#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/44/7214470.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_7214470
loop_
_publ_author_name
'Yang, Wei'
'Wang, Chiming'
'Ma, Qi'
'Liu, Chenxi'
'Wang, Hailong'
'Jiang, Jianzhuang'
_publ_section_title
;
 Synthesis, crystal structures, and luminescence properties of seven
 tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by
 tricarboxylates
;
_journal_issue                   21
_journal_name_full               CrystEngComm
_journal_page_first              4554
_journal_paper_doi               10.1039/c4ce00212a
_journal_volume                  16
_journal_year                    2014
_chemical_formula_sum            'C30 H23 N6 O9 Zn1.5'
_chemical_formula_weight         709.60
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 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                 134.36(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   37.342(7)
_cell_length_b                   8.2819(4)
_cell_length_c                   26.577(9)
_cell_measurement_reflns_used    3174
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.94
_cell_measurement_theta_min      2.98
_cell_volume                     5876(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 16.2141
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω 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  0.0781
_diffrn_reflns_av_sigmaI/netI    0.0833
_diffrn_reflns_limit_h_max       44
_diffrn_reflns_limit_h_min       -44
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            20047
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.99
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.301
_exptl_absorpt_correction_T_max  0.901
_exptl_absorpt_correction_T_min  0.855
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.34.40 (release 27-08-2010 CrysAlis171 .NET)
(compiled Aug 27 2010,11:50:40)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.604
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2896
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.529
_refine_diff_density_min         -0.463
_refine_diff_density_rms         0.069
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     421
_refine_ls_number_reflns         5160
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      1.047
_refine_ls_R_factor_all          0.1415
_refine_ls_R_factor_gt           0.0794
_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)+(0.0478P)²+19.2138P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1381
_refine_ls_wR_factor_ref         0.1575
_reflns_number_gt                3093
_reflns_number_total             5160
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4ce00212a3.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/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 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 7214470--7214476.cif.
;
_cod_original_cell_volume        5877(2)
_cod_original_sg_symbol_H-M      C2/c
_cod_original_formula_sum        'C30 H23 N6 O9 Zn1.50'
_cod_database_code               7214470
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.4167(3) 1.4297(10) -0.2766(5) 0.114(3) Uani 1 1 d . . .
H1 H 0.3918 1.5012 -0.3112 0.136 Uiso 1 1 calc R . .
C2 C 0.4093(4) 1.2982(11) -0.2539(5) 0.114(3) Uani 1 1 d . . .
H2 H 0.3793 1.2656 -0.2686 0.137 Uiso 1 1 calc R . .
C3 C 0.4862(3) 1.3183(8) -0.1991(4) 0.077(2) Uani 1 1 d . . .
H3 H 0.5205 1.2986 -0.1671 0.092 Uiso 1 1 calc R . .
C4 C 0.4651(3) 1.0832(8) -0.1652(4) 0.072(2) Uani 1 1 d . . .
C5 C 0.5104(3) 1.0697(8) -0.0967(4) 0.0654(19) Uani 1 1 d . . .
H5 H 0.5353 1.1470 -0.0768 0.078 Uiso 1 1 calc R . .
C6 C 0.5182(3) 0.9387(7) -0.0582(4) 0.0586(17) Uani 1 1 d . . .
C7 C 0.4810(3) 0.8221(7) -0.0886(4) 0.0630(18) Uani 1 1 d . . .
H7 H 0.4863 0.7343 -0.0622 0.076 Uiso 1 1 calc R . .
C8 C 0.4369(3) 0.8377(7) -0.1572(4) 0.0606(18) Uani 1 1 d . A .
C9 C 0.4284(3) 0.9669(8) -0.1967(4) 0.068(2) Uani 1 1 d . . .
H9 H 0.3984 0.9760 -0.2438 0.082 Uiso 1 1 calc R . .
C10 C 0.5953(3) 1.0522(8) 0.0578(4) 0.074(2) Uani 1 1 d . . .
H10 H 0.5903 1.1610 0.0460 0.089 Uiso 1 1 calc R . .
C11 C 0.6336(3) 0.9895(8) 0.1201(4) 0.078(2) Uani 1 1 d . . .
H11 H 0.6603 1.0482 0.1595 0.093 Uiso 1 1 calc R . .
C12 C 0.5870(3) 0.7928(8) 0.0540(4) 0.070(2) Uani 1 1 d . . .
H12 H 0.5744 0.6891 0.0372 0.084 Uiso 1 1 calc R . .
C13 C 0.3932(3) 0.5953(9) -0.1640(3) 0.082(2) Uani 1 1 d D A .
H13 H 0.4188 0.5629 -0.1174 0.099 Uiso 1 1 calc R . .
C14 C 0.3189(5) 0.6325(19) -0.2604(10) 0.122(6) Uani 0.527(16) 1 d PD A 1
H14 H 0.2843 0.6231 -0.2973 0.147 Uiso 0.527(16) 1 calc PR A 1
C15 C 0.3475(4) 0.761(2) -0.2473(10) 0.122(6) Uani 0.527(16) 1 d PD A 1
H15 H 0.3356 0.8571 -0.2726 0.147 Uiso 0.527(16) 1 calc PR A 1
C14A C 0.3300(7) 0.567(2) -0.2746(6) 0.122(6) Uani 0.473(16) 1 d PD A 2
H14A H 0.3023 0.5227 -0.3179 0.147 Uiso 0.473(16) 1 calc PR A 2
C15A C 0.3588(7) 0.695(2) -0.2625(5) 0.122(6) Uani 0.473(16) 1 d PD A 2
H15A H 0.3536 0.7529 -0.2970 0.147 Uiso 0.473(16) 1 calc PR A 2
C16 C 0.6920(2) 0.5274(7) 0.1224(3) 0.0522(16) Uani 1 1 d . . .
C17 C 0.7129(2) 0.5143(7) 0.0904(3) 0.0491(16) Uani 1 1 d . . .
C18 C 0.6899(2) 0.5993(8) 0.0294(3) 0.0581(17) Uani 1 1 d . . .
C19 C 0.7084(3) 0.5997(10) -0.0003(4) 0.079(2) Uani 1 1 d . . .
H19 H 0.6923 0.6584 -0.0412 0.095 Uiso 1 1 calc R . .
C20 C 0.7510(3) 0.5125(10) 0.0306(5) 0.088(2) Uani 1 1 d . . .
H20 H 0.7634 0.5095 0.0100 0.105 Uiso 1 1 calc R . .
C21 C 0.7755(3) 0.4292(8) 0.0928(4) 0.075(2) Uani 1 1 d . . .
H21 H 0.8046 0.3722 0.1142 0.090 Uiso 1 1 calc R . .
C22 C 0.7571(2) 0.4298(7) 0.1232(3) 0.0497(15) Uani 1 1 d . . .
C23 C 0.7855(3) 0.3398(8) 0.1909(4) 0.071(2) Uani 1 1 d . . .
C24 C 0.6438(2) 0.8418(8) -0.0184(4) 0.0566(17) Uani 1 1 d . . .
C25 C 0.6752(3) 0.9532(13) 0.0345(4) 0.097(3) Uani 1 1 d . . .
H25 H 0.6990 0.9198 0.0812 0.117 Uiso 1 1 calc R . .
C26 C 0.6713(5) 1.1115(14) 0.0184(8) 0.132(5) Uani 1 1 d . . .
H26 H 0.6915 1.1865 0.0546 0.158 Uiso 1 1 calc R . .
C27 C 0.6391(4) 1.1623(11) -0.0484(8) 0.122(4) Uani 1 1 d . . .
H27 H 0.6381 1.2707 -0.0585 0.147 Uiso 1 1 calc R . .
C28 C 0.6077(3) 1.0542(9) -0.1018(5) 0.090(2) Uani 1 1 d . . .
H28 H 0.5850 1.0897 -0.1482 0.107 Uiso 1 1 calc R . .
C29 C 0.6092(2) 0.8904(7) -0.0874(3) 0.0523(16) Uani 1 1 d . . .
C30 C 0.5720(3) 0.7785(9) -0.1479(4) 0.068(2) Uani 1 1 d . . .
N1 N 0.4649(2) 1.4406(6) -0.2419(3) 0.0717(17) Uani 1 1 d . . .
N2 N 0.4547(2) 1.2242(7) -0.2051(3) 0.0787(18) Uani 1 1 d . . .
N3 N 0.6282(2) 0.8238(6) 0.1182(3) 0.0687(16) Uani 1 1 d . . .
N4 N 0.5641(2) 0.9278(6) 0.0139(3) 0.0601(14) Uani 1 1 d . . .
N5 N 0.3969(2) 0.7227(6) -0.1904(3) 0.0670(16) Uani 1 1 d D . .
N6 N 0.3508(2) 0.5201(6) -0.2086(3) 0.0649(15) Uani 1 1 d D . .
O1 O 0.65000(16) 0.4674(5) 0.0902(2) 0.0652(12) Uani 1 1 d . . .
O2 O 0.71815(16) 0.6056(5) 0.1788(2) 0.0662(12) Uani 1 1 d . . .
O3 O 0.7625(2) 0.2604(7) 0.1990(3) 0.0857(16) Uani 1 1 d . . .
O4 O 0.8315(2) 0.3480(6) 0.2360(3) 0.112(2) Uani 1 1 d . . .
O5 O 0.64616(16) 0.6807(6) -0.0020(2) 0.0805(15) Uani 1 1 d . . .
O6 O 0.55311(19) 0.6695(6) -0.1415(3) 0.0884(16) Uani 1 1 d . . .
O7 O 0.5602(3) 0.8032(7) -0.2032(3) 0.124(2) Uani 1 1 d . . .
O8 O 0.56409(18) 0.4557(6) -0.0471(3) 0.0900(16) Uani 1 1 d D . .
H8A H 0.5920 0.4587 -0.0042 0.135 Uiso 1 1 d RD . .
H8B H 0.5613 0.5388 -0.0684 0.135 Uiso 1 1 d RD . .
O9 O 0.4988(3) 1.4034(8) -0.0398(5) 0.176(3) Uani 1 1 d D . .
H9B H 0.4737 1.3524 -0.0760 0.264 Uiso 1 1 d RD . .
H9A H 0.5205 1.4227 -0.0411 0.264 Uiso 1 1 d RD . .
Zn1 Zn 0.5000 1.60873(11) -0.2500 0.0566(3) Uani 1 2 d S . .
Zn2 Zn 0.67818(3) 0.66932(8) 0.19908(4) 0.0622(3) 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
N1 C1 C2 109.9(8) . .
N1 C1 H1 125.0 . .
C2 C1 H1 125.0 . .
N2 C2 C1 106.1(8) . .
N2 C2 H2 127.0 . .
C1 C2 H2 127.0 . .
N1 C3 N2 113.8(7) . .
N1 C3 H3 123.1 . .
N2 C3 H3 123.1 . .
C5 C4 C9 121.9(6) . .
C5 C4 N2 119.5(6) . .
C9 C4 N2 118.5(7) . .
C4 C5 C6 118.3(6) . .
C4 C5 H5 120.8 . .
C6 C5 H5 120.8 . .
C5 C6 C7 120.5(7) . .
C5 C6 N4 118.6(6) . .
C7 C6 N4 120.8(6) . .
C8 C7 C6 119.5(6) . .
C8 C7 H7 120.2 . .
C6 C7 H7 120.2 . .
C7 C8 C9 121.0(6) . .
C7 C8 N5 121.6(6) . .
C9 C8 N5 117.4(7) . .
C8 C9 C4 118.6(7) . .
C8 C9 H9 120.7 . .
C4 C9 H9 120.7 . .
C11 C10 N4 107.7(6) . .
C11 C10 H10 126.2 . .
N4 C10 H10 126.2 . .
C10 C11 N3 109.9(7) . .
C10 C11 H11 125.0 . .
N3 C11 H11 125.0 . .
N3 C12 N4 112.8(6) . .
N3 C12 H12 123.6 . .
N4 C12 H12 123.6 . .
N6 C13 N5 114.3(6) . .
N6 C13 H13 122.9 . .
N5 C13 H13 122.9 . .
C15 C14 N6 107.2(9) . .
C15 C14 H14 126.4 . .
N6 C14 H14 126.4 . .
C14 C15 N5 108.0(8) . .
C14 C15 H15 126.0 . .
N5 C15 H15 126.0 . .
C15A C14A N6 105.3(10) . .
C15A C14A H14A 127.3 . .
N6 C14A H14A 127.3 . .
C14A C15A N5 109.4(9) . .
C14A C15A H15A 125.3 . .
N5 C15A H15A 125.3 . .
O1 C16 O2 125.4(6) . .
O1 C16 C17 118.8(6) . .
O2 C16 C17 115.7(6) . .
C18 C17 C22 118.7(6) . .
C18 C17 C16 118.8(6) . .
C22 C17 C16 122.3(5) . .
C19 C18 O5 120.7(6) . .
C19 C18 C17 121.9(7) . .
O5 C18 C17 117.4(6) . .
C18 C19 C20 119.6(7) . .
C18 C19 H19 120.2 . .
C20 C19 H19 120.2 . .
C19 C20 C21 119.5(7) . .
C19 C20 H20 120.3 . .
C21 C20 H20 120.3 . .
C22 C21 C20 120.9(7) . .
C22 C21 H21 119.5 . .
C20 C21 H21 119.5 . .
C21 C22 C17 119.3(6) . .
C21 C22 C23 118.4(7) . .
C17 C22 C23 122.2(6) . .
O3 C23 O4 122.4(8) . .
O3 C23 C22 119.1(7) . .
O4 C23 C22 118.5(8) . .
C29 C24 C25 120.1(7) . .
C29 C24 O5 119.8(5) . .
C25 C24 O5 120.1(7) . .
C26 C25 C24 120.0(9) . .
C26 C25 H25 120.0 . .
C24 C25 H25 120.0 . .
C27 C26 C25 121.4(10) . .
C27 C26 H26 119.3 . .
C25 C26 H26 119.3 . .
C26 C27 C28 119.6(9) . .
C26 C27 H27 120.2 . .
C28 C27 H27 120.2 . .
C27 C28 C29 120.7(8) . .
C27 C28 H28 119.6 . .
C29 C28 H28 119.6 . .
C24 C29 C28 118.1(6) . .
C24 C29 C30 123.5(6) . .
C28 C29 C30 118.4(7) . .
O7 C30 O6 122.0(8) . .
O7 C30 C29 118.2(8) . .
O6 C30 C29 119.7(7) . .
O7 C30 Zn1 65.3(5) . 1_545
O6 C30 Zn1 57.0(4) . 1_545
C29 C30 Zn1 171.4(5) . 1_545
C3 N1 C1 104.9(6) . .
C3 N1 Zn1 125.7(5) . .
C1 N1 Zn1 129.3(5) . .
C3 N2 C2 105.1(6) . .
C3 N2 C4 129.0(7) . .
C2 N2 C4 125.6(7) . .
C12 N3 C11 104.7(6) . .
C12 N3 Zn2 129.5(5) . .
C11 N3 Zn2 125.7(6) . .
C12 N4 C10 104.8(6) . .
C12 N4 C6 127.9(6) . .
C10 N4 C6 127.3(6) . .
C13 N5 C15 102.1(7) . .
C13 N5 C15A 102.2(7) . .
C15 N5 C15A 39.6(11) . .
C13 N5 C8 130.4(6) . .
C15 N5 C8 122.8(7) . .
C15A N5 C8 125.4(8) . .
C13 N6 C14 103.9(7) . .
C13 N6 C14A 105.6(7) . .
C14 N6 C14A 38.3(11) . .
C13 N6 Zn2 132.7(5) . 5_665
C14 N6 Zn2 119.1(7) . 5_665
C14A N6 Zn2 120.1(7) . 5_665
C16 O2 Zn2 110.9(4) . .
C23 O3 Zn2 100.6(5) . 4_645
C23 O4 Zn2 82.0(5) . 4_645
C18 O5 C24 116.6(5) . .
C30 O6 Zn1 93.9(5) . 1_545
C30 O7 Zn1 85.9(5) . 1_545
H8A O8 H8B 109.4 . .
H9B O9 H9A 111.9 . .
N1 Zn1 N1 93.0(4) 2_654 .
N1 Zn1 O6 104.4(2) 2_654 1_565
N1 Zn1 O6 94.5(2) . 1_565
N1 Zn1 O6 94.5(2) 2_654 2_664
N1 Zn1 O6 104.4(2) . 2_664
O6 Zn1 O6 152.6(3) 1_565 2_664
N1 Zn1 O7 94.5(2) 2_654 1_565
N1 Zn1 O7 152.3(2) . 1_565
O6 Zn1 O7 57.81(19) 1_565 1_565
O6 Zn1 O7 101.6(2) 2_664 1_565
N1 Zn1 O7 152.3(2) 2_654 2_664
N1 Zn1 O7 94.5(2) . 2_664
O6 Zn1 O7 101.6(2) 1_565 2_664
O6 Zn1 O7 57.81(19) 2_664 2_664
O7 Zn1 O7 91.0(3) 1_565 2_664
N1 Zn1 C30 102.4(2) 2_654 1_565
N1 Zn1 C30 123.5(3) . 1_565
O6 Zn1 C30 29.1(2) 1_565 1_565
O6 Zn1 C30 127.6(3) 2_664 1_565
O7 Zn1 C30 28.8(2) 1_565 1_565
O7 Zn1 C30 95.5(2) 2_664 1_565
N1 Zn1 C30 123.5(3) 2_654 2_664
N1 Zn1 C30 102.4(2) . 2_664
O6 Zn1 C30 127.6(3) 1_565 2_664
O6 Zn1 C30 29.1(2) 2_664 2_664
O7 Zn1 C30 95.5(2) 1_565 2_664
O7 Zn1 C30 28.8(2) 2_664 2_664
C30 Zn1 C30 112.3(3) 1_565 2_664
O2 Zn2 N6 113.5(2) . 5_665
O2 Zn2 N3 100.9(2) . .
N6 Zn2 N3 116.4(2) 5_665 .
O2 Zn2 O3 97.5(2) . 4_655
N6 Zn2 O3 106.9(2) 5_665 4_655
N3 Zn2 O3 119.9(2) . 4_655
O2 Zn2 O4 148.36(19) . 4_655
N6 Zn2 O4 91.4(2) 5_665 4_655
N3 Zn2 O4 83.6(2) . 4_655
O3 Zn2 O4 54.9(2) 4_655 4_655
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 N1 1.334(9) .
C1 C2 1.365(10) .
C1 H1 0.9300 .
C2 N2 1.362(10) .
C2 H2 0.9300 .
C3 N1 1.299(8) .
C3 N2 1.325(8) .
C3 H3 0.9300 .
C4 C5 1.372(9) .
C4 C9 1.381(9) .
C4 N2 1.437(8) .
C5 C6 1.377(8) .
C5 H5 0.9300 .
C6 C7 1.393(8) .
C6 N4 1.423(8) .
C7 C8 1.362(9) .
C7 H7 0.9300 .
C8 C9 1.371(8) .
C8 N5 1.441(8) .
C9 H9 0.9300 .
C10 C11 1.321(9) .
C10 N4 1.370(8) .
C10 H10 0.9300 .
C11 N3 1.383(8) .
C11 H11 0.9300 .
C12 N3 1.293(8) .
C12 N4 1.358(8) .
C12 H12 0.9300 .
C13 N6 1.294(8) .
C13 N5 1.327(7) .
C13 H13 0.9300 .
C14 C15 1.370(9) .
C14 N6 1.373(8) .
C14 H14 0.9300 .
C15 N5 1.373(9) .
C15 H15 0.9300 .
C14A C15A 1.373(9) .
C14A N6 1.388(9) .
C14A H14A 0.9300 .
C15A N5 1.391(9) .
C15A H15A 0.9300 .
C16 O1 1.250(7) .
C16 O2 1.255(7) .
C16 C17 1.508(8) .
C17 C18 1.384(8) .
C17 C22 1.400(8) .
C18 C19 1.365(9) .
C18 O5 1.383(8) .
C19 C20 1.380(10) .
C19 H19 0.9300 .
C20 C21 1.391(10) .
C20 H20 0.9300 .
C21 C22 1.377(9) .
C21 H21 0.9300 .
C22 C23 1.499(10) .
C23 O3 1.215(8) .
C23 O4 1.231(8) .
C24 C29 1.371(8) .
C24 C25 1.378(9) .
C24 O5 1.387(7) .
C25 C26 1.355(13) .
C25 H25 0.9300 .
C26 C27 1.339(13) .
C26 H26 0.9300 .
C27 C28 1.365(12) .
C27 H27 0.9300 .
C28 C29 1.399(8) .
C28 H28 0.9300 .
C29 C30 1.501(9) .
C30 O7 1.219(8) .
C30 O6 1.229(8) .
C30 Zn1 2.523(8) 1_545
N1 Zn1 2.024(5) .
N3 Zn2 2.033(6) .
N6 Zn2 2.020(5) 5_665
O2 Zn2 1.979(4) .
O3 Zn2 2.103(5) 4_645
O4 Zn2 2.485(6) 4_645
O6 Zn1 2.122(5) 1_545
O7 Zn1 2.298(7) 1_545
O8 H8A 0.8518 .
O8 H8B 0.8498 .
O9 H9B 0.8492 .
O9 H9A 0.8524 .
Zn1 N1 2.024(5) 2_654
Zn1 O6 2.122(5) 1_565
Zn1 O6 2.122(5) 2_664
Zn1 O7 2.298(7) 1_565
Zn1 O7 2.298(7) 2_664
Zn1 C30 2.523(8) 1_565
Zn1 C30 2.523(8) 2_664
Zn2 N6 2.020(5) 5_665
Zn2 O3 2.103(5) 4_655
Zn2 O4 2.485(6) 4_655
