# 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 2014

#\#CIF_1.1
 
#  CIF produced by WinGX routine CIF_UPDATE
#  Created on 2013-02-15 at 16:14:45
#  Using CIFtbx version 2.6.2 16 Jun 1998
 
#  Dictionary name : cif_core.dic
#  Dictionary vers : 2.4
#  Request file    : c:\wingx\files\archive.reqdat
#  CIF files read  : shelxlakaradagno25 struct
 
#------------------ SECTION 1. GLOBAL INFORMATION ---------------------------#
 
data_global
 
#------------------ AUDIT DETAILS -------------------------------------------#
 
_audit_creation_date            2013-02-15
_audit_creation_method          'WinGX routine CIF_UPDATE'
_audit_conform_dict_name        cif_core.dic
_audit_conform_dict_version     2.4
_audit_conform_dict_location    ftp://ftp.iucr.org/pub/cif_core.dic
_audit_update_record            ?
 
#==============================================================================
#
# SUBMISSION DETAILS
 
_publ_contact_author_name            'Sahin, Ertan'
# Name of author for correspondence
 
_publ_contact_author_address
;
Department of Chemistry
Ataturk University 
25240 Erzurum Turkey

;
# Address of author for correspondence
 
_publ_contact_author_email           ertan@atauni.edu.tr
_publ_contact_author_fax             '00(000)0000000'
_publ_contact_author_phone           '90(442)2314380'

 
_publ_contact_letter
;
 Submission dated :2013-02-15
 
Please consider this CIF for submission to the Cambridge Crystallographic
Data Centre. I certify that all authors have seen and approved of this
submission, that all have made significant scientific contributions to the
work reported, and that all share responsibility and accountability for
the results.
 
This CIF  is submitted as a personal communication
 
This CIF is submitted as part of a journal submission
<Insert Journal details here>
 
Sahin, ertan.
;
 
 
#==============================================================================
#
# TITLE AND AUTHOR LIST
 
_publ_section_title
; ?
;
_publ_section_title_footnote
; ?
;
 
# The loop structure below should contain the names and addresses of all
# authors, in the required order of publication. Repeat as necessary.
 
loop_
 _publ_author_name
 _publ_author_footnote
 _publ_author_address
 'Sahin, Ertan'                  #<--'Last name, first name'
; ?
;
;
Department of Chemistry
Ataturk University 
25240 Erzurum Turkey

;
 
#------------------  SECTION 2. COMPOUND(S) DETAILS -------------------------#
 
data_shelxlakaradagno25
 
_audit_creation_date                    2013-02-15T16:14:45-00:00
_audit_creation_method                  'WinGX routine CIF_UPDATE'
 
#----------------------------------------------------------------------------#
#                   CHEMICAL INFORMATION                                     #
#----------------------------------------------------------------------------#
 
_chemical_name_systematic
;
 ?
;
_chemical_formula_moiety                'C16 H24 Ag4 Cd2 N12 O2'
_chemical_formula_sum                   'C16 H24 Ag4 Cd2 N12 O2'
_chemical_formula_weight                1072.75
_chemical_compound_source               'synthesis as described'
 
#----------------------------------------------------------------------------#
#                   UNIT CELL INFORMATION                                    #
#----------------------------------------------------------------------------#
 
_symmetry_cell_setting                  monoclinic
_symmetry_space_group_name_H-M          'P 21/c'
_symmetry_space_group_name_Hall         '-P 2ybc'
_symmetry_Int_Tables_number             14
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'
 
_cell_length_a                          15.7839(2)
_cell_length_b                          12.0002(2)
_cell_length_c                          15.8813(4)
_cell_angle_alpha                       90
_cell_angle_beta                        96.187(10)
_cell_angle_gamma                       90
_cell_volume                            2990.56(11)
_cell_formula_units_Z                   4
_cell_measurement_temperature           293(2)
_cell_measurement_reflns_used           12088
_cell_measurement_theta_min             2.1316
_cell_measurement_theta_max             26.4533
_cell_measurement_wavelength            0.71073
 
#----------------------------------------------------------------------------#
#                   CRYSTAL INFORMATION                                      #
#----------------------------------------------------------------------------#
 
_exptl_crystal_description              prism
_exptl_crystal_colour                   colourless
_exptl_crystal_size_max                 0.3
_exptl_crystal_size_mid                 0.2
_exptl_crystal_size_min                 0.1
_exptl_crystal_density_diffrn           2.383
_exptl_crystal_density_method           'not measured'
_exptl_crystal_F_000                    2016
_exptl_special_details
;
 ?
;
 
#----------------------------------------------------------------------------#
#                   ABSORPTION CORRECTION                                    #
#----------------------------------------------------------------------------#
 
_exptl_absorpt_coefficient_mu           3.999
_exptl_absorpt_correction_type          'Multi-scan'
_exptl_absorpt_correction_T_max         0.670
_exptl_absorpt_correction_T_min         0.398 

#----------------------------------------------------------------------------#
#                   DATA COLLECTION                                          #
#----------------------------------------------------------------------------#
 
_diffrn_ambient_temperature             293(2)
_diffrn_radiation_wavelength            0.71073
_diffrn_radiation_type                  MoK\a
_diffrn_radiation_monochromator         graphite
_diffrn_radiation_probe                 x-ray
_diffrn_reflns_av_R_equivalents         0.052
_diffrn_reflns_av_unetI/netI            0.0352
_diffrn_reflns_number                   61284
_diffrn_reflns_limit_h_min              -19
_diffrn_reflns_limit_h_max              19
_diffrn_reflns_limit_k_min              -14
_diffrn_reflns_limit_k_max              15
_diffrn_reflns_limit_l_min              -18
_diffrn_reflns_limit_l_max              19
_diffrn_reflns_theta_min                2.42
_diffrn_reflns_theta_max                26.52
_diffrn_reflns_theta_full               26.52
_diffrn_measured_fraction_theta_full
                                        0.98
_diffrn_measured_fraction_theta_max
                                        0.98
_reflns_number_total                    6074
_reflns_number_gt                       4916
_reflns_threshold_expression            >2σ(I)
_diffrn_radiation_detector              'RX'
_diffrn_measurement_device
;
RAXIS conversion
;
_diffrn_detector_area_resol_mean        10.0000
_diffrn_measurement_method              'dtprofit.ref'

#----------------------------------------------------------------------------#
#                   COMPUTER PROGRAMS USED                                   #
#----------------------------------------------------------------------------#
 
_computing_structure_solution           'SHELXS-86 (Sheldrick, 1986)'
_computing_structure_refinement         'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics           'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material
                                   'WinGX publication routines (Farrugia, 1999)'
 
#----------------------------------------------------------------------------#
#                   STRUCTURE SOLUTION
#----------------------------------------------------------------------------#
 
_atom_sites_solution_primary            direct
_atom_sites_solution_secondary          difmap
_atom_sites_solution_hydrogens          geom
 
#----------------------------------------------------------------------------#
#                   REFINEMENT INFORMATION                                   #
#----------------------------------------------------------------------------#
 
_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 > 2σ(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
         'calc w=1/[σ²(Fo²)+(0.0664P)²+7.8415P] where P=(Fo²+2Fc²)/3'
_refine_ls_hydrogen_treatment           constr
_refine_ls_extinction_method            SHELXL
_refine_ls_extinction_expression
                                    Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_coef              0.00124(12)
_refine_ls_number_reflns                6074
_refine_ls_number_parameters            327
_refine_ls_number_restraints            1
_refine_ls_R_factor_all                 0.0604
_refine_ls_R_factor_gt                  0.0482
_refine_ls_wR_factor_ref                0.1381
_refine_ls_wR_factor_gt                 0.1271
_refine_ls_goodness_of_fit_ref          1.095
_refine_ls_restrained_S_all             1.105
_refine_ls_shift/su_max                 0.001
_refine_ls_shift/su_mean                0
_refine_diff_density_max                1.044
_refine_diff_density_min                -0.938
_refine_diff_density_rms                0.164
 
#----------------------------------------------------------------------------#
#                   ATOMIC TYPES, COORDINATES AND THERMAL PARAMETERS         #
#----------------------------------------------------------------------------#
 
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 0 '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'
Cd Cd -0.8075 1.2024 '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 0.006 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 
loop_
    _atom_site_label
    _atom_site_type_symbol
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_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
N5 N 0.9240(4) 0.7837(6) 0.0530(4) 0.0604(17) Uani 1 1 d . . .
N6 N 1.0756(4) 0.5836(6) 0.0832(4) 0.0632(17) Uani 1 1 d . . .
C9 C 0.6226(4) 0.4438(6) 0.2844(5) 0.0518(17) Uani 1 1 d . . .
N2 N 1.1109(5) 0.6792(6) 0.2944(5) 0.0692(18) Uani 1 1 d . . .
H2A H 1.0843 0.6229 0.3196 0.083 Uiso 1 1 calc R . .
N1 N 1.1281(5) 0.8373(6) 0.1144(5) 0.071(2) Uani 1 1 d . . .
N4 N 0.9118(4) 0.6111(6) 0.2058(5) 0.0646(18) Uani 1 1 d . . .
N3 N 0.9892(5) 0.8563(6) 0.2556(4) 0.0661(18) Uani 1 1 d . . .
H3A H 1.0147 0.921 0.2445 0.079 Uiso 1 1 calc R . .
H3B H 0.9325 0.8673 0.2495 0.079 Uiso 1 1 calc R . .
O1 O 0.4338(5) 0.6539(5) -0.6243(4) 0.088(2) Uani 1 1 d . . .
C1 C 0.8484(5) 0.5817(7) 0.2219(5) 0.0554(18) Uani 1 1 d . . .
C14 C 0.4245(5) 0.8232(7) -0.5464(5) 0.0577(18) Uani 1 1 d . . .
H14A H 0.3703 0.841 -0.5784 0.069 Uiso 1 1 calc R . .
H14B H 0.4542 0.8927 -0.5328 0.069 Uiso 1 1 calc R . .
C7 C 0.8700(6) 0.7863(7) 0.0003(6) 0.062(2) Uani 1 1 d . . .
C8 C 0.6791(5) 0.7334(7) -0.1961(5) 0.0549(18) Uani 1 1 d . . .
C2 C 1.1737(5) 0.8911(7) 0.0846(5) 0.0603(19) Uani 1 1 d . . .
O2 O 1.1814(6) 0.4567(7) 0.3210(7) 0.124(3) Uani 1 1 d D . .
C13 C 0.3476(4) 0.8305(7) -0.4203(5) 0.0569(18) Uani 1 1 d . . .
H13A H 0.3232 0.7812 -0.3809 0.068 Uiso 1 1 calc R . .
H13B H 0.3015 0.8589 -0.4599 0.068 Uiso 1 1 calc R . .
C12 C 0.3913(6) 0.9252(6) -0.3730(5) 0.061(2) Uani 1 1 d . . .
H12A H 0.4168 0.9735 -0.4122 0.074 Uiso 1 1 calc R . .
H12B H 0.3499 0.9684 -0.346 0.074 Uiso 1 1 calc R . .
C15 C 0.4751(6) 0.7552(9) -0.5993(5) 0.072(2) Uani 1 1 d . . .
H15A H 0.4853 0.7972 -0.6493 0.087 Uiso 1 1 calc R . .
H15B H 0.5299 0.7389 -0.5679 0.087 Uiso 1 1 calc R . .
C3 C 1.0166(8) 0.8219(9) 0.3415(6) 0.087(3) Uani 1 1 d . . .
H3C H 0.979 0.764 0.3584 0.105 Uiso 1 1 calc R . .
H3D H 1.0134 0.8847 0.3795 0.105 Uiso 1 1 calc R . .
C5 C 1.2016(6) 0.6497(10) 0.2993(10) 0.114(5) Uani 1 1 d . . .
H5A H 1.2277 0.6967 0.2596 0.137 Uiso 1 1 calc R . .
H5B H 1.2276 0.6688 0.3556 0.137 Uiso 1 1 calc R . .
C4 C 1.1052(9) 0.7794(10) 0.3482(7) 0.106(4) Uani 1 1 d . . .
H4A H 1.1238 0.7608 0.4067 0.127 Uiso 1 1 calc R . .
H4B H 1.1426 0.837 0.3305 0.127 Uiso 1 1 calc R . .
C6 C 1.2227(8) 0.5411(13) 0.2834(11) 0.128(5) Uani 1 1 d . . .
H6A H 1.2137 0.5297 0.2227 0.154 Uiso 1 1 calc R . .
H6B H 1.2833 0.5324 0.3002 0.154 Uiso 1 1 calc R . .
Ag1 Ag 1.26430(4) 0.98619(5) 0.03404(5) 0.0675(2) Uani 1 1 d . . .
Ag4 Ag 0.79261(4) 0.55258(5) 0.01599(4) 0.05881(19) Uani 1 1 d . . .
N10 N 0.6188(4) 0.8578(6) -0.4234(4) 0.0585(15) Uani 1 1 d . . .
C10 C 1.3615(5) 1.0589(7) -0.0234(5) 0.060(2) Uani 1 1 d . . .
N12 N 1.4126(5) 1.0971(6) -0.0584(5) 0.0663(18) Uani 1 1 d . . .
C11 C 0.6794(5) 0.8905(6) -0.4445(5) 0.0509(16) Uani 1 1 d . . .
C16 C 1.1175(5) 0.5325(7) 0.0439(5) 0.0571(18) Uani 1 1 d . . .
H1 H 0.4484 0.5962 -0.6095 0.069 Uiso 1 1 d . . .
H9A H 0.3781 0.6948 -0.4852 0.06(2) Uiso 1 1 d . . .
H2 H 1.1785 0.383 0.3509 0.085 Uiso 1 1 d D . .
Cd1 Cd 1.02411(3) 0.72102(4) 0.16224(3) 0.04607(16) Uani 1 1 d . . .
Cd2 Cd 0.52650(3) 0.73257(4) -0.36353(3) 0.04111(15) Uani 1 1 d . . .
Ag3 Ag 0.77199(4) 0.76715(6) -0.09713(4) 0.0635(2) Uani 1 1 d . . .
Ag2 Ag 0.73181(4) 0.52201(6) 0.25353(4) 0.0650(2) Uani 1 1 d . . .
N9 N 0.4085(4) 0.7672(5) -0.4673(4) 0.0445(13) Uani 1 1 d . . .
N7 N 0.6280(4) 0.7163(6) -0.2490(4) 0.0618(17) Uani 1 1 d . . .
N11 N 0.5658(4) 0.3976(5) 0.3063(4) 0.0522(14) Uani 1 1 d . . .
N8 N 0.4577(4) 0.8851(5) -0.3084(4) 0.0534(14) Uani 1 1 d . . .
H8A H 0.4342 0.8644 -0.2616 0.064 Uiso 1 1 calc R . .
H8B H 0.4955 0.9398 -0.2942 0.064 Uiso 1 1 calc R . .
 
 
 
#----------------------------------------------------------------------------#
#                   MOLECULAR GEOMETRY                                       #
#----------------------------------------------------------------------------#
 
_geom_special_details
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s 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
N5 C7 1.128(10) . ?
N5 Cd1 2.341(7) . ?
N6 C16 1.137(9) . ?
N6 Cd1 2.275(6) . ?
C9 N11 1.140(9) . ?
C9 Ag2 2.068(7) . ?
N2 C5 1.470(12) . ?
N2 C4 1.483(13) . ?
N2 Cd1 2.431(7) . ?
N2 H2A 0.91 . ?
N1 C2 1.111(10) . ?
N1 Cd1 2.342(6) . ?
N4 C1 1.117(9) . ?
N4 Cd1 2.372(6) . ?
N3 C3 1.446(11) . ?
N3 Cd1 2.306(6) . ?
N3 H3A 0.9 . ?
N3 H3B 0.9 . ?
O1 C15 1.416(12) . ?
O1 H1 0.759(7) . ?
C1 Ag2 2.086(7) . ?
C14 C15 1.468(12) . ?
C14 N9 1.470(9) . ?
C14 H14A 0.97 . ?
C14 H14B 0.97 . ?
C7 Ag3 2.080(9) . ?
C8 N7 1.118(10) . ?
C8 Ag3 2.071(8) . ?
C2 Ag1 2.058(8) . ?
O2 C6 1.374(15) . ?
O2 H2 1.008(8) . ?
C13 N9 1.487(9) . ?
C13 C12 1.490(11) . ?
C13 H13A 0.97 . ?
C13 H13B 0.97 . ?
C12 N8 1.465(10) . ?
C12 H12A 0.97 . ?
C12 H12B 0.97 . ?
C15 H15A 0.97 . ?
C15 H15B 0.97 . ?
C3 C4 1.481(16) . ?
C3 H3C 0.97 . ?
C3 H3D 0.97 . ?
C5 C6 1.375(17) . ?
C5 H5A 0.97 . ?
C5 H5B 0.97 . ?
C4 H4A 0.97 . ?
C4 H4B 0.97 . ?
C6 H6A 0.97 . ?
C6 H6B 0.97 . ?
Ag1 C10 2.060(8) . ?
Ag1 Ag3 3.1964(10) 3_775 ?
Ag4 C16 2.062(7) 3_765 ?
Ag4 C11 2.073(7) 4_576 ?
Ag4 Ag3 3.1365(9) . ?
N10 C11 1.118(9) . ?
N10 Cd2 2.363(6) . ?
C10 N12 1.125(9) . ?
N12 Cd2 2.316(6) 2_754 ?
C11 Ag4 2.073(7) 4_575 ?
C16 Ag4 2.062(7) 3_765 ?
Cd2 N7 2.300(7) . ?
Cd2 N12 2.316(6) 2_744 ?
Cd2 N8 2.345(6) . ?
Cd2 N11 2.381(5) 3_665 ?
Cd2 N9 2.386(6) . ?
Ag3 Ag1 3.1964(10) 3_775 ?
N9 H9A 1.019(6) . ?
N11 Cd2 2.381(5) 3_665 ?
N8 H8A 0.9 . ?
N8 H8B 0.9 . ?
 
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
C7 N5 Cd1 162.5(7) . . ?
C16 N6 Cd1 163.2(7) . . ?
N11 C9 Ag2 175.1(7) . . ?
C5 N2 C4 106.5(9) . . ?
C5 N2 Cd1 123.4(7) . . ?
C4 N2 Cd1 105.4(6) . . ?
C5 N2 H2A 106.8 . . ?
C4 N2 H2A 106.8 . . ?
Cd1 N2 H2A 106.8 . . ?
C2 N1 Cd1 173.7(8) . . ?
C1 N4 Cd1 163.6(7) . . ?
C3 N3 Cd1 109.7(5) . . ?
C3 N3 H3A 109.7 . . ?
Cd1 N3 H3A 109.7 . . ?
C3 N3 H3B 109.7 . . ?
Cd1 N3 H3B 109.7 . . ?
H3A N3 H3B 108.2 . . ?
C15 O1 H1 125.5(9) . . ?
N4 C1 Ag2 178.2(8) . . ?
C15 C14 N9 112.9(7) . . ?
C15 C14 H14A 109 . . ?
N9 C14 H14A 109 . . ?
C15 C14 H14B 109 . . ?
N9 C14 H14B 109 . . ?
H14A C14 H14B 107.8 . . ?
N5 C7 Ag3 172.1(8) . . ?
N7 C8 Ag3 178.9(8) . . ?
N1 C2 Ag1 176.4(8) . . ?
C6 O2 H2 154.0(10) . . ?
N9 C13 C12 110.7(6) . . ?
N9 C13 H13A 109.5 . . ?
C12 C13 H13A 109.5 . . ?
N9 C13 H13B 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 108.1 . . ?
N8 C12 C13 111.1(6) . . ?
N8 C12 H12A 109.4 . . ?
C13 C12 H12A 109.4 . . ?
N8 C12 H12B 109.4 . . ?
C13 C12 H12B 109.4 . . ?
H12A C12 H12B 108 . . ?
O1 C15 C14 112.1(8) . . ?
O1 C15 H15A 109.2 . . ?
C14 C15 H15A 109.2 . . ?
O1 C15 H15B 109.2 . . ?
C14 C15 H15B 109.2 . . ?
H15A C15 H15B 107.9 . . ?
N3 C3 C4 110.5(9) . . ?
N3 C3 H3C 109.6 . . ?
C4 C3 H3C 109.6 . . ?
N3 C3 H3D 109.6 . . ?
C4 C3 H3D 109.6 . . ?
H3C C3 H3D 108.1 . . ?
C6 C5 N2 118.2(10) . . ?
C6 C5 H5A 107.8 . . ?
N2 C5 H5A 107.8 . . ?
C6 C5 H5B 107.8 . . ?
N2 C5 H5B 107.8 . . ?
H5A C5 H5B 107.1 . . ?
C3 C4 N2 110.7(9) . . ?
C3 C4 H4A 109.5 . . ?
N2 C4 H4A 109.5 . . ?
C3 C4 H4B 109.5 . . ?
N2 C4 H4B 109.5 . . ?
H4A C4 H4B 108.1 . . ?
O2 C6 C5 118.9(13) . . ?
O2 C6 H6A 107.6 . . ?
C5 C6 H6A 107.6 . . ?
O2 C6 H6B 107.6 . . ?
C5 C6 H6B 107.6 . . ?
H6A C6 H6B 107 . . ?
C2 Ag1 C10 171.3(3) . . ?
C2 Ag1 Ag3 103.6(2) . 3_775 ?
C10 Ag1 Ag3 85.0(2) . 3_775 ?
C16 Ag4 C11 164.0(3) 3_765 4_576 ?
C16 Ag4 Ag3 100.1(2) 3_765 . ?
C11 Ag4 Ag3 82.2(2) 4_576 . ?
C11 N10 Cd2 158.2(6) . . ?
N12 C10 Ag1 176.7(8) . . ?
C10 N12 Cd2 155.7(7) . 2_754 ?
N10 C11 Ag4 178.7(7) . 4_575 ?
N6 C16 Ag4 172.2(7) . 3_765 ?
N6 Cd1 N3 171.8(3) . . ?
N6 Cd1 N5 94.4(3) . . ?
N3 Cd1 N5 93.5(3) . . ?
N6 Cd1 N1 87.1(3) . . ?
N3 Cd1 N1 90.8(3) . . ?
N5 Cd1 N1 90.5(3) . . ?
N6 Cd1 N4 94.6(2) . . ?
N3 Cd1 N4 88.1(3) . . ?
N5 Cd1 N4 85.9(3) . . ?
N1 Cd1 N4 176.2(3) . . ?
N6 Cd1 N2 97.2(3) . . ?
N3 Cd1 N2 75.0(2) . . ?
N5 Cd1 N2 168.0(2) . . ?
N1 Cd1 N2 93.1(3) . . ?
N4 Cd1 N2 90.1(3) . . ?
N7 Cd2 N12 94.0(3) . 2_744 ?
N7 Cd2 N8 94.7(2) . . ?
N12 Cd2 N8 169.6(2) 2_744 . ?
N7 Cd2 N10 88.0(2) . . ?
N12 Cd2 N10 85.5(2) 2_744 . ?
N8 Cd2 N10 89.1(2) . . ?
N7 Cd2 N11 92.6(2) . 3_665 ?
N12 Cd2 N11 92.9(2) 2_744 3_665 ?
N8 Cd2 N11 92.4(2) . 3_665 ?
N10 Cd2 N11 178.3(2) . 3_665 ?
N7 Cd2 N9 170.6(2) . . ?
N12 Cd2 N9 95.2(2) 2_744 . ?
N8 Cd2 N9 76.3(2) . . ?
N10 Cd2 N9 94.6(2) . . ?
N11 Cd2 N9 85.1(2) 3_665 . ?
C8 Ag3 C7 174.6(3) . . ?
C8 Ag3 Ag4 107.2(2) . . ?
C7 Ag3 Ag4 69.0(2) . . ?
C8 Ag3 Ag1 106.4(2) . 3_775 ?
C7 Ag3 Ag1 79.0(2) . 3_775 ?
Ag4 Ag3 Ag1 126.28(3) . 3_775 ?
C9 Ag2 C1 173.1(3) . . ?
C14 N9 C13 112.0(6) . . ?
C14 N9 Cd2 118.5(4) . . ?
C13 N9 Cd2 104.0(4) . . ?
C14 N9 H9A 105.7(5) . . ?
C13 N9 H9A 105.4(5) . . ?
Cd2 N9 H9A 110.7(4) . . ?
C8 N7 Cd2 164.3(7) . . ?
C9 N11 Cd2 165.7(6) . 3_665 ?
C12 N8 Cd2 108.7(4) . . ?
C12 N8 H8A 110 . . ?
Cd2 N8 H8A 110 . . ?
C12 N8 H8B 110 . . ?
Cd2 N8 H8B 110 . . ?
H8A N8 H8B 108.3 . . ?
 
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
Cd1 N4 C1 Ag2 -17E1(10) . . . . ?
Cd1 N5 C7 Ag3 -15(8) . . . . ?
Cd1 N1 C2 Ag1 -137(10) . . . . ?
N9 C13 C12 N8 -63.0(8) . . . . ?
N9 C14 C15 O1 61.0(9) . . . . ?
Cd1 N3 C3 C4 46.8(11) . . . . ?
C4 N2 C5 C6 155.7(14) . . . . ?
Cd1 N2 C5 C6 -82.4(15) . . . . ?
N3 C3 C4 N2 -62.5(13) . . . . ?
C5 N2 C4 C3 175.0(10) . . . . ?
Cd1 N2 C4 C3 42.4(11) . . . . ?
N2 C5 C6 O2 -46(2) . . . . ?
N1 C2 Ag1 C10 64(14) . . . . ?
N1 C2 Ag1 Ag3 -113(13) . . . 3_775 ?
C2 Ag1 C10 N12 65(14) . . . . ?
Ag3 Ag1 C10 N12 -117(14) 3_775 . . . ?
Ag1 C10 N12 Cd2 81(14) . . . 2_754 ?
Cd2 N10 C11 Ag4 3E1(3) . . . 4_575 ?
Cd1 N6 C16 Ag4 39(8) . . . 3_765 ?
C16 N6 Cd1 N3 -59(4) . . . . ?
C16 N6 Cd1 N5 106(3) . . . . ?
C16 N6 Cd1 N1 16(3) . . . . ?
C16 N6 Cd1 N4 -168(3) . . . . ?
C16 N6 Cd1 N2 -77(3) . . . . ?
C3 N3 Cd1 N6 -35(2) . . . . ?
C3 N3 Cd1 N5 159.4(7) . . . . ?
C3 N3 Cd1 N1 -110.1(7) . . . . ?
C3 N3 Cd1 N4 73.6(7) . . . . ?
C3 N3 Cd1 N2 -17.1(7) . . . . ?
C7 N5 Cd1 N6 54(2) . . . . ?
C7 N5 Cd1 N3 -128(2) . . . . ?
C7 N5 Cd1 N1 141(2) . . . . ?
C7 N5 Cd1 N4 -41(2) . . . . ?
C7 N5 Cd1 N2 -112(2) . . . . ?
C2 N1 Cd1 N6 64(7) . . . . ?
C2 N1 Cd1 N3 -124(7) . . . . ?
C2 N1 Cd1 N5 -31(7) . . . . ?
C2 N1 Cd1 N4 -52(9) . . . . ?
C2 N1 Cd1 N2 161(7) . . . . ?
C1 N4 Cd1 N6 -136(3) . . . . ?
C1 N4 Cd1 N3 52(3) . . . . ?
C1 N4 Cd1 N5 -42(3) . . . . ?
C1 N4 Cd1 N1 -20(5) . . . . ?
C1 N4 Cd1 N2 127(3) . . . . ?
C5 N2 Cd1 N6 41.7(8) . . . . ?
C4 N2 Cd1 N6 164.1(7) . . . . ?
C5 N2 Cd1 N3 -135.7(8) . . . . ?
C4 N2 Cd1 N3 -13.3(7) . . . . ?
C5 N2 Cd1 N5 -153.0(11) . . . . ?
C4 N2 Cd1 N5 -30.7(15) . . . . ?
C5 N2 Cd1 N1 -45.7(8) . . . . ?
C4 N2 Cd1 N1 76.6(7) . . . . ?
C5 N2 Cd1 N4 136.4(8) . . . . ?
C4 N2 Cd1 N4 -101.3(7) . . . . ?
C11 N10 Cd2 N7 48.6(18) . . . . ?
C11 N10 Cd2 N12 -45.6(18) . . . 2_744 ?
C11 N10 Cd2 N8 143.3(18) . . . . ?
C11 N10 Cd2 N11 -61(8) . . . 3_665 ?
C11 N10 Cd2 N9 -140.5(18) . . . . ?
N7 C8 Ag3 C7 15E1(4) . . . . ?
N7 C8 Ag3 Ag4 11E1(4) . . . . ?
N7 C8 Ag3 Ag1 -3E1(4) . . . 3_775 ?
N5 C7 Ag3 C8 -20(8) . . . . ?
N5 C7 Ag3 Ag4 26(6) . . . . ?
N5 C7 Ag3 Ag1 162(6) . . . 3_775 ?
C16 Ag4 Ag3 C8 88.0(3) 3_765 . . . ?
C11 Ag4 Ag3 C8 -76.0(3) 4_576 . . . ?
C16 Ag4 Ag3 C7 -88.0(3) 3_765 . . . ?
C11 Ag4 Ag3 C7 108.0(3) 4_576 . . . ?
C16 Ag4 Ag3 Ag1 -145.6(2) 3_765 . . 3_775 ?
C11 Ag4 Ag3 Ag1 50.4(2) 4_576 . . 3_775 ?
N11 C9 Ag2 C1 59(10) . . . . ?
N4 C1 Ag2 C9 -2E1(3) . . . . ?
C15 C14 N9 C13 -172.2(7) . . . . ?
C15 C14 N9 Cd2 66.8(8) . . . . ?
C12 C13 N9 C14 -79.3(8) . . . . ?
C12 C13 N9 Cd2 49.8(6) . . . . ?
N7 Cd2 N9 C14 121.7(13) . . . . ?
N12 Cd2 N9 C14 -70.0(5) 2_744 . . . ?
N8 Cd2 N9 C14 103.8(5) . . . . ?
N10 Cd2 N9 C14 15.9(5) . . . . ?
N11 Cd2 N9 C14 -162.4(5) 3_665 . . . ?
N7 Cd2 N9 C13 -3.3(15) . . . . ?
N12 Cd2 N9 C13 165.0(4) 2_744 . . . ?
N8 Cd2 N9 C13 -21.2(4) . . . . ?
N10 Cd2 N9 C13 -109.1(4) . . . . ?
N11 Cd2 N9 C13 72.5(4) 3_665 . . . ?
Ag3 C8 N7 Cd2 6E1(4) . . . . ?
N12 Cd2 N7 C8 126(3) 2_744 . . . ?
N8 Cd2 N7 C8 -49(3) . . . . ?
N10 Cd2 N7 C8 40(3) . . . . ?
N11 Cd2 N7 C8 -141(3) 3_665 . . . ?
N9 Cd2 N7 C8 -66(3) . . . . ?
Ag2 C9 N11 Cd2 -34(11) . . . 3_665 ?
C13 C12 N8 Cd2 38.7(7) . . . . ?
N7 Cd2 N8 C12 174.3(5) . . . . ?
N12 Cd2 N8 C12 27.6(15) 2_744 . . . ?
N10 Cd2 N8 C12 86.4(5) . . . . ?
N11 Cd2 N8 C12 -92.9(5) 3_665 . . . ?
N9 Cd2 N8 C12 -8.6(5) . . . . ?
 
# The following lines are used to test the character set of files sent by
# network email or other means. They are not part of the CIF data set
# abcdefghijklmnopqrstuvwxyzABCDEFGHIJKLMNOPQRSTUVWXYZ0123456789
# !@#$%^&*()_+{}:"~<>?|\-=[];'`,./
 
# END of CIF
