#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/19/4501907.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_4501907
loop_
_publ_author_name
'Liu, Hai-Yan'
'Wu, Hua'
'Ma, Jian-Fang'
'Liu, Ying-Ying'
'Liu, Bo'
'Yang, Jin'
_publ_section_title
;
 Syntheses, Structures, and Photoluminescence of Zinc(II) Coordination
 Polymers Based on Carboxylates and Flexible Bis-[(pyridyl)-benzimidazole]
 Ligands
;
_journal_issue                   11
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              4795
_journal_paper_doi               10.1021/cg100688z
_journal_volume                  10
_journal_year                    2010
_chemical_formula_moiety         'C50 H48 N6 O10 Zn2'
_chemical_formula_sum            'C50 H48 N6 O10 Zn2'
_chemical_formula_weight         1023.68
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.000(5)
_cell_angle_beta                 110.388(5)
_cell_angle_gamma                90.000(5)
_cell_formula_units_Z            2
_cell_length_a                   10.811(5)
_cell_length_b                   15.391(5)
_cell_length_c                   15.011(5)
_cell_measurement_reflns_used    5578
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.8
_cell_measurement_theta_min      2.0
_cell_volume                     2341.2(15)
_computing_cell_refinement       CrysAlis
_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_data_reduction        CrysAlis
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 10.0
_diffrn_measured_fraction_theta_full 0.964
_diffrn_measured_fraction_theta_max 0.831
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_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  0.0441
_diffrn_reflns_av_sigmaI/netI    0.0976
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            16395
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         29.81
_diffrn_reflns_theta_min         1.96
_exptl_absorpt_coefficient_mu    1.091
_exptl_absorpt_correction_T_max  0.863
_exptl_absorpt_correction_T_min  0.711
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.452
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1060
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.18
_refine_diff_density_max         0.679
_refine_diff_density_min         -0.265
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.841
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     316
_refine_ls_number_reflns         5578
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.841
_refine_ls_R_factor_all          0.1180
_refine_ls_R_factor_gt           0.0496
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0910P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1364
_refine_ls_wR_factor_ref         0.1526
_reflns_number_gt                2650
_reflns_number_total             5578
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg100688z_si_002.cif
_cod_data_source_block           5
_cod_original_sg_symbol_Hall     '-P 2yn '
_cod_original_sg_symbol_H-M      'P 21/n '
_cod_database_code               4501907
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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
Zn1 Zn 0.09600(4) 0.07045(3) 0.42666(3) 0.04476(18) Uani 1 1 d .
C1 C -0.1056(4) 0.1784(3) 0.3126(5) 0.0665(14) Uani 1 1 d .
C2 C -0.1969(4) 0.2532(3) 0.3038(3) 0.0554(11) Uani 1 1 d .
C3 C -0.2494(3) 0.2996(2) 0.2192(3) 0.0444(9) Uani 1 1 d .
H3 H -0.2287 0.2834 0.1664 0.053 Uiso 1 1 calc R
C4 C -0.3320(3) 0.3696(2) 0.2132(3) 0.0439(10) Uani 1 1 d .
C5 C -0.3633(5) 0.3922(3) 0.2910(4) 0.0702(13) Uani 1 1 d .
H5 H -0.4200 0.4387 0.2869 0.084 Uiso 1 1 calc R
C6 C -0.3118(5) 0.3472(4) 0.3750(4) 0.0854(16) Uani 1 1 d .
H6 H -0.3332 0.3633 0.4275 0.102 Uiso 1 1 calc R
C7 C -0.2289(5) 0.2787(3) 0.3808(4) 0.0755(14) Uani 1 1 d .
H7 H -0.1936 0.2487 0.4379 0.091 Uiso 1 1 calc R
C8 C -0.3900(3) 0.4192(2) 0.1233(3) 0.0443(10) Uani 1 1 d .
C9 C 0.1804(5) 0.2716(3) 0.4132(4) 0.0870(17) Uani 1 1 d .
H9 H 0.1127 0.2842 0.4360 0.104 Uiso 1 1 calc R
C10 C 0.2412(5) 0.3403(3) 0.3859(4) 0.0857(17) Uani 1 1 d .
H10 H 0.2159 0.3973 0.3913 0.103 Uiso 1 1 calc R
C11 C 0.3385(5) 0.3231(3) 0.3509(4) 0.0769(15) Uani 1 1 d .
H11 H 0.3811 0.3676 0.3311 0.092 Uiso 1 1 calc R
C12 C 0.3728(4) 0.2358(3) 0.3458(3) 0.0668(13) Uani 1 1 d .
H12 H 0.4384 0.2214 0.3215 0.080 Uiso 1 1 calc R
C13 C 0.3098(3) 0.1725(2) 0.3765(3) 0.0448(10) Uani 1 1 d .
C14 C 0.3357(3) 0.0784(2) 0.3767(3) 0.0417(9) Uani 1 1 d .
C15 C 0.2985(4) -0.0591(2) 0.3889(3) 0.0470(10) Uani 1 1 d .
C16 C 0.2505(4) -0.1412(3) 0.4003(3) 0.0575(11) Uani 1 1 d .
H16 H 0.1695 -0.1479 0.4084 0.069 Uiso 1 1 calc R
C17 C 0.3277(4) -0.2110(3) 0.3992(4) 0.0658(13) Uani 1 1 d .
H17 H 0.2986 -0.2665 0.4067 0.079 Uiso 1 1 calc R
C18 C 0.4496(4) -0.2015(3) 0.3870(3) 0.0664(13) Uani 1 1 d .
H18 H 0.4990 -0.2509 0.3867 0.080 Uiso 1 1 calc R
C19 C 0.4980(4) -0.1226(3) 0.3756(3) 0.0611(12) Uani 1 1 d .
H19 H 0.5793 -0.1164 0.3681 0.073 Uiso 1 1 calc R
C20 C 0.4192(4) -0.0519(2) 0.3760(3) 0.0466(10) Uani 1 1 d .
C21 C 0.5661(4) 0.0701(3) 0.3606(3) 0.0536(11) Uani 1 1 d .
H21A H 0.6393 0.0423 0.4093 0.064 Uiso 1 1 calc R
H21B H 0.5718 0.1320 0.3735 0.064 Uiso 1 1 calc R
C22 C 0.5794(5) 0.0545(3) 0.2643(4) 0.0749(14) Uani 1 1 d .
H22A H 0.6713 0.0620 0.2712 0.090 Uiso 1 1 calc R
H22B H 0.5562 -0.0055 0.2464 0.090 Uiso 1 1 calc R
C23 C 0.5001(5) 0.1099(4) 0.1868(4) 0.0858(16) Uani 1 1 d .
H23A H 0.5175 0.1703 0.2053 0.103 Uiso 1 1 calc R
H23B H 0.4073 0.0988 0.1745 0.103 Uiso 1 1 calc R
C24 C 0.5314(6) 0.0932(4) 0.0933(4) 0.0895(17) Uani 1 1 d .
H24A H 0.4902 0.1388 0.0480 0.107 Uiso 1 1 calc R
H24B H 0.6260 0.0977 0.1083 0.107 Uiso 1 1 calc R
C25 C 0.4859(6) 0.0067(4) 0.0468(4) 0.0916(17) Uani 1 1 d .
H25A H 0.3917 0.0013 0.0333 0.110 Uiso 1 1 calc R
H25B H 0.5294 -0.0391 0.0910 0.110 Uiso 1 1 calc R
N1 N 0.4406(3) 0.0368(2) 0.3671(2) 0.0488(8) Uani 1 1 d .
N2 N 0.2481(3) 0.0237(2) 0.3892(2) 0.0463(8) Uani 1 1 d .
N3 N 0.2124(3) 0.1890(2) 0.4091(3) 0.0613(10) Uani 1 1 d .
O1 O -0.3286(2) 0.41712(17) 0.0662(2) 0.0520(7) Uani 1 1 d .
O2 O -0.4962(2) 0.45720(18) 0.1099(2) 0.0674(9) Uani 1 1 d .
O3 O -0.0807(3) 0.1550(2) 0.2421(3) 0.0868(11) Uani 1 1 d .
O4 O -0.0580(3) 0.1460(2) 0.3947(3) 0.0817(11) Uani 1 1 d .
O1W O 0.0823(9) 0.0565(4) 0.1515(7) 0.153(3) Uani 0.75 1 d P
O1W' O -0.013(2) 0.0583(9) 0.0899(11) 0.120(8) Uani 0.25 1 d P
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
O4 Zn1 O1 101.80(14) . 4_666
O4 Zn1 O2 96.78(13) . 2_445
O1 Zn1 O2 110.80(12) 4_666 2_445
O4 Zn1 N2 147.39(14) . .
O1 Zn1 N2 104.55(12) 4_666 .
O2 Zn1 N2 91.53(12) 2_445 .
O4 Zn1 N3 87.28(13) . .
O1 Zn1 N3 90.24(13) 4_666 .
O2 Zn1 N3 157.07(14) 2_445 .
N2 Zn1 N3 73.82(12) . .
O3 C1 O4 125.9(5) . .
O3 C1 C2 119.0(5) . .
O4 C1 C2 115.0(5) . .
C7 C2 C3 118.6(4) . .
C7 C2 C1 119.9(4) . .
C3 C2 C1 121.5(5) . .
C4 C3 C2 120.5(4) . .
C4 C3 H3 119.7 . .
C2 C3 H3 119.7 . .
C5 C4 C3 119.3(4) . .
C5 C4 C8 119.5(4) . .
C3 C4 C8 121.2(4) . .
C4 C5 C6 120.8(4) . .
C4 C5 H5 119.6 . .
C6 C5 H5 119.6 . .
C7 C6 C5 119.6(5) . .
C7 C6 H6 120.2 . .
C5 C6 H6 120.2 . .
C6 C7 C2 121.2(4) . .
C6 C7 H7 119.4 . .
C2 C7 H7 119.4 . .
O2 C8 O1 125.6(4) . .
O2 C8 C4 117.6(4) . .
O1 C8 C4 116.8(3) . .
N3 C9 C10 124.2(4) . .
N3 C9 H9 117.9 . .
C10 C9 H9 117.9 . .
C11 C10 C9 118.7(4) . .
C11 C10 H10 120.7 . .
C9 C10 H10 120.7 . .
C10 C11 C12 117.7(4) . .
C10 C11 H11 121.2 . .
C12 C11 H11 121.2 . .
C13 C12 C11 119.7(4) . .
C13 C12 H12 120.2 . .
C11 C12 H12 120.2 . .
N3 C13 C12 122.8(4) . .
N3 C13 C14 111.2(3) . .
C12 C13 C14 126.0(4) . .
N2 C14 N1 112.4(3) . .
N2 C14 C13 118.5(3) . .
N1 C14 C13 129.1(3) . .
N2 C15 C20 108.5(3) . .
N2 C15 C16 131.8(4) . .
C20 C15 C16 119.7(3) . .
C17 C16 C15 117.0(4) . .
C17 C16 H16 121.5 . .
C15 C16 H16 121.5 . .
C16 C17 C18 121.8(4) . .
C16 C17 H17 119.1 . .
C18 C17 H17 119.1 . .
C19 C18 C17 122.1(4) . .
C19 C18 H18 118.9 . .
C17 C18 H18 118.9 . .
C18 C19 C20 116.0(4) . .
C18 C19 H19 122.0 . .
C20 C19 H19 122.0 . .
C19 C20 C15 123.2(4) . .
C19 C20 N1 130.2(4) . .
C15 C20 N1 106.6(3) . .
N1 C21 C22 113.5(3) . .
N1 C21 H21A 108.9 . .
C22 C21 H21A 108.9 . .
N1 C21 H21B 108.9 . .
C22 C21 H21B 108.9 . .
H21A C21 H21B 107.7 . .
C23 C22 C21 116.3(4) . .
C23 C22 H22A 108.2 . .
C21 C22 H22A 108.2 . .
C23 C22 H22B 108.2 . .
C21 C22 H22B 108.2 . .
H22A C22 H22B 107.4 . .
C22 C23 C24 111.6(4) . .
C22 C23 H23A 109.3 . .
C24 C23 H23A 109.3 . .
C22 C23 H23B 109.3 . .
C24 C23 H23B 109.3 . .
H23A C23 H23B 108.0 . .
C25 C24 C23 114.8(4) . .
C25 C24 H24A 108.6 . .
C23 C24 H24A 108.6 . .
C25 C24 H24B 108.6 . .
C23 C24 H24B 108.6 . .
H24A C24 H24B 107.5 . .
C24 C25 C25 113.7(5) . 3_655
C24 C25 H25A 108.8 . .
C25 C25 H25A 108.8 3_655 .
C24 C25 H25B 108.8 . .
C25 C25 H25B 108.8 3_655 .
H25A C25 H25B 107.7 . .
C14 N1 C20 106.2(3) . .
C14 N1 C21 131.4(3) . .
C20 N1 C21 121.9(3) . .
C14 N2 C15 106.3(3) . .
C14 N2 Zn1 119.9(3) . .
C15 N2 Zn1 132.8(3) . .
C9 N3 C13 117.0(4) . .
C9 N3 Zn1 126.8(3) . .
C13 N3 Zn1 115.3(2) . .
C8 O1 Zn1 127.0(2) . 4_565
C8 O2 Zn1 145.7(3) . 2_455
C1 O4 Zn1 119.9(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O4 1.949(3) .
Zn1 O1 1.975(3) 4_666
Zn1 O2 2.023(3) 2_445
Zn1 N2 2.045(3) .
Zn1 N3 2.284(3) .
C1 O3 1.233(6) .
C1 O4 1.262(6) .
C1 C2 1.492(6) .
C2 C7 1.374(7) .
C2 C3 1.393(5) .
C3 C4 1.382(5) .
C3 H3 0.9300 .
C4 C5 1.368(6) .
C4 C8 1.487(5) .
C5 C6 1.376(7) .
C5 H5 0.9300 .
C6 C7 1.367(7) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 O2 1.240(4) .
C8 O1 1.254(5) .
C9 N3 1.324(5) .
C9 C10 1.381(7) .
C9 H9 0.9300 .
C10 C11 1.355(6) .
C10 H10 0.9300 .
C11 C12 1.403(6) .
C11 H11 0.9300 .
C12 C13 1.359(6) .
C12 H12 0.9300 .
C13 N3 1.332(5) .
C13 C14 1.475(5) .
C14 N2 1.329(4) .
C14 N1 1.353(5) .
C15 N2 1.387(5) .
C15 C20 1.389(5) .
C15 C16 1.399(5) .
C16 C17 1.365(6) .
C16 H16 0.9300 .
C17 C18 1.399(6) .
C17 H17 0.9300 .
C18 C19 1.357(6) .
C18 H18 0.9300 .
C19 C20 1.382(5) .
C19 H19 0.9300 .
C20 N1 1.399(5) .
C21 N1 1.484(5) .
C21 C22 1.521(7) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 C23 1.456(7) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 C24 1.576(7) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
C24 C25 1.505(7) .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 C25 1.551(10) 3_655
C25 H25A 0.9700 .
C25 H25B 0.9700 .
O1 Zn1 1.975(3) 4_565
O2 Zn1 2.023(3) 2_455
O1W O1W' 1.122(14) .
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_4
O3 C1 C2 C7 178.1(4) . .
O4 C1 C2 C7 -3.5(6) . .
O3 C1 C2 C3 -3.1(6) . .
O4 C1 C2 C3 175.3(4) . .
C7 C2 C3 C4 -0.1(6) . .
C1 C2 C3 C4 -178.9(3) . .
C2 C3 C4 C5 -0.8(6) . .
C2 C3 C4 C8 -179.4(3) . .
C3 C4 C5 C6 1.1(7) . .
C8 C4 C5 C6 179.7(4) . .
C4 C5 C6 C7 -0.3(8) . .
C5 C6 C7 C2 -0.6(8) . .
C3 C2 C7 C6 0.8(7) . .
C1 C2 C7 C6 179.7(4) . .
C5 C4 C8 O2 -25.1(5) . .
C3 C4 C8 O2 153.5(3) . .
C5 C4 C8 O1 156.8(4) . .
C3 C4 C8 O1 -24.6(5) . .
N3 C9 C10 C11 1.2(9) . .
C9 C10 C11 C12 -0.8(8) . .
C10 C11 C12 C13 -0.8(8) . .
C11 C12 C13 N3 2.2(7) . .
C11 C12 C13 C14 -179.3(4) . .
N3 C13 C14 N2 13.1(5) . .
C12 C13 C14 N2 -165.6(4) . .
N3 C13 C14 N1 -165.7(4) . .
C12 C13 C14 N1 15.7(7) . .
N2 C15 C16 C17 -178.0(4) . .
C20 C15 C16 C17 0.8(6) . .
C15 C16 C17 C18 -0.1(7) . .
C16 C17 C18 C19 -0.1(8) . .
C17 C18 C19 C20 -0.5(7) . .
C18 C19 C20 C15 1.3(7) . .
C18 C19 C20 N1 179.2(4) . .
N2 C15 C20 C19 177.6(4) . .
C16 C15 C20 C19 -1.4(7) . .
N2 C15 C20 N1 -0.8(4) . .
C16 C15 C20 N1 -179.8(4) . .
N1 C21 C22 C23 74.6(5) . .
C21 C22 C23 C24 175.0(4) . .
C22 C23 C24 C25 69.5(7) . .
C23 C24 C25 C25 178.2(6) . 3_655
N2 C14 N1 C20 -1.1(4) . .
C13 C14 N1 C20 177.7(4) . .
N2 C14 N1 C21 -173.7(4) . .
C13 C14 N1 C21 5.1(7) . .
C19 C20 N1 C14 -177.1(4) . .
C15 C20 N1 C14 1.1(4) . .
C19 C20 N1 C21 -3.6(6) . .
C15 C20 N1 C21 174.6(4) . .
C22 C21 N1 C14 -113.3(5) . .
C22 C21 N1 C20 75.1(5) . .
N1 C14 N2 C15 0.6(4) . .
C13 C14 N2 C15 -178.4(3) . .
N1 C14 N2 Zn1 170.2(2) . .
C13 C14 N2 Zn1 -8.7(5) . .
C20 C15 N2 C14 0.2(4) . .
C16 C15 N2 C14 179.0(4) . .
C20 C15 N2 Zn1 -167.5(3) . .
C16 C15 N2 Zn1 11.3(7) . .
O4 Zn1 N2 C14 58.8(4) . .
O1 Zn1 N2 C14 -84.1(3) 4_666 .
O2 Zn1 N2 C14 164.0(3) 2_445 .
N3 Zn1 N2 C14 1.9(3) . .
O4 Zn1 N2 C15 -134.8(4) . .
O1 Zn1 N2 C15 82.3(4) 4_666 .
O2 Zn1 N2 C15 -29.7(4) 2_445 .
N3 Zn1 N2 C15 168.2(4) . .
C10 C9 N3 C13 0.1(8) . .
C10 C9 N3 Zn1 -168.1(4) . .
C12 C13 N3 C9 -1.8(7) . .
C14 C13 N3 C9 179.5(4) . .
C12 C13 N3 Zn1 167.8(3) . .
C14 C13 N3 Zn1 -11.0(4) . .
O4 Zn1 N3 C9 20.9(5) . .
O1 Zn1 N3 C9 -80.9(5) 4_666 .
O2 Zn1 N3 C9 121.9(5) 2_445 .
N2 Zn1 N3 C9 174.0(5) . .
O4 Zn1 N3 C13 -147.5(3) . .
O1 Zn1 N3 C13 110.7(3) 4_666 .
O2 Zn1 N3 C13 -46.4(5) 2_445 .
N2 Zn1 N3 C13 5.6(3) . .
O2 C8 O1 Zn1 -26.0(5) . 4_565
C4 C8 O1 Zn1 152.0(3) . 4_565
O1 C8 O2 Zn1 -51.8(8) . 2_455
C4 C8 O2 Zn1 130.3(5) . 2_455
O3 C1 O4 Zn1 14.7(7) . .
C2 C1 O4 Zn1 -163.6(3) . .
O1 Zn1 O4 C1 155.7(3) 4_666 .
O2 Zn1 O4 C1 -91.3(4) 2_445 .
N2 Zn1 O4 C1 12.3(5) . .
N3 Zn1 O4 C1 66.1(4) . .
