#------------------------------------------------------------------------------
#$Date: 2016-02-20 18:35:30 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176787 $
#$URL: svn://www.crystallography.net/cod/cif/2/21/81/2218185.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2218185
loop_
_publ_author_name
'Lo, Kong Mun'
'Ng, Seik Weng'
_publ_section_title
Bis[μ-bis(diphenylphosphino)methane-κ²P:P']bis[(chlorodifluoroacetato-κO)silver(I)](Ag---Ag)
_journal_coeditor_code           LH2610
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m717
_journal_paper_doi               10.1107/S1600536808011033
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac          '[Ag2 (C2 Cl F2 O2)2 (C25 H22 P2)2]'
_chemical_formula_moiety         'C54 H44 Ag2 Cl2 F4 O4 P4'
_chemical_formula_sum            'C54 H44 Ag2 Cl2 F4 O4 P4'
_chemical_formula_weight         1243.41
_chemical_name_systematic
;
Bis[μ-bis(diphenylphosphino)methane-
κ²P:P']bis[(chlorodifluoroacetato-
κO)silver(I)](Ag---Ag)
;
_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                83.0400(10)
_cell_angle_beta                 86.4770(10)
_cell_angle_gamma                72.1880(10)
_cell_formula_units_Z            2
_cell_length_a                   10.8127(3)
_cell_length_b                   14.4911(3)
_cell_length_c                   17.2340(3)
_cell_measurement_reflns_used    4611
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      25.1
_cell_measurement_theta_min      2.3
_cell_volume                     2551.12(10)
_computing_cell_refinement       'SAINT (Bruker, 2007)'
_computing_data_collection       'APEX2  (Bruker, 2007)'
_computing_data_reduction        'SAINT (Bruker, 2007)'
_computing_molecular_graphics    'X-SEED (Barbour, 2001)'
_computing_publication_material  'publCIF (Westrip, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Bruker SMART APEXII'
_diffrn_measurement_method       ω
_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  0.0664
_diffrn_reflns_av_sigmaI/netI    0.0834
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            31942
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.19
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.058
_exptl_absorpt_correction_T_max  0.857
_exptl_absorpt_correction_T_min  0.648
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.619
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             1248
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.906
_refine_diff_density_min         -1.050
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.007
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     641
_refine_ls_number_reflns         11567
_refine_ls_number_restraints     54
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.0716
_refine_ls_R_factor_gt           0.0454
_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)+(0.0475P)²+0.1513P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0981
_refine_ls_wR_factor_ref         0.1116
_reflns_number_gt                8338
_reflns_number_total             11567
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            lh2610.cif
_cod_data_source_block           I
_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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        2551.10(10)
_cod_database_code               2218185
_cod_database_fobs_code          2218185
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag Ag1 0.57141(3) 0.89080(2) 1.025045(18) 0.01359(9) Uani d . 1 . .
Ag Ag2 0.44457(3) 0.57795(2) 0.435262(17) 0.01308(9) Uani d . 1 . .
P P1 0.36794(11) 0.90512(8) 1.09660(6) 0.0128(2) Uani d . 1 . .
P P2 0.21898(11) 1.08082(8) 0.99185(6) 0.0126(2) Uani d . 1 . .
P P3 0.22156(11) 0.57580(8) 0.45928(6) 0.0123(2) Uani d . 1 . .
P P4 0.33747(11) 0.49679(8) 0.61526(6) 0.0123(2) Uani d . 1 . .
Cl Cl1 0.4662(5) 0.6779(3) 0.79374(16) 0.0304(8) Uani d PDU 0.528(4) A 1
Cl Cl1' 0.4581(6) 0.5832(3) 0.9291(2) 0.0379(9) Uani d PD 0.472(4) A 2
Cl Cl2 0.57724(14) 0.91381(9) 0.36753(7) 0.0349(3) Uani d D 1 . .
F F1 0.4587(11) 0.6087(7) 0.9329(5) 0.0379(9) Uani d PDU 0.528(4) A 1
F F2 0.6495(6) 0.5949(9) 0.8867(7) 0.057(3) Uani d PDU 0.528(4) A 1
F F1' 0.4795(11) 0.6915(7) 0.8078(4) 0.0304(8) Uani d PD 0.47 A 2
F F2' 0.6572(6) 0.6182(9) 0.8661(8) 0.057(3) Uani d PD 0.47 A 2
F F3 0.3672(3) 0.93038(18) 0.44623(16) 0.0303(7) Uani d D 1 . .
F F4 0.5391(3) 0.89416(18) 0.51371(14) 0.0281(7) Uani d D 1 . .
O O1 0.6050(3) 0.7406(2) 0.97176(19) 0.0252(8) Uani d . 1 . .
O O2 0.4233(3) 0.8250(2) 0.90831(18) 0.0250(8) Uani d . 1 . .
O O3 0.4269(3) 0.7468(2) 0.40995(17) 0.0194(7) Uani d . 1 . .
O O4 0.5974(3) 0.7093(2) 0.48919(17) 0.0210(7) Uani d . 1 . .
C C1 0.5177(5) 0.7528(3) 0.9251(3) 0.0177(10) Uani d . 1 A .
C C2 0.5279(4) 0.6620(3) 0.8834(2) 0.0320(13) Uani d D 1 . .
C C3 0.3471(4) 0.7884(3) 1.1364(2) 0.0134(9) Uani d . 1 . .
C C4 0.3135(5) 0.7311(3) 1.0871(2) 0.0182(10) Uani d . 1 . .
H H4 0.2984 0.7544 1.0335 0.022 Uiso calc R 1 . .
C C5 0.3020(5) 0.6412(3) 1.1149(3) 0.0203(10) Uani d . 1 . .
H H5 0.2785 0.6030 1.0807 0.024 Uiso calc R 1 . .
C C6 0.3245(4) 0.6058(3) 1.1930(3) 0.0195(10) Uani d . 1 . .
H H6 0.3159 0.5438 1.2125 0.023 Uiso calc R 1 . .
C C7 0.3599(4) 0.6621(3) 1.2422(3) 0.0192(10) Uani d . 1 . .
H H7 0.3757 0.6381 1.2956 0.023 Uiso calc R 1 . .
C C8 0.3725(4) 0.7528(3) 1.2146(2) 0.0176(10) Uani d . 1 . .
H H8 0.3981 0.7903 1.2486 0.021 Uiso calc R 1 . .
C C9 0.3251(4) 0.9819(3) 1.1755(2) 0.0151(9) Uani d . 1 . .
C C10 0.2197(5) 0.9807(3) 1.2262(2) 0.0196(10) Uani d . 1 . .
H H10 0.1697 0.9385 1.2203 0.023 Uiso calc R 1 . .
C C11 0.1883(5) 1.0417(3) 1.2856(3) 0.0247(11) Uani d . 1 . .
H H11 0.1177 1.0401 1.3208 0.030 Uiso calc R 1 . .
C C12 0.2601(5) 1.1050(3) 1.2934(3) 0.0284(12) Uani d . 1 . .
H H12 0.2387 1.1464 1.3341 0.034 Uiso calc R 1 . .
C C13 0.3617(5) 1.1072(3) 1.2422(3) 0.0250(11) Uani d . 1 . .
H H13 0.4094 1.1515 1.2467 0.030 Uiso calc R 1 . .
C C14 0.3950(5) 1.0457(3) 1.1842(3) 0.0197(10) Uani d . 1 . .
H H14 0.4666 1.0470 1.1497 0.024 Uiso calc R 1 . .
C C15 0.2313(4) 0.9546(3) 1.0303(2) 0.0147(9) Uani d . 1 . .
H H15A 0.1496 0.9527 1.0588 0.018 Uiso calc R 1 . .
H H15B 0.2440 0.9141 0.9865 0.018 Uiso calc R 1 . .
C C16 0.0933(4) 1.1592(3) 1.0494(2) 0.0161(9) Uani d . 1 . .
C C17 -0.0165(5) 1.1347(3) 1.0790(2) 0.0213(10) Uani d . 1 . .
H H17 -0.0218 1.0712 1.0751 0.026 Uiso calc R 1 . .
C C18 -0.1181(5) 1.2016(4) 1.1138(3) 0.0282(12) Uani d . 1 . .
H H18 -0.1916 1.1837 1.1352 0.034 Uiso calc R 1 . .
C C19 -0.1112(5) 1.2954(4) 1.1172(3) 0.0331(13) Uani d . 1 . .
H H19 -0.1813 1.3419 1.1402 0.040 Uiso calc R 1 . .
C C20 -0.0046(5) 1.3213(4) 1.0877(3) 0.0312(13) Uani d . 1 . .
H H20 -0.0015 1.3857 1.0901 0.037 Uiso calc R 1 . .
C C21 0.1000(5) 1.2531(3) 1.0541(3) 0.0257(11) Uani d . 1 . .
H H21 0.1749 1.2706 1.0347 0.031 Uiso calc R 1 . .
C C22 0.1465(4) 1.0963(3) 0.8966(2) 0.0136(9) Uani d . 1 . .
C C23 0.0346(4) 1.1716(3) 0.8754(2) 0.0153(9) Uani d . 1 . .
H H23 -0.0120 1.2131 0.9129 0.018 Uiso calc R 1 . .
C C24 -0.0092(5) 1.1862(3) 0.7991(2) 0.0192(10) Uani d . 1 . .
H H24 -0.0854 1.2377 0.7847 0.023 Uiso calc R 1 . .
C C25 0.0581(5) 1.1261(3) 0.7447(2) 0.0201(10) Uani d . 1 . .
H H25 0.0284 1.1363 0.6927 0.024 Uiso calc R 1 . .
C C26 0.1690(5) 1.0508(3) 0.7656(3) 0.0228(11) Uani d . 1 . .
H H26 0.2148 1.0092 0.7279 0.027 Uiso calc R 1 . .
C C27 0.2132(5) 1.0358(3) 0.8403(2) 0.0175(10) Uani d . 1 . .
H H27 0.2896 0.9841 0.8540 0.021 Uiso calc R 1 . .
C C28 0.5066(4) 0.7659(3) 0.4504(2) 0.0159(9) Uani d . 1 . .
C C29 0.4938(4) 0.8749(3) 0.4479(2) 0.0180(10) Uani d D 1 . .
C C30 0.0954(4) 0.6894(3) 0.4722(2) 0.0147(9) Uani d . 1 . .
C C31 0.1256(4) 0.7772(3) 0.4582(2) 0.0150(9) Uani d . 1 . .
H H31 0.2112 0.7774 0.4423 0.018 Uiso calc R 1 . .
C C32 0.0285(5) 0.8645(3) 0.4677(2) 0.0186(10) Uani d . 1 . .
H H32 0.0485 0.9244 0.4587 0.022 Uiso calc R 1 . .
C C33 -0.0963(5) 0.8647(3) 0.4902(3) 0.0225(11) Uani d . 1 . .
H H33 -0.1615 0.9248 0.4963 0.027 Uiso calc R 1 . .
C C34 -0.1273(5) 0.7780(3) 0.5038(3) 0.0230(11) Uani d . 1 . .
H H34 -0.2133 0.7782 0.5191 0.028 Uiso calc R 1 . .
C C35 -0.0303(5) 0.6904(3) 0.4948(2) 0.0189(10) Uani d . 1 . .
H H35 -0.0507 0.6307 0.5043 0.023 Uiso calc R 1 . .
C C36 0.1645(4) 0.5244(3) 0.3820(2) 0.0129(9) Uani d . 1 . .
C C37 0.0671(4) 0.5790(3) 0.3314(2) 0.0156(9) Uani d . 1 . .
H H37 0.0206 0.6443 0.3399 0.019 Uiso calc R 1 . .
C C38 0.0372(5) 0.5388(4) 0.2684(3) 0.0244(11) Uani d . 1 . .
H H38 -0.0290 0.5767 0.2337 0.029 Uiso calc R 1 . .
C C39 0.1038(5) 0.4439(3) 0.2564(3) 0.0231(11) Uani d . 1 . .
H H39 0.0833 0.4165 0.2133 0.028 Uiso calc R 1 . .
C C40 0.1998(5) 0.3883(3) 0.3063(3) 0.0231(11) Uani d . 1 . .
H H40 0.2447 0.3227 0.2981 0.028 Uiso calc R 1 . .
C C41 0.2302(5) 0.4287(3) 0.3684(3) 0.0199(10) Uani d . 1 . .
H H41 0.2972 0.3905 0.4024 0.024 Uiso calc R 1 . .
C C42 0.2131(4) 0.4938(3) 0.5487(2) 0.0137(9) Uani d . 1 . .
H H42A 0.1259 0.5155 0.5740 0.016 Uiso calc R 1 . .
H H42B 0.2286 0.4266 0.5354 0.016 Uiso calc R 1 . .
C C43 0.2848(4) 0.6229(3) 0.6363(2) 0.0134(9) Uani d . 1 . .
C C44 0.1606(5) 0.6641(3) 0.6664(2) 0.0200(10) Uani d . 1 . .
H H44 0.1048 0.6248 0.6792 0.024 Uiso calc R 1 . .
C C45 0.1174(5) 0.7612(3) 0.6780(3) 0.0274(12) Uani d . 1 . .
H H45 0.0329 0.7884 0.6995 0.033 Uiso calc R 1 . .
C C46 0.1990(6) 0.8198(3) 0.6579(3) 0.0313(13) Uani d . 1 . .
H H46 0.1688 0.8873 0.6644 0.038 Uiso calc R 1 . .
C C47 0.3228(6) 0.7794(3) 0.6289(3) 0.0306(13) Uani d . 1 . .
H H47 0.3781 0.8191 0.6159 0.037 Uiso calc R 1 . .
C C48 0.3675(5) 0.6805(3) 0.6185(3) 0.0219(10) Uani d . 1 . .
H H48 0.4536 0.6526 0.5994 0.026 Uiso calc R 1 . .
C C49 0.3078(4) 0.4276(3) 0.7060(2) 0.0132(9) Uani d . 1 . .
C C50 0.2893(4) 0.3372(3) 0.7047(2) 0.0159(9) Uani d . 1 . .
H H50 0.2852 0.3139 0.6560 0.019 Uiso calc R 1 . .
C C51 0.2767(4) 0.2804(3) 0.7737(3) 0.0182(10) Uani d . 1 . .
H H51 0.2634 0.2189 0.7722 0.022 Uiso calc R 1 . .
C C52 0.2837(5) 0.3134(3) 0.8447(3) 0.0220(10) Uani d . 1 . .
H H52 0.2737 0.2750 0.8920 0.026 Uiso calc R 1 . .
C C53 0.3050(5) 0.4020(3) 0.8470(3) 0.0220(10) Uani d . 1 . .
H H53 0.3121 0.4237 0.8959 0.026 Uiso calc R 1 . .
C C54 0.3161(5) 0.4597(3) 0.7781(2) 0.0175(10) Uani d . 1 . .
H H54 0.3295 0.5212 0.7800 0.021 Uiso calc R 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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O1 Ag1 P1 . . 100.92(9) yes
O1 Ag1 P2 . 2_677 103.78(9) yes
P1 Ag1 P2 . 2_677 151.19(4) yes
O1 Ag1 Ag1 . 2_677 136.10(8) ?
P2 Ag1 Ag1 2_677 2_677 91.48(3) ?
P1 Ag1 Ag1 . 2_677 80.72(3) ?
O3 Ag2 P3 . . 104.14(8) yes
O3 Ag2 P4 . 2_666 101.43(8) yes
P3 Ag2 P4 . 2_666 149.67(4) yes
O3 Ag2 Ag2 . 2_666 134.22(7) ?
P4 Ag2 Ag2 2_666 2_666 78.04(3) ?
P3 Ag2 Ag2 . 2_666 95.23(3) ?
C9 P1 C3 . . 105.99(19) ?
C9 P1 C15 . . 103.98(19) ?
C3 P1 C15 . . 102.13(19) ?
C9 P1 Ag1 . . 119.10(15) ?
C3 P1 Ag1 . . 113.66(15) ?
C15 P1 Ag1 . . 110.26(15) ?
C16 P2 C22 . . 103.7(2) ?
C16 P2 C15 . . 106.9(2) ?
C22 P2 C15 . . 104.17(18) ?
C16 P2 Ag1 . 2_677 118.83(15) ?
C22 P2 Ag1 . 2_677 109.27(15) ?
C15 P2 Ag1 . 2_677 112.61(15) ?
C30 P3 C36 . . 105.1(2) ?
C30 P3 C42 . . 105.46(19) ?
C36 P3 C42 . . 104.87(18) ?
C30 P3 Ag2 . . 119.03(15) ?
C36 P3 Ag2 . . 112.02(15) ?
C42 P3 Ag2 . . 109.25(15) ?
C43 P4 C49 . . 104.85(19) ?
C43 P4 C42 . . 102.48(19) ?
C49 P4 C42 . . 105.27(19) ?
C43 P4 Ag2 . 2_666 121.28(15) ?
C49 P4 Ag2 . 2_666 109.90(14) ?
C42 P4 Ag2 . 2_666 111.71(14) ?
C1 O1 Ag1 . . 107.5(3) ?
C28 O3 Ag2 . . 109.5(3) ?
O1 C1 O2 . . 130.1(4) ?
O1 C1 C2 . . 113.9(4) ?
O2 C1 C2 . . 115.9(4) ?
F2' C2 F1' . . 100.4(6) ?
F2 C2 F1 . . 99.3(6) ?
F2 C2 C1 . . 113.2(7) ?
F2' C2 C1 . . 108.0(8) ?
F1' C2 C1 . . 109.5(5) ?
F1 C2 C1 . . 105.0(5) ?
F2' C2 Cl1' . . 111.8(6) ?
F1' C2 Cl1' . . 109.7(4) ?
C1 C2 Cl1' . . 116.3(3) ?
F2 C2 Cl1 . . 111.4(6) ?
F1 C2 Cl1 . . 106.8(5) ?
C1 C2 Cl1 . . 118.8(3) ?
C4 C3 C8 . . 119.5(4) ?
C4 C3 P1 . . 119.6(3) ?
C8 C3 P1 . . 120.8(3) ?
C5 C4 C3 . . 120.8(4) ?
C5 C4 H4 . . 119.6 ?
C3 C4 H4 . . 119.6 ?
C4 C5 C6 . . 120.3(4) ?
C4 C5 H5 . . 119.9 ?
C6 C5 H5 . . 119.9 ?
C5 C6 C7 . . 119.2(4) ?
C5 C6 H6 . . 120.4 ?
C7 C6 H6 . . 120.4 ?
C8 C7 C6 . . 121.1(4) ?
C8 C7 H7 . . 119.5 ?
C6 C7 H7 . . 119.5 ?
C7 C8 C3 . . 119.1(4) ?
C7 C8 H8 . . 120.4 ?
C3 C8 H8 . . 120.4 ?
C14 C9 C10 . . 119.2(4) ?
C14 C9 P1 . . 119.6(4) ?
C10 C9 P1 . . 121.2(3) ?
C11 C10 C9 . . 119.7(4) ?
C11 C10 H10 . . 120.1 ?
C9 C10 H10 . . 120.1 ?
C10 C11 C12 . . 120.2(5) ?
C10 C11 H11 . . 119.9 ?
C12 C11 H11 . . 119.9 ?
C13 C12 C11 . . 119.8(4) ?
C13 C12 H12 . . 120.1 ?
C11 C12 H12 . . 120.1 ?
C12 C13 C14 . . 120.4(5) ?
C12 C13 H13 . . 119.8 ?
C14 C13 H13 . . 119.8 ?
C13 C14 C9 . . 120.8(5) ?
C13 C14 H14 . . 119.6 ?
C9 C14 H14 . . 119.6 ?
P1 C15 P2 . . 110.3(2) ?
P1 C15 H15A . . 109.6 ?
P2 C15 H15A . . 109.6 ?
P1 C15 H15B . . 109.6 ?
P2 C15 H15B . . 109.6 ?
H15A C15 H15B . . 108.1 ?
C17 C16 C21 . . 119.4(4) ?
C17 C16 P2 . . 122.7(3) ?
C21 C16 P2 . . 117.2(4) ?
C18 C17 C16 . . 120.9(5) ?
C18 C17 H17 . . 119.5 ?
C16 C17 H17 . . 119.5 ?
C17 C18 C19 . . 119.2(5) ?
C17 C18 H18 . . 120.4 ?
C19 C18 H18 . . 120.4 ?
C20 C19 C18 . . 120.8(5) ?
C20 C19 H19 . . 119.6 ?
C18 C19 H19 . . 119.6 ?
C19 C20 C21 . . 120.2(5) ?
C19 C20 H20 . . 119.9 ?
C21 C20 H20 . . 119.9 ?
C16 C21 C20 . . 119.4(5) ?
C16 C21 H21 . . 120.3 ?
C20 C21 H21 . . 120.3 ?
C23 C22 C27 . . 118.9(4) ?
C23 C22 P2 . . 122.4(3) ?
C27 C22 P2 . . 118.4(3) ?
C22 C23 C24 . . 120.1(4) ?
C22 C23 H23 . . 120.0 ?
C24 C23 H23 . . 120.0 ?
C25 C24 C23 . . 120.0(4) ?
C25 C24 H24 . . 120.0 ?
C23 C24 H24 . . 120.0 ?
C24 C25 C26 . . 120.1(4) ?
C24 C25 H25 . . 119.9 ?
C26 C25 H25 . . 119.9 ?
C27 C26 C25 . . 120.4(4) ?
C27 C26 H26 . . 119.8 ?
C25 C26 H26 . . 119.8 ?
C26 C27 C22 . . 120.5(4) ?
C26 C27 H27 . . 119.8 ?
C22 C27 H27 . . 119.8 ?
O4 C28 O3 . . 129.2(4) ?
O4 C28 C29 . . 115.7(4) ?
O3 C28 C29 . . 115.0(4) ?
F4 C29 F3 . . 104.5(3) ?
F4 C29 C28 . . 111.2(3) ?
F3 C29 C28 . . 111.3(3) ?
F4 C29 Cl2 . . 108.8(3) ?
F3 C29 Cl2 . . 109.3(3) ?
C28 C29 Cl2 . . 111.5(3) ?
C35 C30 C31 . . 119.7(4) ?
C35 C30 P3 . . 121.1(3) ?
C31 C30 P3 . . 119.3(3) ?
C32 C31 C30 . . 119.2(4) ?
C32 C31 H31 . . 120.4 ?
C30 C31 H31 . . 120.4 ?
C33 C32 C31 . . 120.7(4) ?
C33 C32 H32 . . 119.7 ?
C31 C32 H32 . . 119.7 ?
C32 C33 C34 . . 120.5(4) ?
C32 C33 H33 . . 119.8 ?
C34 C33 H33 . . 119.8 ?
C33 C34 C35 . . 119.1(5) ?
C33 C34 H34 . . 120.5 ?
C35 C34 H34 . . 120.5 ?
C30 C35 C34 . . 120.9(4) ?
C30 C35 H35 . . 119.6 ?
C34 C35 H35 . . 119.6 ?
C37 C36 C41 . . 118.4(4) ?
C37 C36 P3 . . 123.0(3) ?
C41 C36 P3 . . 118.2(3) ?
C36 C37 C38 . . 120.5(4) ?
C36 C37 H37 . . 119.7 ?
C38 C37 H37 . . 119.7 ?
C39 C38 C37 . . 119.8(4) ?
C39 C38 H38 . . 120.1 ?
C37 C38 H38 . . 120.1 ?
C40 C39 C38 . . 120.6(4) ?
C40 C39 H39 . . 119.7 ?
C38 C39 H39 . . 119.7 ?
C39 C40 C41 . . 119.6(4) ?
C39 C40 H40 . . 120.2 ?
C41 C40 H40 . . 120.2 ?
C40 C41 C36 . . 121.2(4) ?
C40 C41 H41 . . 119.4 ?
C36 C41 H41 . . 119.4 ?
P4 C42 P3 . . 108.4(2) ?
P4 C42 H42A . . 110.0 ?
P3 C42 H42A . . 110.0 ?
P4 C42 H42B . . 110.0 ?
P3 C42 H42B . . 110.0 ?
H42A C42 H42B . . 108.4 ?
C44 C43 C48 . . 119.6(4) ?
C44 C43 P4 . . 120.6(3) ?
C48 C43 P4 . . 119.7(4) ?
C45 C44 C43 . . 120.8(4) ?
C45 C44 H44 . . 119.6 ?
C43 C44 H44 . . 119.6 ?
C44 C45 C46 . . 119.6(5) ?
C44 C45 H45 . . 120.2 ?
C46 C45 H45 . . 120.2 ?
C47 C46 C45 . . 119.9(4) ?
C47 C46 H46 . . 120.0 ?
C45 C46 H46 . . 120.0 ?
C46 C47 C48 . . 120.5(5) ?
C46 C47 H47 . . 119.8 ?
C48 C47 H47 . . 119.8 ?
C47 C48 C43 . . 119.5(5) ?
C47 C48 H48 . . 120.3 ?
C43 C48 H48 . . 120.3 ?
C50 C49 C54 . . 118.8(4) ?
C50 C49 P4 . . 120.2(3) ?
C54 C49 P4 . . 120.7(3) ?
C51 C50 C49 . . 120.7(4) ?
C51 C50 H50 . . 119.7 ?
C49 C50 H50 . . 119.7 ?
C52 C51 C50 . . 119.9(4) ?
C52 C51 H51 . . 120.0 ?
C50 C51 H51 . . 120.0 ?
C53 C52 C51 . . 120.1(4) ?
C53 C52 H52 . . 120.0 ?
C51 C52 H52 . . 120.0 ?
C52 C53 C54 . . 120.2(4) ?
C52 C53 H53 . . 119.9 ?
C54 C53 H53 . . 119.9 ?
C53 C54 C49 . . 120.2(4) ?
C53 C54 H54 . . 119.9 ?
C49 C54 H54 . . 119.9 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 O1 . 2.382(3) yes
Ag1 P1 . 2.4194(12) yes
Ag1 P2 2_677 2.4190(10) yes
Ag1 Ag1 2_677 3.1078(6) no
Ag2 O3 . 2.383(3) yes
Ag2 P3 . 2.4300(10) yes
Ag2 P4 2_666 2.4290(10) yes
Ag2 Ag2 2_666 2.9950(6) no
P1 C9 . 1.810(4) ?
P1 C3 . 1.821(4) ?
P1 C15 . 1.834(4) ?
P2 C16 . 1.813(4) ?
P2 C22 . 1.822(4) ?
P2 C15 . 1.836(4) ?
P2 Ag1 2_677 2.4188(12) ?
P3 C30 . 1.816(4) ?
P3 C36 . 1.825(4) ?
P3 C42 . 1.843(4) ?
P4 C43 . 1.816(4) ?
P4 C49 . 1.818(4) ?
P4 C42 . 1.834(4) ?
P4 Ag2 2_666 2.4291(12) ?
Cl1 C2 . 1.683(5) ?
Cl1' C2 . 1.652(5) ?
Cl2 C29 . 1.737(4) ?
F1 C2 . 1.413(6) ?
F2 C2 . 1.375(7) ?
F1' C2 . 1.402(6) ?
F2' C2 . 1.378(7) ?
F3 C29 . 1.360(4) ?
F4 C29 . 1.354(4) ?
O1 C1 . 1.235(5) ?
O2 C1 . 1.236(5) ?
O3 C28 . 1.254(5) ?
O4 C28 . 1.240(5) ?
C1 C2 . 1.547(6) ?
C3 C4 . 1.392(6) ?
C3 C8 . 1.397(5) ?
C4 C5 . 1.372(6) ?
C4 H4 . 0.9500 ?
C5 C6 . 1.388(6) ?
C5 H5 . 0.9500 ?
C6 C7 . 1.389(6) ?
C6 H6 . 0.9500 ?
C7 C8 . 1.386(6) ?
C7 H7 . 0.9500 ?
C8 H8 . 0.9500 ?
C9 C14 . 1.386(6) ?
C9 C10 . 1.396(6) ?
C10 C11 . 1.390(6) ?
C10 H10 . 0.9500 ?
C11 C12 . 1.393(7) ?
C11 H11 . 0.9500 ?
C12 C13 . 1.373(7) ?
C12 H12 . 0.9500 ?
C13 C14 . 1.378(6) ?
C13 H13 . 0.9500 ?
C14 H14 . 0.9500 ?
C15 H15A . 0.9900 ?
C15 H15B . 0.9900 ?
C16 C17 . 1.390(6) ?
C16 C21 . 1.397(6) ?
C17 C18 . 1.384(7) ?
C17 H17 . 0.9500 ?
C18 C19 . 1.392(7) ?
C18 H18 . 0.9500 ?
C19 C20 . 1.370(7) ?
C19 H19 . 0.9500 ?
C20 C21 . 1.402(7) ?
C20 H20 . 0.9500 ?
C21 H21 . 0.9500 ?
C22 C23 . 1.392(6) ?
C22 C27 . 1.401(6) ?
C23 C24 . 1.395(6) ?
C23 H23 . 0.9500 ?
C24 C25 . 1.376(6) ?
C24 H24 . 0.9500 ?
C25 C26 . 1.385(6) ?
C25 H25 . 0.9500 ?
C26 C27 . 1.370(6) ?
C26 H26 . 0.9500 ?
C27 H27 . 0.9500 ?
C28 C29 . 1.539(5) ?
C30 C35 . 1.387(6) ?
C30 C31 . 1.397(6) ?
C31 C32 . 1.395(6) ?
C31 H31 . 0.9500 ?
C32 C33 . 1.380(7) ?
C32 H32 . 0.9500 ?
C33 C34 . 1.387(6) ?
C33 H33 . 0.9500 ?
C34 C35 . 1.395(6) ?
C34 H34 . 0.9500 ?
C35 H35 . 0.9500 ?
C36 C37 . 1.390(6) ?
C36 C41 . 1.392(6) ?
C37 C38 . 1.392(6) ?
C37 H37 . 0.9500 ?
C38 C39 . 1.378(7) ?
C38 H38 . 0.9500 ?
C39 C40 . 1.377(7) ?
C39 H39 . 0.9500 ?
C40 C41 . 1.382(6) ?
C40 H40 . 0.9500 ?
C41 H41 . 0.9500 ?
C42 H42A . 0.9900 ?
C42 H42B . 0.9900 ?
C43 C44 . 1.388(6) ?
C43 C48 . 1.397(6) ?
C44 C45 . 1.376(6) ?
C44 H44 . 0.9500 ?
C45 C46 . 1.402(7) ?
C45 H45 . 0.9500 ?
C46 C47 . 1.376(8) ?
C46 H46 . 0.9500 ?
C47 C48 . 1.395(6) ?
C47 H47 . 0.9500 ?
C48 H48 . 0.9500 ?
C49 C50 . 1.387(6) ?
C49 C54 . 1.396(6) ?
C50 C51 . 1.387(6) ?
C50 H50 . 0.9500 ?
C51 C52 . 1.380(6) ?
C51 H51 . 0.9500 ?
C52 C53 . 1.378(6) ?
C52 H52 . 0.9500 ?
C53 C54 . 1.387(6) ?
C53 H53 . 0.9500 ?
C54 H54 . 0.9500 ?
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
O1 Ag1 P1 C9 . 158.28(17)
P2 Ag1 P1 C9 2_677 9.62(18)
Ag1 Ag1 P1 C9 2_677 -66.32(15)
O1 Ag1 P1 C3 . 32.26(17)
P2 Ag1 P1 C3 2_677 -116.40(16)
Ag1 Ag1 P1 C3 2_677 167.66(15)
O1 Ag1 P1 C15 . -81.72(16)
P2 Ag1 P1 C15 2_677 129.63(15)
Ag1 Ag1 P1 C15 2_677 53.68(14)
O3 Ag2 P3 C30 . -11.10(17)
P4 Ag2 P3 C30 2_666 -157.73(15)
Ag2 Ag2 P3 C30 2_666 127.08(15)
O3 Ag2 P3 C36 . 112.04(16)
P4 Ag2 P3 C36 2_666 -34.59(17)
Ag2 Ag2 P3 C36 2_666 -109.78(14)
O3 Ag2 P3 C42 . -132.21(16)
P4 Ag2 P3 C42 2_666 81.16(16)
Ag2 Ag2 P3 C42 2_666 5.97(14)
P2 Ag1 O1 C1 2_677 -129.4(3)
P1 Ag1 O1 C1 . 65.6(3)
Ag1 Ag1 O1 C1 2_677 -22.3(4)
P4 Ag2 O3 C28 2_666 -65.3(3)
P3 Ag2 O3 C28 . 131.1(3)
Ag2 Ag2 O3 C28 2_666 19.0(3)
Ag1 O1 C1 O2 . -3.4(6)
Ag1 O1 C1 C2 . 178.4(3)
O1 C1 C2 F2 . -18.6(7)
O2 C1 C2 F2 . 163.0(6)
O1 C1 C2 F2' . -39.4(7)
O2 C1 C2 F2' . 142.2(6)
O1 C1 C2 F1' . -147.8(6)
O2 C1 C2 F1' . 33.8(7)
O1 C1 C2 F1 . 88.6(6)
O2 C1 C2 F1 . -89.8(6)
O1 C1 C2 Cl1' . 87.2(5)
O2 C1 C2 Cl1' . -91.3(5)
O1 C1 C2 Cl1 . -152.1(4)
O2 C1 C2 Cl1 . 29.5(6)
C9 P1 C3 C4 . 150.5(4)
C15 P1 C3 C4 . 41.9(4)
Ag1 P1 C3 C4 . -76.9(4)
C9 P1 C3 C8 . -33.6(4)
C15 P1 C3 C8 . -142.2(4)
Ag1 P1 C3 C8 . 99.1(4)
C8 C3 C4 C5 . 1.6(7)
P1 C3 C4 C5 . 177.5(4)
C3 C4 C5 C6 . -0.3(7)
C4 C5 C6 C7 . -0.6(7)
C5 C6 C7 C8 . 0.2(7)
C6 C7 C8 C3 . 1.0(7)
C4 C3 C8 C7 . -1.9(7)
P1 C3 C8 C7 . -177.8(3)
C3 P1 C9 C14 . 142.2(3)
C15 P1 C9 C14 . -110.6(4)
Ag1 P1 C9 C14 . 12.6(4)
C3 P1 C9 C10 . -40.2(4)
C15 P1 C9 C10 . 67.0(4)
Ag1 P1 C9 C10 . -169.8(3)
C14 C9 C10 C11 . -1.5(6)
P1 C9 C10 C11 . -179.1(3)
C9 C10 C11 C12 . 1.3(7)
C10 C11 C12 C13 . 0.2(7)
C11 C12 C13 C14 . -1.5(7)
C12 C13 C14 C9 . 1.3(7)
C10 C9 C14 C13 . 0.2(6)
P1 C9 C14 C13 . 177.9(3)
C9 P1 C15 P2 . 62.7(3)
C3 P1 C15 P2 . 172.8(2)
Ag1 P1 C15 P2 . -66.1(2)
C16 P2 C15 P1 . -99.2(2)
C22 P2 C15 P1 . 151.4(2)
Ag1 P2 C15 P1 2_677 33.1(2)
C22 P2 C16 C17 . 75.3(4)
C15 P2 C16 C17 . -34.4(4)
Ag1 P2 C16 C17 2_677 -163.2(3)
C22 P2 C16 C21 . -95.5(4)
C15 P2 C16 C21 . 154.8(3)
Ag1 P2 C16 C21 2_677 26.0(4)
C21 C16 C17 C18 . -0.9(7)
P2 C16 C17 C18 . -171.5(3)
C16 C17 C18 C19 . 1.8(7)
C17 C18 C19 C20 . -1.1(7)
C18 C19 C20 C21 . -0.5(8)
C17 C16 C21 C20 . -0.7(7)
P2 C16 C21 C20 . 170.4(4)
C19 C20 C21 C16 . 1.4(7)
C16 P2 C22 C23 . 14.1(4)
C15 P2 C22 C23 . 125.9(4)
Ag1 P2 C22 C23 2_677 -113.5(3)
C16 P2 C22 C27 . -172.3(3)
C15 P2 C22 C27 . -60.5(4)
Ag1 P2 C22 C27 2_677 60.0(3)
C27 C22 C23 C24 . -0.3(6)
P2 C22 C23 C24 . 173.3(3)
C22 C23 C24 C25 . 0.1(6)
C23 C24 C25 C26 . 0.3(7)
C24 C25 C26 C27 . -0.5(7)
C25 C26 C27 C22 . 0.3(7)
C23 C22 C27 C26 . 0.1(6)
P2 C22 C27 C26 . -173.7(3)
Ag2 O3 C28 O4 . 11.0(6)
Ag2 O3 C28 C29 . -172.5(3)
O4 C28 C29 F4 . -29.1(5)
O3 C28 C29 F4 . 153.9(4)
O4 C28 C29 F3 . -145.2(4)
O3 C28 C29 F3 . 37.9(5)
O4 C28 C29 Cl2 . 92.5(4)
O3 C28 C29 Cl2 . -84.4(4)
C36 P3 C30 C35 . 60.9(4)
C42 P3 C30 C35 . -49.6(4)
Ag2 P3 C30 C35 . -172.6(3)
C36 P3 C30 C31 . -118.2(3)
C42 P3 C30 C31 . 131.3(3)
Ag2 P3 C30 C31 . 8.2(4)
C35 C30 C31 C32 . 0.5(6)
P3 C30 C31 C32 . 179.7(3)
C30 C31 C32 C33 . -0.5(6)
C31 C32 C33 C34 . 0.2(7)
C32 C33 C34 C35 . 0.2(7)
C31 C30 C35 C34 . -0.1(6)
P3 C30 C35 C34 . -179.2(3)
C33 C34 C35 C30 . -0.3(7)
C30 P3 C36 C37 . 17.4(4)
C42 P3 C36 C37 . 128.4(4)
Ag2 P3 C36 C37 . -113.2(4)
C30 P3 C36 C41 . -169.0(3)
C42 P3 C36 C41 . -58.0(4)
Ag2 P3 C36 C41 . 60.3(4)
C41 C36 C37 C38 . -0.5(7)
P3 C36 C37 C38 . 173.0(4)
C36 C37 C38 C39 . 0.6(7)
C37 C38 C39 C40 . 0.1(7)
C38 C39 C40 C41 . -0.7(7)
C39 C40 C41 C36 . 0.7(7)
C37 C36 C41 C40 . -0.1(7)
P3 C36 C41 C40 . -174.0(4)
C43 P4 C42 P3 . 63.2(3)
C49 P4 C42 P3 . 172.6(2)
Ag2 P4 C42 P3 2_666 -68.2(2)
C30 P3 C42 P4 . -97.8(2)
C36 P3 C42 P4 . 151.5(2)
Ag2 P3 C42 P4 . 31.2(2)
C49 P4 C43 C44 . -54.0(4)
C42 P4 C43 C44 . 55.8(4)
Ag2 P4 C43 C44 2_666 -178.9(3)
C49 P4 C43 C48 . 129.3(3)
C42 P4 C43 C48 . -121.0(3)
Ag2 P4 C43 C48 2_666 4.3(4)
C48 C43 C44 C45 . 0.8(6)
P4 C43 C44 C45 . -176.0(3)
C43 C44 C45 C46 . 1.1(7)
C44 C45 C46 C47 . -1.9(7)
C45 C46 C47 C48 . 0.7(7)
C46 C47 C48 C43 . 1.2(7)
C44 C43 C48 C47 . -2.0(6)
P4 C43 C48 C47 . 174.8(3)
C43 P4 C49 C50 . 155.4(4)
C42 P4 C49 C50 . 47.7(4)
Ag2 P4 C49 C50 2_666 -72.7(4)
C43 P4 C49 C54 . -31.0(4)
C42 P4 C49 C54 . -138.7(4)
Ag2 P4 C49 C54 2_666 100.9(3)
C54 C49 C50 C51 . 1.2(7)
P4 C49 C50 C51 . 174.9(3)
C49 C50 C51 C52 . -0.5(7)
C50 C51 C52 C53 . -1.0(7)
C51 C52 C53 C54 . 1.7(7)
C52 C53 C54 C49 . -1.0(7)
C50 C49 C54 C53 . -0.5(7)
P4 C49 C54 C53 . -174.1(4)
