#------------------------------------------------------------------------------
#$Date: 2019-11-07 22:42:39 +0200 (Thu, 07 Nov 2019) $
#$Revision: 223843 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/10/7701051.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_7701051
loop_
_publ_author_name
'Dominelli, Bruno'
'Roberts, Gerri M.'
'Jandl, Christian'
'Fischer, Pauline J.'
'Reich, Robert M.'
'Pöthig, Alexander'
'Correia, João D G'
'Kühn, Fritz E'
_publ_section_title
;
 Dinuclear zwitterionic silver(i) and gold(i) complexes bearing
 2,2-acetate-bridged bisimidazolylidene ligands.
;
_journal_issue                   37
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              14036
_journal_page_last               14043
_journal_paper_doi               10.1039/c9dt03035b
_journal_volume                  48
_journal_year                    2019
_chemical_compound_source        'see text'
_chemical_formula_moiety         '2(C20 H22 Ag2 N8 O4)'
_chemical_formula_sum            'C40 H44 Ag4 N16 O8'
_chemical_formula_weight         1308.39
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2019-07-24 deposited with the CCDC.    2019-08-26 downloaded from the CCDC.
;
_cell_angle_alpha                107.761(2)
_cell_angle_beta                 99.703(2)
_cell_angle_gamma                113.659(2)
_cell_formula_units_Z            1
_cell_length_a                   11.3434(5)
_cell_length_b                   12.6516(5)
_cell_length_c                   12.7157(6)
_cell_measurement_reflns_used    9826
_cell_measurement_temperature    100
_cell_measurement_theta_max      28.3237
_cell_measurement_theta_min      2.6475
_cell_volume                     1500.65(12)
_computing_cell_refinement       'SAINT (Bruker, 2014)'
_computing_data_collection       'APEX III Control Software (Bruker, 2015)'
_computing_data_reduction        'SAINT (Bruker, 2014)'
_computing_molecular_graphics    'PLATON (Spek, 2011)'
_computing_publication_material  'PLATON (Spek, 2011), enCIFer (Allen, 2014)'
_computing_structure_refinement
'SHELXL2014 (Sheldrick, 2014), SHELXLE (Huebschle, 2011)'
_computing_structure_solution    'SHELXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      100
_diffrn_detector                 ' CMOS plate '
_diffrn_detector_area_resol_mean 16
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device       ' κ-geometry diffractometer '
_diffrn_measurement_device_type  ' Bruker Photon CMOS '
_diffrn_measurement_method       ' phi- and omega-rotation '
_diffrn_radiation_monochromator  'Helios optic'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'IMS microsource'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0554
_diffrn_reflns_av_unetI/netI     0.0187
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            107428
_diffrn_reflns_reduction_process
;
;
_diffrn_reflns_theta_full        25.24
_diffrn_reflns_theta_max         27.45
_diffrn_reflns_theta_min         2.24
_exptl_absorpt_coefficient_mu    1.339
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.7165
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS 2016/2, Bruker, 2016'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.448
_exptl_crystal_density_method    'Not Measured'
_exptl_crystal_description       fragment
_exptl_crystal_F_000             648
_exptl_crystal_size_max          0.146
_exptl_crystal_size_mid          0.133
_exptl_crystal_size_min          0.082
_platon_squeeze_details
;
The unit cell contains a network of 16 partly disordered molecules of water
which were treated as a diffuse contribution to the overall scattering 
without specific atom positions by SQUEEZE/PLATON.
;
_refine_diff_density_max         0.431
_refine_diff_density_min         -0.555
_refine_diff_density_rms         0.074
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.054
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     311
_refine_ls_number_reflns         6857
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.054
_refine_ls_R_factor_all          0.0293
_refine_ls_R_factor_gt           0.0226
_refine_ls_shift/su_max          0.006
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'W=1/[Σ²(FO²)+(0.0164P)²+1.8533P] WHERE P=(FO²+2FC²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0459
_refine_ls_wR_factor_ref         0.0477
_reflns_number_gt                6017
_reflns_number_total             6857
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c9dt03035b2.cif
_cod_data_source_block           Ag2(La2)2
_cod_depositor_comments
'Adding full bibliography for 7701048--7701051.cif.'
_cod_database_code               7701051
_platon_squeeze_void_probe_radius 1.20
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,-y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_thermal_displace_type
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
_atom_site_calc_flag
_atom_site_refinement_flags
Ag1 Ag Uani 0.21213(2) 0.53459(2) 0.57531(2) 1.000 0.0111(1) d .
Ag2 Ag Uani 0.33142(2) 0.72693(2) 0.41807(2) 1.000 0.0133(1) d .
O1 O Uani 0.45295(15) 0.33382(14) 0.40037(13) 1.000 0.0197(5) d .
O2 O Uani 0.54961(16) 0.46512(16) 0.31863(14) 1.000 0.0239(5) d .
O3 O Uani 0.69159(15) 1.01683(15) 0.81325(15) 1.000 0.0251(5) d .
O4 O Uani 0.61950(16) 0.88065(15) 0.89630(14) 1.000 0.0257(5) d .
N1 N Uani 0.04170(17) 0.25607(16) 0.39208(16) 1.000 0.0163(5) d .
N2 N Uani 0.21761(17) 0.34795(16) 0.34842(14) 1.000 0.0124(5) d .
N3 N Uani 0.31381(17) 0.47897(16) 0.25162(15) 1.000 0.0141(5) d .
N4 N Uani 0.25973(18) 0.57209(18) 0.15337(16) 1.000 0.0206(5) d .
N5 N Uani 0.35779(17) 0.98613(16) 0.54548(16) 1.000 0.0163(5) d .
N6 N Uani 0.43276(17) 0.93341(15) 0.67592(15) 1.000 0.0136(5) d .
N7 N Uani 0.35030(17) 0.80685(15) 0.77879(14) 1.000 0.0120(5) d .
N8 N Uani 0.16605(17) 0.68356(17) 0.79465(15) 1.000 0.0145(5) d .
C1 C Uani -0.0614(2) 0.2309(2) 0.4495(2) 1.000 0.0212(6) d .
C2 C Uani 0.1519(2) 0.37018(19) 0.42654(18) 1.000 0.0130(6) d .
C3 C Uani 0.0377(2) 0.1648(2) 0.2962(2) 1.000 0.0233(7) d .
C4 C Uani 0.1486(2) 0.2218(2) 0.26847(19) 1.000 0.0216(6) d .
C5 C Uani 0.3414(2) 0.44467(19) 0.34857(17) 1.000 0.0132(6) d .
C6 C Uani 0.2955(2) 0.5810(2) 0.26398(18) 1.000 0.0150(6) d .
C7 C Uani 0.2903(2) 0.4076(2) 0.13555(19) 1.000 0.0236(7) d .
C8 C Uani 0.2558(3) 0.4666(2) 0.0743(2) 1.000 0.0285(7) d .
C9 C Uani 0.2245(3) 0.6595(2) 0.1202(2) 1.000 0.0311(8) d .
C10 C Uani 0.4574(2) 0.40786(19) 0.35410(18) 1.000 0.0157(6) d .
C11 C Uani 0.2945(2) 0.9822(2) 0.4331(2) 1.000 0.0221(7) d .
C12 C Uani 0.37595(19) 0.89106(19) 0.55869(18) 1.000 0.0136(5) d .
C13 C Uani 0.4020(2) 1.0858(2) 0.6525(2) 1.000 0.0204(6) d .
C14 C Uani 0.4494(2) 1.05341(19) 0.7349(2) 1.000 0.0196(6) d .
C15 C Uani 0.4585(2) 0.85643(18) 0.73174(18) 1.000 0.0130(5) d .
C16 C Uani 0.2459(2) 0.68560(19) 0.72660(17) 1.000 0.0120(5) d .
C17 C Uani 0.3339(2) 0.8788(2) 0.87661(18) 1.000 0.0174(6) d .
C18 C Uani 0.2180(2) 0.8003(2) 0.88643(18) 1.000 0.0185(6) d .
C19 C Uani 0.0417(2) 0.5715(2) 0.7764(2) 1.000 0.0213(6) d .
C20 C Uani 0.6042(2) 0.9270(2) 0.82426(19) 1.000 0.0180(6) d .
H1A H Uiso -0.01740 0.25450 0.53240 1.000 0.0320 c RU
H1B H Uiso -0.12840 0.14050 0.41170 1.000 0.0320 c RU
H1C H Uiso -0.10750 0.28070 0.44280 1.000 0.0320 c RU
H3 H Uiso -0.03040 0.07830 0.25720 1.000 0.0280 c RU
H4 H Uiso 0.17470 0.18360 0.20660 1.000 0.0260 c RU
H5 H Uiso 0.37400 0.52180 0.42210 1.000 0.0160 c RU
H7 H Uiso 0.29720 0.33260 0.10560 1.000 0.0280 c RU
H8 H Uiso 0.23290 0.44070 -0.00800 1.000 0.0340 c RU
H9A H Uiso 0.25220 0.73540 0.19050 1.000 0.0470 c RU
H9B H Uiso 0.12570 0.61800 0.08090 1.000 0.0470 c RU
H9C H Uiso 0.27200 0.68360 0.06680 1.000 0.0470 c RU
H11A H Uiso 0.33850 1.06700 0.43410 1.000 0.0330 c RU
H11B H Uiso 0.19710 0.95360 0.41990 1.000 0.0330 c RU
H11C H Uiso 0.30560 0.92320 0.36990 1.000 0.0330 c RU
H13 H Uiso 0.39930 1.16270 0.66530 1.000 0.0240 c RU
H14 H Uiso 0.48680 1.10270 0.81710 1.000 0.0240 c RU
H15 H Uiso 0.45230 0.78210 0.66880 1.000 0.0160 c RU
H17 H Uiso 0.39270 0.96590 0.92650 1.000 0.0210 c RU
H18 H Uiso 0.17930 0.82120 0.94520 1.000 0.0220 c RU
H19A H Uiso -0.01260 0.59760 0.81970 1.000 0.0320 c RU
H19B H Uiso 0.06610 0.51650 0.80450 1.000 0.0320 c RU
H19C H Uiso -0.01170 0.52520 0.69270 1.000 0.0320 c RU
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'
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_publ_flag
C2 Ag1 C16 172.01(10) . yes
O2 Ag1 C2 92.66(8) 2_666 yes
O2 Ag1 C16 91.82(7) 2_666 yes
C6 Ag2 C12 171.15(9) . yes
Ag1 O2 C10 108.28(15) 2_666 yes
C1 N1 C2 124.32(19) . yes
C1 N1 C3 123.5(2) . yes
C2 N1 C3 112.1(2) . yes
C2 N2 C4 111.3(2) . yes
C2 N2 C5 123.80(18) . yes
C4 N2 C5 124.90(19) . yes
C5 N3 C6 122.55(18) . yes
C5 N3 C7 125.4(2) . yes
C6 N3 C7 111.83(19) . yes
C6 N4 C8 111.2(2) . yes
C6 N4 C9 124.8(2) . yes
C8 N4 C9 123.99(19) . yes
C11 N5 C12 124.56(19) . yes
C11 N5 C13 124.3(2) . yes
C12 N5 C13 111.14(19) . yes
C12 N6 C14 111.11(19) . yes
C12 N6 C15 123.55(19) . yes
C14 N6 C15 125.03(18) . yes
C15 N7 C16 123.76(18) . yes
C15 N7 C17 124.68(19) . yes
C16 N7 C17 111.4(2) . yes
C16 N8 C18 111.8(2) . yes
C16 N8 C19 124.72(19) . yes
C18 N8 C19 123.5(2) . yes
Ag1 C2 N1 126.61(17) . yes
Ag1 C2 N2 129.70(17) . yes
N1 C2 N2 103.45(19) . yes
N1 C3 C4 106.8(2) . yes
N2 C4 C3 106.3(2) . yes
N2 C5 N3 110.93(18) . yes
N2 C5 C10 112.19(19) . yes
N3 C5 C10 113.27(18) . yes
Ag2 C6 N3 128.26(15) . yes
Ag2 C6 N4 127.65(18) . yes
N3 C6 N4 103.86(19) . yes
N3 C7 C8 105.8(2) . yes
N4 C8 C7 107.3(2) . yes
O1 C10 O2 128.0(2) . yes
O1 C10 C5 116.8(2) . yes
O2 C10 C5 115.1(2) . yes
Ag2 C12 N5 123.28(15) . yes
Ag2 C12 N6 132.24(17) . yes
N5 C12 N6 104.38(19) . yes
N5 C13 C14 107.1(2) . yes
N6 C14 C13 106.3(2) . yes
N6 C15 N7 109.36(19) . yes
N6 C15 C20 113.09(19) . yes
N7 C15 C20 113.10(17) . yes
Ag1 C16 N7 129.08(17) . yes
Ag1 C16 N8 127.11(17) . yes
N7 C16 N8 103.81(18) . yes
N7 C17 C18 106.2(2) . yes
N8 C18 C17 106.8(2) . yes
O3 C20 O4 128.2(2) . yes
O3 C20 C15 116.2(2) . yes
O4 C20 C15 115.4(2) . yes
N1 C1 H1A 109.00 . no
N1 C1 H1B 109.00 . no
N1 C1 H1C 109.00 . no
H1A C1 H1B 109.00 . no
H1A C1 H1C 110.00 . no
H1B C1 H1C 110.00 . no
N1 C3 H3 127.00 . no
C4 C3 H3 127.00 . no
N2 C4 H4 127.00 . no
C3 C4 H4 127.00 . no
N2 C5 H5 107.00 . no
N3 C5 H5 107.00 . no
C10 C5 H5 107.00 . no
N3 C7 H7 127.00 . no
C8 C7 H7 127.00 . no
N4 C8 H8 126.00 . no
C7 C8 H8 126.00 . no
N4 C9 H9A 109.00 . no
N4 C9 H9B 110.00 . no
N4 C9 H9C 109.00 . no
H9A C9 H9B 109.00 . no
H9A C9 H9C 109.00 . no
H9B C9 H9C 109.00 . no
N5 C11 H11A 110.00 . no
N5 C11 H11B 109.00 . no
N5 C11 H11C 109.00 . no
H11A C11 H11B 110.00 . no
H11A C11 H11C 109.00 . no
H11B C11 H11C 109.00 . no
N5 C13 H13 126.00 . no
C14 C13 H13 127.00 . no
N6 C14 H14 127.00 . no
C13 C14 H14 127.00 . no
N6 C15 H15 107.00 . no
N7 C15 H15 107.00 . no
C20 C15 H15 107.00 . no
N7 C17 H17 127.00 . no
C18 C17 H17 127.00 . no
N8 C18 H18 127.00 . no
C17 C18 H18 127.00 . no
N8 C19 H19A 109.00 . no
N8 C19 H19B 109.00 . no
N8 C19 H19C 109.00 . no
H19A C19 H19B 109.00 . no
H19A C19 H19C 109.00 . no
H19B C19 H19C 109.00 . no
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 C2 2.097(2) . yes
Ag1 C16 2.102(2) . yes
Ag1 O2 2.808(2) 2_666 yes
Ag2 C6 2.082(2) . yes
Ag2 C12 2.086(2) . yes
O1 C10 1.239(3) . yes
O2 C10 1.254(3) . yes
O3 C20 1.238(3) . yes
O4 C20 1.253(3) . yes
N1 C1 1.461(3) . yes
N1 C2 1.349(3) . yes
N1 C3 1.379(3) . yes
N2 C2 1.367(3) . yes
N2 C4 1.390(3) . yes
N2 C5 1.445(3) . yes
N3 C5 1.453(3) . yes
N3 C6 1.355(3) . yes
N3 C7 1.388(3) . yes
N4 C6 1.353(3) . yes
N4 C8 1.383(3) . yes
N4 C9 1.464(4) . yes
N5 C11 1.464(3) . yes
N5 C12 1.352(3) . yes
N5 C13 1.382(3) . yes
N6 C12 1.355(3) . yes
N6 C14 1.390(3) . yes
N6 C15 1.455(3) . yes
N7 C15 1.455(3) . yes
N7 C16 1.361(3) . yes
N7 C17 1.391(3) . yes
N8 C16 1.352(3) . yes
N8 C18 1.382(3) . yes
N8 C19 1.462(3) . yes
C3 C4 1.343(4) . no
C5 C10 1.560(4) . no
C7 C8 1.343(4) . no
C13 C14 1.343(3) . no
C15 C20 1.560(3) . no
C17 C18 1.347(4) . no
C1 H1A 0.9800 . no
C1 H1B 0.9800 . no
C1 H1C 0.9800 . no
C3 H3 0.9500 . no
C4 H4 0.9500 . no
C5 H5 1.0000 . no
C7 H7 0.9500 . no
C8 H8 0.9500 . no
C9 H9A 0.9800 . no
C9 H9B 0.9800 . no
C9 H9C 0.9800 . no
C11 H11A 0.9800 . no
C11 H11B 0.9800 . no
C11 H11C 0.9800 . no
C13 H13 0.9500 . no
C14 H14 0.9500 . no
C15 H15 1.0000 . no
C17 H17 0.9500 . no
C18 H18 0.9500 . no
C19 H19A 0.9800 . no
C19 H19B 0.9800 . no
C19 H19C 0.9800 . no
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
_geom_hbond_publ_flag
C5 H5 O1 1.0000 2.3200 3.205(3) 146.00 2_666 yes
C15 H15 O1 1.0000 2.2100 3.109(3) 149.00 2_666 yes
C17 H17 O4 0.9500 2.5500 3.273(3) 133.00 2_677 yes
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_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O2 Ag1 C2 N1 113.8(2) 2_666 . . no
O2 Ag1 C2 N2 -59.6(2) 2_666 . . no
O2 Ag1 C16 N7 63.8(2) 2_666 . . no
O2 Ag1 C16 N8 -116.7(2) 2_666 . . no
C2 Ag1 O2 C10 86.43(16) . 2_666 2_666 no
C16 Ag1 O2 C10 -100.18(16) . 2_666 2_666 no
Ag1 O2 C10 O1 -18.6(3) 2_666 . . no
Ag1 O2 C10 C5 155.59(14) 2_666 . . no
C1 N1 C2 Ag1 5.0(3) . . . no
C1 N1 C2 N2 179.8(2) . . . no
C3 N1 C2 Ag1 -174.55(17) . . . no
C3 N1 C2 N2 0.2(3) . . . no
C1 N1 C3 C4 -179.4(2) . . . no
C2 N1 C3 C4 0.2(3) . . . no
C4 N2 C2 Ag1 174.03(17) . . . no
C4 N2 C2 N1 -0.5(3) . . . no
C5 N2 C2 Ag1 -7.1(3) . . . no
C5 N2 C2 N1 178.3(2) . . . no
C2 N2 C4 C3 0.6(3) . . . no
C5 N2 C4 C3 -178.2(2) . . . no
C2 N2 C5 N3 -106.5(2) . . . no
C2 N2 C5 C10 125.7(2) . . . no
C4 N2 C5 N3 72.2(3) . . . no
C4 N2 C5 C10 -55.6(3) . . . no
C6 N3 C5 N2 97.1(3) . . . no
C6 N3 C5 C10 -135.7(2) . . . no
C7 N3 C5 N2 -76.5(3) . . . no
C7 N3 C5 C10 50.7(3) . . . no
C5 N3 C6 Ag2 10.9(3) . . . no
C5 N3 C6 N4 -174.2(2) . . . no
C7 N3 C6 Ag2 -174.71(18) . . . no
C7 N3 C6 N4 0.1(3) . . . no
C5 N3 C7 C8 173.9(2) . . . no
C6 N3 C7 C8 -0.3(3) . . . no
C8 N4 C6 Ag2 175.0(2) . . . no
C8 N4 C6 N3 0.1(3) . . . no
C9 N4 C6 Ag2 -7.2(4) . . . no
C9 N4 C6 N3 177.9(2) . . . no
C6 N4 C8 C7 -0.3(3) . . . no
C9 N4 C8 C7 -178.2(3) . . . no
C11 N5 C12 Ag2 5.5(3) . . . no
C11 N5 C12 N6 -177.9(2) . . . no
C13 N5 C12 Ag2 -176.87(17) . . . no
C13 N5 C12 N6 -0.2(3) . . . no
C11 N5 C13 C14 177.9(2) . . . no
C12 N5 C13 C14 0.2(3) . . . no
C14 N6 C12 Ag2 176.37(19) . . . no
C14 N6 C12 N5 0.1(3) . . . no
C15 N6 C12 Ag2 -9.8(4) . . . no
C15 N6 C12 N5 174.0(2) . . . no
C12 N6 C14 C13 0.0(3) . . . no
C15 N6 C14 C13 -173.8(2) . . . no
C12 N6 C15 N7 -99.7(2) . . . no
C12 N6 C15 C20 133.3(2) . . . no
C14 N6 C15 N7 73.4(3) . . . no
C14 N6 C15 C20 -53.7(3) . . . no
C16 N7 C15 N6 102.6(2) . . . no
C16 N7 C15 C20 -130.4(2) . . . no
C17 N7 C15 N6 -72.0(3) . . . no
C17 N7 C15 C20 55.0(3) . . . no
C15 N7 C16 Ag1 3.6(3) . . . no
C15 N7 C16 N8 -176.0(2) . . . no
C17 N7 C16 Ag1 178.82(17) . . . no
C17 N7 C16 N8 -0.8(2) . . . no
C15 N7 C17 C18 176.0(2) . . . no
C16 N7 C17 C18 0.9(3) . . . no
C18 N8 C16 Ag1 -179.16(17) . . . no
C18 N8 C16 N7 0.5(3) . . . no
C19 N8 C16 Ag1 2.4(3) . . . no
C19 N8 C16 N7 -178.0(2) . . . no
C16 N8 C18 C17 0.0(3) . . . no
C19 N8 C18 C17 178.5(2) . . . no
N1 C3 C4 N2 -0.5(3) . . . no
N2 C5 C10 O1 -26.4(3) . . . no
N2 C5 C10 O2 158.81(18) . . . no
N3 C5 C10 O1 -152.90(19) . . . no
N3 C5 C10 O2 32.3(3) . . . no
N3 C7 C8 N4 0.4(3) . . . no
N5 C13 C14 N6 -0.1(3) . . . no
N6 C15 C20 O3 -22.6(3) . . . no
N6 C15 C20 O4 161.4(2) . . . no
N7 C15 C20 O3 -147.6(2) . . . no
N7 C15 C20 O4 36.4(3) . . . no
N7 C17 C18 N8 -0.5(3) . . . no
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 -0.009 -0.008 0.003 424 156 ' '
