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#$Date: 2022-02-04 21:17:26 +0200 (Fri, 04 Feb 2022) $
#$Revision: 272599 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/38/7243890.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_7243890
loop_
_publ_author_name
'Bai, Ye'
'Zhang, Mei-li'
'Wang, Bo-Tao'
'Ren, Yi-Xia'
'Zhao, Yu-Chao'
'Yang, Hua'
'Yang, Xiaogang'
_publ_section_title
;
 Four MOFs with isomeric ligands as fluorescent probes for highly
 selective, sensitive and stable detection of antibiotics in water
;
_journal_issue                   1
_journal_name_full               CrystEngComm
_journal_page_first              169
_journal_page_last               181
_journal_paper_doi               10.1039/D1CE01261D
_journal_volume                  24
_journal_year                    2022
_chemical_formula_sum            'C24 H22 N4 O4 Zn'
_chemical_formula_weight         495.82
_space_group_crystal_system      orthorhombic
_space_group_IT_number           19
_space_group_name_Hall           'P 2ac 2ab'
_space_group_name_H-M_alt        'P 21 21 21'
_atom_sites_solution_hydrogens   geom
_audit_block_doi                 10.5517/ccdc.csd.cc242y39
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2019-11-29 deposited with the CCDC.	2021-11-08 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.3124(11)
_cell_length_b                   14.5576(19)
_cell_length_c                   17.939(2)
_cell_measurement_reflns_used    5900
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      26.72
_cell_measurement_theta_min      2.27
_cell_volume                     2170.8(5)
_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-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.993
_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  0.0196
_diffrn_reflns_av_unetI/netI     0.0406
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            13267
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.973
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.869
_diffrn_reflns_theta_min         1.802
_exptl_absorpt_coefficient_mu    1.172
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.517
_exptl_crystal_description       block
_exptl_crystal_F_000             1024
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.130
_exptl_crystal_size_min          0.110
_exptl_transmission_factor_max   0.7457
_exptl_transmission_factor_min   0.6423
_refine_diff_density_max         0.261
_refine_diff_density_min         -0.178
_refine_diff_density_rms         0.040
_refine_ls_abs_structure_details
; 
 Flack x determined using 1705 quotients [(I+)-(I-)]/[(I+)+(I-)] 
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). 
;
_refine_ls_abs_structure_Flack   0.008(5)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.045
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     298
_refine_ls_number_reflns         5024
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.045
_refine_ls_R_factor_all          0.0323
_refine_ls_R_factor_gt           0.0265
_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)+(0.0219P)²+0.2804P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0580
_refine_ls_wR_factor_ref         0.0670
_reflns_Friedel_coverage         0.728
_reflns_Friedel_fraction_full    0.986
_reflns_Friedel_fraction_max     0.947
_reflns_number_gt                4464
_reflns_number_total             5024
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1ce01261d2.cif
_cod_data_source_block           1_a
_cod_depositor_comments
'Adding full bibliography for 7243890--7243892.cif.'
_cod_database_code               7243890
_shelx_shelxl_version_number     2018/3
_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   0.799
_shelx_estimated_absorpt_t_max   0.882
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'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
Zn1 Zn 0.05370(4) 0.55191(2) 0.27311(2) 0.03926(10) Uani 1 1 d . . . . .
O1 O 0.2259(3) 0.73561(17) 0.25718(12) 0.0540(6) Uani 1 1 d . . . . .
O2 O 0.1501(3) 0.63825(17) 0.34424(13) 0.0607(7) Uani 1 1 d . . . . .
O3 O 0.8035(3) 1.01922(18) 0.31139(14) 0.0598(6) Uani 1 1 d . . . . .
O4 O 0.9956(4) 0.9187(2) 0.31913(15) 0.0769(9) Uani 1 1 d . . . . .
N1 N 0.0027(3) 0.45841(16) 0.35397(12) 0.0381(5) Uani 1 1 d . . . . .
N2 N -0.0788(3) 0.33608(15) 0.41487(12) 0.0338(5) Uani 1 1 d . . . . .
N3 N -0.1682(3) 0.27967(17) 0.71512(12) 0.0387(5) Uani 1 1 d . . . . .
N4 N -0.3485(3) 0.38770(17) 0.73578(13) 0.0395(5) Uani 1 1 d . . . . .
C1 C 0.2123(4) 0.7127(2) 0.32299(16) 0.0399(7) Uani 1 1 d . . . . .
C2 C 0.2732(4) 0.7745(2) 0.38473(18) 0.0468(8) Uani 1 1 d . . . . .
H2A H 0.246766 0.837759 0.372914 0.056 Uiso 1 1 calc R U . . .
H2AB H 0.219210 0.758694 0.430916 0.056 Uiso 1 1 calc R U . . .
C3 C 0.4522(4) 0.7662(2) 0.39551(14) 0.0382(6) Uani 1 1 d . . . . .
C4 C 0.5275(4) 0.6809(2) 0.39842(16) 0.0424(7) Uani 1 1 d . . . . .
H4 H 0.466625 0.627562 0.393971 0.051 Uiso 1 1 calc R U . . .
C5 C 0.6928(4) 0.6750(2) 0.40791(18) 0.0474(8) Uani 1 1 d . . . . .
H5 H 0.742122 0.617678 0.409104 0.057 Uiso 1 1 calc R U . . .
C6 C 0.7843(4) 0.7529(3) 0.41556(17) 0.0492(8) Uani 1 1 d . . . . .
H6 H 0.894968 0.748119 0.422162 0.059 Uiso 1 1 calc R U . . .
C7 C 0.7127(4) 0.8383(2) 0.41349(15) 0.0437(7) Uani 1 1 d . . . . .
C8 C 0.5471(5) 0.8437(2) 0.40328(14) 0.0424(7) Uani 1 1 d . . . . .
H8 H 0.498646 0.901213 0.401615 0.051 Uiso 1 1 calc R U . . .
C9 C 0.8124(5) 0.9246(2) 0.42059(18) 0.0590(10) Uani 1 1 d . . . . .
H9A H 0.901903 0.913183 0.454019 0.071 Uiso 1 1 calc R U . . .
H9AB H 0.747037 0.973037 0.442021 0.071 Uiso 1 1 calc R U . . .
C10 C 0.8767(4) 0.9558(2) 0.34500(17) 0.0457(7) Uani 1 1 d . . . . .
C11 C -0.0667(4) 0.37708(18) 0.34797(14) 0.0348(6) Uani 1 1 d . . . . .
H11 H -0.102400 0.351609 0.303401 0.042 Uiso 1 1 calc R U . . .
C12 C 0.0358(4) 0.4704(2) 0.42856(16) 0.0451(7) Uani 1 1 d . . . . .
H12 H 0.085122 0.521714 0.449370 0.054 Uiso 1 1 calc R U . . .
C13 C -0.0148(4) 0.3957(2) 0.46667(16) 0.0447(8) Uani 1 1 d . . . . .
H13 H -0.007849 0.386386 0.517857 0.054 Uiso 1 1 calc R U . . .
C14 C -0.1657(4) 0.24849(19) 0.42813(15) 0.0383(7) Uani 1 1 d . . . . .
H14A H -0.163774 0.212143 0.382827 0.046 Uiso 1 1 calc R U . . .
H14B H -0.277188 0.261928 0.439766 0.046 Uiso 1 1 calc R U . . .
C15 C -0.0936(3) 0.19289(18) 0.49098(15) 0.0320(6) Uani 1 1 d . . . . .
C16 C -0.1311(3) 0.2139(2) 0.56501(15) 0.0337(6) Uani 1 1 d . . . . .
H16 H -0.200498 0.262429 0.575029 0.040 Uiso 1 1 calc R U . . .
C17 C -0.0675(4) 0.16397(18) 0.62383(14) 0.0334(6) Uani 1 1 d . . . . .
C18 C 0.0299(4) 0.08877(19) 0.60785(17) 0.0406(7) Uani 1 1 d . . . . .
H18 H 0.070514 0.053201 0.646599 0.049 Uiso 1 1 calc R U . . .
C19 C 0.0671(4) 0.06637(19) 0.53484(17) 0.0441(7) Uani 1 1 d . . . . .
H19 H 0.132252 0.015957 0.524747 0.053 Uiso 1 1 calc R U . . .
C20 C 0.0070(4) 0.11918(18) 0.47665(16) 0.0389(7) Uani 1 1 d . . . . .
H20 H 0.034488 0.104916 0.427752 0.047 Uiso 1 1 calc R U . . .
C21 C -0.0991(4) 0.1881(2) 0.70493(16) 0.0448(8) Uani 1 1 d . . . . .
H21A H -0.172018 0.142964 0.725932 0.054 Uiso 1 1 calc R U . . .
H21B H 0.001287 0.184522 0.732321 0.054 Uiso 1 1 calc R U . . .
C22 C -0.3207(4) 0.2984(2) 0.73414(16) 0.0382(6) Uani 1 1 d . . . . .
H22 H -0.397586 0.253866 0.744874 0.046 Uiso 1 1 calc R U . . .
C23 C -0.2050(4) 0.4281(2) 0.71623(17) 0.0467(7) Uani 1 1 d . . . . .
H23 H -0.188061 0.491045 0.711977 0.056 Uiso 1 1 calc R U . . .
C24 C -0.0928(4) 0.3632(2) 0.70418(16) 0.0473(8) Uani 1 1 d . . . . .
H24 H 0.014222 0.372652 0.691094 0.057 Uiso 1 1 calc R U . . .
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'
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'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_citation_id
_citation_doi
_citation_year
1 10.1039/D0DT01810D 2020
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
O2 Zn1 O3 113.97(11) . 3_645 ?
O2 Zn1 N4 106.25(11) . 2_464 ?
O3 Zn1 N4 110.76(10) 3_645 2_464 ?
O2 Zn1 N1 92.86(10) . . ?
O3 Zn1 N1 120.62(10) 3_645 . ?
N4 Zn1 N1 110.47(10) 2_464 . ?
C1 O2 Zn1 121.5(2) . . ?
C10 O3 Zn1 104.6(2) . 3_655 ?
C11 N1 C12 106.3(2) . . ?
C11 N1 Zn1 129.23(18) . . ?
C12 N1 Zn1 124.50(19) . . ?
C11 N2 C13 107.1(2) . . ?
C11 N2 C14 124.1(2) . . ?
C13 N2 C14 128.4(2) . . ?
C22 N3 C24 106.7(2) . . ?
C22 N3 C21 126.0(3) . . ?
C24 N3 C21 127.3(3) . . ?
C22 N4 C23 105.3(3) . . ?
C22 N4 Zn1 125.4(2) . 2_465 ?
C23 N4 Zn1 128.8(2) . 2_465 ?
O1 C1 O2 124.1(3) . . ?
O1 C1 C2 120.6(3) . . ?
O2 C1 C2 115.3(3) . . ?
C3 C2 C1 112.1(3) . . ?
C3 C2 H2A 109.2 . . ?
C1 C2 H2A 109.2 . . ?
C3 C2 H2AB 109.2 . . ?
C1 C2 H2AB 109.2 . . ?
H2A C2 H2AB 107.9 . . ?
C8 C3 C4 117.9(3) . . ?
C8 C3 C2 120.7(3) . . ?
C4 C3 C2 121.4(3) . . ?
C5 C4 C3 120.3(3) . . ?
C5 C4 H4 119.8 . . ?
C3 C4 H4 119.8 . . ?
C6 C5 C4 120.7(3) . . ?
C6 C5 H5 119.7 . . ?
C4 C5 H5 119.7 . . ?
C5 C6 C7 120.2(3) . . ?
C5 C6 H6 119.9 . . ?
C7 C6 H6 119.9 . . ?
C6 C7 C8 118.8(3) . . ?
C6 C7 C9 120.7(3) . . ?
C8 C7 C9 120.5(3) . . ?
C3 C8 C7 122.1(3) . . ?
C3 C8 H8 118.9 . . ?
C7 C8 H8 118.9 . . ?
C7 C9 C10 111.4(3) . . ?
C7 C9 H9A 109.3 . . ?
C10 C9 H9A 109.3 . . ?
C7 C9 H9AB 109.3 . . ?
C10 C9 H9AB 109.3 . . ?
H9A C9 H9AB 108.0 . . ?
O4 C10 O3 122.3(3) . . ?
O4 C10 C9 119.4(3) . . ?
O3 C10 C9 118.3(3) . . ?
N1 C11 N2 111.0(2) . . ?
N1 C11 H11 124.5 . . ?
N2 C11 H11 124.5 . . ?
C13 C12 N1 109.1(3) . . ?
C13 C12 H12 125.5 . . ?
N1 C12 H12 125.5 . . ?
C12 C13 N2 106.6(2) . . ?
C12 C13 H13 126.7 . . ?
N2 C13 H13 126.7 . . ?
N2 C14 C15 112.7(2) . . ?
N2 C14 H14A 109.0 . . ?
C15 C14 H14A 109.0 . . ?
N2 C14 H14B 109.0 . . ?
C15 C14 H14B 109.0 . . ?
H14A C14 H14B 107.8 . . ?
C20 C15 C16 118.7(2) . . ?
C20 C15 C14 121.1(2) . . ?
C16 C15 C14 120.2(2) . . ?
C17 C16 C15 121.6(3) . . ?
C17 C16 H16 119.2 . . ?
C15 C16 H16 119.2 . . ?
C16 C17 C18 118.5(3) . . ?
C16 C17 C21 122.8(3) . . ?
C18 C17 C21 118.7(3) . . ?
C19 C18 C17 120.7(3) . . ?
C19 C18 H18 119.7 . . ?
C17 C18 H18 119.7 . . ?
C18 C19 C20 120.0(3) . . ?
C18 C19 H19 120.0 . . ?
C20 C19 H19 120.0 . . ?
C15 C20 C19 120.4(3) . . ?
C15 C20 H20 119.8 . . ?
C19 C20 H20 119.8 . . ?
N3 C21 C17 113.5(2) . . ?
N3 C21 H21A 108.9 . . ?
C17 C21 H21A 108.9 . . ?
N3 C21 H21B 108.9 . . ?
C17 C21 H21B 108.9 . . ?
H21A C21 H21B 107.7 . . ?
N4 C22 N3 111.8(3) . . ?
N4 C22 H22 124.1 . . ?
N3 C22 H22 124.1 . . ?
C24 C23 N4 110.0(3) . . ?
C24 C23 H23 125.0 . . ?
N4 C23 H23 125.0 . . ?
C23 C24 N3 106.3(3) . . ?
C23 C24 H24 126.9 . . ?
N3 C24 H24 126.9 . . ?
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
Zn1 O2 1.962(2) . ?
Zn1 O3 1.983(2) 3_645 ?
Zn1 N4 2.033(2) 2_464 ?
Zn1 N1 2.034(2) . ?
O1 C1 1.232(4) . ?
O2 C1 1.259(4) . ?
O3 C10 1.259(4) . ?
O4 C10 1.218(4) . ?
N1 C11 1.322(4) . ?
N1 C12 1.377(4) . ?
N2 C11 1.344(3) . ?
N2 C13 1.378(4) . ?
N2 C14 1.485(3) . ?
N3 C22 1.341(4) . ?
N3 C24 1.382(4) . ?
N3 C21 1.463(4) . ?
N4 C22 1.321(4) . ?
N4 C23 1.375(4) . ?
C1 C2 1.515(4) . ?
C2 C3 1.505(5) . ?
C2 H2A 0.9700 . ?
C2 H2AB 0.9700 . ?
C3 C8 1.384(4) . ?
C3 C4 1.391(4) . ?
C4 C5 1.388(5) . ?
C4 H4 0.9300 . ?
C5 C6 1.373(5) . ?
C5 H5 0.9300 . ?
C6 C7 1.379(5) . ?
C6 H6 0.9300 . ?
C7 C8 1.391(5) . ?
C7 C9 1.509(4) . ?
C8 H8 0.9300 . ?
C9 C10 1.527(4) . ?
C9 H9A 0.9700 . ?
C9 H9AB 0.9700 . ?
C11 H11 0.9300 . ?
C12 C13 1.352(4) . ?
C12 H12 0.9300 . ?
C13 H13 0.9300 . ?
C14 C15 1.512(4) . ?
C14 H14A 0.9700 . ?
C14 H14B 0.9700 . ?
C15 C20 1.384(4) . ?
C15 C16 1.398(4) . ?
C16 C17 1.386(4) . ?
C16 H16 0.9300 . ?
C17 C18 1.392(4) . ?
C17 C21 1.520(4) . ?
C18 C19 1.385(4) . ?
C18 H18 0.9300 . ?
C19 C20 1.389(4) . ?
C19 H19 0.9300 . ?
C20 H20 0.9300 . ?
C21 H21A 0.9700 . ?
C21 H21B 0.9700 . ?
C22 H22 0.9300 . ?
C23 C24 1.345(5) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
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
Zn1 O2 C1 O1 -3.9(5) . . . . ?
Zn1 O2 C1 C2 176.7(2) . . . . ?
O1 C1 C2 C3 -80.1(4) . . . . ?
O2 C1 C2 C3 99.4(4) . . . . ?
C1 C2 C3 C8 134.3(3) . . . . ?
C1 C2 C3 C4 -46.0(4) . . . . ?
C8 C3 C4 C5 -0.8(4) . . . . ?
C2 C3 C4 C5 179.6(3) . . . . ?
C3 C4 C5 C6 0.9(5) . . . . ?
C4 C5 C6 C7 -0.3(5) . . . . ?
C5 C6 C7 C8 -0.2(4) . . . . ?
C5 C6 C7 C9 -179.0(3) . . . . ?
C4 C3 C8 C7 0.2(4) . . . . ?
C2 C3 C8 C7 179.8(3) . . . . ?
C6 C7 C8 C3 0.3(4) . . . . ?
C9 C7 C8 C3 179.1(3) . . . . ?
C6 C7 C9 C10 86.8(4) . . . . ?
C8 C7 C9 C10 -92.0(4) . . . . ?
Zn1 O3 C10 O4 -9.9(4) 3_655 . . . ?
Zn1 O3 C10 C9 170.5(2) 3_655 . . . ?
C7 C9 C10 O4 -80.5(4) . . . . ?
C7 C9 C10 O3 99.2(4) . . . . ?
C12 N1 C11 N2 -0.4(4) . . . . ?
Zn1 N1 C11 N2 -179.98(19) . . . . ?
C13 N2 C11 N1 0.8(3) . . . . ?
C14 N2 C11 N1 173.5(3) . . . . ?
C11 N1 C12 C13 -0.1(4) . . . . ?
Zn1 N1 C12 C13 179.5(2) . . . . ?
N1 C12 C13 N2 0.6(4) . . . . ?
C11 N2 C13 C12 -0.8(4) . . . . ?
C14 N2 C13 C12 -173.2(3) . . . . ?
C11 N2 C14 C15 149.4(3) . . . . ?
C13 N2 C14 C15 -39.5(4) . . . . ?
N2 C14 C15 C20 -100.4(3) . . . . ?
N2 C14 C15 C16 81.3(3) . . . . ?
C20 C15 C16 C17 1.4(4) . . . . ?
C14 C15 C16 C17 179.8(3) . . . . ?
C15 C16 C17 C18 -3.0(4) . . . . ?
C15 C16 C17 C21 176.8(3) . . . . ?
C16 C17 C18 C19 2.3(4) . . . . ?
C21 C17 C18 C19 -177.5(3) . . . . ?
C17 C18 C19 C20 0.0(5) . . . . ?
C16 C15 C20 C19 1.0(4) . . . . ?
C14 C15 C20 C19 -177.3(3) . . . . ?
C18 C19 C20 C15 -1.7(5) . . . . ?
C22 N3 C21 C17 107.3(3) . . . . ?
C24 N3 C21 C17 -69.8(4) . . . . ?
C16 C17 C21 N3 -14.1(4) . . . . ?
C18 C17 C21 N3 165.7(3) . . . . ?
C23 N4 C22 N3 0.3(3) . . . . ?
Zn1 N4 C22 N3 -172.51(18) 2_465 . . . ?
C24 N3 C22 N4 0.3(3) . . . . ?
C21 N3 C22 N4 -177.2(2) . . . . ?
C22 N4 C23 C24 -0.9(3) . . . . ?
Zn1 N4 C23 C24 171.6(2) 2_465 . . . ?
N4 C23 C24 N3 1.1(3) . . . . ?
C22 N3 C24 C23 -0.8(3) . . . . ?
C21 N3 C24 C23 176.6(3) . . . . ?
