#------------------------------------------------------------------------------
#$Date: 2016-02-11 04:41:58 +0200 (Thu, 11 Feb 2016) $
#$Revision: 176362 $
#$URL: svn://www.crystallography.net/cod/cif/2/24/15/2241548.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_2241548
loop_
_publ_author_name
'Noll, Julian'
'Korb, Marcus'
'Lang, Heinrich'
_publ_section_title
;
 Crystal structure of
 bis[tetrakis(triphenylphosphane-κP)silver(I)]
 (nitrilotriacetato-κ⁴N,O,O',O'')(triphenylphosphane-κP)argentate(I)
 with an unknown amount of methanol as solvate
;
_journal_coeditor_code           PK2571
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              318
_journal_page_last               321
_journal_paper_doi               10.1107/S2056989016001262
_journal_volume                  72
_journal_year                    2016
_chemical_formula_iupac
'[Ag (C18 H15 P)4]2 [Ag (C6 H6 N O6) (C18 H15 P)]'
_chemical_formula_moiety         '2(C72 H60 Ag P4 +), C24 H21 Ag N O6 P 2-'
_chemical_formula_sum            'C168 H141 Ag3 N O6 P9'
_chemical_formula_weight         2872.15
_chemical_name_systematic
;Bis[tetrakis(triphenylphosphane-κP)silver(I)]
(nitrilotriacetato-κ⁴N,O,O',O'')(triphenylphosphane-κP)argentate(I) methanol
monosolvate
;
_space_group_crystal_system      trigonal
_space_group_IT_number           147
_space_group_name_Hall           '-P 3'
_space_group_name_H-M_alt        'P -3'
_symmetry_space_group_name_Hall  '-P 3'
_symmetry_space_group_name_H-M   'P -3'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   19.0095(5)
_cell_length_b                   19.0095(5)
_cell_length_c                   31.9862(10)
_cell_measurement_reflns_used    6868
_cell_measurement_temperature    110
_cell_measurement_theta_max      27.56
_cell_measurement_theta_min      3.33
_cell_volume                     10010.0(5)
_computing_cell_refinement
;
CrysAlis RED (Oxford Diffraction, 2006)
;
_computing_data_collection
;
CrysAlis CCD (Oxford Diffraction, 2006)
;
_computing_data_reduction
;
CrysAlis RED (Oxford Diffraction, 2006)
;
_computing_molecular_graphics
;
ORTEP-3 for Windows (Farrugia, 2012) and SHELXTL (Sheldrick,
2008)
;
_computing_publication_material
;
WinGX (Farrugia, 2012) and publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2013 (Sheldrick, 2015)
;
_computing_structure_solution
;
SHELXS97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      110
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Oxford Gemini S'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0485
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -38
_diffrn_reflns_number            32447
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         25.492
_diffrn_reflns_theta_min         3.184
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 50
_diffrn_standards_interval_time  10
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.404
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.69924
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(CrysAlis RED; Oxford Diffraction, 2006)
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    0.953
_exptl_crystal_description       block
_exptl_crystal_F_000             2960
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.2
_refine_diff_density_max         1.335
_refine_diff_density_min         -0.644
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.048
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     572
_refine_ls_number_reflns         12365
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.048
_refine_ls_R_factor_all          0.0969
_refine_ls_R_factor_gt           0.0664
_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)+(0.1010P)²+10.4365P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1849
_refine_ls_wR_factor_ref         0.1972
_reflns_number_gt                8561
_reflns_number_total             12365
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            pk2571sup1.cif
_cod_data_source_block           I
_cod_original_cell_volume        10010.0(6)
_cod_database_code               2241548
_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.
;
_shelxl_version_number           .2013
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -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_occupancy
C C1 0.9981(4) 1.0723(4) 0.77087(17) 0.0510(15) Uani d 1
H H1A 1.0514 1.1195 0.7667 0.061 Uiso calc 1
H H1B 0.9864 1.0679 0.8006 0.061 Uiso calc 1
C C2 0.9347(4) 1.0855(4) 0.7476(2) 0.0520(15) Uani d 1
C C3 1.0199(3) 0.9244(3) 0.58793(14) 0.0249(10) Uani d 1
C C4 1.0648(3) 0.9386(3) 0.55126(15) 0.0290(11) Uani d 1
H H4 1.0874 0.9891 0.5382 0.035 Uiso calc 1
C C5 1.0757(3) 0.8780(3) 0.53427(16) 0.0341(12) Uani d 1
H H5 1.1063 0.8879 0.5100 0.041 Uiso calc 1
C C6 1.0413(3) 0.8024(3) 0.55318(17) 0.0378(13) Uani d 1
H H6 1.0474 0.7611 0.5412 0.045 Uiso calc 1
C C7 0.9980(3) 0.7884(3) 0.58994(18) 0.0402(13) Uani d 1
H H7 0.9758 0.7382 0.6031 0.048 Uiso calc 1
C C8 0.9878(3) 0.8493(3) 0.60683(16) 0.0317(11) Uani d 1
H H8 0.9586 0.8397 0.6315 0.038 Uiso calc 1
C C9 0.7784(2) 0.4908(3) 0.48160(13) 0.0227(9) Uani d 1
C C10 0.7818(3) 0.5545(3) 0.45909(15) 0.0278(10) Uani d 1
H H10 0.7772 0.5951 0.4730 0.033 Uiso calc 1
C C11 0.7920(3) 0.5586(3) 0.41567(15) 0.0330(11) Uani d 1
H H11 0.7935 0.6013 0.4007 0.040 Uiso calc 1
C C12 0.7997(3) 0.4996(3) 0.39533(15) 0.0362(12) Uani d 1
H H12 0.8076 0.5027 0.3665 0.043 Uiso calc 1
C C13 0.7958(3) 0.4347(3) 0.41765(17) 0.0395(13) Uani d 1
H H13 0.8003 0.3942 0.4037 0.047 Uiso calc 1
C C14 0.7853(3) 0.4306(3) 0.46039(15) 0.0304(11) Uani d 1
H H14 0.7828 0.3873 0.4752 0.036 Uiso calc 1
C C15 0.7362(3) 0.5570(3) 0.55164(13) 0.0218(9) Uani d 1
C C16 0.6549(3) 0.5326(3) 0.55782(14) 0.0257(10) Uani d 1
H H16 0.6157 0.4781 0.5551 0.031 Uiso calc 1
C C17 0.6318(3) 0.5894(3) 0.56809(14) 0.0319(11) Uani d 1
H H17 0.5772 0.5723 0.5725 0.038 Uiso calc 1
C C18 0.6885(3) 0.6700(3) 0.57182(15) 0.0345(12) Uani d 1
H H18 0.6725 0.7076 0.5783 0.041 Uiso calc 1
C C19 0.7696(3) 0.6952(3) 0.56595(16) 0.0372(12) Uani d 1
H H19 0.8081 0.7499 0.5688 0.045 Uiso calc 1
C C20 0.7945(3) 0.6395(3) 0.55582(14) 0.0284(10) Uani d 1
H H20 0.8492 0.6569 0.5519 0.034 Uiso calc 1
C C21 0.8692(3) 0.5295(2) 0.55785(14) 0.0216(9) Uani d 1
C C22 0.9362(3) 0.5552(3) 0.53165(15) 0.0275(10) Uani d 1
H H22 0.9289 0.5481 0.5029 0.033 Uiso calc 1
C C23 1.0147(3) 0.5917(3) 0.54861(16) 0.0348(12) Uani d 1
H H23 1.0594 0.6084 0.5312 0.042 Uiso calc 1
C C24 1.0255(3) 0.6028(3) 0.59136(16) 0.0350(12) Uani d 1
H H24 1.0775 0.6275 0.6027 0.042 Uiso calc 1
C C25 0.9584(3) 0.5770(3) 0.61745(16) 0.0324(11) Uani d 1
H H25 0.9655 0.5848 0.6462 0.039 Uiso calc 1
C C26 0.8818(3) 0.5399(3) 0.60066(15) 0.0286(10) Uani d 1
H H26 0.8373 0.5213 0.6184 0.034 Uiso calc 1
C C27 0.7674(3) 0.3799(3) 0.67114(13) 0.0263(10) Uani d 1
C C28 0.7918(3) 0.4372(3) 0.70267(14) 0.0293(11) Uani d 1
H H28 0.7561 0.4534 0.7126 0.035 Uiso calc 1
C C29 0.8694(3) 0.4708(3) 0.71949(14) 0.0367(12) Uani d 1
H H29 0.8862 0.5106 0.7400 0.044 Uiso calc 1
C C30 0.9217(3) 0.4449(3) 0.70572(15) 0.0388(13) Uani d 1
H H30 0.9729 0.4661 0.7177 0.047 Uiso calc 1
C C31 0.8982(3) 0.3876(3) 0.67416(16) 0.0392(13) Uani d 1
H H31 0.9336 0.3707 0.6647 0.047 Uiso calc 1
C C32 0.8219(3) 0.3560(3) 0.65699(15) 0.0323(11) Uani d 1
H H32 0.8062 0.3180 0.6356 0.039 Uiso calc 1
C C33 0.7197(3) 0.4342(3) 0.83069(14) 0.0324(11) Uani d 1
C C34 0.7969(4) 0.4884(3) 0.84516(16) 0.0457(14) Uani d 1
H H34 0.8199 0.4729 0.8663 0.055 Uiso calc 1
C C35 0.8402(4) 0.5664(4) 0.82803(17) 0.0517(16) Uani d 1
H H35 0.8922 0.6027 0.8376 0.062 Uiso calc 1
C C36 0.8046(4) 0.5899(4) 0.79617(16) 0.0465(14) Uani d 1
H H36 0.8325 0.6419 0.7849 0.056 Uiso calc 1
C C37 0.7297(3) 0.5358(3) 0.78221(16) 0.0390(13) Uani d 1
H H37 0.7064 0.5510 0.7611 0.047 Uiso calc 1
C C38 0.6863(3) 0.4572(3) 0.79896(14) 0.0372(12) Uani d 1
H H38 0.6350 0.4206 0.7887 0.045 Uiso calc 1
C C39 0.8225(4) 0.4078(5) 1.0209(2) 0.073(2) Uani d 1
C C40 0.7801(4) 0.3373(4) 1.04272(19) 0.067(2) Uani d 1
H H40 0.7470 0.2900 1.0279 0.080 Uiso calc 1
C C41 0.7834(5) 0.3322(7) 1.0857(3) 0.126(5) Uani d 1
H H41 0.7567 0.2825 1.0995 0.152 Uiso calc 1
C C42 0.8294(5) 0.4061(6) 1.1079(2) 0.088(3) Uani d 1
H H42 0.8292 0.4063 1.1369 0.106 Uiso calc 1
C C43 0.8754(5) 0.4791(6) 1.0857(2) 0.080(2) Uani d 1
H H43 0.9086 0.5266 1.1004 0.096 Uiso calc 1
C C44 0.8725(4) 0.4820(5) 1.0421(2) 0.077(2) Uani d 1
H H44 0.9021 0.5306 1.0276 0.092 Uiso calc 1
C C45 0.8742(4) 0.3609(4) 0.9471(2) 0.0607(18) Uani d 1
C C46 0.8732(4) 0.3449(4) 0.90415(18) 0.0551(17) Uani d 1
H H46 0.8444 0.3588 0.8856 0.066 Uiso calc 1
C C47 0.9159(5) 0.3081(6) 0.8899(3) 0.090(3) Uani d 1
H H47 0.9131 0.2939 0.8619 0.108 Uiso calc 1
C C48 0.9638(5) 0.2919(5) 0.9180(3) 0.084(2) Uani d 1
H H48 0.9943 0.2693 0.9084 0.101 Uiso calc 1
C C49 0.9645(4) 0.3106(4) 0.9606(2) 0.071(2) Uani d 1
H H49 0.9952 0.2992 0.9791 0.086 Uiso calc 1
C C50 0.9200(4) 0.3458(4) 0.9760(3) 0.069(2) Uani d 1
H H50 0.9211 0.3585 1.0042 0.083 Uiso calc 1
C C51 0.8718(4) 0.5109(4) 0.9494(2) 0.0674(19) Uani d 1
C C52 0.8434(3) 0.5648(4) 0.95708(19) 0.0499(15) Uani d 1
H H52 0.7919 0.5433 0.9688 0.060 Uiso calc 1
C C53 0.8828(5) 0.6430(5) 0.9493(3) 0.104(3) Uani d 1
H H53 0.8630 0.6765 0.9578 0.124 Uiso calc 1
C C54 0.9596(5) 0.6749(5) 0.9266(3) 0.082(2) Uani d 1
H H54 0.9871 0.7285 0.9173 0.098 Uiso calc 1
C C55 0.9905(5) 0.6236(5) 0.9190(2) 0.074(2) Uani d 1
H H55 1.0408 0.6451 0.9059 0.088 Uiso calc 1
C C56 0.9503(4) 0.5414(5) 0.93011(19) 0.067(2) Uani d 1
H H56 0.9728 0.5085 0.9253 0.080 Uiso calc 1
O O1 0.9044(2) 1.0481(2) 0.71512(12) 0.0467(10) Uani d 1
O O2 0.9195(3) 1.1367(3) 0.76428(15) 0.0755(14) Uani d 1
P P1 1.0000 1.0000 0.61143(6) 0.0240(4) Uani d 1
P P2 0.76469(7) 0.48109(7) 0.53863(4) 0.0214(3) Uani d 1
P P3 0.6667 0.3333 0.64650(6) 0.0230(4) Uani d 1
P P4 0.6667 0.3333 0.85547(7) 0.0315(5) Uani d 1
P P5 0.81418(9) 0.40685(9) 0.96398(4) 0.0393(3) Uani d 1
Ag Ag1 1.0000 1.0000 0.68457(2) 0.03511(19) Uani d 1
Ag Ag2 0.6667 0.3333 0.56556(2) 0.01929(15) Uani d 1
Ag Ag3 0.6667 0.3333 0.93618(2) 0.03244(18) Uani d 1
N N1 1.0000 1.0000 0.7572(2) 0.0305(16) Uani 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'
O O 0.0106 0.0060 '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'
Ag Ag -0.8971 1.1015 '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'
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
N1 C1 C2 . . 113.5(5)
N1 C1 H1A . . 108.9
C2 C1 H1A . . 108.9
N1 C1 H1B . . 108.9
C2 C1 H1B . . 108.9
H1A C1 H1B . . 107.7
O1 C2 O2 . . 125.7(6)
O1 C2 C1 . . 119.6(5)
O2 C2 C1 . . 114.8(6)
C8 C3 C4 . . 118.7(4)
C8 C3 P1 . . 118.4(3)
C4 C3 P1 . . 122.9(3)
C5 C4 C3 . . 120.1(5)
C5 C4 H4 . . 119.9
C3 C4 H4 . . 119.9
C4 C5 C6 . . 120.3(5)
C4 C5 H5 . . 119.9
C6 C5 H5 . . 119.9
C7 C6 C5 . . 119.8(5)
C7 C6 H6 . . 120.1
C5 C6 H6 . . 120.1
C8 C7 C6 . . 119.6(5)
C8 C7 H7 . . 120.2
C6 C7 H7 . . 120.2
C7 C8 C3 . . 121.5(5)
C7 C8 H8 . . 119.2
C3 C8 H8 . . 119.2
C10 C9 C14 . . 119.0(4)
C10 C9 P2 . . 123.2(3)
C14 C9 P2 . . 117.8(3)
C9 C10 C11 . . 120.7(4)
C9 C10 H10 . . 119.7
C11 C10 H10 . . 119.7
C12 C11 C10 . . 119.7(4)
C12 C11 H11 . . 120.1
C10 C11 H11 . . 120.1
C11 C12 C13 . . 120.2(5)
C11 C12 H12 . . 119.9
C13 C12 H12 . . 119.9
C14 C13 C12 . . 120.0(5)
C14 C13 H13 . . 120.0
C12 C13 H13 . . 120.0
C13 C14 C9 . . 120.5(4)
C13 C14 H14 . . 119.8
C9 C14 H14 . . 119.8
C16 C15 C20 . . 119.0(4)
C16 C15 P2 . . 119.4(3)
C20 C15 P2 . . 121.7(3)
C15 C16 C17 . . 120.4(4)
C15 C16 H16 . . 119.8
C17 C16 H16 . . 119.8
C18 C17 C16 . . 120.7(4)
C18 C17 H17 . . 119.7
C16 C17 H17 . . 119.7
C17 C18 C19 . . 119.7(5)
C17 C18 H18 . . 120.1
C19 C18 H18 . . 120.1
C18 C19 C20 . . 120.8(5)
C18 C19 H19 . . 119.6
C20 C19 H19 . . 119.6
C19 C20 C15 . . 119.5(4)
C19 C20 H20 . . 120.3
C15 C20 H20 . . 120.3
C26 C21 C22 . . 118.7(4)
C26 C21 P2 . . 118.1(3)
C22 C21 P2 . . 123.2(3)
C21 C22 C23 . . 120.1(4)
C21 C22 H22 . . 120.0
C23 C22 H22 . . 120.0
C24 C23 C22 . . 119.8(4)
C24 C23 H23 . . 120.1
C22 C23 H23 . . 120.1
C23 C24 C25 . . 120.0(4)
C23 C24 H24 . . 120.0
C25 C24 H24 . . 120.0
C26 C25 C24 . . 119.8(5)
C26 C25 H25 . . 120.1
C24 C25 H25 . . 120.1
C25 C26 C21 . . 121.6(4)
C25 C26 H26 . . 119.2
C21 C26 H26 . . 119.2
C28 C27 C32 . . 118.8(4)
C28 C27 P3 . . 123.3(4)
C32 C27 P3 . . 117.9(3)
C27 C28 C29 . . 120.2(5)
C27 C28 H28 . . 119.9
C29 C28 H28 . . 119.9
C30 C29 C28 . . 120.0(5)
C30 C29 H29 . . 120.0
C28 C29 H29 . . 120.0
C29 C30 C31 . . 120.4(5)
C29 C30 H30 . . 119.8
C31 C30 H30 . . 119.8
C32 C31 C30 . . 119.2(5)
C32 C31 H31 . . 120.4
C30 C31 H31 . . 120.4
C31 C32 C27 . . 121.3(5)
C31 C32 H32 . . 119.4
C27 C32 H32 . . 119.4
C38 C33 C34 . . 119.7(5)
C38 C33 P4 . . 123.2(4)
C34 C33 P4 . . 117.1(4)
C33 C34 C35 . . 120.1(5)
C33 C34 H34 . . 120.0
C35 C34 H34 . . 120.0
C34 C35 C36 . . 119.7(6)
C34 C35 H35 . . 120.1
C36 C35 H35 . . 120.1
C37 C36 C35 . . 119.2(5)
C37 C36 H36 . . 120.4
C35 C36 H36 . . 120.4
C36 C37 C38 . . 121.3(5)
C36 C37 H37 . . 119.3
C38 C37 H37 . . 119.3
C33 C38 C37 . . 120.0(5)
C33 C38 H38 . . 120.0
C37 C38 H38 . . 120.0
C40 C39 C44 . . 120.4(6)
C40 C39 P5 . . 119.8(5)
C44 C39 P5 . . 119.9(6)
C39 C40 C41 . . 123.7(7)
C39 C40 H40 . . 118.1
C41 C40 H40 . . 118.1
C40 C41 C42 . . 117.0(8)
C40 C41 H41 . . 121.5
C42 C41 H41 . . 121.5
C43 C42 C41 . . 119.7(7)
C43 C42 H42 . . 120.1
C41 C42 H42 . . 120.1
C44 C43 C42 . . 121.7(8)
C44 C43 H43 . . 119.2
C42 C43 H43 . . 119.2
C43 C44 C39 . . 117.2(8)
C43 C44 H44 . . 121.4
C39 C44 H44 . . 121.4
C50 C45 C46 . . 123.0(7)
C50 C45 P5 . . 120.4(6)
C46 C45 P5 . . 116.6(5)
C47 C46 C45 . . 118.8(6)
C47 C46 H46 . . 120.6
C45 C46 H46 . . 120.6
C46 C47 C48 . . 120.3(7)
C46 C47 H47 . . 119.9
C48 C47 H47 . . 119.9
C49 C48 C47 . . 119.0(8)
C49 C48 H48 . . 120.5
C47 C48 H48 . . 120.5
C50 C49 C48 . . 121.9(7)
C50 C49 H49 . . 119.0
C48 C49 H49 . . 119.0
C45 C50 C49 . . 116.9(7)
C45 C50 H50 . . 121.5
C49 C50 H50 . . 121.5
C52 C51 C56 . . 118.8(7)
C52 C51 P5 . . 121.3(6)
C56 C51 P5 . . 119.9(6)
C53 C52 C51 . . 125.9(7)
C53 C52 H52 . . 117.1
C51 C52 H52 . . 117.1
C52 C53 C54 . . 116.9(8)
C52 C53 H53 . . 121.6
C54 C53 H53 . . 121.6
C55 C54 C53 . . 118.6(8)
C55 C54 H54 . . 120.7
C53 C54 H54 . . 120.7
C54 C55 C56 . . 123.6(8)
C54 C55 H55 . . 118.2
C56 C55 H55 . . 118.2
C55 C56 C51 . . 115.8(8)
C55 C56 H56 . . 122.1
C51 C56 H56 . . 122.1
C2 O1 Ag1 . . 108.3(4)
C3 P1 C3 3_675 2_765 104.14(18)
C3 P1 C3 3_675 . 104.14(18)
C3 P1 C3 2_765 . 104.14(18)
C3 P1 Ag1 3_675 . 114.39(15)
C3 P1 Ag1 2_765 . 114.39(15)
C3 P1 Ag1 . . 114.39(15)
C15 P2 C21 . . 101.7(2)
C15 P2 C9 . . 103.28(19)
C21 P2 C9 . . 102.69(19)
C15 P2 Ag2 . . 116.05(14)
C21 P2 Ag2 . . 116.10(14)
C9 P2 Ag2 . . 115.02(14)
C27 P3 C27 3_665 2_655 102.95(17)
C27 P3 C27 3_665 . 102.95(17)
C27 P3 C27 2_655 . 102.95(17)
C27 P3 Ag2 3_665 . 115.39(15)
C27 P3 Ag2 2_655 . 115.39(15)
C27 P3 Ag2 . . 115.40(15)
C33 P4 C33 . 3_665 102.83(18)
C33 P4 C33 . 2_655 102.83(18)
C33 P4 C33 3_665 2_655 102.83(18)
C33 P4 Ag3 . . 115.49(15)
C33 P4 Ag3 3_665 . 115.50(15)
C33 P4 Ag3 2_655 . 115.50(15)
C51 P5 C39 . . 104.4(3)
C51 P5 C45 . . 105.6(3)
C39 P5 C45 . . 103.1(3)
C51 P5 Ag3 . . 114.1(2)
C39 P5 Ag3 . . 114.4(2)
C45 P5 Ag3 . . 114.0(2)
N1 Ag1 P1 . . 180.0
N1 Ag1 O1 . 2_765 67.92(8)
P1 Ag1 O1 . 2_765 112.08(8)
N1 Ag1 O1 . 3_675 67.92(8)
P1 Ag1 O1 . 3_675 112.08(8)
O1 Ag1 O1 2_765 3_675 106.74(9)
N1 Ag1 O1 . . 67.92(8)
P1 Ag1 O1 . . 112.08(8)
O1 Ag1 O1 2_765 . 106.74(9)
O1 Ag1 O1 3_675 . 106.74(9)
P3 Ag2 P2 . 3_665 109.19(3)
P3 Ag2 P2 . . 109.19(3)
P2 Ag2 P2 3_665 . 109.75(3)
P3 Ag2 P2 . 2_655 109.19(3)
P2 Ag2 P2 3_665 2_655 109.75(3)
P2 Ag2 P2 . 2_655 109.75(3)
P4 Ag3 P5 . 3_665 110.11(3)
P4 Ag3 P5 . 2_655 110.11(3)
P5 Ag3 P5 3_665 2_655 108.83(3)
P4 Ag3 P5 . . 110.11(3)
P5 Ag3 P5 3_665 . 108.83(3)
P5 Ag3 P5 2_655 . 108.82(3)
C1 N1 C1 . 3_675 111.5(3)
C1 N1 C1 . 2_765 111.5(3)
C1 N1 C1 3_675 2_765 111.5(3)
C1 N1 Ag1 . . 107.4(3)
C1 N1 Ag1 3_675 . 107.4(3)
C1 N1 Ag1 2_765 . 107.4(3)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
C1 N1 . 1.460(6)
C1 C2 . 1.541(9)
C1 H1A . 0.9700
C1 H1B . 0.9700
C2 O1 . 1.227(7)
C2 O2 . 1.263(7)
C3 C8 . 1.380(6)
C3 C4 . 1.395(6)
C3 P1 . 1.821(4)
C4 C5 . 1.381(7)
C4 H4 . 0.9300
C5 C6 . 1.385(7)
C5 H5 . 0.9300
C6 C7 . 1.384(7)
C6 H6 . 0.9300
C7 C8 . 1.376(7)
C7 H7 . 0.9300
C8 H8 . 0.9300
C9 C10 . 1.382(6)
C9 C14 . 1.393(6)
C9 P2 . 1.839(5)
C10 C11 . 1.399(6)
C10 H10 . 0.9300
C11 C12 . 1.367(7)
C11 H11 . 0.9300
C12 C13 . 1.396(7)
C12 H12 . 0.9300
C13 C14 . 1.378(7)
C13 H13 . 0.9300
C14 H14 . 0.9300
C15 C16 . 1.387(6)
C15 C20 . 1.403(6)
C15 P2 . 1.824(4)
C16 C17 . 1.392(6)
C16 H16 . 0.9300
C17 C18 . 1.368(7)
C17 H17 . 0.9300
C18 C19 . 1.379(7)
C18 H18 . 0.9300
C19 C20 . 1.397(7)
C19 H19 . 0.9300
C20 H20 . 0.9300
C21 C26 . 1.387(6)
C21 C22 . 1.394(6)
C21 P2 . 1.828(4)
C22 C23 . 1.403(6)
C22 H22 . 0.9300
C23 C24 . 1.383(7)
C23 H23 . 0.9300
C24 C25 . 1.392(7)
C24 H24 . 0.9300
C25 C26 . 1.370(6)
C25 H25 . 0.9300
C26 H26 . 0.9300
C27 C28 . 1.384(6)
C27 C32 . 1.397(7)
C27 P3 . 1.838(4)
C28 C29 . 1.391(7)
C28 H28 . 0.9300
C29 C30 . 1.382(8)
C29 H29 . 0.9300
C30 C31 . 1.385(7)
C30 H30 . 0.9300
C31 C32 . 1.378(7)
C31 H31 . 0.9300
C32 H32 . 0.9300
C33 C38 . 1.379(7)
C33 C34 . 1.384(7)
C33 P4 . 1.841(5)
C34 C35 . 1.399(8)
C34 H34 . 0.9300
C35 C36 . 1.413(8)
C35 H35 . 0.9300
C36 C37 . 1.349(8)
C36 H36 . 0.9300
C37 C38 . 1.402(7)
C37 H37 . 0.9300
C38 H38 . 0.9300
C39 C40 . 1.361(9)
C39 C44 . 1.420(10)
C39 P5 . 1.826(7)
C40 C41 . 1.381(9)
C40 H40 . 0.9300
C41 C42 . 1.419(13)
C41 H41 . 0.9300
C42 C43 . 1.407(11)
C42 H42 . 0.9300
C43 C44 . 1.397(10)
C43 H43 . 0.9300
C44 H44 . 0.9300
C45 C50 . 1.395(9)
C45 C46 . 1.406(8)
C45 P5 . 1.830(7)
C46 C47 . 1.388(10)
C46 H46 . 0.9300
C47 C48 . 1.417(11)
C47 H47 . 0.9300
C48 C49 . 1.406(10)
C48 H48 . 0.9300
C49 C50 . 1.404(10)
C49 H49 . 0.9300
C50 H50 . 0.9300
C51 C52 . 1.399(9)
C51 C56 . 1.441(10)
C51 P5 . 1.778(7)
C52 C53 . 1.310(10)
C52 H52 . 0.9300
C53 C54 . 1.464(12)
C53 H53 . 0.9300
C54 C55 . 1.388(11)
C54 H54 . 0.9300
C55 C56 . 1.399(10)
C55 H55 . 0.9300
C56 H56 . 0.9300
O1 Ag1 . 2.599(4)
P1 C3 3_675 1.821(4)
P1 C3 2_765 1.821(5)
P1 Ag1 . 2.339(2)
P2 Ag2 . 2.6210(11)
P3 C27 3_665 1.838(5)
P3 C27 2_655 1.838(4)
P3 Ag2 . 2.589(2)
P4 C33 3_665 1.841(5)
P4 C33 2_655 1.841(5)
P4 Ag3 . 2.582(2)
P5 Ag3 . 2.5862(14)
Ag1 N1 . 2.324(7)
Ag1 O1 2_765 2.599(4)
Ag1 O1 3_675 2.599(4)
Ag2 P2 3_665 2.6210(11)
Ag2 P2 2_655 2.6211(11)
Ag3 P5 3_665 2.5861(14)
Ag3 P5 2_655 2.5861(14)
N1 C1 3_675 1.460(6)
N1 C1 2_765 1.460(6)
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_4
_geom_torsion
N1 C1 C2 O1 . -15.2(8)
N1 C1 C2 O2 . 165.8(5)
C8 C3 C4 C5 . 0.7(7)
P1 C3 C4 C5 . -178.0(4)
C3 C4 C5 C6 . 0.8(7)
C4 C5 C6 C7 . -2.0(8)
C5 C6 C7 C8 . 1.5(8)
C6 C7 C8 C3 . 0.0(8)
C4 C3 C8 C7 . -1.1(7)
P1 C3 C8 C7 . 177.6(4)
C14 C9 C10 C11 . 0.0(7)
P2 C9 C10 C11 . -179.7(3)
C9 C10 C11 C12 . -0.8(7)
C10 C11 C12 C13 . 1.3(7)
C11 C12 C13 C14 . -1.0(8)
C12 C13 C14 C9 . 0.1(7)
C10 C9 C14 C13 . 0.3(7)
P2 C9 C14 C13 . -179.9(4)
C20 C15 C16 C17 . -0.1(7)
P2 C15 C16 C17 . 179.5(3)
C15 C16 C17 C18 . 0.7(7)
C16 C17 C18 C19 . -0.9(7)
C17 C18 C19 C20 . 0.6(8)
C18 C19 C20 C15 . -0.1(7)
C16 C15 C20 C19 . -0.2(7)
P2 C15 C20 C19 . -179.8(4)
C26 C21 C22 C23 . -0.7(6)
P2 C21 C22 C23 . -179.8(3)
C21 C22 C23 C24 . -0.6(7)
C22 C23 C24 C25 . 0.7(7)
C23 C24 C25 C26 . 0.6(7)
C24 C25 C26 C21 . -2.0(7)
C22 C21 C26 C25 . 2.1(6)
P2 C21 C26 C25 . -178.8(4)
C32 C27 C28 C29 . 0.6(7)
P3 C27 C28 C29 . -179.1(4)
C27 C28 C29 C30 . -2.2(7)
C28 C29 C30 C31 . 2.2(7)
C29 C30 C31 C32 . -0.7(8)
C30 C31 C32 C27 . -0.8(7)
C28 C27 C32 C31 . 0.9(7)
P3 C27 C32 C31 . -179.4(4)
C38 C33 C34 C35 . 0.9(8)
P4 C33 C34 C35 . -179.3(4)
C33 C34 C35 C36 . 0.5(9)
C34 C35 C36 C37 . -1.2(9)
C35 C36 C37 C38 . 0.6(8)
C34 C33 C38 C37 . -1.5(7)
P4 C33 C38 C37 . 178.6(4)
C36 C37 C38 C33 . 0.8(8)
C44 C39 C40 C41 . -1.4(13)
P5 C39 C40 C41 . 179.2(7)
C39 C40 C41 C42 . 4.7(14)
C40 C41 C42 C43 . -6.2(14)
C41 C42 C43 C44 . 4.8(13)
C42 C43 C44 C39 . -1.4(11)
C40 C39 C44 C43 . -0.4(11)
P5 C39 C44 C43 . 179.0(5)
C50 C45 C46 C47 . 3.9(11)
P5 C45 C46 C47 . -178.2(6)
C45 C46 C47 C48 . -4.1(12)
C46 C47 C48 C49 . 2.7(13)
C47 C48 C49 C50 . -1.0(12)
C46 C45 C50 C49 . -2.1(10)
P5 C45 C50 C49 . -179.9(5)
C48 C49 C50 C45 . 0.6(11)
C56 C51 C52 C53 . -1.8(11)
P5 C51 C52 C53 . 176.6(7)
C51 C52 C53 C54 . 6.8(12)
C52 C53 C54 C55 . -7.4(12)
C53 C54 C55 C56 . 3.4(12)
C54 C55 C56 C51 . 1.5(10)
C52 C51 C56 C55 . -2.6(9)
P5 C51 C56 C55 . 178.9(5)
O2 C2 O1 Ag1 . 158.1(6)
C1 C2 O1 Ag1 . -20.8(7)
C8 C3 P1 C3 3_675 -88.0(5)
C4 C3 P1 C3 3_675 90.7(3)
C8 C3 P1 C3 2_765 163.2(4)
C4 C3 P1 C3 2_765 -18.1(4)
C8 C3 P1 Ag1 . 37.6(4)
C4 C3 P1 Ag1 . -143.7(3)
C16 C15 P2 C21 . -154.3(4)
C20 C15 P2 C21 . 25.4(4)
C16 C15 P2 C9 . 99.5(4)
C20 C15 P2 C9 . -80.9(4)
C16 C15 P2 Ag2 . -27.3(4)
C20 C15 P2 Ag2 . 152.3(3)
C26 C21 P2 C15 . 67.2(4)
C22 C21 P2 C15 . -113.8(4)
C26 C21 P2 C9 . 173.8(3)
C22 C21 P2 C9 . -7.1(4)
C26 C21 P2 Ag2 . -59.8(4)
C22 C21 P2 Ag2 . 119.3(3)
C10 C9 P2 C15 . 11.9(4)
C14 C9 P2 C15 . -167.9(3)
C10 C9 P2 C21 . -93.6(4)
C14 C9 P2 C21 . 86.6(4)
C10 C9 P2 Ag2 . 139.3(3)
C14 C9 P2 Ag2 . -40.4(4)
C28 C27 P3 C27 3_665 -102.6(3)
C32 C27 P3 C27 3_665 77.7(5)
C28 C27 P3 C27 2_655 4.2(5)
C32 C27 P3 C27 2_655 -175.5(3)
C28 C27 P3 Ag2 . 130.8(4)
C32 C27 P3 Ag2 . -48.9(4)
C38 C33 P4 C33 3_665 101.8(3)
C34 C33 P4 C33 3_665 -78.0(5)
C38 C33 P4 C33 2_655 -4.8(5)
C34 C33 P4 C33 2_655 175.4(4)
C38 C33 P4 Ag3 . -131.5(4)
C34 C33 P4 Ag3 . 48.7(4)
C52 C51 P5 C39 . -72.5(6)
C56 C51 P5 C39 . 105.9(6)
C52 C51 P5 C45 . 179.2(5)
C56 C51 P5 C45 . -2.4(6)
C52 C51 P5 Ag3 . 53.2(6)
C56 C51 P5 Ag3 . -128.4(5)
C40 C39 P5 C51 . 175.4(7)
C44 C39 P5 C51 . -4.0(7)
C40 C39 P5 C45 . -74.4(7)
C44 C39 P5 C45 . 106.2(6)
C40 C39 P5 Ag3 . 49.9(7)
C44 C39 P5 Ag3 . -129.5(5)
C50 C45 P5 C51 . 101.5(6)
C46 C45 P5 C51 . -76.4(6)
C50 C45 P5 C39 . -7.8(6)
C46 C45 P5 C39 . 174.3(5)
C50 C45 P5 Ag3 . -132.4(5)
C46 C45 P5 Ag3 . 49.7(6)
C2 C1 N1 C1 3_675 163.9(5)
C2 C1 N1 C1 2_765 -70.9(8)
C2 C1 N1 Ag1 . 46.5(5)

_cod_database_fobs_code 2241548
