#------------------------------------------------------------------------------
#$Date: 2017-07-11 15:10:40 +0300 (Tue, 11 Jul 2017) $
#$Revision: 198633 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/33/20/4332014.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_4332014
loop_
_publ_author_name
'Silva, Rosalice M.'
'Smith, Mark D.'
'Gardinier, James R.'
_publ_section_title
;
 Anion- and Solvent-Directed Assembly in Silver Bis(thioimidazolyl)methane
 Chemistry and the Silver−Sulfur Interaction
;
_journal_issue                   5
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2132
_journal_page_last               2142
_journal_paper_doi               10.1021/ic052025a
_journal_volume                  45
_journal_year                    2006
_chemical_formula_moiety         'C18 H24 Ag2 N8 S4, 2(C3 H6 O), 2(F6 P)'
_chemical_formula_sum            'C24 H36 Ag2 F12 N8 O2 P2 S4'
_chemical_formula_weight         1102.53
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                106.1110(10)
_cell_angle_beta                 93.4160(10)
_cell_angle_gamma                115.3340(10)
_cell_formula_units_Z            2
_cell_length_a                   12.2593(8)
_cell_length_b                   12.3743(8)
_cell_length_c                   15.2717(9)
_cell_measurement_reflns_used    8028
_cell_measurement_temperature    150(1)
_cell_measurement_theta_max      26.386
_cell_measurement_theta_min      2.272
_cell_volume                     1968.8(2)
_computing_cell_refinement       'SAINT+ NT V6.22 (Bruker, 2001)'
_computing_data_collection       'SMART NT V5.625 (Bruker, 1998)'
_computing_data_reduction        'SAINT+ NT V6.22'
_computing_molecular_graphics    'SHELXTL V6.1 (Sheldrick, 2000)'
_computing_publication_material  'SHELXTL V6.1'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(1)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker SMART APEX CCD diffractometer'
_diffrn_measurement_method       'omega scans'
_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  0.0383
_diffrn_reflns_av_sigmaI/netI    0.0291
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            23827
_diffrn_reflns_theta_full        26.40
_diffrn_reflns_theta_max         26.40
_diffrn_reflns_theta_min         1.42
_diffrn_standards_decay_%        none
_exptl_absorpt_coefficient_mu    1.382
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.860
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1096
_exptl_crystal_size_max          0.48
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.35
_refine_diff_density_max         1.179
_refine_diff_density_min         -0.509
_refine_diff_density_rms         0.081
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     553
_refine_ls_number_reflns         8055
_refine_ls_number_restraints     63
_refine_ls_restrained_S_all      1.031
_refine_ls_R_factor_all          0.0320
_refine_ls_R_factor_gt           0.0294
_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)+(0.0398P)²+1.5208P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0759
_refine_ls_wR_factor_ref         0.0773
_reflns_number_gt                7402
_reflns_number_total             8055
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic052025asup1.cif
_cod_data_source_block           Ag2(L2)2(PF6)2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_refine_ls_hydrogen_treatment' value 'constr`' was replaced with the
value 'constr' as specified in the replacement file
'src/cod-tools/trunk/data/replacement-values/replacement_values.lst'.

Automatic conversion script
Id: cif_fix_values 5376 2017-05-30 11:51:03Z andrius 
;
_cod_database_code               4332014
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.773338(18) 0.830218(18) 0.311976(13) 0.03261(6) Uani 1 1 d . . .
Ag2 Ag 0.566414(18) 0.574429(18) 0.283269(15) 0.03485(7) Uani 1 1 d . . .
S1 S 0.51132(6) 0.76099(7) 0.14378(5) 0.03804(16) Uani 1 1 d . . .
S2 S 0.54469(6) 0.87870(6) 0.35377(4) 0.02922(13) Uani 1 1 d . . .
S3 S 0.71828(6) 0.63829(6) 0.46695(4) 0.03307(14) Uani 1 1 d . . .
S4 S 0.90093(6) 0.65916(6) 0.33318(5) 0.03425(15) Uani 1 1 d . . .
C1 C 0.4992(2) 0.8782(3) 0.23883(19) 0.0336(6) Uani 1 1 d . . .
H1A H 0.5509 0.9634 0.2352 0.040 Uiso 1 1 calc R . .
H1B H 0.4126 0.8634 0.2304 0.040 Uiso 1 1 calc R . .
C2 C 0.8391(3) 0.6023(3) 0.42562(18) 0.0387(6) Uani 1 1 d . . .
H2A H 0.9081 0.6381 0.4793 0.046 Uiso 1 1 calc R . .
H2B H 0.8063 0.5089 0.4037 0.046 Uiso 1 1 calc R . .
C11 C 0.6635(2) 0.8429(2) 0.13286(16) 0.0277(5) Uani 1 1 d . . .
C12 C 0.8201(3) 0.9496(3) 0.07736(19) 0.0397(6) Uani 1 1 d . . .
H12 H 0.8694 0.9980 0.0430 0.048 Uiso 1 1 calc R . .
C13 C 0.8581(3) 0.9076(3) 0.14000(19) 0.0383(6) Uani 1 1 d . . .
H13 H 0.9405 0.9229 0.1574 0.046 Uiso 1 1 calc R . .
C14 C 0.6179(3) 0.9353(4) 0.0176(2) 0.0564(9) Uani 1 1 d . . .
H14A H 0.5320 0.8718 0.0082 0.085 Uiso 1 1 calc R . .
H14B H 0.6414 0.9322 -0.0430 0.085 Uiso 1 1 calc R . .
H14C H 0.6269 1.0200 0.0498 0.085 Uiso 1 1 calc R . .
C21 C 0.4251(2) 0.7345(2) 0.35191(16) 0.0257(5) Uani 1 1 d . . .
C22 C 0.2521(3) 0.5991(3) 0.3747(2) 0.0373(6) Uani 1 1 d . . .
H22 H 0.1729 0.5618 0.3890 0.045 Uiso 1 1 calc R . .
C23 C 0.3217(3) 0.5413(3) 0.3467(2) 0.0400(6) Uani 1 1 d . . .
H23 H 0.2988 0.4547 0.3381 0.048 Uiso 1 1 calc R . .
C24 C 0.2783(3) 0.8201(3) 0.40547(19) 0.0342(6) Uani 1 1 d . . .
H24A H 0.3432 0.8956 0.4538 0.051 Uiso 1 1 calc R . .
H24B H 0.2029 0.7878 0.4298 0.051 Uiso 1 1 calc R . .
H24C H 0.2621 0.8426 0.3512 0.051 Uiso 1 1 calc R . .
C31 C 0.7966(2) 0.8035(2) 0.51030(16) 0.0248(5) Uani 1 1 d . . .
C32 C 0.8891(2) 0.9982(2) 0.60933(17) 0.0292(5) Uani 1 1 d . . .
H32 H 0.9272 1.0693 0.6651 0.035 Uiso 1 1 calc R . .
C33 C 0.8714(2) 1.0010(2) 0.52157(17) 0.0292(5) Uani 1 1 d . . .
H33 H 0.8957 1.0756 0.5054 0.035 Uiso 1 1 calc R . .
C34 C 0.8404(3) 0.8275(3) 0.68034(18) 0.0368(6) Uani 1 1 d . . .
H34A H 0.7801 0.7376 0.6608 0.055 Uiso 1 1 calc R . .
H34B H 0.8178 0.8763 0.7316 0.055 Uiso 1 1 calc R . .
H34C H 0.9225 0.8379 0.7012 0.055 Uiso 1 1 calc R . .
C41 C 0.7978(2) 0.5407(2) 0.23251(16) 0.0255(5) Uani 1 1 d . . .
C42 C 0.7293(2) 0.3914(3) 0.09614(18) 0.0342(6) Uani 1 1 d . . .
H42 H 0.7241 0.3298 0.0403 0.041 Uiso 1 1 calc R . .
C43 C 0.6390(3) 0.4213(3) 0.12060(18) 0.0352(6) Uani 1 1 d . . .
H43 H 0.5581 0.3828 0.0842 0.042 Uiso 1 1 calc R . .
C44 C 0.9486(3) 0.4650(3) 0.1715(2) 0.0374(6) Uani 1 1 d . . .
H44A H 1.0039 0.5249 0.2312 0.056 Uiso 1 1 calc R . .
H44B H 0.9856 0.4892 0.1204 0.056 Uiso 1 1 calc R . .
H44C H 0.9356 0.3792 0.1656 0.056 Uiso 1 1 calc R . .
C51 C 0.2479(3) 0.3330(3) 0.0989(2) 0.0472(7) Uani 1 1 d . . .
C52 C 0.1267(3) 0.2505(4) 0.1158(2) 0.0576(9) Uani 1 1 d . . .
H52A H 0.1315 0.1814 0.1323 0.086 Uiso 1 1 calc R . .
H52B H 0.0632 0.2150 0.0593 0.086 Uiso 1 1 calc R . .
H52C H 0.1054 0.3009 0.1670 0.086 Uiso 1 1 calc R . .
C53 C 0.2509(5) 0.4268(4) 0.0566(4) 0.0959(17) Uani 1 1 d . . .
H53A H 0.2400 0.4934 0.1016 0.144 Uiso 1 1 calc R . .
H53B H 0.1844 0.3852 0.0013 0.144 Uiso 1 1 calc R . .
H53C H 0.3305 0.4648 0.0385 0.144 Uiso 1 1 calc R . .
C54 C 0.4859(3) 0.2722(3) 0.3390(2) 0.0404(6) Uani 1 1 d . . .
C55 C 0.4832(4) 0.2079(4) 0.4094(2) 0.0584(9) Uani 1 1 d . . .
H55A H 0.4819 0.2608 0.4700 0.088 Uiso 1 1 calc R . .
H55B H 0.5568 0.1954 0.4146 0.088 Uiso 1 1 calc R . .
H55C H 0.4092 0.1253 0.3896 0.088 Uiso 1 1 calc R . .
C56 C 0.4908(3) 0.2054(3) 0.2435(2) 0.0464(7) Uani 1 1 d . . .
H56A H 0.4712 0.2433 0.2003 0.070 Uiso 1 1 calc R . .
H56B H 0.4306 0.1154 0.2246 0.070 Uiso 1 1 calc R . .
H56C H 0.5737 0.2134 0.2424 0.070 Uiso 1 1 calc R . .
N11 N 0.7603(2) 0.8396(2) 0.17470(15) 0.0336(5) Uani 1 1 d . . .
N12 N 0.6975(2) 0.9088(2) 0.07351(14) 0.0330(5) Uani 1 1 d . . .
N21 N 0.4302(2) 0.62546(19) 0.33252(15) 0.0297(4) Uani 1 1 d . . .
N22 N 0.31844(19) 0.72254(19) 0.37820(14) 0.0269(4) Uani 1 1 d . . .
N31 N 0.81288(18) 0.87916(19) 0.45991(14) 0.0261(4) Uani 1 1 d . . .
N32 N 0.84147(19) 0.87362(19) 0.60197(13) 0.0262(4) Uani 1 1 d . . .
N41 N 0.68153(19) 0.5151(2) 0.20557(14) 0.0290(4) Uani 1 1 d . . .
N42 N 0.82987(19) 0.46739(19) 0.16766(14) 0.0278(4) Uani 1 1 d . . .
O51 O 0.3370(2) 0.3208(3) 0.1181(3) 0.0876(10) Uani 1 1 d . . .
O52 O 0.4818(3) 0.3721(2) 0.35868(19) 0.0665(7) Uani 1 1 d . . .
P1 P 0.15736(6) 0.81563(7) 0.12987(4) 0.03032(14) Uani 1 1 d D . .
F1 F 0.04123(15) 0.77982(17) 0.17882(12) 0.0461(4) Uani 1 1 d D . .
F2 F 0.0746(2) 0.7037(2) 0.03795(14) 0.0734(7) Uani 1 1 d D . .
F3 F 0.12448(19) 0.9122(2) 0.09829(15) 0.0614(5) Uani 1 1 d D . .
F4 F 0.27563(17) 0.85313(19) 0.08322(13) 0.0507(4) Uani 1 1 d D . .
F5 F 0.24120(16) 0.92767(17) 0.22449(12) 0.0492(4) Uani 1 1 d D . .
F6 F 0.19298(16) 0.72209(17) 0.16394(15) 0.0539(5) Uani 1 1 d D . .
P2A P 0.8566(7) 0.2417(8) 0.3476(5) 0.0317(4) Uani 0.595(17) 1 d PD A 1
F7A F 0.9061(13) 0.1515(13) 0.3719(10) 0.086(4) Uani 0.595(17) 1 d PD A 1
F8A F 0.8904(6) 0.3230(8) 0.4523(4) 0.103(3) Uani 0.595(17) 1 d PD A 1
F9A F 0.7255(6) 0.1530(8) 0.3622(5) 0.0631(17) Uani 0.595(17) 1 d PD A 1
F10A F 0.8049(11) 0.3279(11) 0.3213(10) 0.079(3) Uani 0.595(17) 1 d PD A 1
F11A F 0.8212(10) 0.1597(8) 0.2442(5) 0.087(3) Uani 0.595(17) 1 d PD A 1
F12A F 0.9884(6) 0.3296(8) 0.3361(7) 0.068(2) Uani 0.595(17) 1 d PD A 1
P2B P 0.8575(11) 0.2483(11) 0.3441(8) 0.0317(4) Uani 0.405(17) 1 d PD A 2
F7B F 0.9203(17) 0.1861(15) 0.3939(10) 0.056(3) Uani 0.405(17) 1 d PD A 2
F8B F 0.9855(11) 0.3683(15) 0.3662(14) 0.107(6) Uani 0.405(17) 1 d PD A 2
F9B F 0.830(2) 0.3069(16) 0.4405(9) 0.125(6) Uani 0.405(17) 1 d PD A 2
F10B F 0.7987(13) 0.3176(15) 0.3006(11) 0.049(3) Uani 0.405(17) 1 d PD A 2
F11B F 0.7289(11) 0.1280(13) 0.3185(18) 0.119(7) Uani 0.405(17) 1 d PD A 2
F12B F 0.886(2) 0.194(2) 0.2490(8) 0.110(6) Uani 0.405(17) 1 d PD A 2
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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'
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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
N11 Ag1 N31 163.38(9) . .
N11 Ag1 Ag2 101.64(6) . .
N31 Ag1 Ag2 93.70(5) . .
N11 Ag1 S2 95.57(6) . .
N31 Ag1 S2 82.16(5) . .
Ag2 Ag1 S2 75.013(13) . .
N11 Ag1 S4 111.02(6) . .
N31 Ag1 S4 79.06(5) . .
Ag2 Ag1 S4 74.579(14) . .
S2 Ag1 S4 142.872(18) . .
N11 Ag1 F7A 82.3(2) . 1_565
N31 Ag1 F7A 81.1(2) . 1_565
Ag2 Ag1 F7A 154.3(2) . 1_565
S2 Ag1 F7A 79.4(2) . 1_565
S4 Ag1 F7A 128.12(19) . 1_565
N11 Ag1 F7B 85.9(2) . 1_565
N31 Ag1 F7B 77.5(2) . 1_565
Ag2 Ag1 F7B 153.1(3) . 1_565
S2 Ag1 F7B 78.6(3) . 1_565
S4 Ag1 F7B 127.1(2) . 1_565
F7A Ag1 F7B 3.6(4) 1_565 1_565
N41 Ag2 N21 167.79(8) . .
N41 Ag2 O52 95.32(8) . .
N21 Ag2 O52 90.10(8) . .
N41 Ag2 S3 94.04(6) . .
N21 Ag2 S3 98.16(6) . .
O52 Ag2 S3 66.40(6) . .
N41 Ag2 Ag1 81.89(6) . .
N21 Ag2 Ag1 100.34(6) . .
O52 Ag2 Ag1 142.71(6) . .
S3 Ag2 Ag1 76.674(14) . .
N41 Ag2 O51 83.55(8) . .
N21 Ag2 O51 87.54(8) . .
O52 Ag2 O51 73.40(8) . .
S3 Ag2 O51 139.34(6) . .
Ag1 Ag2 O51 142.06(7) . .
N41 Ag2 S1 99.08(6) . .
N21 Ag2 S1 71.68(6) . .
O52 Ag2 S1 152.09(6) . .
S3 Ag2 S1 135.507(17) . .
Ag1 Ag2 S1 63.570(12) . .
O51 Ag2 S1 84.57(6) . .
C11 S1 C1 101.82(12) . .
C11 S1 Ag2 97.15(9) . .
C1 S1 Ag2 97.50(8) . .
C21 S2 C1 100.47(12) . .
C21 S2 Ag1 107.05(8) . .
C1 S2 Ag1 95.98(9) . .
C31 S3 C2 100.97(12) . .
C31 S3 Ag2 104.95(8) . .
C2 S3 Ag2 98.47(9) . .
C41 S4 C2 103.26(12) . .
C41 S4 Ag1 88.58(8) . .
C2 S4 Ag1 103.21(9) . .
S2 C1 S1 115.06(14) . .
S2 C1 H1A 108.5 . .
S1 C1 H1A 108.5 . .
S2 C1 H1B 108.5 . .
S1 C1 H1B 108.5 . .
H1A C1 H1B 107.5 . .
S4 C2 S3 117.05(15) . .
S4 C2 H2A 108.0 . .
S3 C2 H2A 108.0 . .
S4 C2 H2B 108.0 . .
S3 C2 H2B 108.0 . .
H2A C2 H2B 107.3 . .
N11 C11 N12 110.5(2) . .
N11 C11 S1 125.18(19) . .
N12 C11 S1 124.03(19) . .
C13 C12 N12 106.3(2) . .
C13 C12 H12 126.9 . .
N12 C12 H12 126.9 . .
C12 C13 N11 110.1(2) . .
C12 C13 H13 124.9 . .
N11 C13 H13 124.9 . .
N12 C14 H14A 109.5 . .
N12 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
N12 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
N21 C21 N22 110.8(2) . .
N21 C21 S2 125.32(19) . .
N22 C21 S2 123.63(18) . .
C23 C22 N22 106.4(2) . .
C23 C22 H22 126.8 . .
N22 C22 H22 126.8 . .
C22 C23 N21 110.1(2) . .
C22 C23 H23 125.0 . .
N21 C23 H23 125.0 . .
N22 C24 H24A 109.5 . .
N22 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
N22 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
N31 C31 N32 110.1(2) . .
N31 C31 S3 125.31(18) . .
N32 C31 S3 124.43(18) . .
C33 C32 N32 106.7(2) . .
C33 C32 H32 126.7 . .
N32 C32 H32 126.7 . .
C32 C33 N31 109.3(2) . .
C32 C33 H33 125.3 . .
N31 C33 H33 125.3 . .
N32 C34 H34A 109.5 . .
N32 C34 H34B 109.5 . .
H34A C34 H34B 109.5 . .
N32 C34 H34C 109.5 . .
H34A C34 H34C 109.5 . .
H34B C34 H34C 109.5 . .
N41 C41 N42 110.6(2) . .
N41 C41 S4 126.10(18) . .
N42 C41 S4 123.15(19) . .
C43 C42 N42 106.5(2) . .
C43 C42 H42 126.8 . .
N42 C42 H42 126.8 . .
C42 C43 N41 109.8(2) . .
C42 C43 H43 125.1 . .
N41 C43 H43 125.1 . .
N42 C44 H44A 109.5 . .
N42 C44 H44B 109.5 . .
H44A C44 H44B 109.5 . .
N42 C44 H44C 109.5 . .
H44A C44 H44C 109.5 . .
H44B C44 H44C 109.5 . .
O51 C51 C53 122.6(4) . .
O51 C51 C52 120.8(3) . .
C53 C51 C52 116.6(3) . .
C51 C52 H52A 109.5 . .
C51 C52 H52B 109.5 . .
H52A C52 H52B 109.5 . .
C51 C52 H52C 109.5 . .
H52A C52 H52C 109.5 . .
H52B C52 H52C 109.5 . .
C51 C53 H53A 109.5 . .
C51 C53 H53B 109.5 . .
H53A C53 H53B 109.5 . .
C51 C53 H53C 109.5 . .
H53A C53 H53C 109.5 . .
H53B C53 H53C 109.5 . .
O52 C54 C56 121.8(3) . .
O52 C54 C55 121.8(3) . .
C56 C54 C55 116.4(3) . .
C54 C55 H55A 109.5 . .
C54 C55 H55B 109.5 . .
H55A C55 H55B 109.5 . .
C54 C55 H55C 109.5 . .
H55A C55 H55C 109.5 . .
H55B C55 H55C 109.5 . .
C54 C56 H56A 109.5 . .
C54 C56 H56B 109.5 . .
H56A C56 H56B 109.5 . .
C54 C56 H56C 109.5 . .
H56A C56 H56C 109.5 . .
H56B C56 H56C 109.5 . .
C11 N11 C13 105.2(2) . .
C11 N11 Ag1 121.46(17) . .
C13 N11 Ag1 124.67(18) . .
C11 N12 C12 107.9(2) . .
C11 N12 C14 126.3(2) . .
C12 N12 C14 125.8(2) . .
C21 N21 C23 105.7(2) . .
C21 N21 Ag2 131.01(17) . .
C23 N21 Ag2 123.28(17) . .
C21 N22 C22 107.1(2) . .
C21 N22 C24 127.6(2) . .
C22 N22 C24 125.3(2) . .
C31 N31 C33 106.4(2) . .
C31 N31 Ag1 128.88(16) . .
C33 N31 Ag1 124.57(16) . .
C31 N32 C32 107.6(2) . .
C31 N32 C34 127.6(2) . .
C32 N32 C34 124.9(2) . .
C41 N41 C43 105.8(2) . .
C41 N41 Ag2 129.43(16) . .
C43 N41 Ag2 123.79(17) . .
C41 N42 C42 107.3(2) . .
C41 N42 C44 127.5(2) . .
C42 N42 C44 125.2(2) . .
C51 O51 Ag2 114.9(2) . .
C54 O52 Ag2 133.0(2) . .
F2 P1 F3 91.64(13) . .
F2 P1 F6 89.93(13) . .
F3 P1 F6 178.42(13) . .
F2 P1 F1 89.69(11) . .
F3 P1 F1 89.88(10) . .
F6 P1 F1 90.31(10) . .
F2 P1 F4 91.55(12) . .
F3 P1 F4 90.55(10) . .
F6 P1 F4 89.22(10) . .
F1 P1 F4 178.68(11) . .
F2 P1 F5 178.90(13) . .
F3 P1 F5 89.34(12) . .
F6 P1 F5 89.09(11) . .
F1 P1 F5 89.80(10) . .
F4 P1 F5 88.95(10) . .
F11A P2A F8A 179.1(8) . .
F11A P2A F12A 91.2(6) . .
F8A P2A F12A 89.7(5) . .
F11A P2A F10A 89.2(7) . .
F8A P2A F10A 90.9(7) . .
F12A P2A F10A 90.7(6) . .
F11A P2A F9A 90.2(5) . .
F8A P2A F9A 88.9(5) . .
F12A P2A F9A 178.2(7) . .
F10A P2A F9A 90.5(7) . .
F11A P2A F7A 89.5(7) . .
F8A P2A F7A 90.4(7) . .
F12A P2A F7A 90.1(7) . .
F10A P2A F7A 178.5(8) . .
F9A P2A F7A 88.7(7) . .
F12B P2B F8B 88.3(9) . .
F12B P2B F11B 90.2(9) . .
F8B P2B F11B 178.1(11) . .
F12B P2B F9B 178.7(11) . .
F8B P2B F9B 90.7(9) . .
F11B P2B F9B 90.8(9) . .
F12B P2B F10B 90.7(9) . .
F8B P2B F10B 88.3(9) . .
F11B P2B F10B 90.5(9) . .
F9B P2B F10B 88.5(9) . .
F12B P2B F7B 92.3(9) . .
F8B P2B F7B 89.5(10) . .
F11B P2B F7B 91.7(10) . .
F9B P2B F7B 88.5(9) . .
F10B P2B F7B 176.3(11) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 N11 2.132(2) .
Ag1 N31 2.137(2) .
Ag1 Ag2 2.9785(3) .
Ag1 S2 3.1724(7) .
Ag1 S4 3.1915(7) .
Ag1 F7A 3.400(13) 1_565
Ag1 F7B 3.754(16) 1_565
Ag2 N41 2.131(2) .
Ag2 N21 2.131(2) .
Ag2 O52 2.862(3) .
Ag2 S3 2.9745(7) .
Ag2 O51 3.366(3) .
Ag2 S1 3.7704(8) .
S1 C11 1.746(3) .
S1 C1 1.810(3) .
S2 C21 1.750(2) .
S2 C1 1.808(3) .
S3 C31 1.741(2) .
S3 C2 1.820(3) .
S4 C41 1.744(2) .
S4 C2 1.813(3) .
C1 H1A 0.9900 .
C1 H1B 0.9900 .
C2 H2A 0.9900 .
C2 H2B 0.9900 .
C11 N11 1.335(3) .
C11 N12 1.350(3) .
C12 C13 1.354(4) .
C12 N12 1.357(4) .
C12 H12 0.9500 .
C13 N11 1.374(4) .
C13 H13 0.9500 .
C14 N12 1.456(4) .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C21 N21 1.328(3) .
C21 N22 1.351(3) .
C22 C23 1.349(4) .
C22 N22 1.372(3) .
C22 H22 0.9500 .
C23 N21 1.369(3) .
C23 H23 0.9500 .
C24 N22 1.458(3) .
C24 H24A 0.9800 .
C24 H24B 0.9800 .
C24 H24C 0.9800 .
C31 N31 1.329(3) .
C31 N32 1.357(3) .
C32 C33 1.357(4) .
C32 N32 1.362(3) .
C32 H32 0.9500 .
C33 N31 1.371(3) .
C33 H33 0.9500 .
C34 N32 1.460(3) .
C34 H34A 0.9800 .
C34 H34B 0.9800 .
C34 H34C 0.9800 .
C41 N41 1.332(3) .
C41 N42 1.345(3) .
C42 C43 1.350(4) .
C42 N42 1.369(3) .
C42 H42 0.9500 .
C43 N41 1.367(3) .
C43 H43 0.9500 .
C44 N42 1.466(3) .
C44 H44A 0.9800 .
C44 H44B 0.9800 .
C44 H44C 0.9800 .
C51 O51 1.195(4) .
C51 C53 1.466(5) .
C51 C52 1.487(5) .
C52 H52A 0.9800 .
C52 H52B 0.9800 .
C52 H52C 0.9800 .
C53 H53A 0.9800 .
C53 H53B 0.9800 .
C53 H53C 0.9800 .
C54 O52 1.212(4) .
C54 C56 1.482(4) .
C54 C55 1.499(4) .
C55 H55A 0.9800 .
C55 H55B 0.9800 .
C55 H55C 0.9800 .
C56 H56A 0.9800 .
C56 H56B 0.9800 .
C56 H56C 0.9800 .
P1 F2 1.5707(19) .
P1 F3 1.5909(19) .
P1 F6 1.5940(18) .
P1 F1 1.5978(17) .
P1 F4 1.5988(17) .
P1 F5 1.5995(18) .
P2A F11A 1.537(8) .
P2A F8A 1.554(8) .
P2A F12A 1.569(8) .
P2A F10A 1.577(8) .
P2A F9A 1.583(8) .
P2A F7A 1.591(8) .
P2B F12B 1.548(12) .
P2B F8B 1.564(12) .
P2B F11B 1.565(12) .
P2B F9B 1.575(11) .
P2B F10B 1.577(11) .
P2B F7B 1.589(11) .
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
_geom_torsion_site_symmetry_1
N11 Ag1 Ag2 N41 67.25(8) .
N31 Ag1 Ag2 N41 -119.17(8) .
S2 Ag1 Ag2 N41 159.96(6) .
S4 Ag1 Ag2 N41 -41.60(6) .
F7A Ag1 Ag2 N41 163.7(5) 1_565
F7B Ag1 Ag2 N41 171.4(4) 1_565
N11 Ag1 Ag2 N21 -100.59(8) .
N31 Ag1 Ag2 N21 72.99(8) .
S2 Ag1 Ag2 N21 -7.87(6) .
S4 Ag1 Ag2 N21 150.57(6) .
F7A Ag1 Ag2 N21 -4.1(5) 1_565
F7B Ag1 Ag2 N21 3.6(4) 1_565
N11 Ag1 Ag2 O52 155.38(11) .
N31 Ag1 Ag2 O52 -31.04(10) .
S2 Ag1 Ag2 O52 -111.90(9) .
S4 Ag1 Ag2 O52 46.54(9) .
F7A Ag1 Ag2 O52 -108.1(5) 1_565
F7B Ag1 Ag2 O52 -100.5(4) 1_565
N11 Ag1 Ag2 S3 163.38(6) .
N31 Ag1 Ag2 S3 -23.04(5) .
S2 Ag1 Ag2 S3 -103.902(19) .
S4 Ag1 Ag2 S3 54.537(19) .
F7A Ag1 Ag2 S3 -100.1(5) 1_565
F7B Ag1 Ag2 S3 -92.5(4) 1_565
N11 Ag1 Ag2 O51 -1.21(10) .
N31 Ag1 Ag2 O51 172.38(9) .
S2 Ag1 Ag2 O51 91.51(8) .
S4 Ag1 Ag2 O51 -110.05(8) .
F7A Ag1 Ag2 O51 95.3(5) 1_565
F7B Ag1 Ag2 O51 103.0(4) 1_565
N11 Ag1 Ag2 S1 -37.17(6) .
N31 Ag1 Ag2 S1 136.41(5) .
S2 Ag1 Ag2 S1 55.548(18) .
S4 Ag1 Ag2 S1 -146.012(19) .
F7A Ag1 Ag2 S1 59.3(5) 1_565
F7B Ag1 Ag2 S1 67.0(4) 1_565
N41 Ag2 S1 C11 -44.95(10) .
N21 Ag2 S1 C11 143.29(10) .
O52 Ag2 S1 C11 -165.11(13) .
S3 Ag2 S1 C11 60.39(9) .
Ag1 Ag2 S1 C11 31.22(8) .
O51 Ag2 S1 C11 -127.51(10) .
N41 Ag2 S1 C1 -147.94(11) .
N21 Ag2 S1 C1 40.29(11) .
O52 Ag2 S1 C1 91.90(14) .
S3 Ag2 S1 C1 -42.60(10) .
Ag1 Ag2 S1 C1 -71.77(9) .
O51 Ag2 S1 C1 129.50(11) .
N11 Ag1 S2 C21 107.66(11) .
N31 Ag1 S2 C21 -88.92(10) .
Ag2 Ag1 S2 C21 7.07(8) .
S4 Ag1 S2 C21 -28.87(9) .
F7A Ag1 S2 C21 -171.3(2) 1_565
F7B Ag1 S2 C21 -167.7(2) 1_565
N11 Ag1 S2 C1 4.75(11) .
N31 Ag1 S2 C1 168.17(11) .
Ag2 Ag1 S2 C1 -95.84(9) .
S4 Ag1 S2 C1 -131.78(9) .
F7A Ag1 S2 C1 85.8(2) 1_565
F7B Ag1 S2 C1 89.4(2) 1_565
N41 Ag2 S3 C31 105.86(10) .
N21 Ag2 S3 C31 -73.58(10) .
O52 Ag2 S3 C31 -160.09(10) .
Ag1 Ag2 S3 C31 25.19(8) .
O51 Ag2 S3 C31 -169.34(11) .
S1 Ag2 S3 C31 -1.46(9) .
N41 Ag2 S3 C2 2.04(11) .
N21 Ag2 S3 C2 -177.39(11) .
O52 Ag2 S3 C2 96.09(11) .
Ag1 Ag2 S3 C2 -78.63(10) .
O51 Ag2 S3 C2 86.85(13) .
S1 Ag2 S3 C2 -105.28(10) .
N11 Ag1 S4 C41 -50.48(11) .
N31 Ag1 S4 C41 143.30(10) .
Ag2 Ag1 S4 C41 46.31(8) .
S2 Ag1 S4 C41 82.34(9) .
F7A Ag1 S4 C41 -147.3(3) 1_565
F7B Ag1 S4 C41 -151.7(4) 1_565
N11 Ag1 S4 C2 -153.77(12) .
N31 Ag1 S4 C2 40.01(11) .
Ag2 Ag1 S4 C2 -56.98(9) .
S2 Ag1 S4 C2 -20.95(10) .
F7A Ag1 S4 C2 109.4(3) 1_565
F7B Ag1 S4 C2 105.0(4) 1_565
C21 S2 C1 S1 -69.18(17) .
Ag1 S2 C1 S1 39.43(15) .
C11 S1 C1 S2 -87.97(16) .
Ag2 S1 C1 S2 10.99(15) .
C41 S4 C2 S3 -84.79(17) .
Ag1 S4 C2 S3 6.88(17) .
C31 S3 C2 S4 -62.48(17) .
Ag2 S3 C2 S4 44.65(16) .
C1 S1 C11 N11 93.0(2) .
Ag2 S1 C11 N11 -6.3(2) .
C1 S1 C11 N12 -93.7(2) .
Ag2 S1 C11 N12 167.0(2) .
N12 C12 C13 N11 0.7(3) .
C1 S2 C21 N21 97.1(2) .
Ag1 S2 C21 N21 -2.6(2) .
C1 S2 C21 N22 -88.9(2) .
Ag1 S2 C21 N22 171.45(18) .
N22 C22 C23 N21 -0.1(3) .
C2 S3 C31 N31 83.5(2) .
Ag2 S3 C31 N31 -18.4(2) .
C2 S3 C31 N32 -101.9(2) .
Ag2 S3 C31 N32 156.16(19) .
N32 C32 C33 N31 0.2(3) .
C2 S4 C41 N41 69.6(2) .
Ag1 S4 C41 N41 -33.6(2) .
C2 S4 C41 N42 -115.1(2) .
Ag1 S4 C41 N42 141.6(2) .
N42 C42 C43 N41 0.5(3) .
N12 C11 N11 C13 0.6(3) .
S1 C11 N11 C13 174.67(19) .
N12 C11 N11 Ag1 149.57(17) .
S1 C11 N11 Ag1 -36.3(3) .
C12 C13 N11 C11 -0.8(3) .
C12 C13 N11 Ag1 -148.5(2) .
N31 Ag1 N11 C11 -90.7(3) .
Ag2 Ag1 N11 C11 66.4(2) .
S2 Ag1 N11 C11 -9.5(2) .
S4 Ag1 N11 C11 144.13(19) .
F7A Ag1 N11 C11 -87.9(3) 1_565
F7B Ag1 N11 C11 -87.5(3) 1_565
N31 Ag1 N11 C13 52.1(4) .
Ag2 Ag1 N11 C13 -150.8(2) .
S2 Ag1 N11 C13 133.4(2) .
S4 Ag1 N11 C13 -73.1(2) .
F7A Ag1 N11 C13 54.9(3) 1_565
F7B Ag1 N11 C13 55.3(3) 1_565
N11 C11 N12 C12 -0.2(3) .
S1 C11 N12 C12 -174.4(2) .
N11 C11 N12 C14 -178.2(3) .
S1 C11 N12 C14 7.6(4) .
C13 C12 N12 C11 -0.3(3) .
C13 C12 N12 C14 177.8(3) .
N22 C21 N21 C23 0.4(3) .
S2 C21 N21 C23 175.0(2) .
N22 C21 N21 Ag2 177.70(16) .
S2 C21 N21 Ag2 -7.6(3) .
C22 C23 N21 C21 -0.2(3) .
C22 C23 N21 Ag2 -177.8(2) .
N41 Ag2 N21 C21 -86.5(4) .
O52 Ag2 N21 C21 157.0(2) .
S3 Ag2 N21 C21 90.8(2) .
Ag1 Ag2 N21 C21 13.0(2) .
O51 Ag2 N21 C21 -129.6(2) .
S1 Ag2 N21 C21 -44.6(2) .
N41 Ag2 N21 C23 90.4(4) .
O52 Ag2 N21 C23 -26.1(2) .
S3 Ag2 N21 C23 -92.3(2) .
Ag1 Ag2 N21 C23 -170.1(2) .
O51 Ag2 N21 C23 47.3(2) .
S1 Ag2 N21 C23 132.4(2) .
N21 C21 N22 C22 -0.4(3) .
S2 C21 N22 C22 -175.2(2) .
N21 C21 N22 C24 179.7(2) .
S2 C21 N22 C24 4.9(4) .
C23 C22 N22 C21 0.3(3) .
C23 C22 N22 C24 -179.8(3) .
N32 C31 N31 C33 0.8(3) .
S3 C31 N31 C33 176.05(18) .
N32 C31 N31 Ag1 175.86(15) .
S3 C31 N31 Ag1 -8.9(3) .
C32 C33 N31 C31 -0.6(3) .
C32 C33 N31 Ag1 -175.94(16) .
N11 Ag1 N31 C31 -173.1(2) .
Ag2 Ag1 N31 C31 29.4(2) .
S2 Ag1 N31 C31 103.7(2) .
S4 Ag1 N31 C31 -44.14(19) .
F7A Ag1 N31 C31 -176.0(3) 1_565
F7B Ag1 N31 C31 -176.4(3) 1_565
N11 Ag1 N31 C33 1.1(4) .
Ag2 Ag1 N31 C33 -156.38(18) .
S2 Ag1 N31 C33 -82.08(18) .
S4 Ag1 N31 C33 130.11(19) .
F7A Ag1 N31 C33 -1.7(3) 1_565
F7B Ag1 N31 C33 -2.1(3) 1_565
N31 C31 N32 C32 -0.7(3) .
S3 C31 N32 C32 -176.00(18) .
N31 C31 N32 C34 179.1(2) .
S3 C31 N32 C34 3.8(4) .
C33 C32 N32 C31 0.3(3) .
C33 C32 N32 C34 -179.5(2) .
N42 C41 N41 C43 0.4(3) .
S4 C41 N41 C43 176.2(2) .
N42 C41 N41 Ag2 169.17(16) .
S4 C41 N41 Ag2 -15.1(3) .
C42 C43 N41 C41 -0.6(3) .
C42 C43 N41 Ag2 -170.13(18) .
N21 Ag2 N41 C41 158.1(3) .
O52 Ag2 N41 C41 -85.9(2) .
S3 Ag2 N41 C41 -19.3(2) .
Ag1 Ag2 N41 C41 56.6(2) .
O51 Ag2 N41 C41 -158.5(2) .
S1 Ag2 N41 C41 118.1(2) .
N21 Ag2 N41 C43 -35.0(5) .
O52 Ag2 N41 C43 81.0(2) .
S3 Ag2 N41 C43 147.6(2) .
Ag1 Ag2 N41 C43 -136.5(2) .
O51 Ag2 N41 C43 8.4(2) .
S1 Ag2 N41 C43 -75.0(2) .
N41 C41 N42 C42 -0.1(3) .
S4 C41 N42 C42 -176.05(18) .
N41 C41 N42 C44 -178.9(2) .
S4 C41 N42 C44 5.2(4) .
C43 C42 N42 C41 -0.2(3) .
C43 C42 N42 C44 178.6(2) .
C53 C51 O51 Ag2 64.2(5) .
C52 C51 O51 Ag2 -116.8(3) .
N41 Ag2 O51 C51 -146.7(3) .
N21 Ag2 O51 C51 24.9(3) .
O52 Ag2 O51 C51 115.8(3) .
S3 Ag2 O51 C51 124.6(3) .
Ag1 Ag2 O51 C51 -78.8(3) .
S1 Ag2 O51 C51 -46.9(3) .
C56 C54 O52 Ag2 -27.1(5) .
C55 C54 O52 Ag2 154.4(3) .
N41 Ag2 O52 C54 -14.5(3) .
N21 Ag2 O52 C54 154.5(3) .
S3 Ag2 O52 C54 -106.6(3) .
Ag1 Ag2 O52 C54 -98.1(3) .
O51 Ag2 O52 C54 67.1(3) .
S1 Ag2 O52 C54 106.5(3) .
