2 2
C51 C51 C52 64.9(11) 2 .
C51 C51 O50 37.5(5) 2 2
C51 C51 O50 116.5(9) 2 .
O50 C51 C52 112.6(11) . 2
O50 C51 C52 134.3(12) . .
O50 C51 O50 80.6(11) . 2
C51 O50 C51 26.0(9) . 2
C49 C48 C45 120(2) . .
O47 C48 C45 117.4(19) . .
O47 C48 C49 119(2) . .
C48 O47 Ag2 135.4(17) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N12 2.281(5) .
Ag1 N26 2.216(5) .
Ag1 O27 2.491(5) .
Ag2 N15 2.284(5) .
Ag2 N3 2.220(5) .
Ag2 O43 2.597(9) .
Ag2 O47 2.36(2) .
S28 O29 1.427(4) .
S28 O27 1.443(5) .
S28 O30 1.448(5) .
S28 C31 1.821(8) .
S36 O35 1.434(6) .
S36 O37 1.436(5) .
S36 O38 1.440(5) .
S36 C39 1.809(7) .
N15 C16 1.491(7) .
N15 C14 1.489(7) .
N15 C18 1.485(8) .
N12 C17 1.477(7) .
N12 C11 1.477(8) .
N12 C13 1.481(7) .
N26 C25 1.145(7) .
C5 C4 1.452(8) 6_565
C5 C6 1.394(8) .
C5 C10 1.397(8) .
N3 C4 1.130(8) .
C24 C23 1.386(8) .
C24 C19 1.390(8) .
C16 C17 1.515(9) .
C14 C13 1.512(9) .
C23 C22 1.385(8) .
C22 C25 1.432(8) .
C22 C21 1.385(9) .
O43 C44 1.227(15) .
C11 C8 1.514(8) .
F42 C39 1.306(8) .
F41 C39 1.337(8) .
F40 C39 1.325(8) .
C8 C7 1.400(8) .
C8 C9 1.386(8) .
F33 C31 1.322(8) .
F34 C31 1.334(8) .
F32 C31 1.349(8) .
C19 C20 1.379(8) .
C19 C18 1.512(8) 6_575
C20 C21 1.389(9) .
C4 C5 1.452(8) 6_566
C7 C6 1.389(8) .
C10 C9 1.375(8) .
C18 C19 1.512(8) 6_576
C45 C44 1.459(14) .
C45 C48 1.48(2) .
C52 C51 1.552(12) .
C52 C51 1.425(12) 2
C44 C46 1.496(16) .
C51 C52 1.425(12) 2
C51 C51 0.89(3) 2
C51 O50 1.814(16) 2
C51 O50 1.234(15) .
O50 C51 1.814(16) 2
C49 C48 1.43(3) .
C48 O47 1.24(3) .
