#------------------------------------------------------------------------------
#$Date: 2016-03-23 15:35:57 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179337 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/34/4323491.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_4323491
loop_
_publ_author_name
'Reint Eujen'
'Berthold Hoge'
'David J. Brauer'
_publ_contact_author
;
       Prof. David J. Brauer
       Anorganische Chemie, Fachbereich 9      
       Bergische Universität Gesamthochschule
       Gauszstr. 20
       42097 Wuppertal
       Bundesrepublik Deutschland
;
_publ_contact_author_email       brauer@wrcs3.urz.uni-wuppertal.de
_publ_contact_author_fax         '049 202 439-2901'
_publ_contact_author_phone       '049 202 439-2457'
_publ_section_title
;
 Preparation and NMR Spectra of Difluoromethylated Silver(I) and
 Silver(III) Compounds. Structure of [PNP][Ag(CF₂H)₄].
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3160
_journal_page_last               3166
_journal_paper_doi               10.1021/ic961398w
_journal_volume                  36
_journal_year                    1997
_chemical_compound_source        'current publication'
_chemical_formula_moiety         'C36 H30 N P2 +, C4 H4 Ag F8 -'
_chemical_formula_structural     '[(C6 H5)3P]2 N +, Ag(CF2 H)4 -'
_chemical_formula_sum            'C40 H34 Ag F8 N P2'
_chemical_formula_weight         850.49
_chemical_melting_point          394.15
_chemical_name_systematic
; 
 Bis-(triphenylphospnoranyliden)ammonium tetrakis-difluoromethylargentate(III) 
;
_space_group_IT_number           78
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  'P 4cw'
_symmetry_space_group_name_H-M   'P 43'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.4748(10)
_cell_length_b                   9.4748(10)
_cell_length_c                   42.159(6)
_cell_measurement_reflns_used    32
_cell_measurement_temperature    297(2)
_cell_measurement_theta_max      32.9
_cell_measurement_theta_min      31.1
_cell_volume                     3784.7(8)
_computing_cell_refinement       'Siemens P3/P4 V4.27'
_computing_data_collection       'Siemens P3/P4 V4.27'
_computing_data_reduction        'Siemens XDISK/XPREP(SHELXTL-PC Version 5)'
_computing_molecular_graphics    'Siemens XP( SHELXTL-PC Version 5'
_computing_publication_material  'SHELXTL-93 (Sheldrick, 1993)'
_computing_structure_refinement  'SHELXL-93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      297(2)
_diffrn_measurement_device       'Siemens P3'
_diffrn_measurement_method       '2θ/θ scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0241
_diffrn_reflns_av_sigmaI/netI    0.0231
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       51
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            4038
_diffrn_reflns_theta_max         69.12
_diffrn_reflns_theta_min         4.19
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 100
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    5.679
_exptl_absorpt_correction_T_max  0.3772
_exptl_absorpt_correction_T_min  0.2468
_exptl_absorpt_correction_type   integration
_exptl_crystal_colour            tan
_exptl_crystal_density_diffrn    1.493
_exptl_crystal_density_method    none
_exptl_crystal_description       'tetragonal bipyramid'
_exptl_crystal_F_000             1720
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.25
_refine_diff_density_max         1.013
_refine_diff_density_min         -0.659
_refine_diff_density_rms         0.072
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.001(11)
_refine_ls_extinction_coef       0.00076(11)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_all   1.008
_refine_ls_goodness_of_fit_obs   1.019
_refine_ls_hydrogen_treatment    refU
_refine_ls_matrix_type           full
_refine_ls_number_parameters     470
_refine_ls_number_reflns         3595
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.008
_refine_ls_restrained_S_obs      1.019
_refine_ls_R_factor_all          0.0469
_refine_ls_R_factor_obs          0.0453
_refine_ls_shift/esd_max         0.113
_refine_ls_shift/esd_mean        0.005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0700P)²+5.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.1171
_refine_ls_wR_factor_obs         0.1155
_reflns_number_observed          3444
_reflns_number_total             3595
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            ic961398w.cif
_cod_data_source_block           pnpag
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '121_C' was changed to '394.15' - it
was converted from degrees Celsius(C) to Kelvins(K).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0700P)^2^+5.0000P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0700P)^2^+5.0000P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        3784.7(6)
_cod_database_code               4323491
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'-y, x, z+3/4'
'y, -x, z+1/4'
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_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
Ag Ag 0.87702(6) 0.97383(6) 0.822339(12) 0.0522(2) Uani 1 d . .
F1 F 1.0969(8) 1.0382(10) 0.8691(2) 0.123(3) Uani 1 d . .
F2 F 0.8953(14) 1.0975(22) 0.8836(4) 0.257(11) Uani 1 d . .
F3 F 0.6302(9) 0.8424(12) 0.8486(3) 0.158(4) Uani 1 d . .
F4 F 0.8083(12) 0.7423(14) 0.8663(3) 0.191(6) Uani 1 d . .
F5 F 0.8069(17) 0.8152(15) 0.7657(3) 0.213(7) Uani 1 d . .
F6 F 0.6513(15) 0.9493(20) 0.7781(3) 0.219(7) Uani 1 d . .
F7 F 1.0753(16) 1.1207(14) 0.7825(5) 0.273(12) Uani 1 d . .
F8 F 0.9073(14) 1.2472(11) 0.7923(4) 0.185(6) Uani 1 d . .
C1 C 0.9661(15) 1.0217(27) 0.8661(4) 0.146(8) Uani 1 d . .
H1 H 0.9548(15) 0.9335(27) 0.8766(4) 0.175 Uiso 1 calc R .
C2 C 0.7622(13) 0.8049(19) 0.8418(4) 0.118(5) Uani 1 d . .
H2 H 0.7559(13) 0.7353(19) 0.8256(4) 0.142 Uiso 1 calc R .
C3 C 0.7816(20) 0.9326(27) 0.7792(4) 0.143(7) Uani 1 d . .
H3 H 0.8187(20) 1.0017(27) 0.7652(4) 0.172 Uiso 1 calc R .
C4 C 0.9849(19) 1.1395(19) 0.8007(6) 0.142(8) Uani 1 d . .
H4 H 1.0357(19) 1.1778(19) 0.8181(6) 0.170 Uiso 1 calc R .
P1 P 0.2723(2) 0.5297(2) 0.89010(4) 0.0392(3) Uani 1 d . .
P2 P 0.3222(2) 0.7116(2) 0.94573(4) 0.0386(3) Uani 1 d . .
N N 0.3486(7) 0.6397(7) 0.91233(14) 0.0484(14) Uani 1 d . .
C11 C 0.1353(7) 0.4310(7) 0.90925(15) 0.0426(14) Uani 1 d . .
C12 C -0.0054(8) 0.4707(9) 0.9073(2) 0.052(2) Uani 1 d . .
H12 H -0.0324(8) 0.5478(9) 0.8942(2) 0.062 Uiso 1 calc R .
C13 C -0.1064(9) 0.3975(11) 0.9244(2) 0.067(2) Uani 1 d . .
H13 H -0.2028(9) 0.4242(11) 0.9229(2) 0.080 Uiso 1 calc R .
C14 C -0.0683(10) 0.2874(11) 0.9434(2) 0.065(2) Uani 1 d . .
H14 H -0.1383(10) 0.2376(11) 0.9550(2) 0.078 Uiso 1 calc R .
C15 C 0.0708(10) 0.2480(10) 0.9458(2) 0.068(2) Uani 1 d . .
H15 H 0.0968(10) 0.1715(10) 0.9591(2) 0.081 Uiso 1 calc R .
C16 C 0.1732(9) 0.3200(9) 0.9288(2) 0.056(2) Uani 1 d . .
H16 H 0.2694(9) 0.2931(9) 0.9306(2) 0.067 Uiso 1 calc R .
C21 C 0.2007(8) 0.6122(8) 0.8555(2) 0.051(2) Uani 1 d . .
C22 C 0.2476(11) 0.7452(10) 0.8466(2) 0.067(2) Uani 1 d . .
H22 H 0.3090(11) 0.7961(10) 0.8602(2) 0.080 Uiso 1 calc R .
C23 C 0.2060(15) 0.8048(14) 0.8180(3) 0.093(4) Uani 1 d . .
H23 H 0.2397(15) 0.8955(14) 0.8121(3) 0.112 Uiso 1 calc R .
C24 C 0.1178(15) 0.7337(17) 0.7988(3) 0.098(4) Uani 1 d . .
H24 H 0.0892(15) 0.7756(17) 0.7794(3) 0.117 Uiso 1 calc R .
C25 C 0.0673(13) 0.6002(15) 0.8067(2) 0.090(4) Uani 1 d . .
H25 H 0.0048(13) 0.5514(15) 0.7929(2) 0.108 Uiso 1 calc R .
C26 C 0.1104(10) 0.5391(11) 0.8353(2) 0.067(2) Uani 1 d . .
H26 H 0.0779(10) 0.4477(11) 0.8410(2) 0.081 Uiso 1 calc R .
C31 C 0.4017(7) 0.4088(8) 0.8747(2) 0.0440(15) Uani 1 d . .
C32 C 0.3627(10) 0.2784(8) 0.8628(2) 0.062(2) Uani 1 d . .
H32 H 0.2684(10) 0.2460(8) 0.8651(2) 0.074 Uiso 1 calc R .
C33 C 0.4612(14) 0.1957(11) 0.8476(3) 0.084(3) Uani 1 d . .
H33 H 0.4352(14) 0.1049(11) 0.8400(3) 0.101 Uiso 1 calc R .
C34 C 0.5964(12) 0.2431(12) 0.8432(3) 0.085(3) Uani 1 d . .
H34 H 0.6623(12) 0.1868(12) 0.8319(3) 0.102 Uiso 1 calc R .
C35 C 0.6372(9) 0.3726(13) 0.8553(3) 0.077(3) Uani 1 d . .
H35 H 0.7317(9) 0.4041(13) 0.8528(3) 0.092 Uiso 1 calc R .
C36 C 0.5397(8) 0.4556(10) 0.8709(2) 0.057(2) Uani 1 d . .
H36 H 0.5669(8) 0.5451(10) 0.8790(2) 0.069 Uiso 1 calc R .
C41 C 0.4126(7) 0.6184(7) 0.9770(2) 0.0418(14) Uani 1 d . .
C42 C 0.3901(10) 0.6535(9) 1.0087(2) 0.059(2) Uani 1 d . .
H42 H 0.3208(10) 0.7217(9) 1.0142(2) 0.071 Uiso 1 calc R .
C43 C 0.4689(12) 0.5888(11) 1.0323(2) 0.074(3) Uani 1 d . .
H43 H 0.4531(12) 0.6123(11) 1.0539(2) 0.088 Uiso 1 calc R .
C44 C 0.5693(11) 0.4914(10) 1.0245(2) 0.071(2) Uani 1 d . .
H44 H 0.6239(11) 0.4481(10) 1.0407(2) 0.085 Uiso 1 calc R .
C45 C 0.5919(10) 0.4556(10) 0.9932(2) 0.067(2) Uani 1 d . .
H45 H 0.6605(10) 0.3866(10) 0.9878(2) 0.080 Uiso 1 calc R .
C46 C 0.5135(9) 0.5211(8) 0.9698(2) 0.054(2) Uani 1 d . .
H46 H 0.5305(9) 0.4978(8) 0.9482(2) 0.065 Uiso 1 calc R .
C51 C 0.4014(7) 0.8832(7) 0.9449(2) 0.0431(14) Uani 1 d . .
C52 C 0.3761(9) 0.9795(8) 0.9692(2) 0.056(2) Uani 1 d . .
H52 H 0.3106(9) 0.9584(8) 0.9856(2) 0.067 Uiso 1 calc R .
C53 C 0.4482(11) 1.1071(9) 0.9690(3) 0.072(3) Uani 1 d . .
H53 H 0.4309(11) 1.1739(9) 0.9853(3) 0.086 Uiso 1 calc R .
C54 C 0.5434(9) 1.1381(9) 0.9457(3) 0.073(3) Uani 1 d . .
H54 H 0.5929(9) 1.2252(9) 0.9463(3) 0.087 Uiso 1 calc R .
C55 C 0.5678(10) 1.0457(10) 0.9218(3) 0.073(3) Uani 1 d . .
H55 H 0.6328(10) 1.0694(10) 0.9055(3) 0.088 Uiso 1 calc R .
C56 C 0.4973(9) 0.9147(9) 0.9210(2) 0.058(2) Uani 1 d . .
H56 H 0.5151(9) 0.8491(9) 0.9044(2) 0.070 Uiso 1 calc R .
C61 C 0.1408(7) 0.7316(7) 0.9566(2) 0.0444(14) Uani 1 d . .
C62 C 0.0745(8) 0.6380(9) 0.9777(2) 0.055(2) Uani 1 d . .
H62 H 0.1271(8) 0.5649(9) 0.9876(2) 0.067 Uiso 1 calc R .
C63 C -0.0685(10) 0.6534(11) 0.9840(2) 0.069(2) Uani 1 d . .
H63 H -0.1139(10) 0.5905(11) 0.9983(2) 0.083 Uiso 1 calc R .
C64 C -0.1445(10) 0.7582(12) 0.9698(3) 0.075(3) Uani 1 d . .
H64 H -0.2424(10) 0.7667(12) 0.9743(3) 0.090 Uiso 1 calc R .
C65 C -0.0824(9) 0.8513(11) 0.9493(2) 0.071(3) Uani 1 d . .
H65 H -0.1362(9) 0.9243(11) 0.9396(2) 0.085 Uiso 1 calc R .
C66 C 0.0624(8) 0.8370(10) 0.9426(2) 0.060(2) Uani 1 d . .
H66 H 0.1066(8) 0.9008(10) 0.9283(2) 0.072 Uiso 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 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1.00 0.00 0.00 0.1400
-1.00 0.00 0.00 0.1600
1.00 0.00 1.00 0.1260
-1.00 0.00 1.00 0.1340
0.00 1.00 1.00 0.1320
0.00 -1.00 1.00 0.1020
0.00 1.00 -4.00 0.1600
0.00 -1.00 -4.00 0.2200
0.00 0.00 1.00 0.2100
0.00 0.00 -1.00 0.2100
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C3 Ag C1 177.5(8) . . ?
C3 Ag C4 88.4(10) . . ?
C1 Ag C4 91.4(10) . . ?
C3 Ag C2 88.4(8) . . ?
C1 Ag C2 91.7(8) . . ?
C4 Ag C2 176.8(9) . . ?
F2 C1 F1 113.9(14) . . ?
F2 C1 Ag 116.1(12) . . ?
F1 C1 Ag 121.1(10) . . ?
F4 C2 F3 105.7(12) . . ?
F4 C2 Ag 119.7(11) . . ?
F3 C2 Ag 111.6(11) . . ?
F6 C3 F5 106.3(18) . . ?
F6 C3 Ag 116.3(12) . . ?
F5 C3 Ag 118.4(14) . . ?
F7 C4 F8 110.8(16) . . ?
F7 C4 Ag 122.3(14) . . ?
F8 C4 Ag 115.5(12) . . ?
N P1 C21 111.7(4) . . ?
N P1 C11 114.2(3) . . ?
C21 P1 C11 108.7(4) . . ?
N P1 C31 108.8(3) . . ?
C21 P1 C31 104.0(3) . . ?
C11 P1 C31 108.9(3) . . ?
N P2 C61 115.1(3) . . ?
N P2 C51 107.8(3) . . ?
C61 P2 C51 108.2(3) . . ?
N P2 C41 111.3(3) . . ?
C61 P2 C41 108.7(3) . . ?
C51 P2 C41 105.1(3) . . ?
P1 N P2 137.7(4) . . ?
C16 C11 C12 119.4(7) . . ?
C16 C11 P1 118.5(6) . . ?
C12 C11 P1 121.8(6) . . ?
C13 C12 C11 119.8(8) . . ?
C14 C13 C12 120.4(8) . . ?
C13 C14 C15 120.4(8) . . ?
C14 C15 C16 120.0(9) . . ?
C11 C16 C15 120.0(8) . . ?
C22 C21 C26 119.0(8) . . ?
C22 C21 P1 119.7(7) . . ?
C26 C21 P1 120.9(7) . . ?
C23 C22 C21 120.9(11) . . ?
C24 C23 C22 119.7(12) . . ?
C23 C24 C25 121.6(10) . . ?
C24 C25 C26 118.8(11) . . ?
C21 C26 C25 120.0(10) . . ?
C32 C31 C36 119.6(7) . . ?
C32 C31 P1 121.2(6) . . ?
C36 C31 P1 118.7(6) . . ?
C33 C32 C31 119.7(9) . . ?
C34 C33 C32 120.7(10) . . ?
C33 C34 C35 120.2(9) . . ?
C36 C35 C34 119.6(9) . . ?
C35 C36 C31 120.2(9) . . ?
C46 C41 C42 118.8(7) . . ?
C46 C41 P2 120.2(6) . . ?
C42 C41 P2 120.8(5) . . ?
C43 C42 C41 119.9(8) . . ?
C44 C43 C42 120.2(9) . . ?
C43 C44 C45 120.3(8) . . ?
C44 C45 C46 119.3(8) . . ?
C41 C46 C45 121.5(8) . . ?
C56 C51 C52 120.3(7) . . ?
C56 C51 P2 119.0(6) . . ?
C52 C51 P2 120.5(6) . . ?
C53 C52 C51 118.7(8) . . ?
C54 C53 C52 121.2(9) . . ?
C55 C54 C53 120.6(8) . . ?
C54 C55 C56 120.4(9) . . ?
C51 C56 C55 118.8(8) . . ?
C66 C61 C62 119.2(7) . . ?
C66 C61 P2 119.0(6) . . ?
C62 C61 P2 121.7(6) . . ?
C63 C62 C61 119.4(8) . . ?
C64 C63 C62 120.5(9) . . ?
C63 C64 C65 121.3(8) . . ?
C64 C65 C66 118.9(9) . . ?
C61 C66 C65 120.7(8) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag C3 2.068(14) . ?
Ag C1 2.079(13) . ?
Ag C4 2.08(2) . ?
Ag C2 2.102(15) . ?
F1 C1 1.26(2) . ?
F2 C1 1.23(2) . ?
F3 C2 1.332(15) . ?
F4 C2 1.27(2) . ?
F5 C3 1.27(2) . ?
F6 C3 1.25(2) . ?
F7 C4 1.16(2) . ?
F8 C4 1.31(2) . ?
P1 N 1.578(6) . ?
P1 C21 1.790(7) . ?
P1 C11 1.792(7) . ?
P1 C31 1.800(7) . ?
P2 N 1.584(6) . ?
P2 C61 1.788(7) . ?
P2 C51 1.791(7) . ?
P2 C41 1.803(7) . ?
C11 C16 1.384(11) . ?
C11 C12 1.387(10) . ?
C12 C13 1.384(12) . ?
C13 C14 1.364(15) . ?
C14 C15 1.373(14) . ?
C15 C16 1.385(12) . ?
C21 C22 1.388(12) . ?
C21 C26 1.389(12) . ?
C22 C23 1.386(14) . ?
C23 C24 1.35(2) . ?
C24 C25 1.39(2) . ?
C25 C26 1.400(13) . ?
C31 C32 1.384(11) . ?
C31 C36 1.390(10) . ?
C32 C33 1.377(13) . ?
C33 C34 1.37(2) . ?
C34 C35 1.38(2) . ?
C35 C36 1.380(12) . ?
C41 C46 1.362(10) . ?
C41 C42 1.395(10) . ?
C42 C43 1.385(12) . ?
C43 C44 1.366(13) . ?
C44 C45 1.375(14) . ?
C45 C46 1.383(12) . ?
C51 C56 1.387(11) . ?
C51 C52 1.393(11) . ?
C52 C53 1.388(11) . ?
C53 C54 1.36(2) . ?
C54 C55 1.35(2) . ?
C55 C56 1.411(12) . ?
C61 C66 1.377(11) . ?
C61 C62 1.405(10) . ?
C62 C63 1.389(12) . ?
C63 C64 1.36(2) . ?
C64 C65 1.369(15) . ?
C65 C66 1.407(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
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C3 Ag C1 F2 8.8(228) . . . . ?
C4 Ag C1 F2 95.1(22) . . . . ?
C2 Ag C1 F2 -84.6(22) . . . . ?
C3 Ag C1 F1 -136.5(203) . . . . ?
C4 Ag C1 F1 -50.2(20) . . . . ?
C2 Ag C1 F1 130.1(20) . . . . ?
C3 Ag C2 F4 155.8(16) . . . . ?
C1 Ag C2 F4 -26.7(16) . . . . ?
C4 Ag C2 F4 159.5(115) . . . . ?
C3 Ag C2 F3 -80.2(14) . . . . ?
C1 Ag C2 F3 97.4(13) . . . . ?
C4 Ag C2 F3 -76.5(126) . . . . ?
C1 Ag C3 F6 -29.2(227) . . . . ?
C4 Ag C3 F6 -115.5(21) . . . . ?
C2 Ag C3 F6 64.3(21) . . . . ?
C1 Ag C3 F5 -157.7(206) . . . . ?
C4 Ag C3 F5 115.9(19) . . . . ?
C2 Ag C3 F5 -64.3(18) . . . . ?
C3 Ag C4 F7 -71.2(24) . . . . ?
C1 Ag C4 F7 111.3(24) . . . . ?
C2 Ag C4 F7 -74.9(124) . . . . ?
C3 Ag C4 F8 68.9(19) . . . . ?
C1 Ag C4 F8 -108.6(19) . . . . ?
C2 Ag C4 F8 65.2(129) . . . . ?
C21 P1 N P2 109.1(7) . . . . ?
C11 P1 N P2 -14.8(8) . . . . ?
C31 P1 N P2 -136.7(6) . . . . ?
C61 P2 N P1 -29.0(8) . . . . ?
C51 P2 N P1 -149.8(6) . . . . ?
C41 P2 N P1 95.4(7) . . . . ?
N P1 C11 C16 -78.1(7) . . . . ?
C21 P1 C11 C16 156.5(6) . . . . ?
C31 P1 C11 C16 43.8(7) . . . . ?
N P1 C11 C12 96.0(7) . . . . ?
C21 P1 C11 C12 -29.4(7) . . . . ?
C31 P1 C11 C12 -142.1(6) . . . . ?
C16 C11 C12 C13 -1.1(12) . . . . ?
P1 C11 C12 C13 -175.1(6) . . . . ?
C11 C12 C13 C14 0.5(13) . . . . ?
C12 C13 C14 C15 0.2(14) . . . . ?
C13 C14 C15 C16 -0.3(15) . . . . ?
C12 C11 C16 C15 1.0(12) . . . . ?
P1 C11 C16 C15 175.3(7) . . . . ?
C14 C15 C16 C11 -0.3(14) . . . . ?
N P1 C21 C22 17.4(8) . . . . ?
C11 P1 C21 C22 144.3(6) . . . . ?
C31 P1 C21 C22 -99.8(7) . . . . ?
N P1 C21 C26 -169.7(6) . . . . ?
C11 P1 C21 C26 -42.8(8) . . . . ?
C31 P1 C21 C26 73.1(7) . . . . ?
C26 C21 C22 C23 -0.3(13) . . . . ?
P1 C21 C22 C23 172.7(8) . . . . ?
C21 C22 C23 C24 0.8(16) . . . . ?
C22 C23 C24 C25 -0.5(18) . . . . ?
C23 C24 C25 C26 -0.2(17) . . . . ?
C22 C21 C26 C25 -0.4(13) . . . . ?
P1 C21 C26 C25 -173.3(7) . . . . ?
C24 C25 C26 C21 0.7(15) . . . . ?
N P1 C31 C32 160.0(6) . . . . ?
C21 P1 C31 C32 -80.8(7) . . . . ?
C11 P1 C31 C32 35.0(7) . . . . ?
N P1 C31 C36 -28.8(7) . . . . ?
C21 P1 C31 C36 90.3(7) . . . . ?
C11 P1 C31 C36 -153.9(6) . . . . ?
C36 C31 C32 C33 0.8(13) . . . . ?
P1 C31 C32 C33 171.8(8) . . . . ?
C31 C32 C33 C34 -2.1(16) . . . . ?
C32 C33 C34 C35 2.7(18) . . . . ?
C33 C34 C35 C36 -2.0(17) . . . . ?
C34 C35 C36 C31 0.7(15) . . . . ?
C32 C31 C36 C35 -0.1(13) . . . . ?
P1 C31 C36 C35 -171.4(7) . . . . ?
N P2 C41 C46 13.7(7) . . . . ?
C61 P2 C41 C46 141.6(6) . . . . ?
C51 P2 C41 C46 -102.8(6) . . . . ?
N P2 C41 C42 -172.2(6) . . . . ?
C61 P2 C41 C42 -44.4(7) . . . . ?
C51 P2 C41 C42 71.3(7) . . . . ?
C46 C41 C42 C43 -0.6(13) . . . . ?
P2 C41 C42 C43 -174.7(8) . . . . ?
C41 C42 C43 C44 0.4(16) . . . . ?
C42 C43 C44 C45 -0.7(18) . . . . ?
C43 C44 C45 C46 1.1(17) . . . . ?
C42 C41 C46 C45 1.0(12) . . . . ?
P2 C41 C46 C45 175.2(7) . . . . ?
C44 C45 C46 C41 -1.3(15) . . . . ?
N P2 C51 C56 -15.3(7) . . . . ?
C61 P2 C51 C56 -140.4(6) . . . . ?
C41 P2 C51 C56 103.6(7) . . . . ?
N P2 C51 C52 169.8(6) . . . . ?
C61 P2 C51 C52 44.7(7) . . . . ?
C41 P2 C51 C52 -71.3(7) . . . . ?
C56 C51 C52 C53 0.1(13) . . . . ?
P2 C51 C52 C53 174.9(7) . . . . ?
C51 C52 C53 C54 -0.6(15) . . . . ?
C52 C53 C54 C55 1.3(16) . . . . ?
C53 C54 C55 C56 -1.4(16) . . . . ?
C52 C51 C56 C55 -0.2(13) . . . . ?
P2 C51 C56 C55 -175.1(7) . . . . ?
C54 C55 C56 C51 0.8(15) . . . . ?
N P2 C61 C66 -76.2(7) . . . . ?
C51 P2 C61 C66 44.5(7) . . . . ?
C41 P2 C61 C66 158.1(6) . . . . ?
N P2 C61 C62 100.4(7) . . . . ?
C51 P2 C61 C62 -138.9(6) . . . . ?
C41 P2 C61 C62 -25.3(7) . . . . ?
C66 C61 C62 C63 0.2(12) . . . . ?
P2 C61 C62 C63 -176.4(7) . . . . ?
C61 C62 C63 C64 0.1(14) . . . . ?
C62 C63 C64 C65 -0.4(16) . . . . ?
C63 C64 C65 C66 0.5(16) . . . . ?
C62 C61 C66 C65 -0.1(13) . . . . ?
P2 C61 C66 C65 176.6(7) . . . . ?
C64 C65 C66 C61 -0.2(15) . . . . ?
