#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:22:40 +0100 (Fri 25 de Mar de 2016) $
#$Revision: 179813 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/09/7010978.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_7010978
loop_
_publ_author_name
'José A. Montes'
'Susana Rodríguez'
'Damián Fernández'
'M. Inés García-Seijo'
'Robert O. Gould'
'M. Esther García-Fernández'
_publ_section_title
;
 Comparative structural studies on silver(I) complexes with tripodal
 polyphosphines. Crystallographic characterisation of the first
 infinite chain structures in 2 ∶ 1 adducts of silver(I) halides
 with 1,1,1-tris(diphenylphosphinomethyl)ethane
;
_journal_issue                   6
_journal_name_full               'J. Chem. Soc., Dalton Trans.'
_journal_page_first              1110
_journal_page_last               1118
_journal_paper_doi               10.1039/b106021j
_journal_year                    2002
_chemical_formula_sum            'C47 H53 Ag2 Cl2 N2 O2 P3'
_chemical_formula_weight         1057.46
_chemical_name_systematic
;
Ag(tripod)Cl.2DMF
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 105.862(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   18.060(3)
_cell_length_b                   14.866(3)
_cell_length_c                   18.468(4)
_cell_measurement_reflns_used    905
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.08
_cell_measurement_theta_min      1.17
_cell_volume                     4769.5(16)
_computing_cell_refinement       'BRUKER Smart'
_computing_data_collection       'BRUKER Smart'
_computing_data_reduction        'BRUKER Shelxtl'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.938
_diffrn_measured_fraction_theta_max 0.938
_diffrn_measurement_device_type  'CCD area detector'
_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  0.1558
_diffrn_reflns_av_sigmaI/netI    0.3282
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            28519
_diffrn_reflns_theta_full        27.08
_diffrn_reflns_theta_max         27.08
_diffrn_reflns_theta_min         1.17
_exptl_absorpt_coefficient_mu    1.072
_exptl_absorpt_correction_T_max  0.8821
_exptl_absorpt_correction_T_min  0.7983
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   Sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.473
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             2152
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.587
_refine_diff_density_min         -0.686
_refine_diff_density_rms         0.115
_refine_ls_extinction_coef       0.00017(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   0.811
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     479
_refine_ls_number_reflns         9827
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.811
_refine_ls_R_factor_all          0.2436
_refine_ls_R_factor_gt           0.0524
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0291P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0882
_refine_ls_wR_factor_ref         0.1311
_reflns_number_gt                2820
_reflns_number_total             9827
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b106021j.txt
_cod_data_source_block           jose_2
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
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 
;
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7010978
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C13 C 0.1893(6) 0.2185(6) 0.1617(6) 0.040(3) Uani 1 1 d . . .
C30 C 0.1952(6) 0.6483(6) 0.1515(5) 0.043(3) Uani 1 1 d . . .
H30 H 0.2384 0.6626 0.1904 0.052 Uiso 1 1 calc R . .
C40 C 0.3205(5) 0.3258(5) 0.2445(4) 0.036(3) Uani 1 1 d . . .
H40A H 0.3082 0.2895 0.2833 0.044 Uiso 1 1 calc R . .
H40B H 0.3759 0.3225 0.2528 0.044 Uiso 1 1 calc R . .
C16 C 0.0580(8) 0.1279(8) 0.1592(8) 0.078(4) Uani 1 1 d . . .
H16 H 0.0134 0.0961 0.1580 0.094 Uiso 1 1 calc R . .
C38 C 0.2154(5) 0.4386(5) 0.2474(5) 0.034(3) Uani 1 1 d . . .
H38A H 0.1887 0.4141 0.1986 0.041 Uiso 1 1 calc R . .
H38B H 0.2065 0.5030 0.2449 0.041 Uiso 1 1 calc R . .
C15 C 0.1225(8) 0.1128(8) 0.2176(7) 0.073(4) Uani 1 1 d . . .
H15 H 0.1211 0.0733 0.2562 0.088 Uiso 1 1 calc R . .
C41 C 0.3441(5) 0.4449(6) 0.3423(4) 0.041(3) Uani 1 1 d . . .
H41A H 0.3320 0.5050 0.3541 0.062 Uiso 1 1 calc R . .
H41B H 0.3986 0.4396 0.3496 0.062 Uiso 1 1 calc R . .
H41C H 0.3280 0.4032 0.3747 0.062 Uiso 1 1 calc R . .
C37 C 0.3014(5) 0.4235(6) 0.2587(5) 0.030(2) Uani 1 1 d . . .
C29 C 0.1312(7) 0.6951(7) 0.1459(6) 0.053(3) Uani 1 1 d . . .
H29 H 0.1304 0.7410 0.1799 0.063 Uiso 1 1 calc R . .
C14 C 0.1893(6) 0.1572(7) 0.2178(6) 0.055(3) Uani 1 1 d . . .
H14 H 0.2343 0.1461 0.2557 0.066 Uiso 1 1 calc R . .
C19 C 0.3342(6) 0.1689(6) 0.1587(6) 0.038(3) Uani 1 1 d . . .
C18 C 0.1240(6) 0.2349(7) 0.1040(5) 0.050(3) Uani 1 1 d . . .
H18 H 0.1249 0.2765 0.0666 0.060 Uiso 1 1 calc R . .
C2 C 0.1456(6) 0.4553(7) 0.4511(5) 0.064(4) Uani 1 1 d . . .
H2 H 0.1350 0.3951 0.4576 0.077 Uiso 1 1 calc R . .
C6 C 0.1841(6) 0.5686(6) 0.3798(6) 0.049(3) Uani 1 1 d . . .
H6 H 0.1987 0.5881 0.3379 0.059 Uiso 1 1 calc R . .
C1 C 0.1671(5) 0.4814(7) 0.3856(5) 0.041(3) Uani 1 1 d . . .
C39 C 0.3282(5) 0.4938(6) 0.2086(4) 0.035(2) Uani 1 1 d . . .
H39A H 0.3817 0.4801 0.2130 0.042 Uiso 1 1 calc R . .
H39B H 0.3278 0.5515 0.2330 0.042 Uiso 1 1 calc R . .
C20 C 0.3835(6) 0.1339(7) 0.2251(6) 0.058(3) Uani 1 1 d . . .
H20 H 0.3921 0.1654 0.2701 0.070 Uiso 1 1 calc R . .
C24 C 0.3243(6) 0.1181(8) 0.0926(6) 0.071(4) Uani 1 1 d . . .
H24 H 0.2919 0.1406 0.0482 0.085 Uiso 1 1 calc R . .
C10 C -0.0760(7) 0.3817(9) 0.1691(7) 0.067(4) Uani 1 1 d . . .
H10 H -0.1267 0.3782 0.1395 0.081 Uiso 1 1 calc R . .
C26 C 0.1343(6) 0.5589(7) 0.0462(6) 0.052(3) Uani 1 1 d . . .
H26 H 0.1343 0.5131 0.0119 0.063 Uiso 1 1 calc R . .
C9 C -0.0454(7) 0.3098(8) 0.2141(7) 0.070(4) Uani 1 1 d . . .
H9 H -0.0748 0.2582 0.2132 0.083 Uiso 1 1 calc R . .
C27 C 0.0684(7) 0.6069(7) 0.0413(6) 0.067(4) Uani 1 1 d . . .
H27 H 0.0239 0.5926 0.0040 0.081 Uiso 1 1 calc R . .
C5 C 0.1802(7) 0.6315(8) 0.4365(7) 0.074(4) Uani 1 1 d . . .
H5 H 0.1936 0.6912 0.4318 0.089 Uiso 1 1 calc R . .
C3 C 0.1400(7) 0.5172(9) 0.5055(6) 0.083(4) Uani 1 1 d . . .
H3 H 0.1247 0.4991 0.5474 0.099 Uiso 1 1 calc R . .
C17 C 0.0566(7) 0.1882(8) 0.1024(7) 0.075(4) Uani 1 1 d . . .
H17 H 0.0119 0.1975 0.0639 0.091 Uiso 1 1 calc R . .
C11 C -0.0363(8) 0.4558(9) 0.1664(7) 0.075(4) Uani 1 1 d . . .
H11 H -0.0574 0.5032 0.1345 0.090 Uiso 1 1 calc R . .
C12 C 0.0383(7) 0.4600(7) 0.2132(6) 0.051(3) Uani 1 1 d . . .
H12 H 0.0665 0.5123 0.2132 0.061 Uiso 1 1 calc R . .
C7 C 0.0731(6) 0.3890(7) 0.2606(5) 0.039(3) Uani 1 1 d . . .
C32 C 0.4191(6) 0.5637(7) 0.0839(5) 0.053(3) Uani 1 1 d . . .
H32 H 0.4309 0.5029 0.0912 0.063 Uiso 1 1 calc R . .
C28 C 0.0668(7) 0.6751(7) 0.0898(7) 0.066(4) Uani 1 1 d . . .
H28 H 0.0219 0.7080 0.0846 0.079 Uiso 1 1 calc R . .
C33 C 0.4724(7) 0.6221(10) 0.0725(6) 0.086(4) Uani 1 1 d . . .
H33 H 0.5207 0.6003 0.0729 0.103 Uiso 1 1 calc R . .
C21 C 0.4193(6) 0.0519(7) 0.2228(7) 0.065(4) Uani 1 1 d . . .
H21 H 0.4528 0.0286 0.2663 0.078 Uiso 1 1 calc R . .
C22 C 0.4051(8) 0.0037(8) 0.1548(8) 0.084(4) Uani 1 1 d . . .
H22 H 0.4274 -0.0527 0.1546 0.101 Uiso 1 1 calc R . .
C4 C 0.1575(8) 0.6060(9) 0.4963(7) 0.084(5) Uani 1 1 d . . .
H4 H 0.1535 0.6484 0.5321 0.101 Uiso 1 1 calc R . .
C23 C 0.3597(8) 0.0375(8) 0.0898(7) 0.086(5) Uani 1 1 d . . .
H23 H 0.3527 0.0068 0.0446 0.103 Uiso 1 1 calc R . .
C25 C 0.2013(6) 0.5788(6) 0.1025(5) 0.034(3) Uani 1 1 d . . .
C35 C 0.3882(8) 0.7450(8) 0.0576(6) 0.069(4) Uani 1 1 d . . .
H35 H 0.3767 0.8055 0.0478 0.083 Uiso 1 1 calc R . .
C36 C 0.3341(6) 0.6856(7) 0.0700(5) 0.057(3) Uani 1 1 d . . .
H36 H 0.2856 0.7078 0.0683 0.068 Uiso 1 1 calc R . .
C34 C 0.4579(7) 0.7117(10) 0.0604(7) 0.083(5) Uani 1 1 d . . .
H34 H 0.4965 0.7498 0.0541 0.100 Uiso 1 1 calc R . .
N2 N 0.5283(5) 0.2474(6) 0.1632(5) 0.065(3) Uiso 1 1 d . . .
N1 N 0.7196(5) 0.3943(6) 0.1819(5) 0.067(3) Uiso 1 1 d . . .
O1 O 0.7332(5) 0.2456(6) 0.1829(4) 0.096(3) Uiso 1 1 d . . .
O2 O 0.4719(5) 0.3746(6) 0.1766(4) 0.102(3) Uiso 1 1 d . . .
C102 C 0.7126(7) 0.3164(8) 0.1490(7) 0.083(4) Uiso 1 1 d . . .
H102 H 0.6909 0.3140 0.0972 0.100 Uiso 1 1 calc R . .
C101 C 0.7501(7) 0.4068(8) 0.2639(6) 0.097(4) Uiso 1 1 d . . .
H10A H 0.7369 0.3556 0.2895 0.146 Uiso 1 1 calc R . .
H10B H 0.7280 0.4600 0.2790 0.146 Uiso 1 1 calc R . .
H10C H 0.8050 0.4130 0.2767 0.146 Uiso 1 1 calc R . .
C105 C 0.5688(7) 0.2421(8) 0.2435(6) 0.100(4) Uiso 1 1 d . . .
H10D H 0.6229 0.2515 0.2503 0.150 Uiso 1 1 calc R . .
H10E H 0.5607 0.1838 0.2624 0.150 Uiso 1 1 calc R . .
H10F H 0.5493 0.2875 0.2703 0.150 Uiso 1 1 calc R . .
C104 C 0.5366(7) 0.1717(7) 0.1147(6) 0.097(4) Uiso 1 1 d . . .
H10G H 0.4980 0.1761 0.0674 0.146 Uiso 1 1 calc R . .
H10H H 0.5305 0.1161 0.1388 0.146 Uiso 1 1 calc R . .
H10I H 0.5868 0.1736 0.1063 0.146 Uiso 1 1 calc R . .
C100 C 0.6935(7) 0.4729(8) 0.1330(7) 0.116(5) Uiso 1 1 d . . .
H10J H 0.7367 0.5111 0.1342 0.174 Uiso 1 1 calc R . .
H10K H 0.6561 0.5058 0.1507 0.174 Uiso 1 1 calc R . .
H10L H 0.6707 0.4531 0.0824 0.174 Uiso 1 1 calc R . .
C103 C 0.4820(7) 0.3105(8) 0.1350(7) 0.090(4) Uiso 1 1 d . . .
H103 H 0.4555 0.3097 0.0842 0.108 Uiso 1 1 calc R . .
Ag2 Ag 0.26425(5) 0.36775(5) 0.03972(4) 0.0427(2) Uani 1 1 d . . .
Ag1 Ag 0.21370(5) 0.25644(5) 0.38015(4) 0.0505(3) Uani 1 1 d . . .
P3 P 0.28197(15) 0.51365(16) 0.10542(13) 0.0332(7) Uani 1 1 d . . .
P1 P 0.16915(16) 0.39243(17) 0.31684(14) 0.0385(7) Uani 1 1 d . . .
P2 P 0.27558(15) 0.26945(17) 0.15221(14) 0.0369(7) Uani 1 1 d . . .
Cl1 Cl 0.13698(15) 0.35536(17) -0.06977(13) 0.0517(7) Uani 1 1 d . . .
Cl2 Cl 0.33943(15) 0.31113(16) -0.05590(14) 0.0506(8) Uani 1 1 d . . .
C31 C 0.3480(6) 0.5942(7) 0.0848(5) 0.037(3) Uani 1 1 d . . .
C8 C 0.0288(7) 0.3138(7) 0.2606(6) 0.052(3) Uani 1 1 d . . .
H8 H 0.0489 0.2656 0.2919 0.062 Uiso 1 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 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
C18 C13 C14 121.5(10) . . ?
C18 C13 P2 115.8(8) . . ?
C14 C13 P2 122.2(8) . . ?
C29 C30 C25 124.0(10) . . ?
C37 C40 P2 121.2(6) . . ?
C15 C16 C17 122.8(12) . . ?
C37 C38 P1 119.2(6) . . ?
C16 C15 C14 118.6(12) . . ?
C38 C37 C40 112.7(7) . . ?
C38 C37 C41 108.3(7) . . ?
C40 C37 C41 106.8(7) . . ?
C38 C37 C39 106.8(7) . . ?
C40 C37 C39 114.4(7) . . ?
C41 C37 C39 107.6(7) . . ?
C30 C29 C28 119.2(11) . . ?
C15 C14 C13 119.7(11) . . ?
C20 C19 C24 117.3(9) . . ?
C20 C19 P2 125.6(8) . . ?
C24 C19 P2 116.8(8) . . ?
C13 C18 C17 119.0(10) . . ?
C3 C2 C1 121.8(11) . . ?
C1 C6 C5 121.2(10) . . ?
C6 C1 C2 116.9(9) . . ?
C6 C1 P1 126.1(8) . . ?
C2 C1 P1 117.0(8) . . ?
C37 C39 P3 125.7(6) . . ?
C21 C20 C19 119.3(10) . . ?
C23 C24 C19 123.7(11) . . ?
C11 C10 C9 122.6(12) . . ?
C27 C26 C25 120.0(10) . . ?
C10 C9 C8 120.2(11) . . ?
C28 C27 C26 121.4(12) . . ?
C4 C5 C6 120.8(11) . . ?
C4 C3 C2 118.8(11) . . ?
C16 C17 C18 118.3(12) . . ?
C10 C11 C12 117.2(12) . . ?
C11 C12 C7 123.1(11) . . ?
C8 C7 C12 116.7(10) . . ?
C8 C7 P1 120.1(8) . . ?
C12 C7 P1 123.1(8) . . ?
C33 C32 C31 119.9(11) . . ?
C27 C28 C29 119.8(11) . . ?
C32 C33 C34 122.6(12) . . ?
C20 C21 C22 120.2(11) . . ?
C23 C22 C21 121.4(12) . . ?
C5 C4 C3 120.4(12) . . ?
C22 C23 C24 118.0(12) . . ?
C26 C25 C30 115.6(9) . . ?
C26 C25 P3 117.0(7) . . ?
C30 C25 P3 127.4(8) . . ?
C34 C35 C36 117.1(12) . . ?
C35 C36 C31 123.9(11) . . ?
C35 C34 C33 120.2(12) . . ?
C103 N2 C105 123.0(11) . . ?
C103 N2 C104 118.8(10) . . ?
C105 N2 C104 118.0(10) . . ?
C102 N1 C100 116.6(10) . . ?
C102 N1 C101 123.7(10) . . ?
C100 N1 C101 119.8(9) . . ?
O1 C102 N1 123.3(12) . . ?
O2 C103 N2 119.7(12) . . ?
P3 Ag2 P2 97.77(8) . . ?
P3 Ag2 Cl1 114.24(8) . . ?
P2 Ag2 Cl1 117.07(9) . . ?
P3 Ag2 Cl2 126.05(8) . . ?
P2 Ag2 Cl2 115.37(9) . . ?
Cl1 Ag2 Cl2 87.96(8) . . ?
P3 Ag2 Ag1 151.29(6) . 4_565 ?
P2 Ag2 Ag1 110.22(7) . 4_565 ?
Cl1 Ag2 Ag1 47.06(6) . 4_565 ?
Cl2 Ag2 Ag1 46.36(6) . 4_565 ?
P1 Ag1 Cl2 136.80(9) . 4_566 ?
P1 Ag1 Cl1 127.15(9) . 4_566 ?
Cl2 Ag1 Cl1 94.75(9) 4_566 4_566 ?
C25 P3 C31 102.7(5) . . ?
C25 P3 C39 104.7(4) . . ?
C31 P3 C39 100.5(4) . . ?
C25 P3 Ag2 118.8(3) . . ?
C31 P3 Ag2 119.0(3) . . ?
C39 P3 Ag2 108.8(3) . . ?
C7 P1 C1 103.0(4) . . ?
C7 P1 C38 99.3(4) . . ?
C1 P1 C38 108.1(4) . . ?
C7 P1 Ag1 114.5(3) . . ?
C1 P1 Ag1 110.0(3) . . ?
C38 P1 Ag1 120.3(3) . . ?
C13 P2 C19 98.8(4) . . ?
C13 P2 C40 105.9(4) . . ?
C19 P2 C40 102.0(4) . . ?
C13 P2 Ag2 117.0(4) . . ?
C19 P2 Ag2 116.7(3) . . ?
C40 P2 Ag2 114.2(3) . . ?
Ag1 Cl1 Ag2 82.77(8) 4_565 . ?
Ag1 Cl2 Ag2 82.87(8) 4_565 . ?
C32 C31 C36 116.1(9) . . ?
C32 C31 P3 117.4(8) . . ?
C36 C31 P3 126.5(9) . . ?
C7 C8 C9 120.0(11) . . ?
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
C13 C18 1.377(12) . ?
C13 C14 1.380(11) . ?
C13 P2 1.784(10) . ?
C30 C29 1.328(12) . ?
C30 C25 1.397(11) . ?
C40 C37 1.532(10) . ?
C40 P2 1.873(8) . ?
C16 C15 1.373(15) . ?
C16 C17 1.373(14) . ?
C38 C37 1.526(11) . ?
C38 P1 1.843(8) . ?
C15 C14 1.374(14) . ?
C41 C37 1.558(10) . ?
C37 C39 1.558(10) . ?
C29 C28 1.363(13) . ?
C19 C20 1.403(12) . ?
C19 C24 1.406(12) . ?
C19 P2 1.817(9) . ?
C18 C17 1.394(13) . ?
C2 C3 1.385(12) . ?
C2 C1 1.421(11) . ?
C6 C1 1.343(11) . ?
C6 C5 1.420(12) . ?
C1 P1 1.841(9) . ?
C39 P3 1.882(8) . ?
C20 C21 1.387(12) . ?
C24 C23 1.365(13) . ?
C10 C11 1.323(13) . ?
C10 C9 1.374(14) . ?
C26 C27 1.368(12) . ?
C26 C25 1.396(12) . ?
C9 C8 1.382(13) . ?
C27 C28 1.357(12) . ?
C5 C4 1.335(13) . ?
C3 C4 1.379(14) . ?
C11 C12 1.388(14) . ?
C12 C7 1.405(12) . ?
C7 C8 1.374(12) . ?
C7 P1 1.763(10) . ?
C32 C33 1.355(13) . ?
C32 C31 1.366(12) . ?
C33 C34 1.363(15) . ?
C21 C22 1.406(13) . ?
C22 C23 1.353(14) . ?
C25 P3 1.738(9) . ?
C35 C34 1.340(14) . ?
C35 C36 1.382(13) . ?
C36 C31 1.394(11) . ?
N2 C103 1.270(12) . ?
N2 C105 1.465(11) . ?
N2 C104 1.471(11) . ?
N1 C102 1.298(11) . ?
N1 C100 1.473(12) . ?
N1 C101 1.476(12) . ?
O1 C102 1.229(12) . ?
O2 C103 1.267(12) . ?
Ag2 P3 2.463(2) . ?
Ag2 P2 2.502(3) . ?
Ag2 Cl1 2.620(3) . ?
Ag2 Cl2 2.642(3) . ?
Ag2 Ag1 3.3847(12) 4_565 ?
Ag1 P1 2.364(3) . ?
Ag1 Cl2 2.469(3) 4_566 ?
Ag1 Cl1 2.498(3) 4_566 ?
P3 C31 1.803(9) . ?
Cl1 Ag1 2.498(3) 4_565 ?
Cl2 Ag1 2.469(3) 4_565 ?
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
C17 C16 C15 C14 -2.5(19) . . . . ?
P1 C38 C37 C40 71.5(9) . . . . ?
P1 C38 C37 C41 -46.4(9) . . . . ?
P1 C38 C37 C39 -162.1(5) . . . . ?
P2 C40 C37 C38 57.0(9) . . . . ?
P2 C40 C37 C41 175.9(6) . . . . ?
P2 C40 C37 C39 -65.2(10) . . . . ?
C25 C30 C29 C28 0.4(16) . . . . ?
C16 C15 C14 C13 2.8(17) . . . . ?
C18 C13 C14 C15 -1.5(16) . . . . ?
P2 C13 C14 C15 -172.9(8) . . . . ?
C14 C13 C18 C17 -0.2(15) . . . . ?
P2 C13 C18 C17 171.7(8) . . . . ?
C5 C6 C1 C2 -0.4(16) . . . . ?
C5 C6 C1 P1 179.7(8) . . . . ?
C3 C2 C1 C6 1.9(16) . . . . ?
C3 C2 C1 P1 -178.1(9) . . . . ?
C38 C37 C39 P3 -51.6(9) . . . . ?
C40 C37 C39 P3 73.8(10) . . . . ?
C41 C37 C39 P3 -167.8(6) . . . . ?
C24 C19 C20 C21 -0.5(15) . . . . ?
P2 C19 C20 C21 173.9(8) . . . . ?
C20 C19 C24 C23 0.1(17) . . . . ?
P2 C19 C24 C23 -174.8(10) . . . . ?
C11 C10 C9 C8 2.0(19) . . . . ?
C25 C26 C27 C28 1.0(17) . . . . ?
C1 C6 C5 C4 -1.7(18) . . . . ?
C1 C2 C3 C4 -1.5(19) . . . . ?
C15 C16 C17 C18 0.8(19) . . . . ?
C13 C18 C17 C16 0.5(16) . . . . ?
C9 C10 C11 C12 -2.0(19) . . . . ?
C10 C11 C12 C7 1.9(17) . . . . ?
C11 C12 C7 C8 -1.7(15) . . . . ?
C11 C12 C7 P1 177.1(8) . . . . ?
C26 C27 C28 C29 -1.8(17) . . . . ?
C30 C29 C28 C27 1.2(17) . . . . ?
C31 C32 C33 C34 -1.1(19) . . . . ?
C19 C20 C21 C22 -1.2(17) . . . . ?
C20 C21 C22 C23 3(2) . . . . ?
C6 C5 C4 C3 2(2) . . . . ?
C2 C3 C4 C5 -1(2) . . . . ?
C21 C22 C23 C24 -4(2) . . . . ?
C19 C24 C23 C22 2(2) . . . . ?
C27 C26 C25 C30 0.5(14) . . . . ?
C27 C26 C25 P3 179.2(8) . . . . ?
C29 C30 C25 C26 -1.2(14) . . . . ?
C29 C30 C25 P3 -179.7(8) . . . . ?
C34 C35 C36 C31 -0.1(17) . . . . ?
C36 C35 C34 C33 2(2) . . . . ?
C32 C33 C34 C35 -2(2) . . . . ?
C100 N1 C102 O1 178.9(11) . . . . ?
C101 N1 C102 O1 -3(2) . . . . ?
C105 N2 C103 O2 3.2(18) . . . . ?
C104 N2 C103 O2 177.3(10) . . . . ?
C26 C25 P3 C31 115.4(8) . . . . ?
C30 C25 P3 C31 -66.1(9) . . . . ?
C26 C25 P3 C39 -140.0(7) . . . . ?
C30 C25 P3 C39 38.5(9) . . . . ?
C26 C25 P3 Ag2 -18.4(9) . . . . ?
C30 C25 P3 Ag2 160.1(7) . . . . ?
C37 C39 P3 C25 79.0(8) . . . . ?
C37 C39 P3 C31 -174.7(7) . . . . ?
C37 C39 P3 Ag2 -48.9(8) . . . . ?
P2 Ag2 P3 C25 -100.9(3) . . . . ?
Cl1 Ag2 P3 C25 23.5(4) . . . . ?
Cl2 Ag2 P3 C25 129.8(3) . . . . ?
Ag1 Ag2 P3 C25 66.4(4) 4_565 . . . ?
P2 Ag2 P3 C31 132.8(4) . . . . ?
Cl1 Ag2 P3 C31 -102.7(4) . . . . ?
Cl2 Ag2 P3 C31 3.5(4) . . . . ?
Ag1 Ag2 P3 C31 -59.9(4) 4_565 . . . ?
P2 Ag2 P3 C39 18.7(3) . . . . ?
Cl1 Ag2 P3 C39 143.1(3) . . . . ?
Cl2 Ag2 P3 C39 -110.7(3) . . . . ?
Ag1 Ag2 P3 C39 -174.1(3) 4_565 . . . ?
C8 C7 P1 C1 -114.5(8) . . . . ?
C12 C7 P1 C1 66.7(8) . . . . ?
C8 C7 P1 C38 134.3(8) . . . . ?
C12 C7 P1 C38 -44.5(8) . . . . ?
C8 C7 P1 Ag1 4.8(9) . . . . ?
C12 C7 P1 Ag1 -174.0(7) . . . . ?
C6 C1 P1 C7 -94.2(10) . . . . ?
C2 C1 P1 C7 85.9(8) . . . . ?
C6 C1 P1 C38 10.2(11) . . . . ?
C2 C1 P1 C38 -169.7(8) . . . . ?
C6 C1 P1 Ag1 143.4(9) . . . . ?
C2 C1 P1 Ag1 -36.5(9) . . . . ?
C37 C38 P1 C7 -158.0(7) . . . . ?
C37 C38 P1 C1 95.0(7) . . . . ?
C37 C38 P1 Ag1 -32.4(8) . . . . ?
Cl2 Ag1 P1 C7 163.3(3) 4_566 . . . ?
Cl1 Ag1 P1 C7 -33.2(4) 4_566 . . . ?
Cl2 Ag1 P1 C1 -81.3(4) 4_566 . . . ?
Cl1 Ag1 P1 C1 82.2(4) 4_566 . . . ?
Cl2 Ag1 P1 C38 45.2(4) 4_566 . . . ?
Cl1 Ag1 P1 C38 -151.3(3) 4_566 . . . ?
C18 C13 P2 C19 -123.4(8) . . . . ?
C14 C13 P2 C19 48.4(9) . . . . ?
C18 C13 P2 C40 131.3(8) . . . . ?
C14 C13 P2 C40 -56.8(9) . . . . ?
C18 C13 P2 Ag2 2.7(9) . . . . ?
C14 C13 P2 Ag2 174.5(7) . . . . ?
C20 C19 P2 C13 -92.2(9) . . . . ?
C24 C19 P2 C13 82.2(9) . . . . ?
C20 C19 P2 C40 16.2(10) . . . . ?
C24 C19 P2 C40 -169.3(8) . . . . ?
C20 C19 P2 Ag2 141.5(8) . . . . ?
C24 C19 P2 Ag2 -44.1(9) . . . . ?
C37 C40 P2 C13 -90.0(8) . . . . ?
C37 C40 P2 C19 167.1(7) . . . . ?
C37 C40 P2 Ag2 40.3(8) . . . . ?
P3 Ag2 P2 C13 107.4(3) . . . . ?
Cl1 Ag2 P2 C13 -15.0(4) . . . . ?
Cl2 Ag2 P2 C13 -116.4(3) . . . . ?
Ag1 Ag2 P2 C13 -66.2(3) 4_565 . . . ?
P3 Ag2 P2 C19 -136.0(4) . . . . ?
Cl1 Ag2 P2 C19 101.7(4) . . . . ?
Cl2 Ag2 P2 C19 0.3(4) . . . . ?
Ag1 Ag2 P2 C19 50.5(4) 4_565 . . . ?
P3 Ag2 P2 C40 -17.1(3) . . . . ?
Cl1 Ag2 P2 C40 -139.5(3) . . . . ?
Cl2 Ag2 P2 C40 119.1(3) . . . . ?
Ag1 Ag2 P2 C40 169.4(3) 4_565 . . . ?
P3 Ag2 Cl1 Ag1 153.50(8) . . . 4_565 ?
P2 Ag2 Cl1 Ag1 -93.13(9) . . . 4_565 ?
Cl2 Ag2 Cl1 Ag1 24.47(8) . . . 4_565 ?
P3 Ag2 Cl2 Ag1 -143.60(9) . . . 4_565 ?
P2 Ag2 Cl2 Ag1 94.38(10) . . . 4_565 ?
Cl1 Ag2 Cl2 Ag1 -24.77(8) . . . 4_565 ?
C33 C32 C31 C36 2.9(16) . . . . ?
C33 C32 C31 P3 -176.7(8) . . . . ?
C35 C36 C31 C32 -2.4(16) . . . . ?
C35 C36 C31 P3 177.2(8) . . . . ?
C25 P3 C31 C32 179.0(8) . . . . ?
C39 P3 C31 C32 71.2(9) . . . . ?
Ag2 P3 C31 C32 -47.4(9) . . . . ?
C25 P3 C31 C36 -0.5(10) . . . . ?
C39 P3 C31 C36 -108.4(9) . . . . ?
Ag2 P3 C31 C36 133.0(8) . . . . ?
C12 C7 C8 C9 1.6(14) . . . . ?
P1 C7 C8 C9 -177.3(8) . . . . ?
C10 C9 C8 C7 -1.7(16) . . . . ?
