#------------------------------------------------------------------------------
#$Date: 2020-04-05 13:13:22 +0300 (Sun, 05 Apr 2020) $
#$Revision: 250197 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/12/60/7126057.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7126057
loop_
_publ_author_name
'Lee, Eunji'
'Hosoi, Yasuhiro'
'Temma, Honoka'
'Ju, Huiyeong'
'Ikeda, Mari'
'Kuwahara, Shunsuke'
'Habata, Yoichi'
_publ_section_title
;
 Silver ion-induced chiral enhancement by argentivorous molecules.
;
_journal_issue                   23
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              3373
_journal_page_last               3376
_journal_paper_doi               10.1039/d0cc00798f
_journal_volume                  56
_journal_year                    2020
_chemical_absolute_configuration syn
_chemical_formula_moiety         'C37 H46 Ag N4, B F4'
_chemical_formula_sum            'C37 H46 Ag B F4 N4'
_chemical_formula_weight         741.46
_space_group_crystal_system      monoclinic
_space_group_IT_number           5
_space_group_name_Hall           'C 2y'
_space_group_name_H-M_alt        'C 1 2 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2020-01-04 deposited with the CCDC.	2020-02-20 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 100.627(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.8399(17)
_cell_length_b                   13.5554(16)
_cell_length_c                   18.233(2)
_cell_measurement_reflns_used    8466
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      28.51
_cell_measurement_theta_min      2.27
_cell_volume                     3361.9(7)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0591
_diffrn_reflns_av_unetI/netI     0.0444
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            9901
_diffrn_reflns_point_group_measured_fraction_full 0.854
_diffrn_reflns_point_group_measured_fraction_max 0.852
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.998
_diffrn_reflns_theta_min         1.136
_exptl_absorpt_coefficient_mu    0.655
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.465
_exptl_crystal_description       block
_exptl_crystal_F_000             1536
_exptl_crystal_size_max          0.478
_exptl_crystal_size_mid          0.297
_exptl_crystal_size_min          0.290
_exptl_transmission_factor_max   0.7457
_exptl_transmission_factor_min   0.6007
_refine_diff_density_max         1.733
_refine_diff_density_min         -2.181
_refine_diff_density_rms         0.149
_refine_ls_abs_structure_details
; 
 Flack x determined using 2005 quotients [(I+)-(I-)]/[(I+)+(I-)] 
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). 
;
_refine_ls_abs_structure_Flack   0.04(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     453
_refine_ls_number_reflns         5609
_refine_ls_number_restraints     132
_refine_ls_restrained_S_all      1.058
_refine_ls_R_factor_all          0.0617
_refine_ls_R_factor_gt           0.0600
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1208P)²+27.8003P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1743
_refine_ls_wR_factor_ref         0.1781
_reflns_Friedel_coverage         0.636
_reflns_Friedel_fraction_full    0.697
_reflns_Friedel_fraction_max     0.694
_reflns_number_gt                5527
_reflns_number_total             5609
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0cc00798f2.cif
_cod_data_source_block           (S)-7-AgBF4
_cod_depositor_comments
'Adding full bibliography for 7126056--7126060.cif.'
_cod_original_sg_symbol_H-M      'C 2'
_cod_database_code               7126057
_shelx_shelxl_version_number     2014/7
_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. 
;
_shelx_estimated_absorpt_t_min   0.745
_shelx_estimated_absorpt_t_max   0.833
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
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
Ag1 Ag 0.79900(4) 0.46439(7) 0.22536(3) 0.0187(2) Uani 1 1 d . . . . .
B1 B 0.7256(9) 0.4670(17) 0.9013(5) 0.031(2) Uani 1 1 d . U . . .
C1 C 0.8652(11) 0.5866(13) 0.0973(8) 0.034(3) Uani 1 1 d D U . . .
H1A H 0.8158 0.5430 0.0659 0.040 Uiso 0.32 1 calc R U P A 1
H1B H 0.8854 0.6454 0.0716 0.040 Uiso 0.68 1 calc R U P B 2
H1C H 0.8167 0.5498 0.0607 0.040 Uiso 0.68 1 calc R U P B 2
C2 C 0.9542(8) 0.5219(9) 0.1213(6) 0.025(2) Uani 1 1 d . U . . .
H2A H 0.9858 0.5092 0.0777 0.030 Uiso 1 1 calc R U . . .
H2B H 1.0022 0.5576 0.1591 0.030 Uiso 1 1 calc R U . . .
C3 C 0.8792(11) 0.3568(12) 0.0954(7) 0.031(3) Uani 1 1 d D U . . .
H3A H 0.8290 0.3960 0.0608 0.037 Uiso 0.25 1 calc R U P C 1
H3B H 0.9282 0.3270 0.0688 0.037 Uiso 0.75 1 calc R U P D 2
H3C H 0.8318 0.3944 0.0585 0.037 Uiso 0.75 1 calc R U P D 2
C4 C 0.8243(8) 0.2744(9) 0.1277(6) 0.023(2) Uani 1 1 d . . . . .
H4A H 0.7988 0.2270 0.0875 0.027 Uiso 1 1 calc R U . . .
H4B H 0.8712 0.2387 0.1662 0.027 Uiso 1 1 calc R U . . .
C5 C 0.6564(10) 0.3376(11) 0.1057(7) 0.027(3) Uani 1 1 d D U . . .
H5A H 0.6828 0.3759 0.0669 0.033 Uiso 0.18 1 calc R U P E 1
H5B H 0.6201 0.2771 0.0867 0.033 Uiso 0.82 1 calc R U P F 2
H5C H 0.6793 0.3698 0.0633 0.033 Uiso 0.82 1 calc R U P F 2
C6 C 0.5857(9) 0.4085(9) 0.1368(6) 0.026(2) Uani 1 1 d . . . . .
H6A H 0.5290 0.4225 0.0965 0.031 Uiso 1 1 calc R U . . .
H6B H 0.5601 0.3739 0.1771 0.031 Uiso 1 1 calc R U . . .
C7 C 0.6429(10) 0.5667(10) 0.1046(7) 0.025(3) Uani 1 1 d D U . . .
H7A H 0.6722 0.5260 0.0684 0.030 Uiso 0.25 1 calc R U P G 1
H7B H 0.5788 0.5940 0.0800 0.030 Uiso 0.75 1 calc R U P H 2
H7C H 0.6695 0.5271 0.0672 0.030 Uiso 0.75 1 calc R U P H 2
C8 C 0.7152(8) 0.6537(9) 0.1317(6) 0.023(2) Uani 1 1 d . . . . .
H8A H 0.7149 0.7004 0.0899 0.028 Uiso 1 1 calc R U . . .
H8B H 0.6917 0.6896 0.1723 0.028 Uiso 1 1 calc R U . . .
C9 C 0.898(3) 0.657(3) 0.0432(18) 0.032(7) Uani 0.32 1 d D U P I 1
H9A H 0.8732 0.7236 0.0511 0.048 Uiso 0.32 1 calc R U P I 1
H9B H 0.8717 0.6360 -0.0080 0.048 Uiso 0.32 1 calc R U P I 1
H9C H 0.9698 0.6587 0.0512 0.048 Uiso 0.32 1 calc R U P I 1
C10 C 0.947(4) 0.313(5) 0.049(3) 0.049(11) Uani 0.25 1 d D U P J 1
H10A H 0.9366 0.3442 0.0001 0.074 Uiso 0.25 1 calc R U P J 1
H10B H 0.9344 0.2417 0.0432 0.074 Uiso 0.25 1 calc R U P J 1
H10C H 1.0155 0.3229 0.0743 0.074 Uiso 0.25 1 calc R U P J 1
C11 C 0.595(5) 0.257(4) 0.065(3) 0.032(11) Uani 0.18 1 d D U P K 1
H11A H 0.6351 0.1977 0.0639 0.048 Uiso 0.18 1 calc R U P K 1
H11B H 0.5689 0.2782 0.0136 0.048 Uiso 0.18 1 calc R U P K 1
H11C H 0.5400 0.2420 0.0903 0.048 Uiso 0.18 1 calc R U P K 1
C12 C 0.554(2) 0.618(3) 0.062(2) 0.027(8) Uani 0.25 1 d D U P L 1
H12A H 0.5021 0.5695 0.0452 0.040 Uiso 0.25 1 calc R U P L 1
H12B H 0.5710 0.6520 0.0189 0.040 Uiso 0.25 1 calc R U P L 1
H12C H 0.5301 0.6664 0.0947 0.040 Uiso 0.25 1 calc R U P L 1
C13 C 0.8743(8) 0.6993(8) 0.2031(6) 0.021(2) Uani 1 1 d . . . . .
H13A H 0.8565 0.7635 0.1784 0.025 Uiso 1 1 calc R U . . .
H13B H 0.9451 0.6879 0.2039 0.025 Uiso 1 1 calc R U . . .
C14 C 0.8571(8) 0.7047(8) 0.2824(6) 0.021(2) Uani 1 1 d . . . . .
C15 C 0.9072(7) 0.6381(9) 0.3353(6) 0.024(2) Uani 1 1 d . . . . .
H15 H 0.9497 0.5899 0.3206 0.029 Uiso 1 1 calc R U . . .
C16 C 0.8946(8) 0.6430(9) 0.4084(6) 0.026(2) Uani 1 1 d . . . . .
H16 H 0.9291 0.5986 0.4443 0.031 Uiso 1 1 calc R U . . .
C17 C 0.8314(8) 0.7125(9) 0.4299(7) 0.023(2) Uani 1 1 d . . . . .
H17 H 0.8235 0.7163 0.4805 0.028 Uiso 1 1 calc R U . . .
C18 C 0.7808(8) 0.7753(9) 0.3781(7) 0.029(2) Uani 1 1 d . . . . .
H18 H 0.7356 0.8210 0.3924 0.034 Uiso 1 1 calc R U . . .
C19 C 0.7952(8) 0.7728(8) 0.3043(6) 0.020(2) Uani 1 1 d . . . . .
H19 H 0.7619 0.8187 0.2691 0.024 Uiso 1 1 calc R U . . .
C20 C 1.0222(7) 0.3787(9) 0.1945(6) 0.024(2) Uani 1 1 d . . . . .
H20A H 1.0761 0.3900 0.1666 0.029 Uiso 1 1 calc R U . . .
H20B H 1.0117 0.3067 0.1969 0.029 Uiso 1 1 calc R U . . .
C21 C 1.0524(7) 0.4184(9) 0.2727(5) 0.020(2) Uani 1 1 d . . . . .
C22 C 1.0054(7) 0.3790(8) 0.3283(6) 0.021(2) Uani 1 1 d . . . . .
H22 H 0.9552 0.3308 0.3162 0.025 Uiso 1 1 calc R U . . .
C23 C 1.0338(8) 0.4122(9) 0.4015(6) 0.024(2) Uani 1 1 d . . . . .
H23 H 1.0026 0.3863 0.4396 0.028 Uiso 1 1 calc R U . . .
C24 C 1.1071(7) 0.4823(8) 0.4192(5) 0.020(2) Uani 1 1 d . U . . .
H24 H 1.1256 0.5043 0.4693 0.024 Uiso 1 1 calc R U . . .
C25 C 1.1531(8) 0.5203(8) 0.3653(6) 0.026(2) Uani 1 1 d . . . . .
H25 H 1.2027 0.5692 0.3776 0.031 Uiso 1 1 calc R U . . .
C26 C 1.1265(7) 0.4865(7) 0.2913(5) 0.020(2) Uani 1 1 d . U . . .
H26 H 1.1600 0.5109 0.2539 0.024 Uiso 1 1 calc R U . . .
C27 C 0.7106(8) 0.2314(8) 0.2090(6) 0.024(2) Uani 1 1 d . . . . .
H27A H 0.7124 0.1674 0.1831 0.029 Uiso 1 1 calc R U . . .
H27B H 0.6417 0.2435 0.2143 0.029 Uiso 1 1 calc R U . . .
C28 C 0.7736(7) 0.2232(8) 0.2864(5) 0.019(2) Uani 1 1 d . U . . .
C29 C 0.7554(7) 0.2895(8) 0.3416(6) 0.019(2) Uani 1 1 d . . . . .
H29 H 0.7077 0.3401 0.3293 0.023 Uiso 1 1 calc R U . . .
C30 C 0.8065(8) 0.2809(9) 0.4132(6) 0.023(2) Uani 1 1 d . . . . .
H30 H 0.7939 0.3259 0.4502 0.027 Uiso 1 1 calc R U . . .
C31 C 0.8760(8) 0.2080(10) 0.4322(6) 0.024(2) Uani 1 1 d . . . . .
H31 H 0.9103 0.2024 0.4822 0.029 Uiso 1 1 calc R U . . .
C32 C 0.8957(7) 0.1432(8) 0.3784(6) 0.023(2) Uani 1 1 d . . . . .
H32 H 0.9441 0.0934 0.3915 0.028 Uiso 1 1 calc R U . . .
C33 C 0.8451(8) 0.1501(9) 0.3050(6) 0.021(2) Uani 1 1 d . U . . .
H33 H 0.8591 0.1057 0.2680 0.025 Uiso 1 1 calc R U . . .
C34 C 0.5616(7) 0.5508(9) 0.2131(6) 0.0212(13) Uani 1 1 d . U . . .
H34A H 0.4924 0.5433 0.1875 0.025 Uiso 1 1 calc R U . . .
H34B H 0.5764 0.6222 0.2174 0.025 Uiso 1 1 calc R U . . .
C35 C 0.5733(7) 0.5059(8) 0.2922(6) 0.0212(12) Uani 1 1 d D U . . .
C36 C 0.6483(7) 0.5441(9) 0.3476(6) 0.0224(12) Uani 1 1 d . U . . .
H36 H 0.6923 0.5930 0.3360 0.027 Uiso 1 1 calc R U . . .
C37 C 0.6561(7) 0.5086(9) 0.4189(5) 0.0226(13) Uani 1 1 d D U . . .
H37 H 0.7045 0.5358 0.4573 0.027 Uiso 1 1 calc R U . . .
C38 C 0.5960(7) 0.4350(7) 0.4366(5) 0.018(2) Uani 1 1 d . . . . .
H38 H 0.6044 0.4100 0.4861 0.022 Uiso 1 1 calc R U . . .
C39 C 0.5238(8) 0.3981(7) 0.3815(6) 0.022(2) Uani 1 1 d D . . . .
H39 H 0.4814 0.3479 0.3934 0.027 Uiso 1 1 calc R U . . .
C40 C 0.5115(7) 0.4336(8) 0.3076(6) 0.022(2) Uani 1 1 d . . . . .
H40 H 0.4616 0.4078 0.2696 0.027 Uiso 1 1 calc R U . . .
F1 F 0.6651(9) 0.5271(11) 0.9297(6) 0.083(4) Uani 1 1 d . U . . .
F2 F 0.8163(7) 0.5068(11) 0.9175(5) 0.085(4) Uani 1 1 d . U . . .
F3 F 0.7139(14) 0.3776(8) 0.9331(6) 0.098(5) Uani 1 1 d . U . . .
F4 F 0.6954(5) 0.4630(10) 0.8249(3) 0.0404(15) Uani 1 1 d . U . . .
N1 N 0.8167(6) 0.6200(7) 0.1588(5) 0.0184(18) Uani 1 1 d . . . . .
N2 N 0.9303(6) 0.4260(7) 0.1533(5) 0.0203(18) Uani 1 1 d . . . . .
N3 N 0.7410(7) 0.3105(6) 0.1617(5) 0.0192(18) Uani 1 1 d . . . . .
N4 N 0.6282(7) 0.5027(8) 0.1664(5) 0.024(2) Uani 1 1 d . . . . .
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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N3 Ag1 N4 76.6(3) . . ?
N3 Ag1 N1 123.3(3) . . ?
N4 Ag1 N1 77.3(3) . . ?
N3 Ag1 N2 77.2(3) . . ?
N4 Ag1 N2 123.3(3) . . ?
N1 Ag1 N2 76.7(3) . . ?
F1 B1 F2 107.1(15) . . ?
F1 B1 F3 104.1(13) . . ?
F2 B1 F3 116.1(16) . . ?
F1 B1 F4 108.6(14) . . ?
F2 B1 F4 109.5(9) . . ?
F3 B1 F4 110.9(14) . . ?
N1 C1 C9 122(2) . . ?
N1 C1 C2 114.6(10) . . ?
C9 C1 C2 103.5(19) . . ?
N2 C2 C1 113.1(9) . . ?
N2 C3 C10 113(3) . . ?
N2 C3 C4 113.0(10) . . ?
C10 C3 C4 109(3) . . ?
N3 C4 C3 113.5(9) . . ?
N3 C5 C11 118(3) . . ?
N3 C5 C6 112.5(9) . . ?
C11 C5 C6 107(3) . . ?
N4 C6 C5 115.9(10) . . ?
N4 C7 C12 117(2) . . ?
N4 C7 C8 112.0(10) . . ?
C12 C7 C8 103.3(18) . . ?
N1 C8 C7 112.8(10) . . ?
N1 C13 C14 113.1(8) . . ?
C19 C14 C15 119.2(10) . . ?
C19 C14 C13 122.0(9) . . ?
C15 C14 C13 118.8(10) . . ?
C16 C15 C14 119.9(11) . . ?
C15 C16 C17 120.2(11) . . ?
C18 C17 C16 119.8(11) . . ?
C17 C18 C19 120.4(10) . . ?
C14 C19 C18 120.4(10) . . ?
N2 C20 C21 112.5(9) . . ?
C26 C21 C22 120.0(9) . . ?
C26 C21 C20 122.4(9) . . ?
C22 C21 C20 117.5(10) . . ?
C23 C22 C21 118.8(10) . . ?
C24 C23 C22 120.6(9) . . ?
C25 C24 C23 120.6(9) . . ?
C24 C25 C26 119.5(10) . . ?
C21 C26 C25 120.4(9) . . ?
N3 C27 C28 114.6(8) . . ?
C33 C28 C29 119.5(9) . . ?
C33 C28 C27 122.4(9) . . ?
C29 C28 C27 118.1(10) . . ?
C30 C29 C28 119.9(10) . . ?
C29 C30 C31 121.0(10) . . ?
C30 C31 C32 119.8(10) . . ?
C31 C32 C33 120.6(10) . . ?
C32 C33 C28 119.2(9) . . ?
N4 C34 C35 112.7(8) . . ?
C40 C35 C36 121.6(10) . . ?
C40 C35 C34 120.8(9) . . ?
C36 C35 C34 117.5(9) . . ?
C37 C36 C35 118.0(10) . . ?
C36 C37 C38 122.2(10) . . ?
C39 C38 C37 118.8(9) . . ?
C38 C39 C40 121.2(9) . . ?
C35 C40 C39 118.1(9) . . ?
C8 N1 C1 112.2(9) . . ?
C8 N1 C13 110.0(9) . . ?
C1 N1 C13 111.2(9) . . ?
C8 N1 Ag1 104.8(6) . . ?
C1 N1 Ag1 102.2(8) . . ?
C13 N1 Ag1 116.3(6) . . ?
C2 N2 C3 112.6(9) . . ?
C2 N2 C20 109.9(8) . . ?
C3 N2 C20 109.5(9) . . ?
C2 N2 Ag1 105.2(6) . . ?
C3 N2 Ag1 102.1(6) . . ?
C20 N2 Ag1 117.4(6) . . ?
C5 N3 C27 108.2(9) . . ?
C5 N3 C4 112.2(9) . . ?
C27 N3 C4 109.2(8) . . ?
C5 N3 Ag1 105.6(7) . . ?
C27 N3 Ag1 116.2(6) . . ?
C4 N3 Ag1 105.4(7) . . ?
C7 N4 C6 109.7(9) . . ?
C7 N4 C34 111.3(10) . . ?
C6 N4 C34 109.7(8) . . ?
C7 N4 Ag1 101.7(7) . . ?
C6 N4 Ag1 105.3(7) . . ?
C34 N4 Ag1 118.7(6) . . ?
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
Ag1 N3 2.450(9) . ?
Ag1 N4 2.465(9) . ?
Ag1 N1 2.468(9) . ?
Ag1 N2 2.486(8) . ?
B1 F1 1.34(2) . ?
B1 F2 1.348(15) . ?
B1 F3 1.37(2) . ?
B1 F4 1.379(11) . ?
C1 N1 1.481(16) . ?
C1 C9 1.504(13) . ?
C1 C2 1.510(18) . ?
C2 N2 1.487(14) . ?
C3 N2 1.490(18) . ?
C3 C10 1.499(13) . ?
C3 C4 1.529(19) . ?
C4 N3 1.487(13) . ?
C5 N3 1.452(15) . ?
C5 C11 1.499(14) . ?
C5 C6 1.550(17) . ?
C6 N4 1.467(16) . ?
C7 N4 1.466(15) . ?
C7 C12 1.501(13) . ?
C7 C8 1.566(17) . ?
C8 N1 1.473(13) . ?
C13 N1 1.485(14) . ?
C13 C14 1.508(14) . ?
C14 C19 1.369(16) . ?
C14 C15 1.407(15) . ?
C15 C16 1.378(15) . ?
C16 C17 1.391(16) . ?
C17 C18 1.365(18) . ?
C18 C19 1.397(16) . ?
C20 N2 1.497(13) . ?
C20 C21 1.509(14) . ?
C21 C26 1.375(15) . ?
C21 C22 1.407(13) . ?
C22 C23 1.394(15) . ?
C23 C24 1.385(16) . ?
C24 C25 1.367(15) . ?
C25 C26 1.408(15) . ?
C27 N3 1.485(13) . ?
C27 C28 1.520(14) . ?
C28 C33 1.397(15) . ?
C28 C29 1.407(14) . ?
C29 C30 1.370(15) . ?
C30 C31 1.378(17) . ?
C31 C32 1.381(16) . ?
C32 C33 1.395(15) . ?
C34 N4 1.514(13) . ?
C34 C35 1.546(14) . ?
C35 C40 1.364(14) . ?
C35 C36 1.407(14) . ?
C36 C37 1.371(14) . ?
C37 C38 1.375(15) . ?
C38 C39 1.374(15) . ?
C39 C40 1.412(14) . ?
