# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2017

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_D:complex2
_database_code_depnum_ccdc_archive 'CCDC 1520933'
_audit_update_record             
;
2016-12-05 deposited with the CCDC.
2017-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C26 H24 Ag N3 O P, N O3'
_chemical_formula_sum            'C26 H24 Ag N4 O4 P'
_chemical_formula_weight         595.33

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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   8.3612(7)
_cell_length_b                   10.4096(9)
_cell_length_c                   14.7569(11)
_cell_angle_alpha                95.769(7)
_cell_angle_beta                 97.078(6)
_cell_angle_gamma                94.544(7)
_cell_volume                     1262.68(18)
_cell_formula_units_Z            2
_cell_measurement_temperature    203(2)
_cell_measurement_reflns_used    8000
_cell_measurement_theta_min      2.20
_cell_measurement_theta_max      28.70

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.566
_exptl_crystal_F_000             604
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.15
_exptl_absorpt_coefficient_mu    0.902
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      203(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS'
_diffrn_measurement_method       'phi oscillation'
_diffrn_detector_area_resol_mean 0.81\%A
_diffrn_reflns_number            21116
_diffrn_reflns_av_unetI/netI     0.0700
_diffrn_reflns_av_R_equivalents  0.0687
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         1.975
_diffrn_reflns_theta_max         29.228
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             6829
_reflns_number_gt                5046
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'EXPOSE (Stoe IPDS Software, 2000)'
_computing_cell_refinement       'CELL (Stoe IPDS Software, 2000)'
_computing_data_reduction        'INTEGRATE (Stoe IPDS Software, 2000)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'ORTEP (Farrugia, 1997)'
_computing_publication_material  'SHELXL-2014/7 (Sheldrick, 2014)'
_refine_special_details          
; 
 Refinement of F² against ALL reflections. The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement. R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0198P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6829
_refine_ls_number_parameters     331
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0465
_refine_ls_R_factor_gt           0.0281
_refine_ls_wR_factor_ref         0.0572
_refine_ls_wR_factor_gt          0.0549
_refine_ls_goodness_of_fit_ref   0.816
_refine_ls_restrained_S_all      0.816
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C -0.2024(3) 0.4664(2) 0.16898(14) 0.0313(5) Uani 1 1 d . . . . .
H1 H -0.2050 0.4327 0.2248 0.038 Uiso 1 1 calc R U . . .
C2 C -0.3158(3) 0.4140(2) 0.09572(15) 0.0324(5) Uani 1 1 d . . . . .
H2 H -0.3935 0.3477 0.1021 0.039 Uiso 1 1 calc R U . . .
C3 C -0.3096(3) 0.4638(2) 0.01261(14) 0.0292(5) Uani 1 1 d . . . . .
H3 H -0.3818 0.4293 -0.0387 0.035 Uiso 1 1 calc R U . . .
C4 C -0.1961(3) 0.5646(2) 0.00613(13) 0.0263(4) Uani 1 1 d . . . . .
H4 H -0.1927 0.6001 -0.0491 0.032 Uiso 1 1 calc R U . . .
C5 C -0.0859(2) 0.61309(19) 0.08339(12) 0.0211(4) Uani 1 1 d . . . . .
C6 C 0.0414(2) 0.71645(19) 0.08162(12) 0.0205(4) Uani 1 1 d . . . . .
C7 C 0.0704(2) 0.80090(19) 0.01651(12) 0.0210(4) Uani 1 1 d . . . . .
C8 C -0.0072(3) 0.8296(2) -0.06980(12) 0.0260(4) Uani 1 1 d . . . . .
H8 H -0.1054 0.7847 -0.0957 0.031 Uiso 1 1 calc R U . . .
C9 C 0.0634(3) 0.9228(2) -0.11382(13) 0.0294(5) Uani 1 1 d . . . . .
H9 H 0.0126 0.9415 -0.1700 0.035 Uiso 1 1 calc R U . . .
C10 C 0.2139(3) 0.9923(2) -0.07535(13) 0.0278(5) Uani 1 1 d . . . . .
H10 H 0.2615 1.0545 -0.1072 0.033 Uiso 1 1 calc R U . . .
C11 C 0.2879(3) 0.9684(2) 0.00711(13) 0.0244(4) Uani 1 1 d . . . . .
H11 H 0.3856 1.0144 0.0327 0.029 Uiso 1 1 calc R U . . .
C12 C 0.2689(2) 0.83367(18) 0.13627(12) 0.0209(4) Uani 1 1 d . . . . .
C13 C 0.4238(2) 0.87994(19) 0.19271(12) 0.0214(4) Uani 1 1 d . . . . .
C14 C 0.5302(3) 0.7893(2) 0.21802(13) 0.0261(4) Uani 1 1 d . . . . .
H14 H 0.5026 0.7019 0.1979 0.031 Uiso 1 1 calc R U . . .
C15 C 0.6765(3) 0.8274(2) 0.27277(14) 0.0298(5) Uani 1 1 d . . . . .
H15 H 0.7468 0.7663 0.2893 0.036 Uiso 1 1 calc R U . . .
C16 C 0.7166(3) 0.9577(2) 0.30250(13) 0.0277(5) Uani 1 1 d . . . . .
H16 H 0.8151 0.9840 0.3388 0.033 Uiso 1 1 calc R U . . .
C17 C 0.6126(3) 1.0492(2) 0.27910(13) 0.0254(4) Uani 1 1 d . . . . .
H17 H 0.6412 1.1363 0.3000 0.031 Uiso 1 1 calc R U . . .
C18 C 0.4647(2) 1.01169(19) 0.22423(12) 0.0223(4) Uani 1 1 d . . . . .
C19 C 0.4127(3) 0.7662(2) 0.46681(16) 0.0375(6) Uani 1 1 d . . . . .
H19A H 0.4453 0.7732 0.5320 0.056 Uiso 1 1 calc R U . . .
H19B H 0.3926 0.8502 0.4489 0.056 Uiso 1 1 calc R U . . .
H19C H 0.4973 0.7330 0.4354 0.056 Uiso 1 1 calc R U . . .
C20 C 0.2841(3) 0.5096(2) 0.48584(14) 0.0303(5) Uani 1 1 d . . . . .
H20A H 0.3372 0.5322 0.5475 0.045 Uiso 1 1 calc R U . . .
H20B H 0.3559 0.4669 0.4494 0.045 Uiso 1 1 calc R U . . .
H20C H 0.1883 0.4525 0.4865 0.045 Uiso 1 1 calc R U . . .
C21 C 0.0903(2) 0.72325(19) 0.51161(12) 0.0228(4) Uani 1 1 d . . . . .
C22 C 0.0896(3) 0.6948(2) 0.60205(13) 0.0309(5) Uani 1 1 d . . . . .
H22 H 0.1641 0.6417 0.6266 0.037 Uiso 1 1 calc R U . . .
C23 C -0.0206(3) 0.7445(2) 0.65558(14) 0.0385(6) Uani 1 1 d . . . . .
H23 H -0.0209 0.7232 0.7153 0.046 Uiso 1 1 calc R U . . .
C24 C -0.1302(3) 0.8256(2) 0.62070(16) 0.0391(6) Uani 1 1 d . . . . .
H24 H -0.2038 0.8594 0.6568 0.047 Uiso 1 1 calc R U . . .
C25 C -0.1295(3) 0.8562(2) 0.53148(16) 0.0369(5) Uani 1 1 d . . . . .
H25 H -0.2022 0.9115 0.5078 0.044 Uiso 1 1 calc R U . . .
C26 C -0.0209(3) 0.8047(2) 0.47750(14) 0.0297(5) Uani 1 1 d . . . . .
H26 H -0.0224 0.8249 0.4174 0.036 Uiso 1 1 calc R U . . .
Ag Ag 0.13249(2) 0.63165(2) 0.27851(2) 0.02651(5) Uani 1 1 d . . . . .
N1 N -0.0890(2) 0.56292(17) 0.16421(11) 0.0246(4) Uani 1 1 d . . . . .
N2 N 0.1660(2) 0.73971(16) 0.15363(10) 0.0218(3) Uani 1 1 d . . . . .
N3 N 0.2159(2) 0.87461(15) 0.05267(10) 0.0204(3) Uani 1 1 d . . . . .
N4 N 0.4232(2) 0.42458(17) 0.26580(11) 0.0269(4) Uani 1 1 d . . . . .
O1 O 0.35744(19) 1.09733(15) 0.19967(10) 0.0291(3) Uani 1 1 d . . . . .
H1O H 0.391(4) 1.165(3) 0.226(2) 0.052(9) Uiso 1 1 d . . . . .
O2 O 0.4870(2) 0.53091(15) 0.30300(11) 0.0416(4) Uani 1 1 d . . . . .
O3 O 0.4960(2) 0.32497(15) 0.27899(13) 0.0421(4) Uani 1 1 d . . . . .
O4 O 0.2888(2) 0.41288(18) 0.21722(11) 0.0438(4) Uani 1 1 d . . . . .
P P 0.22862(6) 0.65619(5) 0.43679(3) 0.02121(11) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
C1 N1 1.338(3) . ?
C1 C2 1.383(3) . ?
C1 H1 0.9300 . ?
C2 C3 1.384(3) . ?
C2 H2 0.9300 . ?
C3 C4 1.377(3) . ?
C3 H3 0.9300 . ?
C4 C5 1.398(2) . ?
C4 H4 0.9300 . ?
C5 N1 1.352(2) . ?
C5 C6 1.457(3) . ?
C6 N2 1.381(2) . ?
C6 C7 1.396(3) . ?
C7 N3 1.401(2) . ?
C7 C8 1.427(2) . ?
C8 C9 1.357(3) . ?
C8 H8 0.9300 . ?
C9 C10 1.424(3) . ?
C9 H9 0.9300 . ?
C10 C11 1.351(3) . ?
C10 H10 0.9300 . ?
C11 N3 1.381(3) . ?
C11 H11 0.9300 . ?
C12 N2 1.317(3) . ?
C12 N3 1.379(2) . ?
C12 C13 1.469(3) . ?
C13 C14 1.394(3) . ?
C13 C18 1.404(3) . ?
C14 C15 1.387(3) . ?
C14 H14 0.9300 . ?
C15 C16 1.384(3) . ?
C15 H15 0.9300 . ?
C16 C17 1.381(3) . ?
C16 H16 0.9300 . ?
C17 C18 1.397(3) . ?
C17 H17 0.9300 . ?
C18 O1 1.357(2) . ?
C19 P 1.824(2) . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 P 1.821(2) . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C21 C26 1.390(3) . ?
C21 C22 1.396(3) . ?
C21 P 1.825(2) . ?
C22 C23 1.383(3) . ?
C22 H22 0.9300 . ?
C23 C24 1.383(4) . ?
C23 H23 0.9300 . ?
C24 C25 1.386(3) . ?
C24 H24 0.9300 . ?
C25 C26 1.385(3) . ?
C25 H25 0.9300 . ?
C26 H26 0.9300 . ?
Ag N2 2.2877(16) . ?
Ag P 2.3562(5) . ?
Ag N1 2.3590(16) . ?
N4 O2 1.234(2) . ?
N4 O4 1.246(2) . ?
N4 O3 1.263(2) . ?
O1 H1O 0.79(3) . ?

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
N1 C1 C2 123.8(2) . . ?
N1 C1 H1 118.1 . . ?
C2 C1 H1 118.1 . . ?
C1 C2 C3 117.7(2) . . ?
C1 C2 H2 121.2 . . ?
C3 C2 H2 121.2 . . ?
C4 C3 C2 119.74(18) . . ?
C4 C3 H3 120.1 . . ?
C2 C3 H3 120.1 . . ?
C3 C4 C5 119.31(19) . . ?
C3 C4 H4 120.3 . . ?
C5 C4 H4 120.3 . . ?
N1 C5 C4 121.20(19) . . ?
N1 C5 C6 115.94(15) . . ?
C4 C5 C6 122.82(17) . . ?
N2 C6 C7 108.50(17) . . ?
N2 C6 C5 119.20(16) . . ?
C7 C6 C5 132.26(16) . . ?
C6 C7 N3 105.19(15) . . ?
C6 C7 C8 137.60(19) . . ?
N3 C7 C8 117.19(18) . . ?
C9 C8 C7 119.53(19) . . ?
C9 C8 H8 120.2 . . ?
C7 C8 H8 120.2 . . ?
C8 C9 C10 121.05(17) . . ?
C8 C9 H9 119.5 . . ?
C10 C9 H9 119.5 . . ?
C11 C10 C9 120.4(2) . . ?
C11 C10 H10 119.8 . . ?
C9 C10 H10 119.8 . . ?
C10 C11 N3 118.86(19) . . ?
C10 C11 H11 120.6 . . ?
N3 C11 H11 120.6 . . ?
N2 C12 N3 109.50(16) . . ?
N2 C12 C13 125.46(16) . . ?
N3 C12 C13 124.82(18) . . ?
C14 C13 C18 119.42(17) . . ?
C14 C13 C12 118.64(18) . . ?
C18 C13 C12 121.90(18) . . ?
C15 C14 C13 121.01(19) . . ?
C15 C14 H14 119.5 . . ?
C13 C14 H14 119.5 . . ?
C16 C15 C14 119.12(19) . . ?
C16 C15 H15 120.4 . . ?
C14 C15 H15 120.4 . . ?
C17 C16 C15 120.96(19) . . ?
C17 C16 H16 119.5 . . ?
C15 C16 H16 119.5 . . ?
C16 C17 C18 120.34(19) . . ?
C16 C17 H17 119.8 . . ?
C18 C17 H17 119.8 . . ?
O1 C18 C17 122.82(18) . . ?
O1 C18 C13 118.04(17) . . ?
C17 C18 C13 119.14(18) . . ?
P C19 H19A 109.5 . . ?
P C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
P C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
P C20 H20A 109.5 . . ?
P C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
P C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C26 C21 C22 118.1(2) . . ?
C26 C21 P 119.17(15) . . ?
C22 C21 P 122.72(17) . . ?
C23 C22 C21 120.9(2) . . ?
C23 C22 H22 119.5 . . ?
C21 C22 H22 119.5 . . ?
C22 C23 C24 120.3(2) . . ?
C22 C23 H23 119.9 . . ?
C24 C23 H23 119.9 . . ?
C23 C24 C25 119.5(2) . . ?
C23 C24 H24 120.2 . . ?
C25 C24 H24 120.2 . . ?
C26 C25 C24 120.1(2) . . ?
C26 C25 H25 119.9 . . ?
C24 C25 H25 119.9 . . ?
C25 C26 C21 121.1(2) . . ?
C25 C26 H26 119.5 . . ?
C21 C26 H26 119.5 . . ?
N2 Ag P 137.66(4) . . ?
N2 Ag N1 72.07(6) . . ?
P Ag N1 146.15(5) . . ?
C1 N1 C5 118.23(16) . . ?
C1 N1 Ag 124.93(13) . . ?
C5 N1 Ag 116.12(13) . . ?
C12 N2 C6 108.78(15) . . ?
C12 N2 Ag 134.97(12) . . ?
C6 N2 Ag 115.66(13) . . ?
C12 N3 C11 129.00(17) . . ?
C12 N3 C7 108.03(16) . . ?
C11 N3 C7 122.96(15) . . ?
O2 N4 O4 121.97(18) . . ?
O2 N4 O3 118.51(18) . . ?
O4 N4 O3 119.51(18) . . ?
C18 O1 H1O 107(2) . . ?
C20 P C19 102.97(11) . . ?
C20 P C21 104.08(10) . . ?
C19 P C21 103.49(10) . . ?
C20 P Ag 116.21(7) . . ?
C19 P Ag 113.21(8) . . ?
C21 P Ag 115.31(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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C1 C2 C3 0.8(4) . . . . ?
C1 C2 C3 C4 -1.9(3) . . . . ?
C2 C3 C4 C5 1.6(3) . . . . ?
C3 C4 C5 N1 -0.1(3) . . . . ?
C3 C4 C5 C6 177.84(19) . . . . ?
N1 C5 C6 N2 12.1(3) . . . . ?
C4 C5 C6 N2 -165.96(19) . . . . ?
N1 C5 C6 C7 -170.7(2) . . . . ?
C4 C5 C6 C7 11.3(3) . . . . ?
N2 C6 C7 N3 -0.1(2) . . . . ?
C5 C6 C7 N3 -177.5(2) . . . . ?
N2 C6 C7 C8 -178.7(2) . . . . ?
C5 C6 C7 C8 3.9(4) . . . . ?
C6 C7 C8 C9 -179.8(2) . . . . ?
N3 C7 C8 C9 1.7(3) . . . . ?
C7 C8 C9 C10 0.1(3) . . . . ?
C8 C9 C10 C11 -1.4(3) . . . . ?
C9 C10 C11 N3 0.7(3) . . . . ?
N2 C12 C13 C14 50.1(3) . . . . ?
N3 C12 C13 C14 -123.9(2) . . . . ?
N2 C12 C13 C18 -127.6(2) . . . . ?
N3 C12 C13 C18 58.4(3) . . . . ?
C18 C13 C14 C15 -0.9(3) . . . . ?
C12 C13 C14 C15 -178.68(19) . . . . ?
C13 C14 C15 C16 0.0(3) . . . . ?
C14 C15 C16 C17 0.6(3) . . . . ?
C15 C16 C17 C18 -0.4(3) . . . . ?
C16 C17 C18 O1 179.55(19) . . . . ?
C16 C17 C18 C13 -0.5(3) . . . . ?
C14 C13 C18 O1 -178.94(18) . . . . ?
C12 C13 C18 O1 -1.2(3) . . . . ?
C14 C13 C18 C17 1.1(3) . . . . ?
C12 C13 C18 C17 178.81(18) . . . . ?
C26 C21 C22 C23 1.1(3) . . . . ?
P C21 C22 C23 -178.00(17) . . . . ?
C21 C22 C23 C24 -1.3(4) . . . . ?
C22 C23 C24 C25 0.4(4) . . . . ?
C23 C24 C25 C26 0.7(4) . . . . ?
C24 C25 C26 C21 -0.9(4) . . . . ?
C22 C21 C26 C25 0.0(3) . . . . ?
P C21 C26 C25 179.09(17) . . . . ?
C2 C1 N1 C5 0.6(3) . . . . ?
C2 C1 N1 Ag -169.20(18) . . . . ?
C4 C5 N1 C1 -1.0(3) . . . . ?
C6 C5 N1 C1 -179.07(19) . . . . ?
C4 C5 N1 Ag 169.72(15) . . . . ?
C6 C5 N1 Ag -8.3(2) . . . . ?
N3 C12 N2 C6 -0.2(2) . . . . ?
C13 C12 N2 C6 -174.99(18) . . . . ?
N3 C12 N2 Ag -170.62(13) . . . . ?
C13 C12 N2 Ag 14.6(3) . . . . ?
C7 C6 N2 C12 0.2(2) . . . . ?
C5 C6 N2 C12 178.02(17) . . . . ?
C7 C6 N2 Ag 172.67(13) . . . . ?
C5 C6 N2 Ag -9.5(2) . . . . ?
N2 C12 N3 C11 -178.44(18) . . . . ?
C13 C12 N3 C11 -3.6(3) . . . . ?
N2 C12 N3 C7 0.2(2) . . . . ?
C13 C12 N3 C7 174.98(18) . . . . ?
C10 C11 N3 C12 179.62(19) . . . . ?
C10 C11 N3 C7 1.2(3) . . . . ?
C6 C7 N3 C12 0.0(2) . . . . ?
C8 C7 N3 C12 178.89(18) . . . . ?
C6 C7 N3 C11 178.66(18) . . . . ?
C8 C7 N3 C11 -2.4(3) . . . . ?
C26 C21 P C20 -156.02(17) . . . . ?
C22 C21 P C20 23.0(2) . . . . ?
C26 C21 P C19 96.64(18) . . . . ?
C22 C21 P C19 -84.30(19) . . . . ?
C26 C21 P Ag -27.53(19) . . . . ?
C22 C21 P Ag 151.53(15) . . . . ?

_refine_diff_density_max         0.534
_refine_diff_density_min         -0.853
_refine_diff_density_rms         0.075

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_complex1
_database_code_depnum_ccdc_archive 'CCDC 1520932'
_audit_update_record             
;
2017-02-21 deposited with the CCDC.
2017-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C36 H28 Ag N3 O P, N O3'
_chemical_formula_sum            'C36 H28 Ag N4 O4 P'
_chemical_formula_weight         719.46

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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   30.9447(16)
_cell_length_b                   9.9074(3)
_cell_length_c                   21.4664(11)
_cell_angle_alpha                90
_cell_angle_beta                 108.445(4)
_cell_angle_gamma                90
_cell_volume                     6243.1(5)
_cell_formula_units_Z            8
_cell_measurement_temperature    203(2)
_cell_measurement_reflns_used    8000
_cell_measurement_theta_min      2.60
_cell_measurement_theta_max      28.85

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.531
_exptl_crystal_F_000             2928
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.17
_exptl_absorpt_coefficient_mu    0.744
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      203(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS'
_diffrn_measurement_method       'phi oscillation'
_diffrn_detector_area_resol_mean 0.81\%A
_diffrn_reflns_number            43681
_diffrn_reflns_av_unetI/netI     0.0355
_diffrn_reflns_av_R_equivalents  0.0514
_diffrn_reflns_limit_h_min       -38
_diffrn_reflns_limit_h_max       38
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         2.000
_diffrn_reflns_theta_max         25.999
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             6130
_reflns_number_gt                4828
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'EXPOSE (Stoe IPDS Software, 2000)'
_computing_cell_refinement       'CELL (Stoe IPDS Software, 2000)'
_computing_data_reduction        'INTEGRATE (Stoe IPDS Software, 2000)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'ORTEP (Farrugia, 1997)'
_computing_publication_material  'SHELXL-2014/7 (Sheldrick, 2014)'
_refine_special_details          
; 
 Refinement of F² against ALL reflections. The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement. R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0298P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6130
_refine_ls_number_parameters     436
_refine_ls_number_restraints     25
_refine_ls_R_factor_all          0.0411
_refine_ls_R_factor_gt           0.0260
_refine_ls_wR_factor_ref         0.0533
_refine_ls_wR_factor_gt          0.0509
_refine_ls_goodness_of_fit_ref   0.928
_refine_ls_restrained_S_all      0.939
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C -0.04421(7) 0.5579(2) 0.10526(11) 0.0340(5) Uani 1 1 d . . . . .
H1 H -0.0361 0.6036 0.1451 0.041 Uiso 1 1 calc R U . . .
C2 C -0.08519(7) 0.5904(3) 0.05874(12) 0.0390(5) Uani 1 1 d . . . . .
H2 H -0.1041 0.6565 0.0669 0.047 Uiso 1 1 calc R U . . .
C3 C -0.09725(7) 0.5218(3) -0.00013(12) 0.0412(6) Uani 1 1 d . . . . .
H3 H -0.1246 0.5408 -0.0326 0.049 Uiso 1 1 calc R U . . .
C4 C -0.06824(7) 0.4245(3) -0.01028(11) 0.0354(5) Uani 1 1 d . . . . .
H4 H -0.0761 0.3774 -0.0498 0.043 Uiso 1 1 calc R U . . .
C5 C -0.02717(6) 0.3968(2) 0.03860(10) 0.0256(4) Uani 1 1 d . . . . .
C6 C 0.00578(6) 0.2958(2) 0.03252(9) 0.0232(4) Uani 1 1 d . . . . .
C7 C 0.00527(6) 0.2076(2) -0.01815(9) 0.0248(4) Uani 1 1 d . . . . .
C8 C -0.02448(7) 0.1733(2) -0.08178(10) 0.0316(5) Uani 1 1 d . . . . .
H8 H -0.0513 0.2217 -0.1001 0.038 Uiso 1 1 calc R U . . .
C9 C -0.01360(8) 0.0703(3) -0.11537(10) 0.0365(5) Uani 1 1 d . . . . .
H9 H -0.0332 0.0479 -0.1567 0.044 Uiso 1 1 calc R U . . .
C10 C 0.02724(8) -0.0041(2) -0.08865(10) 0.0347(5) Uani 1 1 d . . . . .
H10 H 0.0339 -0.0756 -0.1122 0.042 Uiso 1 1 calc R U . . .
C11 C 0.05655(7) 0.0283(2) -0.02920(10) 0.0298(5) Uani 1 1 d . . . . .
H11 H 0.0834 -0.0203 -0.0117 0.036 Uiso 1 1 calc R U . . .
C12 C 0.06945(6) 0.1811(2) 0.06738(9) 0.0235(4) Uani 1 1 d . . . . .
C13 C 0.11373(7) 0.1312(2) 0.10890(10) 0.0260(4) Uani 1 1 d . . . . .
C14 C 0.12010(7) 0.1032(2) 0.17528(10) 0.0294(5) Uani 1 1 d . . . . .
H14 H 0.0958 0.1128 0.1916 0.035 Uiso 1 1 calc R U . . .
C15 C 0.16192(8) 0.0614(2) 0.21690(11) 0.0389(6) Uani 1 1 d . . . . .
H15 H 0.1655 0.0422 0.2607 0.047 Uiso 1 1 calc R U . . .
C16 C 0.19833(8) 0.0482(3) 0.19313(12) 0.0429(6) Uani 1 1 d . . . . .
H16 H 0.2264 0.0198 0.2211 0.052 Uiso 1 1 calc R U . . .
C17 C 0.19340(7) 0.0767(3) 0.12841(12) 0.0381(5) Uani 1 1 d . . . . .
H17 H 0.2181 0.0672 0.1129 0.046 Uiso 1 1 calc R U . . .
C18 C 0.15147(7) 0.1198(2) 0.08617(10) 0.0294(5) Uani 1 1 d . . . . .
C19 C 0.16473(7) 0.5322(2) 0.20770(10) 0.0296(5) Uani 1 1 d . . . . .
C20 C 0.18507(7) 0.4198(3) 0.18935(11) 0.0353(5) Uani 1 1 d . . . . .
H20 H 0.1790 0.3341 0.2022 0.042 Uiso 1 1 calc R U . . .
C21 C 0.21419(8) 0.4346(3) 0.15218(12) 0.0416(6) Uani 1 1 d . . . . .
H21 H 0.2277 0.3590 0.1406 0.050 Uiso 1 1 calc R U . . .
C22 C 0.22308(9) 0.5602(3) 0.13239(13) 0.0501(7) Uani 1 1 d . . . . .
H22 H 0.2424 0.5699 0.1072 0.060 Uiso 1 1 calc R U . . .
C23 C 0.20308(10) 0.6725(3) 0.15004(15) 0.0567(8) Uani 1 1 d . . . . .
H23 H 0.2091 0.7578 0.1367 0.068 Uiso 1 1 calc R U . . .
C24 C 0.17411(9) 0.6588(3) 0.18756(13) 0.0450(6) Uani 1 1 d . . . . .
H24 H 0.1609 0.7350 0.1992 0.054 Uiso 1 1 calc R U . . .
C25 C 0.14600(7) 0.4024(2) 0.31972(10) 0.0284(4) Uani 1 1 d . . . . .
C26 C 0.19238(8) 0.3957(3) 0.35256(13) 0.0501(7) Uani 1 1 d . . . . .
H26 H 0.2129 0.4379 0.3353 0.060 Uiso 1 1 calc R U . . .
C27 C 0.20792(10) 0.3255(4) 0.41143(14) 0.0671(9) Uani 1 1 d . . . . .
H27 H 0.2390 0.3207 0.4335 0.081 Uiso 1 1 calc R U . . .
C28 C 0.17779(10) 0.2629(3) 0.43750(13) 0.0557(7) Uani 1 1 d . . . . .
H28 H 0.1885 0.2174 0.4773 0.067 Uiso 1 1 calc R U . . .
C29 C 0.13211(9) 0.2682(3) 0.40450(12) 0.0422(6) Uani 1 1 d . . . . .
H29 H 0.1117 0.2253 0.4218 0.051 Uiso 1 1 calc R U . . .
C30 C 0.11610(7) 0.3368(2) 0.34559(11) 0.0334(5) Uani 1 1 d . . . . .
H30 H 0.0850 0.3390 0.3232 0.040 Uiso 1 1 calc R U . . .
C31 C 0.11653(7) 0.6708(2) 0.28290(10) 0.0282(4) Uani 1 1 d . . . . .
C32 C 0.15365(8) 0.7290(3) 0.33078(11) 0.0381(5) Uani 1 1 d . . . . .
H32 H 0.1813 0.6832 0.3452 0.046 Uiso 1 1 calc R U . . .
C33 C 0.14945(10) 0.8538(3) 0.35670(13) 0.0476(7) Uani 1 1 d . . . . .
H33 H 0.1743 0.8921 0.3884 0.057 Uiso 1 1 calc R U . . .
C34 C 0.10867(10) 0.9217(3) 0.33582(13) 0.0515(7) Uani 1 1 d . . . . .
H34 H 0.1061 1.0060 0.3533 0.062 Uiso 1 1 calc R U . . .
C35 C 0.07160(10) 0.8659(3) 0.28924(13) 0.0466(6) Uani 1 1 d . . . . .
H35 H 0.0441 0.9123 0.2756 0.056 Uiso 1 1 calc R U . . .
C36 C 0.07535(8) 0.7401(2) 0.26252(11) 0.0351(5) Uani 1 1 d . . . . .
H36 H 0.0503 0.7024 0.2310 0.042 Uiso 1 1 calc R U . . .
Ag Ag 0.05455(2) 0.41371(2) 0.17335(2) 0.02821(5) Uani 1 1 d . . . . .
N1 N -0.01553(6) 0.46462(18) 0.09626(8) 0.0276(4) Uani 1 1 d . . . . .
N2 N 0.04521(5) 0.27615(17) 0.08393(8) 0.0233(3) Uani 1 1 d . . . . .
N3 N 0.04623(5) 0.13441(17) 0.00521(8) 0.0236(4) Uani 1 1 d . . . . .
N4 N 0.0000 0.2418(3) 0.2500 0.0285(6) Uani 1 2 d S T P . .
O1 O 0.14584(5) 0.15403(18) 0.02271(7) 0.0372(4) Uani 1 1 d . . . . .
H1A H 0.1706 0.1740 0.0189 0.056 Uiso 1 1 calc R U . . .
O2 O 0.02396(6) 0.1823(2) 0.22215(9) 0.0570(5) Uani 1 1 d . . . . .
O3 O 0.0000 0.3679(2) 0.2500 0.0415(6) Uani 1 2 d S T P . .
P P 0.12088(2) 0.50703(6) 0.24702(3) 0.02591(12) Uani 1 1 d . . . . .
N5 N 0.24756(19) 0.2986(6) -0.0040(2) 0.0523(11) Uani 0.5 1 d D U P A -1
O4 O 0.2553(3) 0.1975(9) -0.0263(5) 0.144(3) Uani 0.5 1 d D U P A -1
O5 O 0.27383(13) 0.3907(5) -0.0008(2) 0.0726(12) Uani 0.5 1 d D U P A -1
O6 O 0.21320(19) 0.3101(6) 0.0130(3) 0.105(2) Uani 0.5 1 d D U P A -1


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
C1 N1 1.337(3) . ?
C1 C2 1.381(3) . ?
C1 H1 0.9300 . ?
C2 C3 1.379(4) . ?
C2 H2 0.9300 . ?
C3 C4 1.381(3) . ?
C3 H3 0.9300 . ?
C4 C5 1.395(3) . ?
C4 H4 0.9300 . ?
C5 N1 1.353(3) . ?
C5 C6 1.463(3) . ?
C6 N2 1.376(2) . ?
C6 C7 1.392(3) . ?
C7 N3 1.408(3) . ?
C7 C8 1.426(3) . ?
C8 C9 1.352(3) . ?
C8 H8 0.9300 . ?
C9 C10 1.418(3) . ?
C9 H9 0.9300 . ?
C10 C11 1.350(3) . ?
C10 H10 0.9300 . ?
C11 N3 1.379(3) . ?
C11 H11 0.9300 . ?
C12 N2 1.321(3) . ?
C12 N3 1.380(2) . ?
C12 C13 1.464(3) . ?
C13 C14 1.403(3) . ?
C13 C18 1.405(3) . ?
C14 C15 1.383(3) . ?
C14 H14 0.9300 . ?
C15 C16 1.382(3) . ?
C15 H15 0.9300 . ?
C16 C17 1.378(3) . ?
C16 H16 0.9300 . ?
C17 C18 1.394(3) . ?
C17 H17 0.9300 . ?
C18 O1 1.361(3) . ?
C19 C24 1.387(3) . ?
C19 C20 1.396(3) . ?
C19 P 1.828(2) . ?
C20 C21 1.387(3) . ?
C20 H20 0.9300 . ?
C21 C22 1.371(4) . ?
C21 H21 0.9300 . ?
C22 C23 1.383(4) . ?
C22 H22 0.9300 . ?
C23 C24 1.389(3) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 C30 1.383(3) . ?
C25 C26 1.386(3) . ?
C25 P 1.829(2) . ?
C26 C27 1.388(4) . ?
C26 H26 0.9300 . ?
C27 C28 1.378(4) . ?
C27 H27 0.9300 . ?
C28 C29 1.367(4) . ?
C28 H28 0.9300 . ?
C29 C30 1.382(3) . ?
C29 H29 0.9300 . ?
C30 H30 0.9300 . ?
C31 C36 1.390(3) . ?
C31 C32 1.400(3) . ?
C31 P 1.820(2) . ?
C32 C33 1.379(4) . ?
C32 H32 0.9300 . ?
C33 C34 1.374(4) . ?
C33 H33 0.9300 . ?
C34 C35 1.377(4) . ?
C34 H34 0.9300 . ?
C35 C36 1.393(3) . ?
C35 H35 0.9300 . ?
C36 H36 0.9300 . ?
Ag N2 2.2965(16) . ?
Ag N1 2.3291(17) . ?
Ag P 2.3483(5) . ?
N4 O2 1.239(2) 2 ?
N4 O2 1.239(2) . ?
N4 O3 1.249(3) . ?
O1 H1A 0.8200 . ?
N5 O4 1.168(7) . ?
N5 O5 1.210(7) . ?
N5 O6 1.234(7) . ?

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
N1 C1 C2 123.8(2) . . ?
N1 C1 H1 118.1 . . ?
C2 C1 H1 118.1 . . ?
C3 C2 C1 117.9(2) . . ?
C3 C2 H2 121.0 . . ?
C1 C2 H2 121.0 . . ?
C2 C3 C4 119.2(2) . . ?
C2 C3 H3 120.4 . . ?
C4 C3 H3 120.4 . . ?
C3 C4 C5 120.1(2) . . ?
C3 C4 H4 119.9 . . ?
C5 C4 H4 119.9 . . ?
N1 C5 C4 120.4(2) . . ?
N1 C5 C6 115.44(17) . . ?
C4 C5 C6 124.20(19) . . ?
N2 C6 C7 109.01(17) . . ?
N2 C6 C5 119.45(17) . . ?
C7 C6 C5 131.53(18) . . ?
C6 C7 N3 105.01(16) . . ?
C6 C7 C8 138.0(2) . . ?
N3 C7 C8 117.01(19) . . ?
C9 C8 C7 119.8(2) . . ?
C9 C8 H8 120.1 . . ?
C7 C8 H8 120.1 . . ?
C8 C9 C10 121.14(19) . . ?
C8 C9 H9 119.4 . . ?
C10 C9 H9 119.4 . . ?
C11 C10 C9 120.3(2) . . ?
C11 C10 H10 119.8 . . ?
C9 C10 H10 119.8 . . ?
C10 C11 N3 119.2(2) . . ?
C10 C11 H11 120.4 . . ?
N3 C11 H11 120.4 . . ?
N2 C12 N3 109.46(16) . . ?
N2 C12 C13 125.37(17) . . ?
N3 C12 C13 125.17(18) . . ?
C14 C13 C18 118.13(18) . . ?
C14 C13 C12 119.27(18) . . ?
C18 C13 C12 122.43(18) . . ?
C15 C14 C13 121.2(2) . . ?
C15 C14 H14 119.4 . . ?
C13 C14 H14 119.4 . . ?
C16 C15 C14 119.7(2) . . ?
C16 C15 H15 120.2 . . ?
C14 C15 H15 120.2 . . ?
C17 C16 C15 120.7(2) . . ?
C17 C16 H16 119.7 . . ?
C15 C16 H16 119.7 . . ?
C16 C17 C18 120.1(2) . . ?
C16 C17 H17 119.9 . . ?
C18 C17 H17 119.9 . . ?
O1 C18 C17 121.70(19) . . ?
O1 C18 C13 118.05(18) . . ?
C17 C18 C13 120.2(2) . . ?
C24 C19 C20 118.4(2) . . ?
C24 C19 P 121.78(17) . . ?
C20 C19 P 119.21(17) . . ?
C21 C20 C19 120.7(2) . . ?
C21 C20 H20 119.6 . . ?
C19 C20 H20 119.6 . . ?
C22 C21 C20 120.3(2) . . ?
C22 C21 H21 119.8 . . ?
C20 C21 H21 119.8 . . ?
C21 C22 C23 119.6(2) . . ?
C21 C22 H22 120.2 . . ?
C23 C22 H22 120.2 . . ?
C22 C23 C24 120.5(3) . . ?
C22 C23 H23 119.8 . . ?
C24 C23 H23 119.8 . . ?
C19 C24 C23 120.4(2) . . ?
C19 C24 H24 119.8 . . ?
C23 C24 H24 119.8 . . ?
C30 C25 C26 119.3(2) . . ?
C30 C25 P 116.82(15) . . ?
C26 C25 P 123.59(18) . . ?
C25 C26 C27 119.5(2) . . ?
C25 C26 H26 120.3 . . ?
C27 C26 H26 120.3 . . ?
C28 C27 C26 120.7(2) . . ?
C28 C27 H27 119.6 . . ?
C26 C27 H27 119.6 . . ?
C29 C28 C27 119.6(2) . . ?
C29 C28 H28 120.2 . . ?
C27 C28 H28 120.2 . . ?
C28 C29 C30 120.4(2) . . ?
C28 C29 H29 119.8 . . ?
C30 C29 H29 119.8 . . ?
C29 C30 C25 120.5(2) . . ?
C29 C30 H30 119.8 . . ?
C25 C30 H30 119.8 . . ?
C36 C31 C32 119.0(2) . . ?
C36 C31 P 119.34(16) . . ?
C32 C31 P 121.62(17) . . ?
C33 C32 C31 120.3(2) . . ?
C33 C32 H32 119.8 . . ?
C31 C32 H32 119.8 . . ?
C34 C33 C32 120.1(2) . . ?
C34 C33 H33 120.0 . . ?
C32 C33 H33 120.0 . . ?
C33 C34 C35 120.6(2) . . ?
C33 C34 H34 119.7 . . ?
C35 C34 H34 119.7 . . ?
C34 C35 C36 120.0(2) . . ?
C34 C35 H35 120.0 . . ?
C36 C35 H35 120.0 . . ?
C31 C36 C35 120.0(2) . . ?
C31 C36 H36 120.0 . . ?
C35 C36 H36 120.0 . . ?
N2 Ag N1 72.06(6) . . ?
N2 Ag P 130.44(4) . . ?
N1 Ag P 144.31(5) . . ?
C1 N1 C5 118.60(18) . . ?
C1 N1 Ag 123.95(14) . . ?
C5 N1 Ag 117.44(13) . . ?
C12 N2 C6 108.69(16) . . ?
C12 N2 Ag 135.72(13) . . ?
C6 N2 Ag 115.56(13) . . ?
C11 N3 C12 129.47(18) . . ?
C11 N3 C7 122.47(17) . . ?
C12 N3 C7 107.83(16) . . ?
O2 N4 O2 123.1(3) 2 . ?
O2 N4 O3 118.44(15) 2 . ?
O2 N4 O3 118.44(15) . . ?
C18 O1 H1A 109.5 . . ?
C31 P C19 103.81(10) . . ?
C31 P C25 102.28(10) . . ?
C19 P C25 107.10(10) . . ?
C31 P Ag 118.06(7) . . ?
C19 P Ag 111.17(7) . . ?
C25 P Ag 113.35(7) . . ?
O4 N5 O5 116.7(6) . . ?
O4 N5 O6 120.7(6) . . ?
O5 N5 O6 122.6(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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C1 C2 C3 0.5(3) . . . . ?
C1 C2 C3 C4 -0.1(3) . . . . ?
C2 C3 C4 C5 -0.2(4) . . . . ?
C3 C4 C5 N1 0.2(3) . . . . ?
C3 C4 C5 C6 -180.0(2) . . . . ?
N1 C5 C6 N2 0.1(3) . . . . ?
C4 C5 C6 N2 -179.73(19) . . . . ?
N1 C5 C6 C7 179.3(2) . . . . ?
C4 C5 C6 C7 -0.6(3) . . . . ?
N2 C6 C7 N3 -0.1(2) . . . . ?
C5 C6 C7 N3 -179.31(19) . . . . ?
N2 C6 C7 C8 177.9(2) . . . . ?
C5 C6 C7 C8 -1.3(4) . . . . ?
C6 C7 C8 C9 -174.9(2) . . . . ?
N3 C7 C8 C9 2.9(3) . . . . ?
C7 C8 C9 C10 -0.5(3) . . . . ?
C8 C9 C10 C11 -1.1(3) . . . . ?
C9 C10 C11 N3 0.1(3) . . . . ?
N2 C12 C13 C14 44.7(3) . . . . ?
N3 C12 C13 C14 -134.2(2) . . . . ?
N2 C12 C13 C18 -130.3(2) . . . . ?
N3 C12 C13 C18 50.8(3) . . . . ?
C18 C13 C14 C15 -1.9(3) . . . . ?
C12 C13 C14 C15 -177.2(2) . . . . ?
C13 C14 C15 C16 0.7(3) . . . . ?
C14 C15 C16 C17 0.2(4) . . . . ?
C15 C16 C17 C18 0.2(4) . . . . ?
C16 C17 C18 O1 177.3(2) . . . . ?
C16 C17 C18 C13 -1.6(4) . . . . ?
C14 C13 C18 O1 -176.52(19) . . . . ?
C12 C13 C18 O1 -1.4(3) . . . . ?
C14 C13 C18 C17 2.4(3) . . . . ?
C12 C13 C18 C17 177.5(2) . . . . ?
C24 C19 C20 C21 0.4(3) . . . . ?
P C19 C20 C21 171.87(17) . . . . ?
C19 C20 C21 C22 -0.6(4) . . . . ?
C20 C21 C22 C23 0.4(4) . . . . ?
C21 C22 C23 C24 0.0(4) . . . . ?
C20 C19 C24 C23 0.0(4) . . . . ?
P C19 C24 C23 -171.3(2) . . . . ?
C22 C23 C24 C19 -0.2(4) . . . . ?
C30 C25 C26 C27 -1.2(4) . . . . ?
P C25 C26 C27 172.8(2) . . . . ?
C25 C26 C27 C28 -0.1(5) . . . . ?
C26 C27 C28 C29 1.1(5) . . . . ?
C27 C28 C29 C30 -0.6(4) . . . . ?
C28 C29 C30 C25 -0.8(4) . . . . ?
C26 C25 C30 C29 1.7(3) . . . . ?
P C25 C30 C29 -172.75(18) . . . . ?
C36 C31 C32 C33 -0.7(3) . . . . ?
P C31 C32 C33 179.47(19) . . . . ?
C31 C32 C33 C34 0.3(4) . . . . ?
C32 C33 C34 C35 0.3(4) . . . . ?
C33 C34 C35 C36 -0.5(4) . . . . ?
C32 C31 C36 C35 0.6(3) . . . . ?
P C31 C36 C35 -179.59(17) . . . . ?
C34 C35 C36 C31 0.0(4) . . . . ?
C2 C1 N1 C5 -0.5(3) . . . . ?
C2 C1 N1 Ag 178.18(17) . . . . ?
C4 C5 N1 C1 0.2(3) . . . . ?
C6 C5 N1 C1 -179.68(18) . . . . ?
C4 C5 N1 Ag -178.59(15) . . . . ?
C6 C5 N1 Ag 1.5(2) . . . . ?
N3 C12 N2 C6 -1.0(2) . . . . ?
C13 C12 N2 C6 179.97(18) . . . . ?
N3 C12 N2 Ag -178.75(13) . . . . ?
C13 C12 N2 Ag 2.2(3) . . . . ?
C7 C6 N2 C12 0.7(2) . . . . ?
C5 C6 N2 C12 -179.98(17) . . . . ?
C7 C6 N2 Ag 178.95(12) . . . . ?
C5 C6 N2 Ag -1.7(2) . . . . ?
C10 C11 N3 C12 176.3(2) . . . . ?
C10 C11 N3 C7 2.5(3) . . . . ?
N2 C12 N3 C11 -173.56(18) . . . . ?
C13 C12 N3 C11 5.4(3) . . . . ?
N2 C12 N3 C7 0.9(2) . . . . ?
C13 C12 N3 C7 179.96(18) . . . . ?
C6 C7 N3 C11 174.49(17) . . . . ?
C8 C7 N3 C11 -4.0(3) . . . . ?
C6 C7 N3 C12 -0.5(2) . . . . ?
C8 C7 N3 C12 -178.99(17) . . . . ?
C36 C31 P C19 119.02(18) . . . . ?
C32 C31 P C19 -61.2(2) . . . . ?
C36 C31 P C25 -129.67(18) . . . . ?
C32 C31 P C25 50.2(2) . . . . ?
C36 C31 P Ag -4.5(2) . . . . ?
C32 C31 P Ag 175.31(15) . . . . ?
C24 C19 P C31 -24.8(2) . . . . ?
C20 C19 P C31 164.05(17) . . . . ?
C24 C19 P C25 -132.5(2) . . . . ?
C20 C19 P C25 56.31(19) . . . . ?
C24 C19 P Ag 103.14(19) . . . . ?
C20 C19 P Ag -68.02(18) . . . . ?
C30 C25 P C31 90.30(18) . . . . ?
C26 C25 P C31 -83.9(2) . . . . ?
C30 C25 P C19 -160.88(17) . . . . ?
C26 C25 P C19 24.9(2) . . . . ?
C30 C25 P Ag -37.89(19) . . . . ?
C26 C25 P Ag 147.9(2) . . . . ?

_refine_diff_density_max         0.461
_refine_diff_density_min         -0.329
_refine_diff_density_rms         0.049

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_D:complex5
_database_code_depnum_ccdc_archive 'CCDC 1520934'
_audit_update_record             
;
2016-12-05 deposited with the CCDC.
2017-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C30 H40 Ag N3 O P, N O3'
_chemical_formula_sum            'C30 H40 Ag N4 O4 P'
_chemical_formula_weight         659.50

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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   19.5618(5)
_cell_length_b                   8.2302(11)
_cell_length_c                   20.9709(11)
_cell_angle_alpha                90
_cell_angle_beta                 112.52
_cell_angle_gamma                90
_cell_volume                     3118.9(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    203(2)
_cell_measurement_reflns_used    8000
_cell_measurement_theta_min      2.35
_cell_measurement_theta_max      29.10

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.405
_exptl_crystal_F_000             1368
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.18
_exptl_absorpt_coefficient_mu    0.737
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      203(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS'
_diffrn_measurement_method       'phi oscillation'
_diffrn_detector_area_resol_mean 0.81\%A
_diffrn_reflns_number            44194
_diffrn_reflns_av_unetI/netI     0.0643
_diffrn_reflns_av_R_equivalents  0.1025
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         1.969
_diffrn_reflns_theta_max         29.219
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             8428
_reflns_number_gt                6029
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'EXPOSE (Stoe IPDS Software, 2000)'
_computing_cell_refinement       'CELL (Stoe IPDS Software, 2000)'
_computing_data_reduction        'INTEGRATE (Stoe IPDS Software, 2000)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'ORTEP (Farrugia, 1997)'
_computing_publication_material  'SHELXL-2014/7 (Sheldrick, 2014)'
_refine_special_details          
; 
 Refinement of F² against ALL reflections. The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement. R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0536P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         8428
_refine_ls_number_parameters     365
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0623
_refine_ls_R_factor_gt           0.0408
_refine_ls_wR_factor_ref         0.0977
_refine_ls_wR_factor_gt          0.0922
_refine_ls_goodness_of_fit_ref   0.906
_refine_ls_restrained_S_all      0.906
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.44761(17) 0.1810(4) 0.52858(14) 0.0508(7) Uani 1 1 d . . . . .
H1 H 0.4169 0.1332 0.5479 0.061 Uiso 1 1 calc R U . . .
C2 C 0.52128(18) 0.2013(4) 0.56969(15) 0.0527(7) Uani 1 1 d . . . . .
H2 H 0.5400 0.1683 0.6156 0.063 Uiso 1 1 calc R U . . .
C3 C 0.56664(17) 0.2722(4) 0.54060(15) 0.0536(8) Uani 1 1 d . . . . .
H3 H 0.6168 0.2867 0.5666 0.064 Uiso 1 1 calc R U . . .
C4 C 0.53639(16) 0.3213(4) 0.47226(14) 0.0469(6) Uani 1 1 d . . . . .
H4 H 0.5660 0.3697 0.4520 0.056 Uiso 1 1 calc R U . . .
C5 C 0.46144(14) 0.2978(3) 0.43426(12) 0.0354(5) Uani 1 1 d . . . . .
C6 C 0.42480(13) 0.3460(3) 0.36141(12) 0.0337(5) Uani 1 1 d . . . . .
C7 C 0.45095(13) 0.4251(3) 0.31656(12) 0.0334(5) Uani 1 1 d . . . . .
C8 C 0.51830(14) 0.4946(3) 0.31825(15) 0.0405(6) Uani 1 1 d . . . . .
H8 H 0.5602 0.4928 0.3590 0.049 Uiso 1 1 calc R U . . .
C9 C 0.52160(16) 0.5630(3) 0.26092(15) 0.0451(6) Uani 1 1 d . . . . .
H9 H 0.5658 0.6083 0.2625 0.054 Uiso 1 1 calc R U . . .
C10 C 0.45784(16) 0.5667(3) 0.19780(15) 0.0443(6) Uani 1 1 d . . . . .
H10 H 0.4610 0.6133 0.1586 0.053 Uiso 1 1 calc R U . . .
C11 C 0.39287(15) 0.5028(3) 0.19459(13) 0.0374(5) Uani 1 1 d . . . . .
H11 H 0.3511 0.5070 0.1538 0.045 Uiso 1 1 calc R U . . .
C12 C 0.33074(14) 0.3584(3) 0.26215(12) 0.0323(5) Uani 1 1 d . . . . .
C13 C 0.25558(14) 0.3433(3) 0.20971(12) 0.0349(5) Uani 1 1 d . . . . .
C14 C 0.24219(15) 0.2705(3) 0.14575(13) 0.0382(5) Uani 1 1 d . . . . .
C15 C 0.16962(18) 0.2516(4) 0.09789(14) 0.0513(7) Uani 1 1 d . . . . .
H15 H 0.1607 0.2043 0.0552 0.062 Uiso 1 1 calc R U . . .
C16 C 0.11106(17) 0.3038(4) 0.11441(17) 0.0587(8) Uani 1 1 d . . . . .
H16 H 0.0629 0.2916 0.0824 0.070 Uiso 1 1 calc R U . . .
C17 C 0.12334(16) 0.3737(4) 0.17776(17) 0.0547(7) Uani 1 1 d . . . . .
H17 H 0.0837 0.4081 0.1884 0.066 Uiso 1 1 calc R U . . .
C18 C 0.19545(15) 0.3922(3) 0.22543(14) 0.0421(6) Uani 1 1 d . . . . .
H18 H 0.2038 0.4378 0.2683 0.051 Uiso 1 1 calc R U . . .
C19 C 0.20333(16) -0.0556(4) 0.46932(13) 0.0444(6) Uani 1 1 d . . . . .
H19A H 0.2463 -0.1256 0.4886 0.053 Uiso 1 1 calc R U . . .
H19B H 0.2130 0.0405 0.4982 0.053 Uiso 1 1 calc R U . . .
C20 C 0.1378(2) -0.1439(4) 0.47555(16) 0.0584(8) Uani 1 1 d . . . . .
H20A H 0.0962 -0.0698 0.4634 0.070 Uiso 1 1 calc R U . . .
H20B H 0.1236 -0.2334 0.4430 0.070 Uiso 1 1 calc R U . . .
C21 C 0.1548(2) -0.2093(4) 0.54768(16) 0.0555(8) Uani 1 1 d . . . . .
H21A H 0.1951 -0.2868 0.5589 0.067 Uiso 1 1 calc R U . . .
H21B H 0.1714 -0.1204 0.5804 0.067 Uiso 1 1 calc R U . . .
C22 C 0.0896(3) -0.2910(6) 0.5559(2) 0.0843(13) Uani 1 1 d . . . . .
H22A H 0.0500 -0.2141 0.5465 0.126 Uiso 1 1 calc R U . . .
H22B H 0.1040 -0.3307 0.6022 0.126 Uiso 1 1 calc R U . . .
H22C H 0.0732 -0.3802 0.5241 0.126 Uiso 1 1 calc R U . . .
C23 C 0.10497(16) 0.1006(4) 0.34081(15) 0.0456(6) Uani 1 1 d . . . . .
H23A H 0.0948 0.1102 0.2919 0.055 Uiso 1 1 calc R U . . .
H23B H 0.0682 0.0281 0.3457 0.055 Uiso 1 1 calc R U . . .
C24 C 0.09587(17) 0.2663(4) 0.36787(16) 0.0484(7) Uani 1 1 d . . . . .
H24A H 0.1339 0.3386 0.3652 0.058 Uiso 1 1 calc R U . . .
H24B H 0.1026 0.2568 0.4160 0.058 Uiso 1 1 calc R U . . .
C25 C 0.01971(17) 0.3403(4) 0.32717(16) 0.0502(7) Uani 1 1 d . . . . .
H25A H 0.0127 0.3482 0.2789 0.060 Uiso 1 1 calc R U . . .
H25B H -0.0183 0.2688 0.3304 0.060 Uiso 1 1 calc R U . . .
C26 C 0.0108(2) 0.5062(4) 0.35319(19) 0.0626(8) Uani 1 1 d . . . . .
H26A H 0.0212 0.5005 0.4017 0.094 Uiso 1 1 calc R U . . .
H26B H -0.0390 0.5434 0.3291 0.094 Uiso 1 1 calc R U . . .
H26C H 0.0446 0.5806 0.3453 0.094 Uiso 1 1 calc R U . . .
C27 C 0.18267(17) -0.1812(3) 0.33361(14) 0.0456(6) Uani 1 1 d . . . . .
H27A H 0.2133 -0.2659 0.3630 0.055 Uiso 1 1 calc R U . . .
H27B H 0.1314 -0.2147 0.3192 0.055 Uiso 1 1 calc R U . . .
C28 C 0.20190(15) -0.1634(3) 0.26988(13) 0.0427(6) Uani 1 1 d . . . . .
H28A H 0.1744 -0.2438 0.2359 0.051 Uiso 1 1 calc R U . . .
H28B H 0.1865 -0.0568 0.2498 0.051 Uiso 1 1 calc R U . . .
C29 C 0.28397(16) -0.1845(4) 0.28594(15) 0.0480(6) Uani 1 1 d . . . . .
H29A H 0.3115 -0.1073 0.3215 0.058 Uiso 1 1 calc R U . . .
H29B H 0.2989 -0.2929 0.3041 0.058 Uiso 1 1 calc R U . . .
C30 C 0.3038(2) -0.1601(5) 0.2240(2) 0.0679(9) Uani 1 1 d . . . . .
H30A H 0.2776 -0.2377 0.1890 0.102 Uiso 1 1 calc R U . . .
H30B H 0.3561 -0.1749 0.2372 0.102 Uiso 1 1 calc R U . . .
H30C H 0.2903 -0.0521 0.2063 0.102 Uiso 1 1 calc R U . . .
Ag Ag 0.29351(2) 0.17857(2) 0.38717(2) 0.03655(7) Uani 1 1 d . . . . .
N1 N 0.41775(13) 0.2267(3) 0.46217(11) 0.0406(5) Uani 1 1 d . . . . .
N2 N 0.35131(11) 0.3082(2) 0.32684(10) 0.0334(4) Uani 1 1 d . . . . .
N3 N 0.38961(11) 0.4313(2) 0.25287(10) 0.0307(4) Uani 1 1 d . . . . .
N4 N 0.28203(13) 0.4745(3) 0.48467(12) 0.0424(5) Uani 1 1 d . . . . .
O1 O 0.30192(11) 0.2176(2) 0.13391(9) 0.0460(5) Uani 1 1 d . . . . .
H1A H 0.2895 0.1959 0.0929 0.069 Uiso 1 1 calc R U . . .
O2 O 0.27567(14) 0.4957(3) 0.42383(11) 0.0590(6) Uani 1 1 d . . . . .
O3 O 0.26634(17) 0.3385(3) 0.50176(11) 0.0675(7) Uani 1 1 d . . . . .
O4 O 0.30559(14) 0.5815(3) 0.52958(14) 0.0664(6) Uani 1 1 d . . . . .
P P 0.19641(4) 0.00789(8) 0.38349(3) 0.03642(14) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
C1 N1 1.341(3) . ?
C1 C2 1.377(4) . ?
C1 H1 0.9300 . ?
C2 C3 1.384(5) . ?
C2 H2 0.9300 . ?
C3 C4 1.385(4) . ?
C3 H3 0.9300 . ?
C4 C5 1.388(4) . ?
C4 H4 0.9300 . ?
C5 N1 1.341(4) . ?
C5 C6 1.472(3) . ?
C6 N2 1.375(3) . ?
C6 C7 1.392(4) . ?
C7 N3 1.414(3) . ?
C7 C8 1.424(4) . ?
C8 C9 1.352(4) . ?
C8 H8 0.9300 . ?
C9 C10 1.430(4) . ?
C9 H9 0.9300 . ?
C10 C11 1.353(4) . ?
C10 H10 0.9300 . ?
C11 N3 1.380(3) . ?
C11 H11 0.9300 . ?
C12 N2 1.325(3) . ?
C12 N3 1.377(3) . ?
C12 C13 1.466(3) . ?
C13 C18 1.397(4) . ?
C13 C14 1.399(4) . ?
C14 O1 1.356(3) . ?
C14 C15 1.398(4) . ?
C15 C16 1.386(5) . ?
C15 H15 0.9300 . ?
C16 C17 1.382(5) . ?
C16 H16 0.9300 . ?
C17 C18 1.390(4) . ?
C17 H17 0.9300 . ?
C18 H18 0.9300 . ?
C19 C20 1.522(4) . ?
C19 P 1.829(3) . ?
C19 H19A 0.9700 . ?
C19 H19B 0.9700 . ?
C20 C21 1.518(4) . ?
C20 H20A 0.9700 . ?
C20 H20B 0.9700 . ?
C21 C22 1.510(5) . ?
C21 H21A 0.9700 . ?
C21 H21B 0.9700 . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C23 C24 1.514(4) . ?
C23 P 1.832(3) . ?
C23 H23A 0.9700 . ?
C23 H23B 0.9700 . ?
C24 C25 1.531(4) . ?
C24 H24A 0.9700 . ?
C24 H24B 0.9700 . ?
C25 C26 1.505(5) . ?
C25 H25A 0.9700 . ?
C25 H25B 0.9700 . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C27 C28 1.528(4) . ?
C27 P 1.837(3) . ?
C27 H27A 0.9700 . ?
C27 H27B 0.9700 . ?
C28 C29 1.519(4) . ?
C28 H28A 0.9700 . ?
C28 H28B 0.9700 . ?
C29 C30 1.505(5) . ?
C29 H29A 0.9700 . ?
C29 H29B 0.9700 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
Ag N2 2.261(2) . ?
Ag P 2.3399(7) . ?
Ag N1 2.368(2) . ?
N4 O4 1.242(3) . ?
N4 O2 1.246(3) . ?
N4 O3 1.249(3) . ?
O1 H1A 0.8200 . ?

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
N1 C1 C2 123.5(3) . . ?
N1 C1 H1 118.3 . . ?
C2 C1 H1 118.3 . . ?
C1 C2 C3 118.0(3) . . ?
C1 C2 H2 121.0 . . ?
C3 C2 H2 121.0 . . ?
C2 C3 C4 119.2(3) . . ?
C2 C3 H3 120.4 . . ?
C4 C3 H3 120.4 . . ?
C3 C4 C5 119.5(3) . . ?
C3 C4 H4 120.3 . . ?
C5 C4 H4 120.3 . . ?
N1 C5 C4 121.3(2) . . ?
N1 C5 C6 115.6(2) . . ?
C4 C5 C6 123.1(2) . . ?
N2 C6 C7 109.3(2) . . ?
N2 C6 C5 118.8(2) . . ?
C7 C6 C5 131.9(2) . . ?
C6 C7 N3 104.9(2) . . ?
C6 C7 C8 138.3(2) . . ?
N3 C7 C8 116.8(2) . . ?
C9 C8 C7 120.3(2) . . ?
C9 C8 H8 119.9 . . ?
C7 C8 H8 119.9 . . ?
C8 C9 C10 120.7(2) . . ?
C8 C9 H9 119.7 . . ?
C10 C9 H9 119.7 . . ?
C11 C10 C9 120.5(2) . . ?
C11 C10 H10 119.7 . . ?
C9 C10 H10 119.7 . . ?
C10 C11 N3 118.9(2) . . ?
C10 C11 H11 120.6 . . ?
N3 C11 H11 120.6 . . ?
N2 C12 N3 109.8(2) . . ?
N2 C12 C13 124.5(2) . . ?
N3 C12 C13 125.7(2) . . ?
C18 C13 C14 119.0(2) . . ?
C18 C13 C12 119.5(2) . . ?
C14 C13 C12 121.4(2) . . ?
O1 C14 C15 122.8(3) . . ?
O1 C14 C13 117.1(2) . . ?
C15 C14 C13 120.1(3) . . ?
C16 C15 C14 119.7(3) . . ?
C16 C15 H15 120.2 . . ?
C14 C15 H15 120.2 . . ?
C17 C16 C15 120.9(3) . . ?
C17 C16 H16 119.6 . . ?
C15 C16 H16 119.6 . . ?
C16 C17 C18 119.5(3) . . ?
C16 C17 H17 120.3 . . ?
C18 C17 H17 120.3 . . ?
C17 C18 C13 120.8(3) . . ?
C17 C18 H18 119.6 . . ?
C13 C18 H18 119.6 . . ?
C20 C19 P 118.3(2) . . ?
C20 C19 H19A 107.7 . . ?
P C19 H19A 107.7 . . ?
C20 C19 H19B 107.7 . . ?
P C19 H19B 107.7 . . ?
H19A C19 H19B 107.1 . . ?
C21 C20 C19 112.6(3) . . ?
C21 C20 H20A 109.1 . . ?
C19 C20 H20A 109.1 . . ?
C21 C20 H20B 109.1 . . ?
C19 C20 H20B 109.1 . . ?
H20A C20 H20B 107.8 . . ?
C22 C21 C20 113.5(3) . . ?
C22 C21 H21A 108.9 . . ?
C20 C21 H21A 108.9 . . ?
C22 C21 H21B 108.9 . . ?
C20 C21 H21B 108.9 . . ?
H21A C21 H21B 107.7 . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C24 C23 P 115.2(2) . . ?
C24 C23 H23A 108.5 . . ?
P C23 H23A 108.5 . . ?
C24 C23 H23B 108.5 . . ?
P C23 H23B 108.5 . . ?
H23A C23 H23B 107.5 . . ?
C23 C24 C25 112.2(2) . . ?
C23 C24 H24A 109.2 . . ?
C25 C24 H24A 109.2 . . ?
C23 C24 H24B 109.2 . . ?
C25 C24 H24B 109.2 . . ?
H24A C24 H24B 107.9 . . ?
C26 C25 C24 112.4(3) . . ?
C26 C25 H25A 109.1 . . ?
C24 C25 H25A 109.1 . . ?
C26 C25 H25B 109.1 . . ?
C24 C25 H25B 109.1 . . ?
H25A C25 H25B 107.9 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C28 C27 P 112.69(19) . . ?
C28 C27 H27A 109.1 . . ?
P C27 H27A 109.1 . . ?
C28 C27 H27B 109.1 . . ?
P C27 H27B 109.1 . . ?
H27A C27 H27B 107.8 . . ?
C29 C28 C27 112.9(2) . . ?
C29 C28 H28A 109.0 . . ?
C27 C28 H28A 109.0 . . ?
C29 C28 H28B 109.0 . . ?
C27 C28 H28B 109.0 . . ?
H28A C28 H28B 107.8 . . ?
C30 C29 C28 113.2(3) . . ?
C30 C29 H29A 108.9 . . ?
C28 C29 H29A 108.9 . . ?
C30 C29 H29B 108.9 . . ?
C28 C29 H29B 108.9 . . ?
H29A C29 H29B 107.8 . . ?
C29 C30 H30A 109.5 . . ?
C29 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C29 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
N2 Ag P 146.96(5) . . ?
N2 Ag N1 71.75(7) . . ?
P Ag N1 137.38(6) . . ?
C1 N1 C5 118.6(2) . . ?
C1 N1 Ag 124.80(19) . . ?
C5 N1 Ag 116.52(16) . . ?
C12 N2 C6 108.4(2) . . ?
C12 N2 Ag 134.37(17) . . ?
C6 N2 Ag 117.22(15) . . ?
C12 N3 C11 129.5(2) . . ?
C12 N3 C7 107.69(19) . . ?
C11 N3 C7 122.8(2) . . ?
O4 N4 O2 122.6(3) . . ?
O4 N4 O3 118.6(2) . . ?
O2 N4 O3 118.7(2) . . ?
C14 O1 H1A 109.5 . . ?
C19 P C23 106.88(14) . . ?
C19 P C27 104.94(13) . . ?
C23 P C27 99.92(13) . . ?
C19 P Ag 112.70(9) . . ?
C23 P Ag 113.23(10) . . ?
C27 P Ag 117.86(10) . . ?

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
N1 C1 C2 C3 -0.2(5) . . . . ?
C1 C2 C3 C4 0.8(5) . . . . ?
C2 C3 C4 C5 -0.3(5) . . . . ?
C3 C4 C5 N1 -0.8(4) . . . . ?
C3 C4 C5 C6 -179.9(3) . . . . ?
N1 C5 C6 N2 -3.3(3) . . . . ?
C4 C5 C6 N2 175.9(2) . . . . ?
N1 C5 C6 C7 178.0(2) . . . . ?
C4 C5 C6 C7 -2.9(4) . . . . ?
N2 C6 C7 N3 -0.7(3) . . . . ?
C5 C6 C7 N3 178.1(2) . . . . ?
N2 C6 C7 C8 179.8(3) . . . . ?
C5 C6 C7 C8 -1.3(5) . . . . ?
C6 C7 C8 C9 179.7(3) . . . . ?
N3 C7 C8 C9 0.3(4) . . . . ?
C7 C8 C9 C10 -0.1(4) . . . . ?
C8 C9 C10 C11 0.6(4) . . . . ?
C9 C10 C11 N3 -1.3(4) . . . . ?
N2 C12 C13 C18 48.3(3) . . . . ?
N3 C12 C13 C18 -129.1(3) . . . . ?
N2 C12 C13 C14 -127.2(3) . . . . ?
N3 C12 C13 C14 55.4(3) . . . . ?
C18 C13 C14 O1 -176.9(2) . . . . ?
C12 C13 C14 O1 -1.3(3) . . . . ?
C18 C13 C14 C15 1.7(4) . . . . ?
C12 C13 C14 C15 177.3(2) . . . . ?
O1 C14 C15 C16 177.8(3) . . . . ?
C13 C14 C15 C16 -0.7(4) . . . . ?
C14 C15 C16 C17 -0.3(5) . . . . ?
C15 C16 C17 C18 0.2(5) . . . . ?
C16 C17 C18 C13 0.9(4) . . . . ?
C14 C13 C18 C17 -1.9(4) . . . . ?
C12 C13 C18 C17 -177.5(2) . . . . ?
P C19 C20 C21 172.3(2) . . . . ?
C19 C20 C21 C22 177.5(3) . . . . ?
P C23 C24 C25 176.8(2) . . . . ?
C23 C24 C25 C26 -179.1(3) . . . . ?
P C27 C28 C29 83.8(3) . . . . ?
C27 C28 C29 C30 -177.5(3) . . . . ?
C2 C1 N1 C5 -0.9(5) . . . . ?
C2 C1 N1 Ag 175.6(2) . . . . ?
C4 C5 N1 C1 1.4(4) . . . . ?
C6 C5 N1 C1 -179.5(2) . . . . ?
C4 C5 N1 Ag -175.4(2) . . . . ?
C6 C5 N1 Ag 3.7(3) . . . . ?
N3 C12 N2 C6 -0.6(3) . . . . ?
C13 C12 N2 C6 -178.4(2) . . . . ?
N3 C12 N2 Ag -179.74(16) . . . . ?
C13 C12 N2 Ag 2.5(4) . . . . ?
C7 C6 N2 C12 0.8(3) . . . . ?
C5 C6 N2 C12 -178.2(2) . . . . ?
C7 C6 N2 Ag -179.86(15) . . . . ?
C5 C6 N2 Ag 1.1(3) . . . . ?
N2 C12 N3 C11 -178.8(2) . . . . ?
C13 C12 N3 C11 -1.0(4) . . . . ?
N2 C12 N3 C7 0.2(3) . . . . ?
C13 C12 N3 C7 177.9(2) . . . . ?
C10 C11 N3 C12 -179.7(2) . . . . ?
C10 C11 N3 C7 1.5(4) . . . . ?
C6 C7 N3 C12 0.3(2) . . . . ?
C8 C7 N3 C12 179.9(2) . . . . ?
C6 C7 N3 C11 179.4(2) . . . . ?
C8 C7 N3 C11 -1.0(3) . . . . ?
C20 C19 P C23 45.3(3) . . . . ?
C20 C19 P C27 -60.3(3) . . . . ?
C20 C19 P Ag 170.3(2) . . . . ?
C24 C23 P C19 72.5(2) . . . . ?
C24 C23 P C27 -178.4(2) . . . . ?
C24 C23 P Ag -52.1(2) . . . . ?
C28 C27 P C19 -160.2(2) . . . . ?
C28 C27 P C23 89.2(2) . . . . ?
C28 C27 P Ag -33.8(2) . . . . ?

_refine_diff_density_max         0.803
_refine_diff_density_min         -0.981
_refine_diff_density_rms         0.078

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
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data_D:complex6
_database_code_depnum_ccdc_archive 'CCDC 1520935'
_audit_update_record             
;
2016-12-05 deposited with the CCDC.
2017-03-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C36 H28 Ag N3 O4 P, N O3'
_chemical_formula_sum            'C36 H28 Ag N4 O7 P'
_chemical_formula_weight         767.46

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'
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   9.3609(4)
_cell_length_b                   13.7302(7)
_cell_length_c                   26.0386(10)
_cell_angle_alpha                90
_cell_angle_beta                 100.3550(10)
_cell_angle_gamma                90
_cell_volume                     3292.2(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    203(2)
_cell_measurement_reflns_used    8000
_cell_measurement_theta_min      1.90
_cell_measurement_theta_max      24.85

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.548
_exptl_crystal_F_000             1560
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.17
_exptl_absorpt_coefficient_mu    0.718
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      203(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS'
_diffrn_measurement_method       'phi oscillation'
_diffrn_detector_area_resol_mean 0.81\%A
_diffrn_reflns_number            22822
_diffrn_reflns_av_unetI/netI     0.0270
_diffrn_reflns_av_R_equivalents  0.0343
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         1.590
_diffrn_reflns_theta_max         25.629
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             6211
_reflns_number_gt                5283
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'EXPOSE (Stoe IPDS Software, 2000)'
_computing_cell_refinement       'CELL (Stoe IPDS Software, 2000)'
_computing_data_reduction        'INTEGRATE (Stoe IPDS Software, 2000)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'ORTEP (Farrugia, 1997)'
_computing_publication_material  'SHELXL-2014/7 (Sheldrick, 2014)'
_refine_special_details          
; 
 Refinement of F² against ALL reflections. The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement. R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0360P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6211
_refine_ls_number_parameters     443
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0276
_refine_ls_R_factor_gt           0.0216
_refine_ls_wR_factor_ref         0.0554
_refine_ls_wR_factor_gt          0.0543
_refine_ls_goodness_of_fit_ref   1.004
_refine_ls_restrained_S_all      1.004
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.4699(2) 0.64746(13) 0.00299(7) 0.0324(4) Uani 1 1 d . . . . .
H1 H 0.3798 0.6658 -0.0157 0.039 Uiso 1 1 calc R U . . .
C2 C 0.5689(2) 0.60632(14) -0.02414(8) 0.0372(4) Uani 1 1 d . . . . .
H2 H 0.5462 0.5977 -0.0601 0.045 Uiso 1 1 calc R U . . .
C3 C 0.7017(2) 0.57852(14) 0.00354(8) 0.0370(4) Uani 1 1 d . . . . .
H3 H 0.7703 0.5500 -0.0135 0.044 Uiso 1 1 calc R U . . .
C4 C 0.7323(2) 0.59347(13) 0.05701(8) 0.0314(4) Uani 1 1 d . . . . .
H4 H 0.8217 0.5751 0.0763 0.038 Uiso 1 1 calc R U . . .
C5 C 0.62746(18) 0.63649(11) 0.08175(7) 0.0240(3) Uani 1 1 d . . . . .
C6 C 0.65253(17) 0.66059(11) 0.13750(7) 0.0229(3) Uani 1 1 d . . . . .
C7 C 0.77005(18) 0.64474(12) 0.17751(7) 0.0245(3) Uani 1 1 d . . . . .
C8 C 0.90500(19) 0.59461(14) 0.18414(8) 0.0339(4) Uani 1 1 d . . . . .
H8 H 0.9341 0.5643 0.1558 0.041 Uiso 1 1 calc R U . . .
C9 C 0.9908(2) 0.59107(16) 0.23163(9) 0.0425(5) Uani 1 1 d . . . . .
H9 H 1.0787 0.5578 0.2359 0.051 Uiso 1 1 calc R U . . .
C10 C 0.9482(2) 0.63771(15) 0.27530(8) 0.0392(5) Uani 1 1 d . . . . .
H10 H 1.0083 0.6342 0.3078 0.047 Uiso 1 1 calc R U . . .
C11 C 0.82192(19) 0.68683(14) 0.27016(7) 0.0314(4) Uani 1 1 d . . . . .
H11 H 0.7946 0.7172 0.2988 0.038 Uiso 1 1 calc R U . . .
C12 C 0.59860(17) 0.73274(11) 0.20660(7) 0.0228(3) Uani 1 1 d . . . . .
C13 C 0.51559(18) 0.78686(12) 0.24037(6) 0.0238(3) Uani 1 1 d . . . . .
C14 C 0.36878(19) 0.76362(12) 0.23829(7) 0.0263(4) Uani 1 1 d . . . . .
H14 H 0.3274 0.7134 0.2167 0.032 Uiso 1 1 calc R U . . .
C15 C 0.2843(2) 0.81418(13) 0.26791(8) 0.0317(4) Uani 1 1 d . . . . .
H15 H 0.1872 0.7978 0.2664 0.038 Uiso 1 1 calc R U . . .
C16 C 0.3463(2) 0.88967(13) 0.29990(7) 0.0330(4) Uani 1 1 d . . . . .
H16 H 0.2904 0.9236 0.3201 0.040 Uiso 1 1 calc R U . . .
C17 C 0.4902(2) 0.91488(13) 0.30206(7) 0.0310(4) Uani 1 1 d . . . . .
H17 H 0.5304 0.9656 0.3236 0.037 Uiso 1 1 calc R U . . .
C18 C 0.57544(19) 0.86458(12) 0.27206(7) 0.0265(4) Uani 1 1 d . . . . .
C19 C 0.23830(17) 1.01318(11) 0.12725(7) 0.0227(3) Uani 1 1 d . . . . .
C20 C 0.2292(2) 1.08761(13) 0.09109(7) 0.0320(4) Uani 1 1 d . . . . .
H20 H 0.1557 1.0886 0.0619 0.038 Uiso 1 1 calc R U . . .
C21 C 0.3330(2) 1.16103(14) 0.09962(8) 0.0391(5) Uani 1 1 d . . . . .
H21 H 0.3289 1.2120 0.0759 0.047 Uiso 1 1 calc R U . . .
C22 C 0.4419(2) 1.15901(13) 0.14300(8) 0.0356(4) Uani 1 1 d . . . . .
H22 H 0.5113 1.2082 0.1483 0.043 Uiso 1 1 calc R U . . .
C23 C 0.4479(2) 1.08377(13) 0.17851(8) 0.0329(4) Uani 1 1 d . . . . .
H23 H 0.5211 1.0827 0.2078 0.039 Uiso 1 1 calc R U . . .
C24 C 0.34541(19) 1.00972(12) 0.17079(7) 0.0281(4) Uani 1 1 d . . . . .
H24 H 0.3492 0.9589 0.1946 0.034 Uiso 1 1 calc R U . . .
C25 C -0.13864(18) 0.84158(11) 0.09606(7) 0.0253(4) Uani 1 1 d . . . . .
C26 C -0.1746(2) 0.88362(13) 0.14031(8) 0.0314(4) Uani 1 1 d . . . . .
H26 H -0.1109 0.8812 0.1721 0.038 Uiso 1 1 calc R U . . .
C27 C -0.3081(2) 0.92936(14) 0.13600(9) 0.0379(5) Uani 1 1 d . . . . .
H27 H -0.3345 0.9580 0.1653 0.045 Uiso 1 1 calc R U . . .
C28 C -0.4023(2) 0.93289(14) 0.08872(9) 0.0378(5) Uani 1 1 d . . . . .
H28 H -0.4914 0.9642 0.0863 0.045 Uiso 1 1 calc R U . . .
C29 C -0.3645(2) 0.88981(13) 0.04479(8) 0.0339(4) Uani 1 1 d . . . . .
H29 H -0.4281 0.8919 0.0130 0.041 Uiso 1 1 calc R U . . .
C30 C -0.23001(19) 0.84321(12) 0.04871(7) 0.0282(4) Uani 1 1 d . . . . .
H30 H -0.2032 0.8139 0.0197 0.034 Uiso 1 1 calc R U . . .
C31 C 0.11213(18) 0.82815(12) -0.01205(7) 0.0246(3) Uani 1 1 d . . . . .
C32 C 0.0606(2) 0.73334(13) -0.01656(7) 0.0299(4) Uani 1 1 d . . . . .
H32 H 0.0191 0.7055 0.0098 0.036 Uiso 1 1 calc R U . . .
C33 C 0.0718(2) 0.68068(14) -0.06109(8) 0.0387(4) Uani 1 1 d . . . . .
H33 H 0.0372 0.6171 -0.0648 0.046 Uiso 1 1 calc R U . . .
C34 C 0.1344(3) 0.72266(18) -0.09999(8) 0.0465(5) Uani 1 1 d . . . . .
H34 H 0.1402 0.6876 -0.1301 0.056 Uiso 1 1 calc R U . . .
C35 C 0.1883(2) 0.81626(17) -0.09433(8) 0.0442(5) Uani 1 1 d . . . . .
H35 H 0.2325 0.8432 -0.1203 0.053 Uiso 1 1 calc R U . . .
C36 C 0.1771(2) 0.87074(14) -0.05018(8) 0.0349(4) Uani 1 1 d . . . . .
H36 H 0.2124 0.9341 -0.0464 0.042 Uiso 1 1 calc R U . . .
Ag Ag 0.33881(2) 0.74139(2) 0.10206(2) 0.02512(5) Uani 1 1 d . . . . .
N1 N 0.49646(16) 0.66240(10) 0.05468(6) 0.0259(3) Uani 1 1 d . . . . .
N2 N 0.54997(14) 0.71396(9) 0.15698(5) 0.0221(3) Uani 1 1 d . . . . .
N3 N 0.73361(15) 0.69134(10) 0.22159(6) 0.0240(3) Uani 1 1 d . . . . .
N4 N 0.17829(16) 0.53592(10) 0.11914(6) 0.0274(3) Uani 1 1 d . . . . .
O1 O 0.71516(13) 0.89006(10) 0.27095(5) 0.0343(3) Uani 1 1 d . . . . .
H1A H 0.7475 0.9221 0.2970 0.051 Uiso 1 1 calc R U . . .
O2 O 0.12889(12) 0.94187(8) 0.12126(5) 0.0267(3) Uani 1 1 d . . . . .
O3 O -0.00500(12) 0.79129(8) 0.10085(5) 0.0252(2) Uani 1 1 d . . . . .
O4 O 0.09526(12) 0.88678(8) 0.03089(5) 0.0253(3) Uani 1 1 d . . . . .
O5 O 0.27891(16) 0.58437(10) 0.14461(7) 0.0505(4) Uani 1 1 d . . . . .
O6 O 0.11237(17) 0.56290(10) 0.07634(5) 0.0453(4) Uani 1 1 d . . . . .
O7 O 0.14157(15) 0.45857(9) 0.13970(6) 0.0421(3) Uani 1 1 d . . . . .
P P 0.13878(4) 0.84300(3) 0.08923(2) 0.02146(9) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
C1 N1 1.340(2) . ?
C1 C2 1.382(3) . ?
C1 H1 0.9300 . ?
C2 C3 1.374(3) . ?
C2 H2 0.9300 . ?
C3 C4 1.385(3) . ?
C3 H3 0.9300 . ?
C4 C5 1.398(2) . ?
C4 H4 0.9300 . ?
C5 N1 1.348(2) . ?
C5 C6 1.466(2) . ?
C6 N2 1.375(2) . ?
C6 C7 1.390(2) . ?
C7 N3 1.409(2) . ?
C7 C8 1.422(2) . ?
C8 C9 1.349(3) . ?
C8 H8 0.9300 . ?
C9 C10 1.423(3) . ?
C9 H9 0.9300 . ?
C10 C11 1.346(3) . ?
C10 H10 0.9300 . ?
C11 N3 1.382(2) . ?
C11 H11 0.9300 . ?
C12 N2 1.316(2) . ?
C12 N3 1.377(2) . ?
C12 C13 1.475(2) . ?
C13 C14 1.402(2) . ?
C13 C18 1.403(2) . ?
C14 C15 1.386(2) . ?
C14 H14 0.9300 . ?
C15 C16 1.390(3) . ?
C15 H15 0.9300 . ?
C16 C17 1.382(3) . ?
C16 H16 0.9300 . ?
C17 C18 1.396(2) . ?
C17 H17 0.9300 . ?
C18 O1 1.359(2) . ?
C19 C24 1.373(2) . ?
C19 C20 1.382(2) . ?
C19 O2 1.4052(19) . ?
C20 C21 1.390(3) . ?
C20 H20 0.9300 . ?
C21 C22 1.380(3) . ?
C21 H21 0.9300 . ?
C22 C23 1.381(3) . ?
C22 H22 0.9300 . ?
C23 C24 1.387(3) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 C30 1.369(3) . ?
C25 C26 1.384(2) . ?
C25 O3 1.415(2) . ?
C26 C27 1.384(3) . ?
C26 H26 0.9300 . ?
C27 C28 1.380(3) . ?
C27 H27 0.9300 . ?
C28 C29 1.389(3) . ?
C28 H28 0.9300 . ?
C29 C30 1.399(3) . ?
C29 H29 0.9300 . ?
C30 H30 0.9300 . ?
C31 C36 1.384(2) . ?
C31 C32 1.386(2) . ?
C31 O4 1.409(2) . ?
C32 C33 1.386(3) . ?
C32 H32 0.9300 . ?
C33 C34 1.384(3) . ?
C33 H33 0.9300 . ?
C34 C35 1.379(3) . ?
C34 H34 0.9300 . ?
C35 C36 1.391(3) . ?
C35 H35 0.9300 . ?
C36 H36 0.9300 . ?
Ag N2 2.2534(14) . ?
Ag P 2.3107(4) . ?
Ag N1 2.3517(14) . ?
Ag O5 2.5324(14) . ?
N4 O6 1.230(2) . ?
N4 O5 1.243(2) . ?
N4 O7 1.2644(19) . ?
O1 H1A 0.8200 . ?
O2 P 1.6046(11) . ?
O3 P 1.5980(11) . ?
O4 P 1.6162(12) . ?

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
N1 C1 C2 123.76(18) . . ?
N1 C1 H1 118.1 . . ?
C2 C1 H1 118.1 . . ?
C3 C2 C1 118.13(18) . . ?
C3 C2 H2 120.9 . . ?
C1 C2 H2 120.9 . . ?
C2 C3 C4 119.36(17) . . ?
C2 C3 H3 120.3 . . ?
C4 C3 H3 120.3 . . ?
C3 C4 C5 119.33(18) . . ?
C3 C4 H4 120.3 . . ?
C5 C4 H4 120.3 . . ?
N1 C5 C4 121.25(16) . . ?
N1 C5 C6 115.27(14) . . ?
C4 C5 C6 123.43(16) . . ?
N2 C6 C7 108.55(14) . . ?
N2 C6 C5 119.17(15) . . ?
C7 C6 C5 132.16(15) . . ?
C6 C7 N3 105.35(14) . . ?
C6 C7 C8 137.17(17) . . ?
N3 C7 C8 117.45(16) . . ?
C9 C8 C7 119.88(18) . . ?
C9 C8 H8 120.1 . . ?
C7 C8 H8 120.1 . . ?
C8 C9 C10 120.69(18) . . ?
C8 C9 H9 119.7 . . ?
C10 C9 H9 119.7 . . ?
C11 C10 C9 120.86(19) . . ?
C11 C10 H10 119.6 . . ?
C9 C10 H10 119.6 . . ?
C10 C11 N3 118.90(18) . . ?
C10 C11 H11 120.6 . . ?
N3 C11 H11 120.6 . . ?
N2 C12 N3 109.59(14) . . ?
N2 C12 C13 123.90(15) . . ?
N3 C12 C13 126.47(15) . . ?
C14 C13 C18 118.74(15) . . ?
C14 C13 C12 118.69(15) . . ?
C18 C13 C12 122.46(15) . . ?
C15 C14 C13 121.19(17) . . ?
C15 C14 H14 119.4 . . ?
C13 C14 H14 119.4 . . ?
C14 C15 C16 119.23(16) . . ?
C14 C15 H15 120.4 . . ?
C16 C15 H15 120.4 . . ?
C17 C16 C15 120.69(16) . . ?
C17 C16 H16 119.7 . . ?
C15 C16 H16 119.7 . . ?
C16 C17 C18 120.29(17) . . ?
C16 C17 H17 119.9 . . ?
C18 C17 H17 119.9 . . ?
O1 C18 C17 122.26(16) . . ?
O1 C18 C13 117.86(15) . . ?
C17 C18 C13 119.84(16) . . ?
C24 C19 C20 122.33(16) . . ?
C24 C19 O2 118.50(15) . . ?
C20 C19 O2 119.03(15) . . ?
C19 C20 C21 118.16(17) . . ?
C19 C20 H20 120.9 . . ?
C21 C20 H20 120.9 . . ?
C22 C21 C20 120.60(17) . . ?
C22 C21 H21 119.7 . . ?
C20 C21 H21 119.7 . . ?
C21 C22 C23 119.86(17) . . ?
C21 C22 H22 120.1 . . ?
C23 C22 H22 120.1 . . ?
C22 C23 C24 120.52(18) . . ?
C22 C23 H23 119.7 . . ?
C24 C23 H23 119.7 . . ?
C19 C24 C23 118.53(17) . . ?
C19 C24 H24 120.7 . . ?
C23 C24 H24 120.7 . . ?
C30 C25 C26 122.49(16) . . ?
C30 C25 O3 119.15(15) . . ?
C26 C25 O3 118.30(16) . . ?
C25 C26 C27 118.23(19) . . ?
C25 C26 H26 120.9 . . ?
C27 C26 H26 120.9 . . ?
C28 C27 C26 120.73(18) . . ?
C28 C27 H27 119.6 . . ?
C26 C27 H27 119.6 . . ?
C27 C28 C29 120.19(18) . . ?
C27 C28 H28 119.9 . . ?
C29 C28 H28 119.9 . . ?
C28 C29 C30 119.59(19) . . ?
C28 C29 H29 120.2 . . ?
C30 C29 H29 120.2 . . ?
C25 C30 C29 118.78(17) . . ?
C25 C30 H30 120.6 . . ?
C29 C30 H30 120.6 . . ?
C36 C31 C32 121.83(16) . . ?
C36 C31 O4 117.01(15) . . ?
C32 C31 O4 121.11(15) . . ?
C31 C32 C33 118.89(17) . . ?
C31 C32 H32 120.6 . . ?
C33 C32 H32 120.6 . . ?
C34 C33 C32 120.04(18) . . ?
C34 C33 H33 120.0 . . ?
C32 C33 H33 120.0 . . ?
C35 C34 C33 120.33(19) . . ?
C35 C34 H34 119.8 . . ?
C33 C34 H34 119.8 . . ?
C34 C35 C36 120.61(19) . . ?
C34 C35 H35 119.7 . . ?
C36 C35 H35 119.7 . . ?
C31 C36 C35 118.28(18) . . ?
C31 C36 H36 120.9 . . ?
C35 C36 H36 120.9 . . ?
N2 Ag P 142.03(4) . . ?
N2 Ag N1 72.20(5) . . ?
P Ag N1 140.46(4) . . ?
N2 Ag O5 79.52(5) . . ?
P Ag O5 109.87(4) . . ?
N1 Ag O5 92.64(5) . . ?
C1 N1 C5 118.15(15) . . ?
C1 N1 Ag 125.25(12) . . ?
C5 N1 Ag 116.43(11) . . ?
C12 N2 C6 108.99(14) . . ?
C12 N2 Ag 134.39(11) . . ?
C6 N2 Ag 116.48(11) . . ?
C12 N3 C11 130.19(15) . . ?
C12 N3 C7 107.52(14) . . ?
C11 N3 C7 122.18(14) . . ?
O6 N4 O5 122.06(15) . . ?
O6 N4 O7 120.43(15) . . ?
O5 N4 O7 117.46(15) . . ?
C18 O1 H1A 109.5 . . ?
C19 O2 P 122.56(10) . . ?
C25 O3 P 121.86(10) . . ?
C31 O4 P 119.20(10) . . ?
N4 O5 Ag 115.36(11) . . ?
O3 P O2 98.52(6) . . ?
O3 P O4 105.35(6) . . ?
O2 P O4 98.37(6) . . ?
O3 P Ag 113.11(4) . . ?
O2 P Ag 123.82(5) . . ?
O4 P Ag 114.92(4) . . ?

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
N1 C1 C2 C3 0.5(3) . . . . ?
C1 C2 C3 C4 -0.7(3) . . . . ?
C2 C3 C4 C5 0.0(3) . . . . ?
C3 C4 C5 N1 1.0(3) . . . . ?
C3 C4 C5 C6 -176.26(16) . . . . ?
N1 C5 C6 N2 -5.7(2) . . . . ?
C4 C5 C6 N2 171.71(15) . . . . ?
N1 C5 C6 C7 178.88(16) . . . . ?
C4 C5 C6 C7 -3.7(3) . . . . ?
N2 C6 C7 N3 -0.31(17) . . . . ?
C5 C6 C7 N3 175.50(15) . . . . ?
N2 C6 C7 C8 177.69(19) . . . . ?
C5 C6 C7 C8 -6.5(3) . . . . ?
C6 C7 C8 C9 -176.22(19) . . . . ?
N3 C7 C8 C9 1.6(3) . . . . ?
C7 C8 C9 C10 -0.5(3) . . . . ?
C8 C9 C10 C11 -0.4(3) . . . . ?
C9 C10 C11 N3 0.0(3) . . . . ?
N2 C12 C13 C14 45.1(2) . . . . ?
N3 C12 C13 C14 -132.32(17) . . . . ?
N2 C12 C13 C18 -130.90(18) . . . . ?
N3 C12 C13 C18 51.7(2) . . . . ?
C18 C13 C14 C15 -1.8(3) . . . . ?
C12 C13 C14 C15 -177.92(16) . . . . ?
C13 C14 C15 C16 0.5(3) . . . . ?
C14 C15 C16 C17 0.5(3) . . . . ?
C15 C16 C17 C18 -0.1(3) . . . . ?
C16 C17 C18 O1 176.58(17) . . . . ?
C16 C17 C18 C13 -1.3(3) . . . . ?
C14 C13 C18 O1 -175.80(15) . . . . ?
C12 C13 C18 O1 0.2(2) . . . . ?
C14 C13 C18 C17 2.1(2) . . . . ?
C12 C13 C18 C17 178.15(16) . . . . ?
C24 C19 C20 C21 0.0(3) . . . . ?
O2 C19 C20 C21 175.67(15) . . . . ?
C19 C20 C21 C22 0.2(3) . . . . ?
C20 C21 C22 C23 -0.4(3) . . . . ?
C21 C22 C23 C24 0.4(3) . . . . ?
C20 C19 C24 C23 -0.1(3) . . . . ?
O2 C19 C24 C23 -175.71(14) . . . . ?
C22 C23 C24 C19 -0.1(3) . . . . ?
C30 C25 C26 C27 -0.4(3) . . . . ?
O3 C25 C26 C27 -177.39(15) . . . . ?
C25 C26 C27 C28 -0.1(3) . . . . ?
C26 C27 C28 C29 0.4(3) . . . . ?
C27 C28 C29 C30 -0.3(3) . . . . ?
C26 C25 C30 C29 0.5(2) . . . . ?
O3 C25 C30 C29 177.49(14) . . . . ?
C28 C29 C30 C25 -0.2(2) . . . . ?
C36 C31 C32 C33 -1.4(3) . . . . ?
O4 C31 C32 C33 176.05(16) . . . . ?
C31 C32 C33 C34 0.4(3) . . . . ?
C32 C33 C34 C35 1.2(3) . . . . ?
C33 C34 C35 C36 -1.7(3) . . . . ?
C32 C31 C36 C35 0.9(3) . . . . ?
O4 C31 C36 C35 -176.67(17) . . . . ?
C34 C35 C36 C31 0.7(3) . . . . ?
C2 C1 N1 C5 0.5(3) . . . . ?
C2 C1 N1 Ag 175.67(13) . . . . ?
C4 C5 N1 C1 -1.2(2) . . . . ?
C6 C5 N1 C1 176.23(14) . . . . ?
C4 C5 N1 Ag -176.82(12) . . . . ?
C6 C5 N1 Ag 0.63(17) . . . . ?
N3 C12 N2 C6 -0.81(17) . . . . ?
C13 C12 N2 C6 -178.62(14) . . . . ?
N3 C12 N2 Ag 174.53(10) . . . . ?
C13 C12 N2 Ag -3.3(2) . . . . ?
C7 C6 N2 C12 0.70(17) . . . . ?
C5 C6 N2 C12 -175.75(14) . . . . ?
C7 C6 N2 Ag -175.58(10) . . . . ?
C5 C6 N2 Ag 7.97(17) . . . . ?
N2 C12 N3 C11 -175.64(16) . . . . ?
C13 C12 N3 C11 2.1(3) . . . . ?
N2 C12 N3 C7 0.61(17) . . . . ?
C13 C12 N3 C7 178.34(15) . . . . ?
C10 C11 N3 C12 176.98(17) . . . . ?
C10 C11 N3 C7 1.2(2) . . . . ?
C6 C7 N3 C12 -0.16(16) . . . . ?
C8 C7 N3 C12 -178.63(14) . . . . ?
C6 C7 N3 C11 176.45(14) . . . . ?
C8 C7 N3 C11 -2.0(2) . . . . ?
C24 C19 O2 P -93.21(17) . . . . ?
C20 C19 O2 P 90.98(17) . . . . ?
C30 C25 O3 P 88.16(17) . . . . ?
C26 C25 O3 P -94.73(16) . . . . ?
C36 C31 O4 P -134.07(14) . . . . ?
C32 C31 O4 P 48.4(2) . . . . ?
O6 N4 O5 Ag -0.3(2) . . . . ?
O7 N4 O5 Ag -177.71(12) . . . . ?
C25 O3 P O2 46.52(14) . . . . ?
C25 O3 P O4 -54.65(14) . . . . ?
C25 O3 P Ag 179.03(11) . . . . ?
C19 O2 P O3 175.29(13) . . . . ?
C19 O2 P O4 -77.70(13) . . . . ?
C19 O2 P Ag 49.97(14) . . . . ?
C31 O4 P O3 -89.03(12) . . . . ?
C31 O4 P O2 169.69(11) . . . . ?
C31 O4 P Ag 36.17(12) . . . . ?

_refine_diff_density_max         0.355
_refine_diff_density_min         -0.452
_refine_diff_density_rms         0.049

