#------------------------------------------------------------------------------
#$Date: 2022-11-18 11:18:13 +0200 (Fri, 18 Nov 2022) $
#$Revision: 279385 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/61/8106151.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_8106151
loop_
_publ_author_name
'Zhang, Ping'
'Wang, Yan-Bin'
'Su, Qiong'
_publ_section_title
;
 Crystal structure of
 bis{5-methoxy-2-(((2-oxo-2H-chromen-6-yl)imino)methyl)phenolato-κ2
 N,O}zinc(II), C34H24N2O8Zn
;
_journal_issue                   3
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              355
_journal_page_last               357
_journal_paper_doi               10.1515/ncrs-2017-0220
_journal_volume                  233
_journal_year                    2018
_chemical_formula_moiety         'C34 H24 N2 O8 Zn'
_chemical_formula_sum            'C34 H24 N2 O8 Zn'
_chemical_formula_weight         653.92
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_cell_angle_alpha                83.799(2)
_cell_angle_beta                 76.063(2)
_cell_angle_gamma                81.385(2)
_cell_formula_units_Z            2
_cell_length_a                   9.1202(6)
_cell_length_b                   12.2985(8)
_cell_length_c                   12.9973(9)
_cell_measurement_reflns_used    6057
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      28.36
_cell_measurement_theta_min      2.32
_cell_volume                     1395.02(16)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      296.15
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0204
_diffrn_reflns_av_unetI/netI     0.0335
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            9489
_diffrn_reflns_point_group_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        24.999
_diffrn_reflns_theta_max         24.999
_diffrn_reflns_theta_min         2.244
_exptl_absorpt_coefficient_mu    0.941
_exptl_absorpt_correction_T_max  0.873
_exptl_absorpt_correction_T_min  0.765
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.33 (release 27-03-2014 CrysAlis171 .NET)
(compiled Mar 27 2014,17:12:48)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.557
_exptl_crystal_description       block
_exptl_crystal_F_000             672
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.22
_refine_diff_density_max         0.281
_refine_diff_density_min         -0.270
_refine_diff_density_rms         0.050
_refine_ls_extinction_coef       .
_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     408
_refine_ls_number_reflns         4876
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.0354
_refine_ls_R_factor_gt           0.0292
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0171P)²+1.1971P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0666
_refine_ls_wR_factor_ref         0.0691
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4335
_reflns_number_total             4876
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            suppl_ncrs-2017-0220_suppl.cif
_cod_data_source_block           c34h24n2o8zn
_cod_database_code               8106151
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_max   0.820
_shelx_estimated_absorpt_t_min   0.785
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C3(H3), C4(H4), C7(H7), C8(H8), C10(H10), C12(H12), C13(H13), C16(H16),
 C17(H17), C20(H20), C21(H21), C24(H24), C25(H25), C27(H27), C28(H28), C31(H31),
  C32(H32), C34(H34)
2.b Idealised Me refined as rotating group:
 C1(H1A,H1B,H1C), C18(H18A,H18B,H18C)
;
_shelx_shelxl_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.6028(3) 0.7541(2) 1.01772(19) 0.0364(6) Uani 1 1 d . . . . .
H1A H 0.7035 0.7323 0.9766 0.055 Uiso 1 1 calc GR . . . .
H1B H 0.6065 0.7576 1.0905 0.055 Uiso 1 1 calc GR . . . .
H1C H 0.5640 0.8253 0.9901 0.055 Uiso 1 1 calc GR . . . .
C2 C 0.4813(2) 0.66082(17) 0.91538(17) 0.0246(5) Uani 1 1 d . . . . .
C3 C 0.3867(3) 0.57961(17) 0.91688(17) 0.0273(5) Uani 1 1 d . . . . .
H3 H 0.3490 0.5390 0.9798 0.033 Uiso 1 1 calc R . . . .
C4 C 0.3517(3) 0.56173(17) 0.82474(17) 0.0273(5) Uani 1 1 d . . . . .
H4 H 0.2898 0.5078 0.8260 0.033 Uiso 1 1 calc R . . . .
C5 C 0.4057(2) 0.62196(16) 0.72643(16) 0.0220(4) Uani 1 1 d . . . . .
C6 C 0.5039(2) 0.70298(16) 0.72507(16) 0.0208(4) Uani 1 1 d . . . . .
C7 C 0.5407(2) 0.71963(16) 0.82147(16) 0.0222(4) Uani 1 1 d . . . . .
H7 H 0.6058 0.7709 0.8217 0.027 Uiso 1 1 calc R . . . .
C8 C 0.3577(2) 0.59388(16) 0.63712(17) 0.0236(5) Uani 1 1 d . . . . .
H8 H 0.2977 0.5369 0.6503 0.028 Uiso 1 1 calc R . . . .
C9 C 0.3271(2) 0.59785(16) 0.46024(17) 0.0221(4) Uani 1 1 d . . . . .
C10 C 0.2537(2) 0.50454(17) 0.47601(17) 0.0243(5) Uani 1 1 d . . . . .
H10 H 0.2422 0.4631 0.5410 0.029 Uiso 1 1 calc R . . . .
C11 C 0.1970(2) 0.47220(17) 0.39504(17) 0.0246(5) Uani 1 1 d . . . . .
C12 C 0.1176(3) 0.37721(19) 0.40816(19) 0.0337(5) Uani 1 1 d . . . . .
H12 H 0.1019 0.3351 0.4728 0.040 Uiso 1 1 calc R . . . .
C13 C 0.0662(3) 0.3492(2) 0.3279(2) 0.0362(6) Uani 1 1 d . . . . .
H13 H 0.0142 0.2879 0.3382 0.043 Uiso 1 1 calc R . . . .
C14 C 0.0890(3) 0.41137(19) 0.2254(2) 0.0359(6) Uani 1 1 d . . . . .
C15 C 0.2175(3) 0.53310(18) 0.29715(18) 0.0272(5) Uani 1 1 d . . . . .
C16 C 0.2930(3) 0.62487(19) 0.27887(19) 0.0349(6) Uani 1 1 d . . . . .
H16 H 0.3079 0.6645 0.2129 0.042 Uiso 1 1 calc R . . . .
C17 C 0.3462(3) 0.65701(18) 0.36056(18) 0.0307(5) Uani 1 1 d . . . . .
H17 H 0.3959 0.7195 0.3490 0.037 Uiso 1 1 calc R . . . .
C18 C 1.0854(3) 0.7387(2) 0.0437(2) 0.0518(8) Uani 1 1 d . . . . .
H18A H 1.1355 0.7287 0.1017 0.078 Uiso 1 1 calc GR . . . .
H18B H 1.1604 0.7354 -0.0224 0.078 Uiso 1 1 calc GR . . . .
H18C H 1.0222 0.6814 0.0500 0.078 Uiso 1 1 calc GR . . . .
C19 C 0.8720(2) 0.86096(18) 0.12963(17) 0.0262(5) Uani 1 1 d . . . . .
C20 C 0.7800(3) 0.96232(18) 0.11907(17) 0.0270(5) Uani 1 1 d . . . . .
H20 H 0.8049 1.0117 0.0601 0.032 Uiso 1 1 calc R . . . .
C21 C 0.6541(3) 0.98597(17) 0.19725(17) 0.0258(5) Uani 1 1 d . . . . .
H21 H 0.5922 1.0524 0.1900 0.031 Uiso 1 1 calc R . . . .
C22 C 0.6119(2) 0.91430(16) 0.28961(16) 0.0216(4) Uani 1 1 d . . . . .
C23 C 0.7082(2) 0.81277(16) 0.30090(16) 0.0208(4) Uani 1 1 d . . . . .
C24 C 0.8373(2) 0.78804(18) 0.21780(17) 0.0253(5) Uani 1 1 d . . . . .
H24 H 0.9000 0.7216 0.2226 0.030 Uiso 1 1 calc R . . . .
C25 C 0.4762(2) 0.95360(16) 0.36321(16) 0.0224(4) Uani 1 1 d . . . . .
H25 H 0.4272 1.0218 0.3436 0.027 Uiso 1 1 calc R . . . .
C26 C 0.2727(2) 0.95897(16) 0.51655(16) 0.0203(4) Uani 1 1 d . . . . .
C27 C 0.1978(2) 1.06238(16) 0.48689(17) 0.0228(4) Uani 1 1 d . . . . .
H27 H 0.2397 1.1012 0.4238 0.027 Uiso 1 1 calc R . . . .
C28 C 0.0630(2) 1.10620(17) 0.55088(17) 0.0252(5) Uani 1 1 d . . . . .
H28 H 0.0137 1.1739 0.5304 0.030 Uiso 1 1 calc R . . . .
C29 C 0.0009(2) 1.04997(17) 0.64517(17) 0.0231(5) Uani 1 1 d . . . . .
C30 C -0.2049(3) 1.0495(2) 0.80146(18) 0.0322(5) Uani 1 1 d . . . . .
C31 C -0.1330(3) 0.94277(19) 0.83469(18) 0.0316(5) Uani 1 1 d . . . . .
H31 H -0.1799 0.9059 0.8975 0.038 Uiso 1 1 calc R . . . .
C32 C -0.0010(3) 0.89561(18) 0.77756(17) 0.0283(5) Uani 1 1 d . . . . .
H32 H 0.0441 0.8282 0.8024 0.034 Uiso 1 1 calc R . . . .
C33 C 0.0719(2) 0.94833(17) 0.67799(16) 0.0221(4) Uani 1 1 d . . . . .
C34 C 0.2082(2) 0.90448(17) 0.61194(16) 0.0226(4) Uani 1 1 d . . . . .
H34 H 0.2570 0.8366 0.6327 0.027 Uiso 1 1 calc R . . . .
N1 N 0.38670(19) 0.63737(13) 0.53957(13) 0.0206(4) Uani 1 1 d . . . . .
N2 N 0.41149(19) 0.90674(13) 0.45446(13) 0.0194(4) Uani 1 1 d . . . . .
O1 O 0.50513(18) 0.67521(13) 1.01177(12) 0.0318(4) Uani 1 1 d . . . . .
O2 O 0.56026(16) 0.76425(11) 0.64012(11) 0.0240(3) Uani 1 1 d . . . . .
O3 O 0.0491(2) 0.39023(16) 0.14867(15) 0.0521(5) Uani 1 1 d . . . . .
O4 O 0.16316(19) 0.50358(13) 0.21484(13) 0.0354(4) Uani 1 1 d . . . . .
O5 O 0.99336(19) 0.84369(14) 0.04619(13) 0.0394(4) Uani 1 1 d . . . . .
O6 O 0.68377(16) 0.74078(11) 0.38353(11) 0.0256(3) Uani 1 1 d . . . . .
O7 O -0.13397(17) 1.09851(12) 0.70506(12) 0.0297(4) Uani 1 1 d . . . . .
O8 O -0.3203(2) 1.09966(16) 0.84904(15) 0.0510(5) Uani 1 1 d . . . . .
Zn1 Zn 0.51481(3) 0.76140(2) 0.50334(2) 0.02154(8) 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
H1A C1 H1B 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
O1 C1 H1A 109.5 . .
O1 C1 H1B 109.5 . .
O1 C1 H1C 109.5 . .
C7 C2 C3 120.78(19) . .
O1 C2 C3 114.38(19) . .
O1 C2 C7 124.84(19) . .
C2 C3 H3 120.6 . .
C4 C3 C2 118.8(2) . .
C4 C3 H3 120.6 . .
C3 C4 H4 118.6 . .
C3 C4 C5 122.8(2) . .
C5 C4 H4 118.6 . .
C4 C5 C6 118.04(18) . .
C4 C5 C8 115.99(18) . .
C8 C5 C6 125.97(19) . .
C7 C6 C5 118.37(19) . .
O2 C6 C5 123.98(18) . .
O2 C6 C7 117.64(18) . .
C2 C7 C6 121.09(19) . .
C2 C7 H7 119.5 . .
C6 C7 H7 119.5 . .
C5 C8 H8 115.6 . .
N1 C8 C5 128.73(19) . .
N1 C8 H8 115.6 . .
C10 C9 C17 118.46(19) . .
C10 C9 N1 123.96(19) . .
C17 C9 N1 117.58(18) . .
C9 C10 H10 119.7 . .
C9 C10 C11 120.5(2) . .
C11 C10 H10 119.7 . .
C10 C11 C12 122.6(2) . .
C15 C11 C10 119.46(19) . .
C15 C11 C12 117.95(19) . .
C11 C12 H12 119.8 . .
C13 C12 C11 120.3(2) . .
C13 C12 H12 119.8 . .
C12 C13 H13 119.0 . .
C12 C13 C14 122.0(2) . .
C14 C13 H13 119.0 . .
O3 C14 C13 126.0(2) . .
O3 C14 O4 117.1(2) . .
O4 C14 C13 116.87(19) . .
C16 C15 C11 121.07(19) . .
C16 C15 O4 117.7(2) . .
O4 C15 C11 121.18(19) . .
C15 C16 H16 120.6 . .
C15 C16 C17 118.8(2) . .
C17 C16 H16 120.6 . .
C9 C17 H17 119.1 . .
C16 C17 C9 121.7(2) . .
C16 C17 H17 119.1 . .
H18A C18 H18B 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
O5 C18 H18A 109.5 . .
O5 C18 H18B 109.5 . .
O5 C18 H18C 109.5 . .
C24 C19 C20 121.3(2) . .
O5 C19 C20 113.78(19) . .
O5 C19 C24 124.9(2) . .
C19 C20 H20 120.9 . .
C21 C20 C19 118.2(2) . .
C21 C20 H20 120.9 . .
C20 C21 H21 118.4 . .
C20 C21 C22 123.2(2) . .
C22 C21 H21 118.4 . .
C21 C22 C23 118.21(19) . .
C21 C22 C25 115.10(19) . .
C25 C22 C23 126.68(19) . .
C24 C23 C22 118.00(19) . .
O6 C23 C22 124.10(19) . .
O6 C23 C24 117.90(18) . .
C19 C24 C23 121.1(2) . .
C19 C24 H24 119.5 . .
C23 C24 H24 119.5 . .
C22 C25 H25 115.6 . .
N2 C25 C22 128.72(19) . .
N2 C25 H25 115.6 . .
C27 C26 N2 124.14(19) . .
C34 C26 C27 118.15(19) . .
C34 C26 N2 117.71(18) . .
C26 C27 H27 119.8 . .
C28 C27 C26 120.39(19) . .
C28 C27 H27 119.8 . .
C27 C28 H28 119.9 . .
C27 C28 C29 120.2(2) . .
C29 C28 H28 119.9 . .
C28 C29 C33 121.3(2) . .
O7 C29 C28 117.14(19) . .
O7 C29 C33 121.61(19) . .
O7 C30 C31 116.7(2) . .
O8 C30 C31 126.5(2) . .
O8 C30 O7 116.7(2) . .
C30 C31 H31 119.1 . .
C32 C31 C30 121.9(2) . .
C32 C31 H31 119.1 . .
C31 C32 H32 119.7 . .
C31 C32 C33 120.6(2) . .
C33 C32 H32 119.7 . .
C29 C33 C32 117.4(2) . .
C29 C33 C34 117.92(19) . .
C34 C33 C32 124.6(2) . .
C26 C34 C33 122.05(19) . .
C26 C34 H34 119.0 . .
C33 C34 H34 119.0 . .
C8 N1 C9 120.54(17) . .
C8 N1 Zn1 118.62(14) . .
C9 N1 Zn1 120.84(13) . .
C25 N2 C26 120.35(17) . .
C25 N2 Zn1 117.62(14) . .
C26 N2 Zn1 122.03(13) . .
C2 O1 C1 118.39(17) . .
C6 O2 Zn1 124.39(12) . .
C14 O4 C15 121.66(19) . .
C19 O5 C18 118.33(19) . .
C23 O6 Zn1 123.37(13) . .
C29 O7 C30 121.74(18) . .
N2 Zn1 N1 115.84(7) . .
O2 Zn1 N1 98.12(6) . .
O2 Zn1 N2 112.49(6) . .
O6 Zn1 N1 114.53(6) . .
O6 Zn1 N2 99.48(6) . .
O6 Zn1 O2 117.36(6) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 H1A 0.9600 .
C1 H1B 0.9600 .
C1 H1C 0.9600 .
C1 O1 1.432(3) .
C2 C3 1.410(3) .
C2 C7 1.384(3) .
C2 O1 1.356(2) .
C3 H3 0.9300 .
C3 C4 1.359(3) .
C4 H4 0.9300 .
C4 C5 1.423(3) .
C5 C6 1.432(3) .
C5 C8 1.426(3) .
C6 C7 1.415(3) .
C6 O2 1.309(2) .
C7 H7 0.9300 .
C8 H8 0.9300 .
C8 N1 1.303(3) .
C9 C10 1.386(3) .
C9 C17 1.401(3) .
C9 N1 1.432(3) .
C10 H10 0.9300 .
C10 C11 1.396(3) .
C11 C12 1.438(3) .
C11 C15 1.391(3) .
C12 H12 0.9300 .
C12 C13 1.337(3) .
C13 H13 0.9300 .
C13 C14 1.448(4) .
C14 O3 1.205(3) .
C14 O4 1.384(3) .
C15 C16 1.378(3) .
C15 O4 1.384(2) .
C16 H16 0.9300 .
C16 C17 1.384(3) .
C17 H17 0.9300 .
C18 H18A 0.9600 .
C18 H18B 0.9600 .
C18 H18C 0.9600 .
C18 O5 1.430(3) .
C19 C20 1.408(3) .
C19 C24 1.380(3) .
C19 O5 1.359(3) .
C20 H20 0.9300 .
C20 C21 1.356(3) .
C21 H21 0.9300 .
C21 C22 1.420(3) .
C22 C23 1.430(3) .
C22 C25 1.425(3) .
C23 C24 1.413(3) .
C23 O6 1.314(2) .
C24 H24 0.9300 .
C25 H25 0.9300 .
C25 N2 1.306(3) .
C26 C27 1.412(3) .
C26 C34 1.386(3) .
C26 N2 1.429(3) .
C27 H27 0.9300 .
C27 C28 1.378(3) .
C28 H28 0.9300 .
C28 C29 1.378(3) .
C29 C33 1.392(3) .
C29 O7 1.377(3) .
C30 C31 1.448(3) .
C30 O7 1.384(3) .
C30 O8 1.202(3) .
C31 H31 0.9300 .
C31 C32 1.338(3) .
C32 H32 0.9300 .
C32 C33 1.439(3) .
C33 C34 1.399(3) .
C34 H34 0.9300 .
N1 Zn1 2.0068(16) .
N2 Zn1 2.0062(16) .
O2 Zn1 1.9252(14) .
O6 Zn1 1.9173(15) .
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
C2 C3 C4 C5 -0.4(3) . . . .
C3 C2 C7 C6 2.3(3) . . . .
C3 C2 O1 C1 178.50(19) . . . .
C3 C4 C5 C6 1.4(3) . . . .
C3 C4 C5 C8 -179.5(2) . . . .
C4 C5 C6 C7 -0.6(3) . . . .
C4 C5 C6 O2 -179.51(19) . . . .
C4 C5 C8 N1 178.1(2) . . . .
C5 C6 C7 C2 -1.2(3) . . . .
C5 C6 O2 Zn1 2.8(3) . . . .
C5 C8 N1 C9 -179.7(2) . . . .
C5 C8 N1 Zn1 -0.2(3) . . . .
C6 C5 C8 N1 -3.0(4) . . . .
C7 C2 C3 C4 -1.5(3) . . . .
C7 C2 O1 C1 -2.2(3) . . . .
C7 C6 O2 Zn1 -176.06(13) . . . .
C8 C5 C6 C7 -179.56(19) . . . .
C8 C5 C6 O2 1.6(3) . . . .
C9 C10 C11 C12 -178.9(2) . . . .
C9 C10 C11 C15 1.4(3) . . . .
C10 C9 C17 C16 0.4(3) . . . .
C10 C9 N1 C8 -8.6(3) . . . .
C10 C9 N1 Zn1 171.93(16) . . . .
C10 C11 C12 C13 -179.6(2) . . . .
C10 C11 C15 C16 0.0(3) . . . .
C10 C11 C15 O4 179.89(19) . . . .
C11 C12 C13 C14 0.6(4) . . . .
C11 C15 C16 C17 -1.1(4) . . . .
C11 C15 O4 C14 -1.3(3) . . . .
C12 C11 C15 C16 -179.8(2) . . . .
C12 C11 C15 O4 0.1(3) . . . .
C12 C13 C14 O3 178.4(3) . . . .
C12 C13 C14 O4 -1.7(4) . . . .
C13 C14 O4 C15 2.1(3) . . . .
C15 C11 C12 C13 0.2(3) . . . .
C15 C16 C17 C9 0.9(4) . . . .
C16 C15 O4 C14 178.6(2) . . . .
C17 C9 C10 C11 -1.6(3) . . . .
C17 C9 N1 C8 172.1(2) . . . .
C17 C9 N1 Zn1 -7.4(3) . . . .
C19 C20 C21 C22 0.9(3) . . . .
C20 C19 C24 C23 -0.2(3) . . . .
C20 C19 O5 C18 -173.7(2) . . . .
C20 C21 C22 C23 0.6(3) . . . .
C20 C21 C22 C25 179.67(19) . . . .
C21 C22 C23 C24 -1.9(3) . . . .
C21 C22 C23 O6 178.37(18) . . . .
C21 C22 C25 N2 -179.15(19) . . . .
C22 C23 C24 C19 1.7(3) . . . .
C22 C23 O6 Zn1 -0.6(3) . . . .
C22 C25 N2 C26 -178.85(18) . . . .
C22 C25 N2 Zn1 1.7(3) . . . .
C23 C22 C25 N2 -0.2(3) . . . .
C24 C19 C20 C21 -1.1(3) . . . .
C24 C19 O5 C18 5.9(3) . . . .
C24 C23 O6 Zn1 179.74(13) . . . .
C25 C22 C23 C24 179.16(19) . . . .
C25 C22 C23 O6 -0.5(3) . . . .
C26 C27 C28 C29 0.8(3) . . . .
C27 C26 C34 C33 0.6(3) . . . .
C27 C26 N2 C25 -1.1(3) . . . .
C27 C26 N2 Zn1 178.32(14) . . . .
C27 C28 C29 C33 -0.1(3) . . . .
C27 C28 C29 O7 -179.92(17) . . . .
C28 C29 C33 C32 179.95(18) . . . .
C28 C29 C33 C34 -0.3(3) . . . .
C28 C29 O7 C30 -179.30(18) . . . .
C29 C33 C34 C26 0.0(3) . . . .
C30 C31 C32 C33 -2.3(3) . . . .
C31 C30 O7 C29 -2.1(3) . . . .
C31 C32 C33 C29 1.0(3) . . . .
C31 C32 C33 C34 -178.7(2) . . . .
C32 C33 C34 C26 179.74(19) . . . .
C33 C29 O7 C30 0.9(3) . . . .
C34 C26 C27 C28 -1.0(3) . . . .
C34 C26 N2 C25 179.06(18) . . . .
C34 C26 N2 Zn1 -1.5(2) . . . .
N1 C9 C10 C11 179.11(19) . . . .
N1 C9 C17 C16 179.8(2) . . . .
N2 C26 C27 C28 179.11(18) . . . .
N2 C26 C34 C33 -179.50(17) . . . .
O1 C2 C3 C4 177.75(19) . . . .
O1 C2 C7 C6 -176.87(19) . . . .
O2 C6 C7 C2 177.75(18) . . . .
O3 C14 O4 C15 -178.0(2) . . . .
O4 C15 C16 C17 179.0(2) . . . .
O5 C19 C20 C21 178.52(19) . . . .
O5 C19 C24 C23 -179.82(19) . . . .
O6 C23 C24 C19 -178.55(18) . . . .
O7 C29 C33 C32 -0.2(3) . . . .
O7 C29 C33 C34 179.52(17) . . . .
O7 C30 C31 C32 2.8(3) . . . .
O8 C30 C31 C32 -177.5(2) . . . .
O8 C30 O7 C29 178.2(2) . . . .
