#------------------------------------------------------------------------------
#$Date: 2016-03-24 14:36:54 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179669 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/22/4512255.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_4512255
loop_
_publ_author_name
'Wen, Yuehong'
'Sheng, Tianlu'
'Xue, Zhenzhen'
'Sun, Zhihao'
'Wang, Yanlong'
'Hu, Shengmin'
'Huang, Yihui'
'Li, Jie'
'Wu, Xintao'
_publ_section_title
;
 Homochiral Layered Coordination Polymers from ChiralN-Carbamylglutamate
 and Achiral Flexible Bis(pyridine) Ligands: Syntheses, Crystal
 Structures, and Properties
;
_journal_issue                   12
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              6230
_journal_paper_doi               10.1021/cg501398c
_journal_volume                  14
_journal_year                    2014
_chemical_absolute_configuration unk
_chemical_formula_sum            'C26 H46 N8 O16 Zn2'
_chemical_formula_weight         857.45
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 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                 100.426(16)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   9.38(3)
_cell_length_b                   16.81(4)
_cell_length_c                   11.48(3)
_cell_measurement_reflns_used    76
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.4855
_cell_measurement_theta_min      2.1736
_cell_volume                     1780(8)
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Saturn724+ (2x2 bin mode)'
_diffrn_measurement_method       CCD_Profile_fitting
_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  0.0271
_diffrn_reflns_av_sigmaI/netI    0.0621
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       11
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            15508
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         2.17
_exptl_absorpt_coefficient_mu    1.429
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8783
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.599
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             892
_exptl_crystal_size_max          0.2000
_exptl_crystal_size_mid          0.2000
_exptl_crystal_size_min          0.2000
_refine_diff_density_max         0.958
_refine_diff_density_min         -0.584
_refine_diff_density_rms         0.134
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   -0.023(13)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     469
_refine_ls_number_reflns         7776
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.0536
_refine_ls_R_factor_gt           0.0434
_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)+(0.0765P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1074
_refine_ls_wR_factor_ref         0.1379
_reflns_number_gt                6574
_reflns_number_total             7776
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg501398c_si_002.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/saulius/struct/COD-crude-data--automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2827 2014-09-09 07:05:25Z andrius 

 Adding full bibliography for 4512255--4512258.cif.
;
_cod_original_cell_volume        1781(9)
_cod_original_sg_symbol_H-M      P2(1)
_cod_database_code               4512255
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, 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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Zn1 Zn 0.98362(5) 0.04761(3) 0.39893(4) 0.02882(14) Uani 1 1 d .
Zn2 Zn 0.92787(6) 0.22144(3) 0.95151(5) 0.03016(14) Uani 1 1 d .
C1 C 1.0125(7) 0.3758(4) 1.0587(5) 0.0471(15) Uani 1 1 d .
H1A H 1.1163 0.3673 1.0682 0.057 Uiso 1 1 calc R
H1B H 0.9956 0.4201 1.1086 0.057 Uiso 1 1 calc R
C2 C 0.9504(8) 0.3939(4) 0.9313(5) 0.0526(17) Uani 1 1 d .
H2A H 0.8468 0.4028 0.9224 0.063 Uiso 1 1 calc R
H2B H 0.9945 0.4419 0.9070 0.063 Uiso 1 1 calc R
C3 C 0.9059(6) 0.3398(3) 0.7329(5) 0.0395(12) Uani 1 1 d .
H3A H 0.9418 0.3886 0.7036 0.047 Uiso 1 1 calc R
H3B H 0.8025 0.3457 0.7303 0.047 Uiso 1 1 calc R
C4 C 0.9329(5) 0.2711(3) 0.6548(4) 0.0312(11) Uani 1 1 d .
C5 C 0.8222(6) 0.2243(5) 0.6056(6) 0.0571(18) Uani 1 1 d .
H5A H 0.7301 0.2343 0.6214 0.069 Uiso 1 1 calc R
C6 C 0.8421(6) 0.1604(4) 0.5304(6) 0.0520(18) Uani 1 1 d .
H6A H 0.7640 0.1284 0.4983 0.062 Uiso 1 1 calc R
C7 C 1.0640(6) 0.2555(4) 0.6253(6) 0.0419(13) Uani 1 1 d .
H7A H 1.1429 0.2876 0.6551 0.050 Uiso 1 1 calc R
C8 C 1.0816(6) 0.1933(4) 0.5524(5) 0.0406(13) Uani 1 1 d .
H8A H 1.1733 0.1840 0.5352 0.049 Uiso 1 1 calc R
C9 C 1.0107(7) 0.2783(3) 1.2123(5) 0.0428(13) Uani 1 1 d .
H9A H 1.1101 0.2634 1.2102 0.051 Uiso 1 1 calc R
H9B H 0.9613 0.2314 1.2340 0.051 Uiso 1 1 calc R
C10 C 1.0114(6) 0.3419(3) 1.3091(5) 0.0357(11) Uani 1 1 d .
C11 C 1.1402(7) 0.3628(4) 1.3848(5) 0.0474(15) Uani 1 1 d .
H11A H 1.2276 0.3388 1.3779 0.057 Uiso 1 1 calc R
C12 C 1.1341(6) 0.4191(4) 1.4685(5) 0.0448(14) Uani 1 1 d .
H12A H 1.2193 0.4324 1.5197 0.054 Uiso 1 1 calc R
C13 C 0.8878(6) 0.4357(4) 1.4097(6) 0.0499(17) Uani 1 1 d .
H13A H 0.8016 0.4609 1.4172 0.060 Uiso 1 1 calc R
C14 C 0.8838(7) 0.3778(5) 1.3242(6) 0.0561(18) Uani 1 1 d .
H14A H 0.7962 0.3631 1.2774 0.067 Uiso 1 1 calc R
C15 C 0.7329(6) -0.0037(3) 0.2480(5) 0.0344(11) Uani 1 1 d .
C16 C 0.5773(5) 0.0099(3) 0.1791(4) 0.0272(10) Uani 1 1 d .
H16A H 0.5747 0.0625 0.1419 0.033 Uiso 1 1 calc R
C17 C 0.4683(6) 0.0109(4) 0.2660(5) 0.0401(13) Uani 1 1 d .
H17A H 0.4506 -0.0435 0.2878 0.048 Uiso 1 1 calc R
H17B H 0.5125 0.0386 0.3376 0.048 Uiso 1 1 calc R
C18 C 0.3235(4) 0.0500(4) 0.2175(4) 0.0339(10) Uani 1 1 d .
H18A H 0.3400 0.1050 0.1981 0.041 Uiso 1 1 calc R
H18B H 0.2794 0.0233 0.1451 0.041 Uiso 1 1 calc R
C19 C 0.2200(5) 0.0475(4) 0.3041(4) 0.0325(10) Uani 1 1 d .
C20 C 0.6116(5) -0.0507(3) -0.0040(5) 0.0348(11) Uani 1 1 d .
C21 C 0.6215(5) 0.2408(3) 0.8996(5) 0.0379(13) Uani 1 1 d .
C22 C 0.4672(5) 0.2098(3) 0.8415(5) 0.0339(11) Uani 1 1 d .
H22A H 0.3956 0.2521 0.8429 0.041 Uiso 1 1 calc R
C23 C 0.4322(6) 0.1399(4) 0.9156(6) 0.0449(14) Uani 1 1 d .
H23A H 0.4441 0.1570 0.9975 0.054 Uiso 1 1 calc R
H23B H 0.5027 0.0982 0.9118 0.054 Uiso 1 1 calc R
C24 C 0.2804(6) 0.1043(3) 0.8798(6) 0.0442(14) Uani 1 1 d .
H24A H 0.2592 0.0991 0.7942 0.053 Uiso 1 1 calc R
H24B H 0.2806 0.0512 0.9130 0.053 Uiso 1 1 calc R
C25 C 0.1601(6) 0.1517(4) 0.9184(6) 0.0469(15) Uani 1 1 d .
C26 C 0.4523(5) 0.2325(4) 0.6274(5) 0.0412(13) Uani 1 1 d .
N1 N 0.9412(4) 0.3033(3) 1.0935(4) 0.0303(9) Uani 1 1 d .
H1C H 0.8486 0.3172 1.0982 0.036 Uiso 1 1 calc R
N2 N 0.9787(5) 0.3262(2) 0.8553(4) 0.0306(9) Uani 1 1 d .
H2C H 1.0757 0.3253 0.8555 0.037 Uiso 1 1 calc R
N3 N 0.9741(5) 0.1458(3) 0.5054(4) 0.0318(10) Uani 1 1 d .
N4 N 1.0081(5) 0.4574(3) 1.4815(4) 0.0301(9) Uani 1 1 d .
N5 N 0.5365(5) -0.0473(3) 0.0871(4) 0.0327(9) Uani 1 1 d .
H5B H 0.4653 -0.0792 0.0891 0.039 Uiso 1 1 calc R
N6 N 0.5756(6) -0.1130(4) -0.0791(5) 0.0614(17) Uani 1 1 d .
H6B H 0.6119 -0.1165 -0.1425 0.074 Uiso 1 1 calc R
H6C H 0.5165 -0.1488 -0.0632 0.074 Uiso 1 1 calc R
N7 N 0.4601(5) 0.1824(3) 0.7215(4) 0.0396(10) Uani 1 1 d .
H7B H 0.4608 0.1320 0.7089 0.048 Uiso 1 1 calc R
N8 N 0.4497(6) 0.1972(4) 0.5212(5) 0.0606(16) Uani 1 1 d .
H8B H 0.4440 0.2257 0.4584 0.073 Uiso 1 1 calc R
H8C H 0.4536 0.1462 0.5166 0.073 Uiso 1 1 calc R
O1 O 0.7814(4) 0.0543(3) 0.3140(3) 0.0402(8) Uani 1 1 d .
O2 O 0.7983(4) -0.0650(3) 0.2378(4) 0.0478(10) Uani 1 1 d .
O3 O 0.6946(4) 0.0004(2) -0.0246(4) 0.0424(9) Uani 1 1 d .
O4 O 0.2601(5) 0.0291(4) 0.4091(4) 0.0709(17) Uani 1 1 d .
O5 O 0.0894(4) 0.0664(3) 0.2660(4) 0.0436(10) Uani 1 1 d .
O6 O 0.7249(3) 0.2089(2) 0.8635(3) 0.0342(8) Uani 1 1 d .
O7 O 0.6254(5) 0.2891(3) 0.9770(5) 0.0716(16) Uani 1 1 d .
O8 O 0.4470(6) 0.3055(3) 0.6403(5) 0.0655(14) Uani 1 1 d .
O9 O 0.1896(5) 0.2012(3) 1.0006(5) 0.0623(13) Uani 1 1 d .
O10 O 0.0350(4) 0.1420(3) 0.8666(4) 0.0508(11) Uani 1 1 d .
O11 O 0.8817(5) 0.1249(2) 1.0716(4) 0.0443(10) Uani 1 1 d .
O12 O -0.1790(6) 0.0272(3) 0.7743(4) 0.0671(14) Uani 1 1 d .
O13 O 0.5701(7) 0.0407(4) 0.6163(6) 0.096(2) Uani 1 1 d .
O14 O 0.6672(6) 0.2102(4) 1.2263(5) 0.0792(16) Uani 1 1 d .
O15 O 0.5501(7) 0.3995(4) 0.4836(6) 0.0861(18) Uani 1 1 d .
O16 O 0.4512(11) 0.2871(7) 0.3000(9) 0.179(6) 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
O1 Zn1 O5 100.4(3) . 1_655
O1 Zn1 N4 107.0(2) . 2_747
O5 Zn1 N4 132.18(19) 1_655 2_747
O1 Zn1 N3 96.1(2) . .
O5 Zn1 N3 114.1(2) 1_655 .
N4 Zn1 N3 101.3(2) 2_747 .
O6 Zn2 O10 101.4(3) . 1_655
O6 Zn2 N1 112.04(18) . .
O10 Zn2 N1 146.4(2) 1_655 .
O6 Zn2 N2 96.0(2) . .
O10 Zn2 N2 96.7(2) 1_655 .
N1 Zn2 N2 83.0(2) . .
O6 Zn2 O11 87.8(2) . .
O10 Zn2 O11 89.2(2) 1_655 .
N1 Zn2 O11 89.3(2) . .
N2 Zn2 O11 172.18(16) . .
O6 Zn2 O9 158.17(17) . 1_655
O10 Zn2 O9 56.8(2) 1_655 1_655
N1 Zn2 O9 89.79(17) . 1_655
N2 Zn2 O9 85.8(2) . 1_655
O11 Zn2 O9 93.2(2) . 1_655
O6 Zn2 C25 129.4(3) . 1_655
O10 Zn2 C25 28.0(2) 1_655 1_655
N1 Zn2 C25 118.6(2) . 1_655
N2 Zn2 C25 91.4(2) . 1_655
O11 Zn2 C25 91.4(2) . 1_655
O9 Zn2 C25 28.8(2) 1_655 1_655
N1 C1 C2 108.3(5) . .
N1 C1 H1A 110.0 . .
C2 C1 H1A 110.0 . .
N1 C1 H1B 110.0 . .
C2 C1 H1B 110.0 . .
H1A C1 H1B 108.4 . .
N2 C2 C1 109.7(5) . .
N2 C2 H2A 109.7 . .
C1 C2 H2A 109.7 . .
N2 C2 H2B 109.7 . .
C1 C2 H2B 109.7 . .
H2A C2 H2B 108.2 . .
N2 C3 C4 110.6(5) . .
N2 C3 H3A 109.5 . .
C4 C3 H3A 109.5 . .
N2 C3 H3B 109.5 . .
C4 C3 H3B 109.5 . .
H3A C3 H3B 108.1 . .
C5 C4 C7 116.6(5) . .
C5 C4 C3 119.8(5) . .
C7 C4 C3 123.5(5) . .
C4 C5 C6 121.7(5) . .
C4 C5 H5A 119.1 . .
C6 C5 H5A 119.1 . .
N3 C6 C5 119.9(5) . .
N3 C6 H6A 120.0 . .
C5 C6 H6A 120.0 . .
C4 C7 C8 121.0(5) . .
C4 C7 H7A 119.5 . .
C8 C7 H7A 119.5 . .
N3 C8 C7 122.9(5) . .
N3 C8 H8A 118.5 . .
C7 C8 H8A 118.5 . .
N1 C9 C10 114.6(5) . .
N1 C9 H9A 108.6 . .
C10 C9 H9A 108.6 . .
N1 C9 H9B 108.6 . .
C10 C9 H9B 108.6 . .
H9A C9 H9B 107.6 . .
C14 C10 C11 118.9(6) . .
C14 C10 C9 120.2(5) . .
C11 C10 C9 120.8(5) . .
C12 C11 C10 118.2(5) . .
C12 C11 H11A 120.9 . .
C10 C11 H11A 120.9 . .
C11 C12 N4 123.4(5) . .
C11 C12 H12A 118.3 . .
N4 C12 H12A 118.3 . .
N4 C13 C14 123.3(6) . .
N4 C13 H13A 118.4 . .
C14 C13 H13A 118.4 . .
C10 C14 C13 119.1(6) . .
C10 C14 H14A 120.5 . .
C13 C14 H14A 120.5 . .
O2 C15 O1 125.2(5) . .
O2 C15 C16 121.5(5) . .
O1 C15 C16 113.3(4) . .
N5 C16 C15 112.4(4) . .
N5 C16 C17 111.3(4) . .
C15 C16 C17 110.1(5) . .
N5 C16 H16A 107.6 . .
C15 C16 H16A 107.6 . .
C17 C16 H16A 107.6 . .
C18 C17 C16 114.7(5) . .
C18 C17 H17A 108.6 . .
C16 C17 H17A 108.6 . .
C18 C17 H17B 108.6 . .
C16 C17 H17B 108.6 . .
H17A C17 H17B 107.6 . .
C19 C18 C17 112.6(5) . .
C19 C18 H18A 109.1 . .
C17 C18 H18A 109.1 . .
C19 C18 H18B 109.1 . .
C17 C18 H18B 109.1 . .
H18A C18 H18B 107.8 . .
O4 C19 O5 120.3(4) . .
O4 C19 C18 122.1(5) . .
O5 C19 C18 117.6(5) . .
O3 C20 N6 121.2(5) . .
O3 C20 N5 124.0(5) . .
N6 C20 N5 114.5(5) . .
O7 C21 O6 128.2(5) . .
O7 C21 C22 116.2(5) . .
O6 C21 C22 115.5(5) . .
N7 C22 C23 108.1(5) . .
N7 C22 C21 113.0(4) . .
C23 C22 C21 107.1(5) . .
N7 C22 H22A 109.5 . .
C23 C22 H22A 109.5 . .
C21 C22 H22A 109.5 . .
C22 C23 C24 115.8(5) . .
C22 C23 H23A 108.3 . .
C24 C23 H23A 108.3 . .
C22 C23 H23B 108.3 . .
C24 C23 H23B 108.3 . .
H23A C23 H23B 107.4 . .
C25 C24 C23 115.0(6) . .
C25 C24 H24A 108.5 . .
C23 C24 H24A 108.5 . .
C25 C24 H24B 108.5 . .
C23 C24 H24B 108.5 . .
H24A C24 H24B 107.5 . .
O10 C25 O9 121.0(5) . .
O10 C25 C24 119.2(7) . .
O9 C25 C24 119.8(6) . .
O10 C25 Zn2 50.8(3) . 1_455
O9 C25 Zn2 70.2(3) . 1_455
C24 C25 Zn2 169.9(5) . 1_455
O8 C26 N7 121.0(6) . .
O8 C26 N8 123.3(6) . .
N7 C26 N8 115.7(6) . .
C1 N1 C9 109.9(5) . .
C1 N1 Zn2 107.1(3) . .
C9 N1 Zn2 119.0(4) . .
C1 N1 H1C 106.7 . .
C9 N1 H1C 106.7 . .
Zn2 N1 H1C 106.7 . .
C2 N2 C3 110.0(5) . .
C2 N2 Zn2 104.1(4) . .
C3 N2 Zn2 120.4(3) . .
C2 N2 H2C 107.2 . .
C3 N2 H2C 107.2 . .
Zn2 N2 H2C 107.2 . .
C8 N3 C6 117.8(5) . .
C8 N3 Zn1 127.8(4) . .
C6 N3 Zn1 114.4(4) . .
C13 N4 C12 117.1(5) . .
C13 N4 Zn1 123.3(4) . 2_757
C12 N4 Zn1 119.5(4) . 2_757
C20 N5 C16 119.3(4) . .
C20 N5 H5B 120.4 . .
C16 N5 H5B 120.4 . .
C20 N6 H6B 120.0 . .
C20 N6 H6C 120.0 . .
H6B N6 H6C 120.0 . .
C26 N7 C22 123.2(5) . .
C26 N7 H7B 118.4 . .
C22 N7 H7B 118.4 . .
C26 N8 H8B 120.0 . .
C26 N8 H8C 120.0 . .
H8B N8 H8C 120.0 . .
C15 O1 Zn1 117.4(4) . .
C19 O5 Zn1 106.3(4) . 1_455
C21 O6 Zn2 121.0(4) . .
C25 O9 Zn2 80.9(4) . 1_455
C25 O10 Zn2 101.2(5) . 1_455
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O1 1.973(7) .
Zn1 O5 1.991(5) 1_655
Zn1 N4 2.037(5) 2_747
Zn1 N3 2.065(6) .
Zn2 O6 1.999(7) .
Zn2 O10 2.024(5) 1_655
Zn2 N1 2.120(6) .
Zn2 N2 2.177(5) .
Zn2 O11 2.223(5) .
Zn2 O9 2.442(10) 1_655
Zn2 C25 2.562(9) 1_655
C1 N1 1.480(8) .
C1 C2 1.505(9) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
C2 N2 1.486(7) .
C2 H2A 0.9700 .
C2 H2B 0.9700 .
C3 N2 1.465(8) .
C3 C4 1.511(8) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 C5 1.343(9) .
C4 C7 1.359(8) .
C5 C6 1.412(9) .
C5 H5A 0.9300 .
C6 N3 1.343(8) .
C6 H6A 0.9300 .
C7 C8 1.368(8) .
C7 H7A 0.9300 .
C8 N3 1.323(8) .
C8 H8A 0.9300 .
C9 N1 1.464(8) .
C9 C10 1.541(8) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 C14 1.379(9) .
C10 C11 1.400(9) .
C11 C12 1.357(9) .
C11 H11A 0.9300 .
C12 N4 1.378(8) .
C12 H12A 0.9300 .
C13 N4 1.323(8) .
C13 C14 1.379(9) .
C13 H13A 0.9300 .
C14 H14A 0.9300 .
C15 O2 1.215(7) .
C15 O1 1.268(7) .
C15 C16 1.546(8) .
C16 N5 1.429(7) .
C16 C17 1.553(7) .
C16 H16A 0.9800 .
C17 C18 1.521(8) .
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C18 C19 1.511(7) .
C18 H18A 0.9700 .
C18 H18B 0.9700 .
C19 O4 1.235(7) .
C19 O5 1.265(7) .
C20 O3 1.211(7) .
C20 N6 1.359(8) .
C20 N5 1.365(7) .
C21 O7 1.199(7) .
C21 O6 1.243(7) .
C21 C22 1.570(8) .
C22 N7 1.443(8) .
C22 C23 1.520(8) .
C22 H22A 0.9800 .
C23 C24 1.531(9) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
C24 C25 1.512(8) .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 O10 1.226(9) .
C25 O9 1.251(9) .
C25 Zn2 2.562(9) 1_455
C26 O8 1.239(9) .
C26 N7 1.362(8) .
C26 N8 1.352(9) .
N1 H1C 0.9100 .
N2 H2C 0.9100 .
N4 Zn1 2.037(5) 2_757
N5 H5B 0.8600 .
N6 H6B 0.8600 .
N6 H6C 0.8600 .
N7 H7B 0.8600 .
N8 H8B 0.8600 .
N8 H8C 0.8600 .
O5 Zn1 1.991(5) 1_455
O9 Zn2 2.442(10) 1_455
O10 Zn2 2.024(5) 1_455
