#------------------------------------------------------------------------------
#$Date: 2016-03-24 02:46:15 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179595 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/59/4505930.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_4505930
loop_
_publ_author_name
'Chen, Shui-Sheng'
'Chen, Zhi-Hao'
'Fan, Jian'
'Okamura, Taka-aki'
'Bai, Zheng-Shuai'
'Lv, Mei-Fang'
'Sun, Wei-Yin'
_publ_section_title
;
 Synthesis and Characterization of Metal Complexes with Mixed
 4-Imidazole-Containing Tripodal Ligand and Varied Dicarboxylic Acid
;
_journal_issue                   5
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              2315
_journal_paper_doi               10.1021/cg2016275
_journal_volume                  12
_journal_year                    2012
_chemical_formula_moiety         'C23 H16 N6 O5 Zn2, H4 O2'
_chemical_formula_sum            'C23 H20 N6 O7 Zn2'
_chemical_formula_weight         623.15
_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                90.00
_cell_angle_beta                 102.542(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.841(4)
_cell_length_b                   15.942(6)
_cell_length_c                   13.104(4)
_cell_measurement_reflns_used    2333
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      22.86
_cell_measurement_theta_min      2.18
_cell_volume                     2414.6(14)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker Smart Apex CCD'
_diffrn_measurement_method       'phi and omega scans'
_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  0.1001
_diffrn_reflns_av_sigmaI/netI    0.1023
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_number            12857
_diffrn_reflns_theta_full        26.01
_diffrn_reflns_theta_max         26.01
_diffrn_reflns_theta_min         2.04
_exptl_absorpt_coefficient_mu    2.044
_exptl_absorpt_correction_T_max  0.7226
_exptl_absorpt_correction_T_min  0.6507
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS; Brucker, 2000'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.700
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1244
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.17
_refine_diff_density_max         1.076
_refine_diff_density_min         -0.694
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     331
_refine_ls_number_reflns         4742
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0866
_refine_ls_R_factor_gt           0.0615
_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)+(0.0670P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1479
_refine_ls_wR_factor_ref         0.1575
_reflns_number_gt                3366
_reflns_number_total             4742
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg2016275_si_002.cif
_cod_data_source_block           2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        2414.5(14)
_cod_original_sg_symbol_H-M      'P2(1)/n  '
_cod_database_code               4505930
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 0.60726(6) 0.62016(4) 0.66125(5) 0.02451(18) Uani 1 1 d .
Zn2 Zn 0.86255(6) 0.69142(4) 0.80561(5) 0.026 Uani 1 1 d .
C1 C 0.1646(5) 0.4034(3) 0.9539(4) 0.0265(13) Uani 1 1 d .
C2 C 0.2360(5) 0.4121(3) 0.8841(5) 0.0286(14) Uani 1 1 d .
H2 H 0.2346 0.3716 0.8327 0.034 Uiso 1 1 calc R
C3 C 0.3093(5) 0.4800(4) 0.8894(4) 0.0283(13) Uani 1 1 d .
C4 C 0.3160(5) 0.5379(4) 0.9691(4) 0.0312(14) Uani 1 1 d .
H4 H 0.3690 0.5817 0.9755 0.037 Uiso 1 1 calc R
C5 C 0.2447(5) 0.5312(3) 1.0392(4) 0.0275(13) Uani 1 1 d .
C6 C 0.1676(5) 0.4645(3) 1.0290(4) 0.0265(13) Uani 1 1 d .
H6 H 0.1167 0.4609 1.0738 0.032 Uiso 1 1 calc R
C7 C 0.0929(5) 0.3283(3) 0.9526(4) 0.0247(13) Uani 1 1 d .
C8 C 0.0400(5) 0.2790(4) 0.8725(5) 0.0321(14) Uani 1 1 d .
H8 H 0.0442 0.2864 0.8030 0.038 Uiso 1 1 calc R
C9 C -0.0021(5) 0.2318(4) 1.0093(5) 0.0334(15) Uani 1 1 d .
H9 H -0.0340 0.1984 1.0540 0.040 Uiso 1 1 calc R
C10 C 0.2593(5) 0.5907(4) 1.1276(5) 0.0296(14) Uani 1 1 d .
C11 C 0.3178(6) 0.6645(4) 1.1464(5) 0.0338(15) Uani 1 1 d .
H11 H 0.3565 0.6903 1.1003 0.041 Uiso 1 1 calc R
C12 C 0.2479(6) 0.6408(4) 1.2794(5) 0.0379(16) Uani 1 1 d .
H12 H 0.2278 0.6464 1.3438 0.045 Uiso 1 1 calc R
C13 C 0.3841(5) 0.4919(4) 0.8154(4) 0.0281(13) Uani 1 1 d .
C14 C 0.4444(5) 0.5592(4) 0.7955(5) 0.0348(15) Uani 1 1 d .
H14 H 0.4475 0.6103 0.8303 0.042 Uiso 1 1 calc R
C15 C 0.4731(5) 0.4652(4) 0.6887(5) 0.0309(14) Uani 1 1 d .
H15 H 0.4986 0.4369 0.6359 0.037 Uiso 1 1 calc R
C16 C 0.8051(5) 0.5297(4) 0.4621(5) 0.0361(15) Uani 1 1 d .
C17 C 0.8892(5) 0.5693(4) 0.4214(5) 0.0404(16) Uani 1 1 d .
H17 H 0.9050 0.6257 0.4363 0.048 Uiso 1 1 calc R
C18 C 0.9497(6) 0.5273(4) 0.3598(5) 0.0428(17) Uani 1 1 d .
H18 H 1.0053 0.5550 0.3319 0.051 Uiso 1 1 calc R
C19 C 0.9274(5) 0.4436(5) 0.3396(5) 0.0365(16) Uani 1 1 d .
C20 C 0.8423(6) 0.4025(4) 0.3778(5) 0.0398(16) Uani 1 1 d .
H20 H 0.8262 0.3462 0.3622 0.048 Uiso 1 1 calc R
C21 C 0.7815(5) 0.4466(4) 0.4397(5) 0.0370(15) Uani 1 1 d .
H21 H 0.7243 0.4197 0.4662 0.044 Uiso 1 1 calc R
C22 C 0.7411(6) 0.5795(4) 0.5294(5) 0.0372(16) Uani 1 1 d .
C23 C 1.0031(6) 0.3946(5) 0.2808(5) 0.0460(19) Uani 1 1 d .
N1 N -0.0198(4) 0.2173(3) 0.9081(4) 0.0293(12) Uani 1 1 d .
N2 N 0.0645(4) 0.2972(3) 1.0425(4) 0.0274(11) Uani 1 1 d .
N3 N 0.3118(4) 0.6953(3) 1.2423(4) 0.0318(12) Uani 1 1 d .
N4 N 0.2153(5) 0.5771(3) 1.2147(4) 0.0382(13) Uani 1 1 d .
H4A H 0.1742 0.5349 1.2254 0.046 Uiso 1 1 calc R
N5 N 0.5008(4) 0.5422(3) 0.7169(4) 0.0298(12) Uani 1 1 d .
N6 N 0.4028(4) 0.4321(3) 0.7458(4) 0.0333(12) Uani 1 1 d .
H6A H 0.3746 0.3822 0.7397 0.040 Uiso 1 1 calc R
O1 O 0.6706(4) 0.5406(3) 0.5719(3) 0.0418(11) Uani 1 1 d .
O2 O 0.7605(5) 0.6556(3) 0.5404(4) 0.0595(15) Uani 1 1 d .
O3 O 1.0816(4) 0.4337(3) 0.2479(4) 0.057 Uani 1 1 d .
O4 O 0.9870(5) 0.3178(3) 0.2642(4) 0.0561(14) Uani 1 1 d .
O5 O 0.7045(3) 0.6497(2) 0.7960(3) 0.0311(9) Uani 1 1 d .
O1W O 0.5842(12) 0.7464(7) 0.9179(10) 0.226(6) Uani 1 1 d .
O2W O 0.2956(5) 0.2766(3) 0.6842(5) 0.0781(19) 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'
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
O5 Zn1 N1 112.09(19) . 2_556
O5 Zn1 O1 117.79(18) . .
N1 Zn1 O1 117.31(19) 2_556 .
O5 Zn1 N5 96.56(18) . .
N1 Zn1 N5 110.1(2) 2_556 .
O1 Zn1 N5 99.6(2) . .
O5 Zn2 N2 107.12(17) . 3_667
O5 Zn2 N3 94.71(19) . 4_675
N2 Zn2 N3 110.7(2) 3_667 4_675
O5 Zn2 O4 143.66(19) . 3_766
N2 Zn2 O4 102.0(2) 3_667 3_766
N3 Zn2 O4 94.90(19) 4_675 3_766
O5 Zn2 O3 91.17(17) . 3_766
N2 Zn2 O3 107.23(19) 3_667 3_766
N3 Zn2 O3 137.86(19) 4_675 3_766
O4 Zn2 O3 59.26(18) 3_766 3_766
O5 Zn2 C23 117.9(2) . 3_766
N2 Zn2 C23 108.4(2) 3_667 3_766
N3 Zn2 C23 117.2(2) 4_675 3_766
O4 Zn2 C23 29.42(19) 3_766 3_766
O3 Zn2 C23 29.9(2) 3_766 3_766
C6 C1 C2 118.5(5) . .
C6 C1 C7 120.7(5) . .
C2 C1 C7 120.7(5) . .
C1 C2 C3 120.9(5) . .
C1 C2 H2 119.5 . .
C3 C2 H2 119.5 . .
C2 C3 C4 119.6(5) . .
C2 C3 C13 122.2(5) . .
C4 C3 C13 118.1(5) . .
C5 C4 C3 120.5(5) . .
C5 C4 H4 119.7 . .
C3 C4 H4 119.7 . .
C4 C5 C6 118.6(5) . .
C4 C5 C10 119.2(5) . .
C6 C5 C10 122.0(5) . .
C1 C6 C5 121.6(5) . .
C1 C6 H6 119.2 . .
C5 C6 H6 119.2 . .
C8 C7 N2 107.2(5) . .
C8 C7 C1 130.8(5) . .
N2 C7 C1 122.0(5) . .
C7 C8 N1 110.1(5) . .
C7 C8 H8 124.9 . .
N1 C8 H8 124.9 . .
N1 C9 N2 115.0(5) . .
N1 C9 H9 122.5 . .
N2 C9 H9 122.5 . .
C11 C10 N4 104.9(5) . .
C11 C10 C5 131.6(5) . .
N4 C10 C5 123.4(5) . .
C10 C11 N3 110.5(5) . .
C10 C11 H11 124.7 . .
N3 C11 H11 124.7 . .
N3 C12 N4 112.4(5) . .
N3 C12 H12 123.8 . .
N4 C12 H12 123.8 . .
C14 C13 N6 104.9(5) . .
C14 C13 C3 131.0(5) . .
N6 C13 C3 124.1(5) . .
C13 C14 N5 110.7(5) . .
C13 C14 H14 124.7 . .
N5 C14 H14 124.7 . .
N5 C15 N6 111.1(5) . .
N5 C15 H15 124.4 . .
N6 C15 H15 124.4 . .
C21 C16 C17 119.3(6) . .
C21 C16 C22 121.8(6) . .
C17 C16 C22 118.8(6) . .
C18 C17 C16 121.3(7) . .
C18 C17 H17 119.4 . .
C16 C17 H17 119.4 . .
C17 C18 C19 119.1(6) . .
C17 C18 H18 120.5 . .
C19 C18 H18 120.5 . .
C18 C19 C20 121.0(6) . .
C18 C19 C23 119.1(6) . .
C20 C19 C23 119.7(7) . .
C19 C20 C21 118.8(6) . .
C19 C20 H20 120.6 . .
C21 C20 H20 120.6 . .
C16 C21 C20 120.4(6) . .
C16 C21 H21 119.8 . .
C20 C21 H21 119.8 . .
O2 C22 O1 123.7(6) . .
O2 C22 C16 118.6(6) . .
O1 C22 C16 117.7(6) . .
O4 C23 O3 121.1(7) . .
O4 C23 C19 120.4(6) . .
O3 C23 C19 118.4(7) . .
O4 C23 Zn2 58.8(4) . 3_766
O3 C23 Zn2 62.6(4) . 3_766
C19 C23 Zn2 176.0(5) . 3_766
C9 N1 C8 103.9(5) . .
C9 N1 Zn1 123.6(4) . 2_546
C8 N1 Zn1 132.4(4) . 2_546
C9 N2 C7 103.9(5) . .
C9 N2 Zn2 119.8(4) . 3_667
C7 N2 Zn2 133.0(4) . 3_667
C12 N3 C11 104.6(5) . .
C12 N3 Zn2 125.6(4) . 4_576
C11 N3 Zn2 128.9(4) . 4_576
C12 N4 C10 107.5(5) . .
C12 N4 H4A 126.2 . .
C10 N4 H4A 126.2 . .
C15 N5 C14 105.4(5) . .
C15 N5 Zn1 128.1(4) . .
C14 N5 Zn1 126.5(4) . .
C15 N6 C13 107.9(5) . .
C15 N6 H6A 126.1 . .
C13 N6 H6A 126.1 . .
C22 O1 Zn1 108.6(4) . .
C23 O3 Zn2 87.5(5) . 3_766
C23 O4 Zn2 91.8(4) . 3_766
Zn1 O5 Zn2 120.53(19) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O5 1.946(4) .
Zn1 N1 1.972(5) 2_556
Zn1 O1 1.981(4) .
Zn1 N5 2.016(5) .
Zn2 O5 1.964(4) .
Zn2 N2 1.998(5) 3_667
Zn2 N3 2.024(5) 4_675
Zn2 O4 2.177(5) 3_766
Zn2 O3 2.261(5) 3_766
Zn2 C23 2.544(7) 3_766
C1 C6 1.379(8) .
C1 C2 1.380(8) .
C1 C7 1.466(7) .
C2 C3 1.380(8) .
C2 H2 0.9300 .
C3 C4 1.383(8) .
C3 C13 1.461(8) .
C4 C5 1.380(8) .
C4 H4 0.9300 .
C5 C6 1.389(8) .
C5 C10 1.477(8) .
C6 H6 0.9300 .
C7 C8 1.351(8) .
C7 N2 1.386(7) .
C8 N1 1.352(7) .
C8 H8 0.9300 .
C9 N1 1.317(7) .
C9 N2 1.323(7) .
C9 H9 0.9300 .
C10 C11 1.361(8) .
C10 N4 1.370(7) .
C11 N3 1.366(7) .
C11 H11 0.9300 .
C12 N3 1.312(7) .
C12 N4 1.327(7) .
C12 H12 0.9300 .
C13 C14 1.346(8) .
C13 N6 1.370(7) .
C14 N5 1.370(7) .
C14 H14 0.9300 .
C15 N5 1.304(7) .
C15 N6 1.341(7) .
C15 H15 0.9300 .
C16 C21 1.373(9) .
C16 C17 1.380(9) .
C16 C22 1.508(8) .
C17 C18 1.366(8) .
C17 H17 0.9300 .
C18 C19 1.375(9) .
C18 H18 0.9300 .
C19 C20 1.382(9) .
C19 C23 1.520(9) .
C20 C21 1.389(8) .
C20 H20 0.9300 .
C21 H21 0.9300 .
C22 O2 1.237(8) .
C22 O1 1.261(7) .
C23 O4 1.250(8) .
C23 O3 1.270(8) .
C23 Zn2 2.544(7) 3_766
N1 Zn1 1.972(5) 2_546
N2 Zn2 1.998(5) 3_667
N3 Zn2 2.024(5) 4_576
N4 H4A 0.8600 .
N6 H6A 0.8600 .
O3 Zn2 2.261(5) 3_766
O4 Zn2 2.177(5) 3_766
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
C6 C1 C2 C3 0.4(9) . .
C7 C1 C2 C3 -175.7(5) . .
C1 C2 C3 C4 3.5(9) . .
C1 C2 C3 C13 -178.7(6) . .
C2 C3 C4 C5 -4.2(9) . .
C13 C3 C4 C5 177.9(6) . .
C3 C4 C5 C6 1.0(9) . .
C3 C4 C5 C10 176.0(6) . .
C2 C1 C6 C5 -3.7(9) . .
C7 C1 C6 C5 172.5(5) . .
C4 C5 C6 C1 3.0(9) . .
C10 C5 C6 C1 -171.8(5) . .
C6 C1 C7 C8 150.6(7) . .
C2 C1 C7 C8 -33.3(10) . .
C6 C1 C7 N2 -27.0(8) . .
C2 C1 C7 N2 149.1(6) . .
N2 C7 C8 N1 -0.6(7) . .
C1 C7 C8 N1 -178.5(6) . .
C4 C5 C10 C11 14.3(10) . .
C6 C5 C10 C11 -171.0(6) . .
C4 C5 C10 N4 -162.7(6) . .
C6 C5 C10 N4 12.1(9) . .
N4 C10 C11 N3 0.7(7) . .
C5 C10 C11 N3 -176.6(6) . .
C2 C3 C13 C14 166.4(7) . .
C4 C3 C13 C14 -15.8(10) . .
C2 C3 C13 N6 -10.8(9) . .
C4 C3 C13 N6 167.0(6) . .
N6 C13 C14 N5 -0.8(7) . .
C3 C13 C14 N5 -178.5(6) . .
C21 C16 C17 C18 -0.3(10) . .
C22 C16 C17 C18 -179.9(6) . .
C16 C17 C18 C19 -1.1(10) . .
C17 C18 C19 C20 2.1(10) . .
C17 C18 C19 C23 -173.6(6) . .
C18 C19 C20 C21 -1.8(10) . .
C23 C19 C20 C21 174.0(6) . .
C17 C16 C21 C20 0.7(10) . .
C22 C16 C21 C20 -179.7(6) . .
C19 C20 C21 C16 0.3(10) . .
C21 C16 C22 O2 -174.8(6) . .
C17 C16 C22 O2 4.8(9) . .
C21 C16 C22 O1 5.5(9) . .
C17 C16 C22 O1 -175.0(6) . .
C18 C19 C23 O4 177.8(6) . .
C20 C19 C23 O4 2.0(10) . .
C18 C19 C23 O3 -3.2(9) . .
C20 C19 C23 O3 -179.0(6) . .
N2 C9 N1 C8 -0.3(7) . .
N2 C9 N1 Zn1 176.1(4) . 2_546
C7 C8 N1 C9 0.6(7) . .
C7 C8 N1 Zn1 -175.3(4) . 2_546
N1 C9 N2 C7 -0.1(7) . .
N1 C9 N2 Zn2 -162.1(4) . 3_667
C8 C7 N2 C9 0.4(6) . .
C1 C7 N2 C9 178.5(5) . .
C8 C7 N2 Zn2 158.9(4) . 3_667
C1 C7 N2 Zn2 -23.0(8) . 3_667
N4 C12 N3 C11 1.4(8) . .
N4 C12 N3 Zn2 171.6(4) . 4_576
C10 C11 N3 C12 -1.3(7) . .
C10 C11 N3 Zn2 -171.0(4) . 4_576
N3 C12 N4 C10 -0.9(8) . .
C11 C10 N4 C12 0.1(7) . .
C5 C10 N4 C12 177.7(6) . .
N6 C15 N5 C14 -0.5(7) . .
N6 C15 N5 Zn1 177.9(4) . .
C13 C14 N5 C15 0.8(7) . .
C13 C14 N5 Zn1 -177.6(4) . .
O5 Zn1 N5 C15 -127.7(5) . .
N1 Zn1 N5 C15 115.9(5) 2_556 .
O1 Zn1 N5 C15 -8.0(6) . .
O5 Zn1 N5 C14 50.4(5) . .
N1 Zn1 N5 C14 -66.0(5) 2_556 .
O1 Zn1 N5 C14 170.1(5) . .
N5 C15 N6 C13 0.0(7) . .
C14 C13 N6 C15 0.5(7) . .
C3 C13 N6 C15 178.3(6) . .
O2 C22 O1 Zn1 -3.0(8) . .
C16 C22 O1 Zn1 176.7(4) . .
O5 Zn1 O1 C22 -77.3(4) . .
N1 Zn1 O1 C22 61.4(5) 2_556 .
N5 Zn1 O1 C22 -180.0(4) . .
O4 C23 O3 Zn2 -5.4(7) . 3_766
C19 C23 O3 Zn2 175.7(5) . 3_766
O3 C23 O4 Zn2 5.6(7) . 3_766
C19 C23 O4 Zn2 -175.5(5) . 3_766
N1 Zn1 O5 Zn2 -87.9(3) 2_556 .
O1 Zn1 O5 Zn2 52.8(3) . .
N5 Zn1 O5 Zn2 157.3(2) . .
N2 Zn2 O5 Zn1 -174.5(2) 3_667 .
N3 Zn2 O5 Zn1 72.2(2) 4_675 .
O4 Zn2 O5 Zn1 -32.7(4) 3_766 .
O3 Zn2 O5 Zn1 -66.0(2) 3_766 .
C23 Zn2 O5 Zn1 -52.0(3) 3_766 .
