#------------------------------------------------------------------------------
#$Date: 2021-02-16 11:27:23 +0200 (Tue, 16 Feb 2021) $
#$Revision: 262003 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/04/1560421.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_1560421
loop_
_publ_author_name
'Jia, Jia'
'Wang, Pengcheng'
'Chai, Juan'
'Ma, Bing'
'Sun, Jing'
'Chen, Xiaobo'
'Fan, Yong'
'Wang, Li'
'Xu, Jianing'
_publ_section_title
;
 Construction of new zinc(II) coordination polymers by
 1-(triazol-1-yl)-2,4,6-benzenetricarboxylate ligand for sensitizing
 lanthanide(III) ions and sensing small molecules
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              430
_journal_page_last               437
_journal_paper_doi               10.1016/j.jssc.2017.06.015
_journal_volume                  253
_journal_year                    2017
_chemical_formula_sum            'C23 H13 N5 O11 Zn2'
_chemical_formula_weight         666.12
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                95.54(3)
_cell_angle_beta                 102.59(3)
_cell_angle_gamma                96.25(3)
_cell_formula_units_Z            2
_cell_length_a                   9.2753(19)
_cell_length_b                   9.853(2)
_cell_length_c                   14.085(3)
_cell_measurement_reflns_used    12165
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.43
_cell_measurement_theta_min      2.99
_cell_volume                     1239.2(5)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0291
_diffrn_reflns_av_sigmaI/netI    0.0378
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            12165
_diffrn_reflns_theta_full        27.43
_diffrn_reflns_theta_max         27.43
_diffrn_reflns_theta_min         2.99
_exptl_absorpt_coefficient_mu    2.009
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.785
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             668
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.412
_refine_diff_density_min         -0.523
_refine_diff_density_rms         0.079
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     374
_refine_ls_number_reflns         5548
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.050
_refine_ls_R_factor_all          0.0459
_refine_ls_R_factor_gt           0.0347
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0327P)²+1.5245P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0796
_refine_ls_wR_factor_ref         0.0869
_reflns_number_gt                4599
_reflns_number_total             5548
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            JSSC-2017-253-430.cif
_cod_data_source_block           j
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Triclinic' was changed to
'triclinic' in accordance with the built-in table derived from the
CIF Core dictionary named 'cif_core.dic' version 2.4.5 last updated
on 2014-11-21.

Automatic conversion script
Id: cif_fix_values 8369 2020-08-20 11:38:08Z andrius 
;
_cod_original_cell_volume        1239.2(4)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               1560421
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
O7 O 1.2385(3) 0.7974(2) -0.2398(2) 0.0480(7) Uani 1 1 d . . .
C22 C 1.1921(3) 0.8852(3) -0.1912(2) 0.0238(6) Uani 1 1 d . . .
C23 C 0.8183(3) 0.5142(3) -0.1356(2) 0.0246(6) Uani 1 1 d . . .
C21 C 0.7250(3) 1.0181(3) -0.10848(19) 0.0200(5) Uani 1 1 d . . .
C16 C 0.8278(3) 0.9087(2) -0.10994(19) 0.0178(5) Uani 1 1 d . . .
C18 C 1.0518(3) 0.8460(3) -0.15603(19) 0.0196(5) Uani 1 1 d . . .
C19 C 0.9992(3) 0.7083(3) -0.1592(2) 0.0225(5) Uani 1 1 d . . .
H19 H 1.0535 0.6416 -0.1795 0.027 Uiso 1 1 calc R . .
C20 C 0.8667(3) 0.6676(3) -0.1325(2) 0.0212(5) Uani 1 1 d . . .
C15 C 0.7815(3) 0.7684(3) -0.10862(18) 0.0183(5) Uani 1 1 d . . .
Zn1 Zn 0.33891(3) 0.71187(3) 0.09166(2) 0.02064(9) Uani 1 1 d . . .
Zn2 Zn 0.59184(3) 0.95220(3) 0.24687(2) 0.02360(9) Uani 1 1 d . . .
O1 O 0.4905(3) 0.7650(2) 0.20909(18) 0.0319(5) Uani 1 1 d . . .
O2 O 0.2119(2) 0.86045(18) 0.07848(15) 0.0272(4) Uani 1 1 d . . .
O4 O 0.4113(2) 1.0181(2) 0.14184(16) 0.0301(5) Uani 1 1 d . . .
O5 O 0.7486(2) 0.9897(2) 0.17083(15) 0.0282(4) Uani 1 1 d . . .
O6 O 0.8255(3) 0.4368(2) -0.20730(18) 0.0449(6) Uani 1 1 d . . .
O3 O 0.2248(2) 0.52442(19) 0.06121(15) 0.0288(4) Uani 1 1 d . . .
N1 N 0.7448(3) 0.8984(3) 0.37394(19) 0.0331(6) Uani 1 1 d . . .
N2 N 0.5581(3) 1.0905(2) 0.36140(19) 0.0306(5) Uani 1 1 d . . .
N3 N 0.4569(3) 0.7007(2) -0.01513(18) 0.0259(5) Uani 1 1 d . . .
N4 N 0.6419(2) 0.7265(2) -0.08628(16) 0.0199(4) Uani 1 1 d . . .
N5 N 0.5358(3) 0.6315(2) -0.14848(18) 0.0282(5) Uani 1 1 d . . .
C6 C 0.8264(5) 1.0510(5) 0.6335(3) 0.0608(12) Uani 1 1 d . . .
H6 H 0.8860 1.0416 0.6942 0.073 Uiso 1 1 calc R . .
C7 C 0.7393(5) 1.1502(5) 0.6274(3) 0.0632(13) Uani 1 1 d . . .
H7 H 0.7390 1.2078 0.6837 0.076 Uiso 1 1 calc R . .
C11 C 0.4621(5) 1.2791(4) 0.4344(4) 0.0585(11) Uani 1 1 d . . .
H11 H 0.3988 1.3463 0.4264 0.070 Uiso 1 1 calc R . .
C13 C 0.4265(3) 0.6201(3) -0.1023(2) 0.0286(6) Uani 1 1 d . . .
H13 H 0.3373 0.5624 -0.1273 0.034 Uiso 1 1 calc R . .
C9 C 0.6463(4) 1.0817(3) 0.4509(2) 0.0341(7) Uani 1 1 d . . .
C14 C 0.5928(3) 0.7660(3) -0.0072(2) 0.0240(6) Uani 1 1 d . . .
H14 H 0.6455 0.8295 0.0454 0.029 Uiso 1 1 calc R . .
C2 C 0.9177(4) 0.7707(4) 0.4671(3) 0.0569(11) Uani 1 1 d . . .
H2 H 0.9747 0.6986 0.4681 0.068 Uiso 1 1 calc R . .
C5 C 0.7431(4) 0.9771(3) 0.4580(2) 0.0341(7) Uani 1 1 d . . .
C8 C 0.6454(4) 1.1700(4) 0.5353(3) 0.0466(9) Uani 1 1 d . . .
C1 C 0.8302(4) 0.7988(4) 0.3790(3) 0.0461(9) Uani 1 1 d . . .
H1 H 0.8320 0.7451 0.3214 0.055 Uiso 1 1 calc R . .
C4 C 0.8315(4) 0.9584(4) 0.5496(3) 0.0484(9) Uani 1 1 d . . .
C12 C 0.4691(4) 1.1866(3) 0.3538(3) 0.0443(8) Uani 1 1 d . . .
H12 H 0.4087 1.1932 0.2928 0.053 Uiso 1 1 calc R . .
C3 C 0.9179(5) 0.8500(4) 0.5507(3) 0.0586(12) Uani 1 1 d . . .
H3 H 0.9760 0.8325 0.6098 0.070 Uiso 1 1 calc R . .
C10 C 0.5487(5) 1.2699(4) 0.5244(3) 0.0584(12) Uani 1 1 d . . .
H10 H 0.5436 1.3298 0.5784 0.070 Uiso 1 1 calc R . .
C17 C 0.9675(3) 0.9456(3) -0.12933(18) 0.0186(5) Uani 1 1 d . . .
H17 H 1.0047 1.0382 -0.1243 0.022 Uiso 1 1 calc R . .
O1W O 0.1742(3) 0.5835(3) 0.6077(2) 0.0650(8) Uani 1 1 d . . .
O2W O 0.4250(4) 0.4526(3) 0.6760(2) 0.0719(9) Uani 1 1 d . . .
O4W O 0.8714(4) 0.5048(3) 0.6060(2) 0.0751(9) Uani 1 1 d . . .
O3W O 0.1325(5) 0.3572(5) 0.8653(3) 0.1093(14) Uani 1 1 d . . .
H20 H 0.516(5) 0.720(4) 0.237(3) 0.045(14) Uiso 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'
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_
_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
O7 C22 O5 124.1(3) . 2_775
O7 C22 C18 118.8(2) . .
O5 C22 C18 117.1(2) 2_775 .
O6 C23 O3 124.6(3) . 2_665
O6 C23 C20 118.6(3) . .
O3 C23 C20 116.7(2) 2_665 .
O4 C21 O2 126.3(2) 2_675 2_675
O4 C21 C16 117.7(2) 2_675 .
O2 C21 C16 115.9(2) 2_675 .
C17 C16 C15 117.9(2) . .
C17 C16 C21 118.1(2) . .
C15 C16 C21 123.2(2) . .
C19 C18 C17 119.3(2) . .
C19 C18 C22 119.4(2) . .
C17 C18 C22 121.0(2) . .
C18 C19 C20 121.3(2) . .
C18 C19 H19 119.4 . .
C20 C19 H19 119.4 . .
C19 C20 C15 118.6(2) . .
C19 C20 C23 118.1(2) . .
C15 C20 C23 123.2(2) . .
C20 C15 C16 121.4(2) . .
C20 C15 N4 118.7(2) . .
C16 C15 N4 119.8(2) . .
O1 Zn1 O2 106.91(10) . .
O1 Zn1 O3 121.72(10) . .
O2 Zn1 O3 113.65(8) . .
O1 Zn1 N3 103.20(10) . .
O2 Zn1 N3 111.66(9) . .
O3 Zn1 N3 98.78(9) . .
O1 Zn2 O5 110.53(10) . .
O1 Zn2 N2 124.96(10) . .
O5 Zn2 N2 124.24(9) . .
O1 Zn2 N1 93.46(10) . .
O5 Zn2 N1 94.94(10) . .
N2 Zn2 N1 77.90(10) . .
O1 Zn2 O4 87.75(9) . .
O5 Zn2 O4 95.88(8) . .
N2 Zn2 O4 91.56(10) . .
N1 Zn2 O4 167.93(9) . .
Zn1 O1 Zn2 122.74(13) . .
Zn1 O1 H20 121(4) . .
Zn2 O1 H20 116(4) . .
C21 O2 Zn1 117.18(17) 2_675 .
C21 O4 Zn2 137.45(18) 2_675 .
C22 O5 Zn2 110.24(18) 2_775 .
C23 O3 Zn1 111.50(17) 2_665 .
C1 N1 C5 118.4(3) . .
C1 N1 Zn2 128.9(2) . .
C5 N1 Zn2 112.6(2) . .
C12 N2 C9 118.4(3) . .
C12 N2 Zn2 127.2(2) . .
C9 N2 Zn2 114.3(2) . .
C14 N3 C13 104.4(2) . .
C14 N3 Zn1 125.0(2) . .
C13 N3 Zn1 130.31(19) . .
C14 N4 N5 109.6(2) . .
C14 N4 C15 128.8(2) . .
N5 N4 C15 121.6(2) . .
C13 N5 N4 103.2(2) . .
C7 C6 C4 122.2(4) . .
C7 C6 H6 118.9 . .
C4 C6 H6 118.9 . .
C6 C7 C8 121.3(4) . .
C6 C7 H7 119.4 . .
C8 C7 H7 119.4 . .
C10 C11 C12 119.5(4) . .
C10 C11 H11 120.2 . .
C12 C11 H11 120.2 . .
N5 C13 N3 113.5(3) . .
N5 C13 H13 123.3 . .
N3 C13 H13 123.3 . .
N2 C9 C8 122.7(3) . .
N2 C9 C5 117.8(3) . .
C8 C9 C5 119.5(3) . .
N3 C14 N4 109.4(2) . .
N3 C14 H14 125.3 . .
N4 C14 H14 125.3 . .
C3 C2 C1 118.8(4) . .
C3 C2 H2 120.6 . .
C1 C2 H2 120.6 . .
N1 C5 C4 122.2(3) . .
N1 C5 C9 117.3(3) . .
C4 C5 C9 120.4(3) . .
C10 C8 C9 117.2(4) . .
C10 C8 C7 124.0(4) . .
C9 C8 C7 118.7(4) . .
N1 C1 C2 123.0(4) . .
N1 C1 H1 118.5 . .
C2 C1 H1 118.5 . .
C3 C4 C5 116.8(4) . .
C3 C4 C6 125.4(4) . .
C5 C4 C6 117.8(4) . .
N2 C12 C11 122.4(4) . .
N2 C12 H12 118.8 . .
C11 C12 H12 118.8 . .
C2 C3 C4 120.8(4) . .
C2 C3 H3 119.6 . .
C4 C3 H3 119.6 . .
C11 C10 C8 119.8(4) . .
C11 C10 H10 120.1 . .
C8 C10 H10 120.1 . .
C18 C17 C16 121.1(2) . .
C18 C17 H17 119.4 . .
C16 C17 H17 119.4 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
O7 C22 1.224(4) .
C22 O5 1.272(3) 2_775
C22 C18 1.516(4) .
C23 O6 1.224(4) .
C23 O3 1.277(3) 2_665
C23 C20 1.523(3) .
C21 O4 1.248(3) 2_675
C21 O2 1.263(3) 2_675
C21 C16 1.517(3) .
C16 C17 1.398(3) .
C16 C15 1.405(3) .
C18 C19 1.384(4) .
C18 C17 1.393(4) .
C19 C20 1.391(4) .
C19 H19 0.9300 .
C20 C15 1.395(4) .
C15 N4 1.426(3) .
Zn1 O1 1.910(2) .
Zn1 O2 1.9742(19) .
Zn1 O3 1.9846(19) .
Zn1 N3 2.045(2) .
Zn2 O1 1.945(2) .
Zn2 O5 2.009(2) .
Zn2 N2 2.109(3) .
Zn2 N1 2.177(3) .
Zn2 O4 2.181(2) .
O1 H20 0.65(4) .
O2 C21 1.263(3) 2_675
O4 C21 1.248(3) 2_675
O5 C22 1.272(3) 2_775
O3 C23 1.277(3) 2_665
N1 C1 1.325(4) .
N1 C5 1.355(4) .
N2 C12 1.319(4) .
N2 C9 1.361(4) .
N3 C14 1.328(4) .
N3 C13 1.353(4) .
N4 C14 1.333(3) .
N4 N5 1.370(3) .
N5 C13 1.319(4) .
C6 C7 1.332(7) .
C6 C4 1.434(6) .
C6 H6 0.9300 .
C7 C8 1.439(6) .
C7 H7 0.9300 .
C11 C10 1.362(7) .
C11 C12 1.404(5) .
C11 H11 0.9300 .
C13 H13 0.9300 .
C9 C8 1.405(5) .
C9 C5 1.436(5) .
C14 H14 0.9300 .
C2 C3 1.348(6) .
C2 C1 1.396(5) .
C2 H2 0.9300 .
C5 C4 1.410(5) .
C8 C10 1.400(6) .
C1 H1 0.9300 .
C4 C3 1.403(6) .
C12 H12 0.9300 .
C3 H3 0.9300 .
C10 H10 0.9300 .
C17 H17 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
O4 C21 C16 C17 143.3(3) 2_675 . . .
O2 C21 C16 C17 -32.7(3) 2_675 . . .
O4 C21 C16 C15 -26.1(4) 2_675 . . .
O2 C21 C16 C15 157.9(2) 2_675 . . .
O7 C22 C18 C19 14.9(4) . . . .
O5 C22 C18 C19 -167.6(2) 2_775 . . .
O7 C22 C18 C17 -159.0(3) . . . .
O5 C22 C18 C17 18.5(4) 2_775 . . .
C17 C18 C19 C20 -2.5(4) . . . .
C22 C18 C19 C20 -176.6(2) . . . .
C18 C19 C20 C15 4.3(4) . . . .
C18 C19 C20 C23 -178.6(2) . . . .
O6 C23 C20 C19 -45.3(4) . . . .
O3 C23 C20 C19 133.4(3) 2_665 . . .
O6 C23 C20 C15 131.6(3) . . . .
O3 C23 C20 C15 -49.7(4) 2_665 . . .
C19 C20 C15 C16 -0.8(4) . . . .
C23 C20 C15 C16 -177.7(2) . . . .
C19 C20 C15 N4 176.7(2) . . . .
C23 C20 C15 N4 -0.2(4) . . . .
C17 C16 C15 C20 -4.4(4) . . . .
C21 C16 C15 C20 165.1(2) . . . .
C17 C16 C15 N4 178.1(2) . . . .
C21 C16 C15 N4 -12.4(4) . . . .
O2 Zn1 O1 Zn2 -41.40(17) . . . .
O3 Zn1 O1 Zn2 -174.30(11) . . . .
N3 Zn1 O1 Zn2 76.47(16) . . . .
O5 Zn2 O1 Zn1 -78.54(16) . . . .
N2 Zn2 O1 Zn1 107.23(16) . . . .
N1 Zn2 O1 Zn1 -175.13(15) . . . .
O4 Zn2 O1 Zn1 16.90(15) . . . .
O1 Zn1 O2 C21 34.1(2) . . . 2_675
O3 Zn1 O2 C21 171.25(19) . . . 2_675
N3 Zn1 O2 C21 -78.1(2) . . . 2_675
O1 Zn2 O4 C21 32.0(3) . . . 2_675
O5 Zn2 O4 C21 142.4(3) . . . 2_675
N2 Zn2 O4 C21 -92.9(3) . . . 2_675
N1 Zn2 O4 C21 -64.0(5) . . . 2_675
O1 Zn2 O5 C22 175.83(18) . . . 2_775
N2 Zn2 O5 C22 -9.9(2) . . . 2_775
N1 Zn2 O5 C22 -88.61(19) . . . 2_775
O4 Zn2 O5 C22 86.04(18) . . . 2_775
O1 Zn1 O3 C23 45.5(2) . . . 2_665
O2 Zn1 O3 C23 -84.61(19) . . . 2_665
N3 Zn1 O3 C23 157.01(18) . . . 2_665
O1 Zn2 N1 C1 51.2(3) . . . .
O5 Zn2 N1 C1 -59.8(3) . . . .
N2 Zn2 N1 C1 176.2(3) . . . .
O4 Zn2 N1 C1 146.6(4) . . . .
O1 Zn2 N1 C5 -125.7(2) . . . .
O5 Zn2 N1 C5 123.4(2) . . . .
N2 Zn2 N1 C5 -0.6(2) . . . .
O4 Zn2 N1 C5 -30.3(5) . . . .
O1 Zn2 N2 C12 -96.2(3) . . . .
O5 Zn2 N2 C12 90.3(3) . . . .
N1 Zn2 N2 C12 178.0(3) . . . .
O4 Zn2 N2 C12 -7.9(3) . . . .
O1 Zn2 N2 C9 87.9(2) . . . .
O5 Zn2 N2 C9 -85.6(2) . . . .
N1 Zn2 N2 C9 2.2(2) . . . .
O4 Zn2 N2 C9 176.2(2) . . . .
O1 Zn1 N3 C14 -23.0(2) . . . .
O2 Zn1 N3 C14 91.5(2) . . . .
O3 Zn1 N3 C14 -148.7(2) . . . .
O1 Zn1 N3 C13 149.8(3) . . . .
O2 Zn1 N3 C13 -95.7(3) . . . .
O3 Zn1 N3 C13 24.1(3) . . . .
C20 C15 N4 C14 126.2(3) . . . .
C16 C15 N4 C14 -56.3(4) . . . .
C20 C15 N4 N5 -52.7(3) . . . .
C16 C15 N4 N5 124.9(3) . . . .
C14 N4 N5 C13 0.4(3) . . . .
C15 N4 N5 C13 179.5(2) . . . .
C4 C6 C7 C8 -0.3(6) . . . .
N4 N5 C13 N3 -0.4(3) . . . .
C14 N3 C13 N5 0.2(3) . . . .
Zn1 N3 C13 N5 -173.7(2) . . . .
C12 N2 C9 C8 0.5(4) . . . .
Zn2 N2 C9 C8 176.8(2) . . . .
C12 N2 C9 C5 -179.7(3) . . . .
Zn2 N2 C9 C5 -3.4(3) . . . .
C13 N3 C14 N4 0.1(3) . . . .
Zn1 N3 C14 N4 174.41(18) . . . .
N5 N4 C14 N3 -0.3(3) . . . .
C15 N4 C14 N3 -179.3(2) . . . .
C1 N1 C5 C4 1.6(5) . . . .
Zn2 N1 C5 C4 178.8(2) . . . .
C1 N1 C5 C9 -178.2(3) . . . .
Zn2 N1 C5 C9 -1.0(3) . . . .
N2 C9 C5 N1 3.0(4) . . . .
C8 C9 C5 N1 -177.2(3) . . . .
N2 C9 C5 C4 -176.8(3) . . . .
C8 C9 C5 C4 3.0(5) . . . .
N2 C9 C8 C10 0.0(5) . . . .
C5 C9 C8 C10 -179.8(3) . . . .
N2 C9 C8 C7 178.1(3) . . . .
C5 C9 C8 C7 -1.7(5) . . . .
C6 C7 C8 C10 178.4(4) . . . .
C6 C7 C8 C9 0.3(6) . . . .
C5 N1 C1 C2 0.4(5) . . . .
Zn2 N1 C1 C2 -176.3(3) . . . .
C3 C2 C1 N1 -1.3(6) . . . .
N1 C5 C4 C3 -2.6(5) . . . .
C9 C5 C4 C3 177.2(3) . . . .
N1 C5 C4 C6 177.3(3) . . . .
C9 C5 C4 C6 -2.9(5) . . . .
C7 C6 C4 C3 -178.6(4) . . . .
C7 C6 C4 C5 1.6(6) . . . .
C9 N2 C12 C11 -0.1(5) . . . .
Zn2 N2 C12 C11 -175.9(3) . . . .
C10 C11 C12 N2 -0.6(6) . . . .
C1 C2 C3 C4 0.3(6) . . . .
C5 C4 C3 C2 1.6(6) . . . .
C6 C4 C3 C2 -178.3(4) . . . .
C12 C11 C10 C8 1.1(6) . . . .
C9 C8 C10 C11 -0.8(5) . . . .
C7 C8 C10 C11 -178.8(4) . . . .
C19 C18 C17 C16 -2.9(4) . . . .
C22 C18 C17 C16 171.1(2) . . . .
C15 C16 C17 C18 6.2(4) . . . .
C21 C16 C17 C18 -163.7(2) . . . .
