#------------------------------------------------------------------------------
#$Date: 2016-03-26 23:11:40 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180531 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/00/7220035.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_7220035
loop_
_publ_author_name
'Xu, Guohai'
'Xie, Min'
'Li, Xiaokang'
'Shi, Wenjie'
'Yu, Hui'
'Hu, Yinhui'
'Xun, Xiaochen'
'Xie, Yongrong'
_publ_section_title
;
 Four binuclear coordination polymers with a 63net and self-assembly of 2D
 63topology into different supramolecular networks using unit--unit
 H-bonds
;
_journal_issue                   19
_journal_name_full               CrystEngComm
_journal_page_first              3677
_journal_paper_doi               10.1039/C5CE00264H
_journal_volume                  17
_journal_year                    2015
_chemical_formula_moiety         'C23 H23 N O9 Zn2'
_chemical_formula_sum            'C23 H23 N O9 Zn2'
_chemical_formula_weight         588.16
_chemical_melting_point          ?
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2015-02-04 deposited with the CCDC.
2015-03-30 downloaded from the CCDC.
;
_cell_angle_alpha                93.6080(10)
_cell_angle_beta                 111.5970(10)
_cell_angle_gamma                107.9950(10)
_cell_formula_units_Z            2
_cell_length_a                   10.7060(5)
_cell_length_b                   11.2340(5)
_cell_length_c                   11.4670(6)
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      26.1
_cell_measurement_theta_min      2.0
_cell_volume                     1195.02(10)
_computing_cell_refinement       'SAINT (Bruker, 1999)'
_computing_data_collection       'SMART (Bruker, 1997)'
_computing_data_reduction        'SAINT (Bruker, 1999)'
_computing_molecular_graphics    'SHELXTL-PLUS (Sheldrick, 1990)'
_computing_publication_material  SHELXL-97
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97(Sheldrick, 1997)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Bruker SMART APEX CCD'
_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  0.0159
_diffrn_reflns_av_sigmaI/netI    0.0330
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            6696
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         26.06
_diffrn_reflns_theta_min         1.95
_exptl_absorpt_coefficient_mu    2.060
_exptl_absorpt_correction_T_max  0.8205
_exptl_absorpt_correction_T_min  0.6834
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.635
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             600
_exptl_crystal_recrystallization_method Solvothermal
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.534
_refine_diff_density_min         -0.352
_refine_diff_density_rms         0.071
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     319
_refine_ls_number_reflns         4662
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.056
_refine_ls_R_factor_all          0.0377
_refine_ls_R_factor_gt           0.0293
_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)+(0.0383P)²+0.4667P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0725
_refine_ls_wR_factor_ref         0.0766
_reflns_number_gt                3942
_reflns_number_total             4662
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5ce00264h2.cif
_cod_data_source_block           compound3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value 'not measured' was changed to '?' -
the value is undefined or not given.

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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 3143 2015-03-26 13:38:13Z robertas 

 Adding full bibliography for 7220033--7220036.cif.
;
_cod_original_sg_symbol_H-M      p-1
_cod_database_code               7220035
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
C1 C 0.2159(3) 0.2886(2) 0.1838(2) 0.0218(5) Uani 1 1 d .
C2 C 0.1466(3) 0.3693(2) -0.0230(2) 0.0220(5) Uani 1 1 d .
H2 H 0.1944 0.3252 -0.0506 0.026 Uiso 1 1 calc R
C3 C 0.1464(3) 0.3674(2) 0.1006(2) 0.0200(5) Uani 1 1 d .
C4 C 0.0772(3) 0.4331(2) 0.1422(2) 0.0204(5) Uani 1 1 d .
H4 H 0.0809 0.4338 0.2246 0.024 Uiso 1 1 calc R
C5 C 0.0002(3) 0.4998(2) 0.0619(2) 0.0170(5) Uani 1 1 d .
C6 C -0.0766(3) 0.5643(2) 0.1012(2) 0.0215(5) Uani 1 1 d .
H6 H -0.0794 0.5613 0.1811 0.026 Uiso 1 1 calc R
C7 C 0.5962(3) 0.2564(2) 0.3792(2) 0.0192(5) Uani 1 1 d .
C8 C 0.7530(3) 0.3312(2) 0.4178(2) 0.0195(5) Uani 1 1 d .
C9 C 0.8385(3) 0.2751(2) 0.3834(2) 0.0230(6) Uani 1 1 d .
H9 H 0.7976 0.1916 0.3373 0.028 Uiso 1 1 calc R
C10 C 0.9807(3) 0.3423(2) 0.4171(2) 0.0237(6) Uani 1 1 d .
H10 H 1.0371 0.3033 0.3967 0.028 Uiso 1 1 calc R
C11 C 1.0431(3) 0.4714(2) 0.4832(2) 0.0204(5) Uani 1 1 d .
C12 C 0.8103(3) 0.4546(2) 0.4838(2) 0.0201(5) Uani 1 1 d .
H12 H 0.7530 0.4901 0.5071 0.024 Uiso 1 1 calc R
C13 C 0.3934(3) 0.2664(3) 0.6740(2) 0.0243(6) Uani 1 1 d .
C14 C 0.4307(3) 0.3368(3) 0.8041(2) 0.0240(6) Uani 1 1 d .
C15 C 0.4410(3) 0.4615(3) 0.8234(2) 0.0243(6) Uani 1 1 d .
H15 H 0.4194 0.5012 0.7536 0.029 Uiso 1 1 calc R
C16 C 0.4613(3) 0.2760(3) 0.9097(2) 0.0258(6) Uani 1 1 d .
H16 H 0.4530 0.1908 0.8966 0.031 Uiso 1 1 calc R
C17 C 0.5024(3) 0.3395(3) 1.0299(3) 0.0269(6) Uani 1 1 d .
H17 H 0.5217 0.2974 1.0980 0.032 Uiso 1 1 calc R
C18 C 0.5164(3) 0.4688(3) 1.0528(2) 0.0225(6) Uani 1 1 d .
C19 C 0.2765(3) -0.0501(3) 0.3920(3) 0.0275(6) Uani 1 1 d .
H19A H 0.2204 -0.0772 0.4417 0.033 Uiso 1 1 calc R
H19B H 0.3776 -0.0213 0.4492 0.033 Uiso 1 1 calc R
C20 C 0.2413(3) -0.1605(2) 0.2890(3) 0.0290(6) Uani 1 1 d .
H20A H 0.2726 -0.2262 0.3278 0.035 Uiso 1 1 calc R
H20B H 0.1381 -0.1970 0.2393 0.035 Uiso 1 1 calc R
C21 C 0.2412(3) -0.1935(3) 0.0729(3) 0.0300(6) Uani 1 1 d .
H21A H 0.1378 -0.2209 0.0458 0.036 Uiso 1 1 calc R
H21B H 0.2669 -0.2690 0.0718 0.036 Uiso 1 1 calc R
C22 C 0.2852(3) -0.1157(3) -0.0186(3) 0.0336(7) Uani 1 1 d .
H22A H 0.3839 -0.1041 -0.0034 0.040 Uiso 1 1 calc R
H22B H 0.2240 -0.1605 -0.1063 0.040 Uiso 1 1 calc R
C23 C 0.0900(4) 0.0395(4) -0.3091(4) 0.0578(10) Uani 1 1 d .
H23A H 0.0235 -0.0169 -0.3894 0.087 Uiso 1 1 calc R
H23B H 0.1849 0.0395 -0.2912 0.087 Uiso 1 1 calc R
H23C H 0.0896 0.1244 -0.3135 0.087 Uiso 1 1 calc R
N1 N 0.3146(2) -0.1154(2) 0.2039(2) 0.0225(5) Uani 1 1 d .
H1 H 0.4059 -0.1154 0.2395 0.027 Uiso 1 1 calc R
O1 O 0.2457(2) 0.20641(18) 0.13130(17) 0.0280(4) Uani 1 1 d .
O2 O 0.2363(2) 0.30933(18) 0.29953(17) 0.0286(4) Uani 1 1 d .
O3 O 0.53488(18) 0.16653(16) 0.28246(17) 0.0227(4) Uani 1 1 d .
O4 O 0.53733(18) 0.28930(18) 0.44537(18) 0.0278(4) Uani 1 1 d .
O5 O 0.3334(2) 0.31284(19) 0.57934(17) 0.0290(4) Uani 1 1 d .
O6 O 0.4213(2) 0.16851(18) 0.66054(18) 0.0312(5) Uani 1 1 d .
O7 O 0.24450(18) 0.05209(16) 0.33406(16) 0.0211(4) Uani 1 1 d .
O8 O 0.2717(2) 0.00580(19) 0.00095(18) 0.0318(5) Uani 1 1 d D
O9 O 0.0491(2) -0.0021(2) -0.2116(2) 0.0487(6) Uani 1 1 d .
H02 H -0.0374 -0.0181 -0.2344 0.073 Uiso 1 1 calc R
Zn1 Zn 0.33764(3) 0.22705(3) 0.43089(3) 0.01916(9) Uani 1 1 d .
Zn2 Zn 0.32389(3) 0.07234(3) 0.19550(3) 0.01841(9) Uani 1 1 d .
H01 H 0.197(2) 0.010(3) -0.059(2) 0.028 Uiso 1 1 d 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 C1 O2 126.0(2) . .
O1 C1 C3 117.1(2) . .
O2 C1 C3 116.9(2) . .
C6 C2 C3 120.1(2) 2_565 .
C6 C2 H2 120.0 2_565 .
C3 C2 H2 120.0 . .
C4 C3 C2 120.2(2) . .
C4 C3 C1 119.5(2) . .
C2 C3 C1 120.2(2) . .
C3 C4 C5 121.0(2) . .
C3 C4 H4 119.5 . .
C5 C4 H4 119.5 . .
C4 C5 C6 122.0(2) . .
C4 C5 C5 118.3(3) . 2_565
C6 C5 C5 119.7(3) . 2_565
C2 C6 C5 120.6(2) 2_565 .
C2 C6 H6 119.7 2_565 .
C5 C6 H6 119.7 . .
O4 C7 O3 125.7(2) . .
O4 C7 C8 117.1(2) . .
O3 C7 C8 117.2(2) . .
C12 C8 C9 120.8(2) . .
C12 C8 C7 119.2(2) . .
C9 C8 C7 119.9(2) . .
C10 C9 C8 120.5(2) . .
C10 C9 H9 119.8 . .
C8 C9 H9 119.8 . .
C9 C10 C11 120.3(2) . .
C9 C10 H10 119.8 . .
C11 C10 H10 119.8 . .
C11 C11 C10 119.3(3) 2_766 .
C11 C11 C12 118.9(3) 2_766 2_766
C10 C11 C12 121.8(2) . 2_766
C8 C12 C11 120.1(2) . 2_766
C8 C12 H12 119.9 . .
C11 C12 H12 119.9 2_766 .
O6 C13 O5 122.6(2) . .
O6 C13 C14 120.8(2) . .
O5 C13 C14 116.6(2) . .
C15 C14 C16 119.3(2) . .
C15 C14 C13 120.8(2) . .
C16 C14 C13 119.9(2) . .
C14 C15 C18 121.3(2) . 2_667
C14 C15 H15 119.3 . .
C18 C15 H15 119.3 2_667 .
C17 C16 C14 121.1(3) . .
C17 C16 H16 119.4 . .
C14 C16 H16 119.4 . .
C16 C17 C18 120.7(2) . .
C16 C17 H17 119.6 . .
C18 C17 H17 119.6 . .
C17 C18 C15 122.5(2) . 2_667
C17 C18 C18 119.0(3) . 2_667
C15 C18 C18 118.5(3) 2_667 2_667
O7 C19 C20 109.3(2) . .
O7 C19 H19A 109.8 . .
C20 C19 H19A 109.8 . .
O7 C19 H19B 109.8 . .
C20 C19 H19B 109.8 . .
H19A C19 H19B 108.3 . .
N1 C20 C19 109.7(2) . .
N1 C20 H20A 109.7 . .
C19 C20 H20A 109.7 . .
N1 C20 H20B 109.7 . .
C19 C20 H20B 109.7 . .
H20A C20 H20B 108.2 . .
N1 C21 C22 109.8(2) . .
N1 C21 H21A 109.7 . .
C22 C21 H21A 109.7 . .
N1 C21 H21B 109.7 . .
C22 C21 H21B 109.7 . .
H21A C21 H21B 108.2 . .
O8 C22 C21 109.2(2) . .
O8 C22 H22A 109.8 . .
C21 C22 H22A 109.8 . .
O8 C22 H22B 109.8 . .
C21 C22 H22B 109.8 . .
H22A C22 H22B 108.3 . .
O9 C23 H23A 109.5 . .
O9 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
O9 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C21 N1 C20 113.8(2) . .
C21 N1 Zn2 109.35(16) . .
C20 N1 Zn2 107.05(16) . .
C21 N1 H1 108.8 . .
C20 N1 H1 108.8 . .
Zn2 N1 H1 108.8 . .
C1 O1 Zn2 132.47(17) . .
C1 O2 Zn1 124.68(17) . .
C7 O3 Zn2 124.94(16) . .
C7 O4 Zn1 132.43(17) . .
C13 O5 Zn1 107.10(17) . .
C19 O7 Zn1 120.59(15) . .
C19 O7 Zn2 107.40(15) . .
Zn1 O7 Zn2 99.20(7) . .
C22 O8 Zn2 111.53(16) . .
C22 O8 H01 112(2) . .
Zn2 O8 H01 121(2) . .
C23 O9 H02 109.5 . .
O5 Zn1 O7 133.62(8) . .
O5 Zn1 O4 108.26(8) . .
O7 Zn1 O4 107.80(7) . .
O5 Zn1 O2 99.72(8) . .
O7 Zn1 O2 98.30(8) . .
O4 Zn1 O2 104.75(8) . .
O5 Zn1 Zn2 175.25(6) . .
O7 Zn1 Zn2 41.71(5) . .
O4 Zn1 Zn2 75.83(5) . .
O2 Zn1 Zn2 81.28(5) . .
O3 Zn2 O1 103.64(8) . .
O3 Zn2 O7 107.69(7) . .
O1 Zn2 O7 95.13(7) . .
O3 Zn2 N1 100.73(8) . .
O1 Zn2 N1 154.66(8) . .
O7 Zn2 N1 83.88(8) . .
O3 Zn2 O8 108.30(8) . .
O1 Zn2 O8 84.70(8) . .
O7 Zn2 O8 142.96(8) . .
N1 Zn2 O8 81.20(8) . .
O3 Zn2 Zn1 80.35(5) . .
O1 Zn2 Zn1 74.89(5) . .
O7 Zn2 Zn1 39.09(5) . .
N1 Zn2 Zn1 116.36(6) . .
O8 Zn2 Zn1 159.30(6) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.253(3) .
C1 O2 1.257(3) .
C1 C3 1.495(3) .
C2 C6 1.363(3) 2_565
C2 C3 1.419(3) .
C2 H2 0.9300 .
C3 C4 1.370(4) .
C4 C5 1.414(3) .
C4 H4 0.9300 .
C5 C6 1.415(3) .
C5 C5 1.419(5) 2_565
C6 C2 1.363(3) 2_565
C6 H6 0.9300 .
C7 O4 1.253(3) .
C7 O3 1.263(3) .
C7 C8 1.502(3) .
C8 C12 1.368(4) .
C8 C9 1.408(4) .
C9 C10 1.362(4) .
C9 H9 0.9300 .
C10 C11 1.419(4) .
C10 H10 0.9300 .
C11 C11 1.418(5) 2_766
C11 C12 1.420(3) 2_766
C12 C11 1.420(3) 2_766
C12 H12 0.9300 .
C13 O6 1.241(3) .
C13 O5 1.276(3) .
C13 C14 1.493(4) .
C14 C15 1.368(4) .
C14 C16 1.411(4) .
C15 C18 1.414(4) 2_667
C15 H15 0.9300 .
C16 C17 1.356(4) .
C16 H16 0.9300 .
C17 C18 1.411(4) .
C17 H17 0.9300 .
C18 C15 1.414(4) 2_667
C18 C18 1.423(5) 2_667
C19 O7 1.431(3) .
C19 C20 1.507(4) .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C20 N1 1.485(3) .
C20 H20A 0.9700 .
C20 H20B 0.9700 .
C21 N1 1.477(3) .
C21 C22 1.520(4) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 O8 1.428(3) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 O9 1.400(4) .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
N1 Zn2 2.090(2) .
N1 H1 0.9100 .
O1 Zn2 1.9940(18) .
O2 Zn1 1.9726(18) .
O3 Zn2 1.9872(17) .
O4 Zn1 1.9716(17) .
O5 Zn1 1.9253(18) .
O7 Zn1 1.9467(17) .
O7 Zn2 2.0540(17) .
O8 Zn2 2.1124(19) .
O8 H01 0.857(17) .
O9 H02 0.8200 .
Zn1 Zn2 3.0475(4) .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
N1 H1 O6 0.91 2.07 2.948(3) 160.7 2_656
O9 H02 O7 0.82 1.98 2.781(3) 164.8 2
O8 H01 O9 0.857(17) 1.842(18) 2.682(3) 166(3) .
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 C2 C3 C4 -0.6(4) 2_565 .
C6 C2 C3 C1 176.5(2) 2_565 .
O1 C1 C3 C4 162.6(2) . .
O2 C1 C3 C4 -16.0(3) . .
O1 C1 C3 C2 -14.5(4) . .
O2 C1 C3 C2 166.9(2) . .
C2 C3 C4 C5 2.4(4) . .
C1 C3 C4 C5 -174.7(2) . .
C3 C4 C5 C6 177.6(2) . .
C3 C4 C5 C5 -1.8(4) . 2_565
C4 C5 C6 C2 178.2(2) . 2_565
C5 C5 C6 C2 -2.5(4) 2_565 2_565
O4 C7 C8 C12 -25.5(3) . .
O3 C7 C8 C12 154.1(2) . .
O4 C7 C8 C9 156.0(2) . .
O3 C7 C8 C9 -24.4(3) . .
C12 C8 C9 C10 1.1(4) . .
C7 C8 C9 C10 179.5(2) . .
C8 C9 C10 C11 -2.4(4) . .
C9 C10 C11 C11 1.7(4) . 2_766
C9 C10 C11 C12 -178.0(2) . 2_766
C9 C8 C12 C11 1.0(4) . 2_766
C7 C8 C12 C11 -177.5(2) . 2_766
O6 C13 C14 C15 160.3(3) . .
O5 C13 C14 C15 -19.1(4) . .
O6 C13 C14 C16 -17.3(4) . .
O5 C13 C14 C16 163.3(2) . .
C16 C14 C15 C18 1.0(4) . 2_667
C13 C14 C15 C18 -176.6(2) . 2_667
C15 C14 C16 C17 -0.9(4) . .
C13 C14 C16 C17 176.7(3) . .
C14 C16 C17 C18 -0.2(4) . .
C16 C17 C18 C15 -180.0(3) . 2_667
C16 C17 C18 C18 1.3(5) . 2_667
O7 C19 C20 N1 53.1(3) . .
N1 C21 C22 O8 -48.7(3) . .
C22 C21 N1 C20 157.9(2) . .
C22 C21 N1 Zn2 38.3(3) . .
C19 C20 N1 C21 -153.7(2) . .
C19 C20 N1 Zn2 -32.7(2) . .
O2 C1 O1 Zn2 3.5(4) . .
C3 C1 O1 Zn2 -174.99(17) . .
O1 C1 O2 Zn1 5.9(4) . .
C3 C1 O2 Zn1 -175.57(16) . .
O4 C7 O3 Zn2 9.9(4) . .
C8 C7 O3 Zn2 -169.60(15) . .
O3 C7 O4 Zn1 -1.9(4) . .
C8 C7 O4 Zn1 177.61(16) . .
O6 C13 O5 Zn1 -12.0(3) . .
C14 C13 O5 Zn1 167.41(18) . .
C20 C19 O7 Zn1 -157.24(17) . .
C20 C19 O7 Zn2 -44.9(2) . .
C21 C22 O8 Zn2 34.9(3) . .
C13 O5 Zn1 O7 67.0(2) . .
C13 O5 Zn1 O4 -72.37(18) . .
C13 O5 Zn1 O2 178.45(17) . .
C13 O5 Zn1 Zn2 76.7(7) . .
C19 O7 Zn1 O5 -64.6(2) . .
Zn2 O7 Zn1 O5 178.80(8) . .
C19 O7 Zn1 O4 74.90(18) . .
Zn2 O7 Zn1 O4 -41.70(9) . .
C19 O7 Zn1 O2 -176.62(18) . .
Zn2 O7 Zn1 O2 66.79(8) . .
C19 O7 Zn1 Zn2 116.60(19) . .
C7 O4 Zn1 O5 173.9(2) . .
C7 O4 Zn1 O7 23.6(2) . .
C7 O4 Zn1 O2 -80.4(2) . .
C7 O4 Zn1 Zn2 -3.6(2) . .
C1 O2 Zn1 O5 177.1(2) . .
C1 O2 Zn1 O7 -45.8(2) . .
C1 O2 Zn1 O4 65.2(2) . .
C1 O2 Zn1 Zn2 -7.6(2) . .
C7 O3 Zn2 O1 62.9(2) . .
C7 O3 Zn2 O7 -37.1(2) . .
C7 O3 Zn2 N1 -124.01(19) . .
C7 O3 Zn2 O8 151.81(18) . .
C7 O3 Zn2 Zn1 -8.79(18) . .
C1 O1 Zn2 O3 -82.6(2) . .
C1 O1 Zn2 O7 27.1(2) . .
C1 O1 Zn2 N1 113.6(3) . .
C1 O1 Zn2 O8 169.9(2) . .
C1 O1 Zn2 Zn1 -6.7(2) . .
C19 O7 Zn2 O3 -78.42(16) . .
Zn1 O7 Zn2 O3 47.81(9) . .
C19 O7 Zn2 O1 175.49(15) . .
Zn1 O7 Zn2 O1 -58.29(8) . .
C19 O7 Zn2 N1 20.93(15) . .
Zn1 O7 Zn2 N1 147.16(9) . .
C19 O7 Zn2 O8 87.49(18) . .
Zn1 O7 Zn2 O8 -146.28(10) . .
C19 O7 Zn2 Zn1 -126.23(17) . .
C21 N1 Zn2 O3 -122.39(17) . .
C20 N1 Zn2 O3 113.86(16) . .
C21 N1 Zn2 O1 41.6(3) . .
C20 N1 Zn2 O1 -82.1(2) . .
C21 N1 Zn2 O7 130.70(17) . .
C20 N1 Zn2 O7 6.96(16) . .
C21 N1 Zn2 O8 -15.29(17) . .
C20 N1 Zn2 O8 -139.03(17) . .
C21 N1 Zn2 Zn1 153.14(15) . .
C20 N1 Zn2 Zn1 29.40(17) . .
C22 O8 Zn2 O3 87.15(19) . .
C22 O8 Zn2 O1 -170.21(19) . .
C22 O8 Zn2 O7 -78.7(2) . .
C22 O8 Zn2 N1 -11.32(19) . .
C22 O8 Zn2 Zn1 -160.77(15) . .
O5 Zn1 Zn2 O3 -144.8(7) . .
O7 Zn1 Zn2 O3 -134.27(9) . .
O4 Zn1 Zn2 O3 4.94(8) . .
O2 Zn1 Zn2 O3 112.66(8) . .
O5 Zn1 Zn2 O1 108.1(7) . .
O7 Zn1 Zn2 O1 118.64(9) . .
O4 Zn1 Zn2 O1 -102.14(8) . .
O2 Zn1 Zn2 O1 5.58(8) . .
O5 Zn1 Zn2 O7 -10.6(7) . .
O4 Zn1 Zn2 O7 139.21(9) . .
O2 Zn1 Zn2 O7 -113.06(10) . .
O5 Zn1 Zn2 N1 -47.6(7) . .
O7 Zn1 Zn2 N1 -37.00(10) . .
O4 Zn1 Zn2 N1 102.21(9) . .
O2 Zn1 Zn2 N1 -150.06(9) . .
O5 Zn1 Zn2 O8 98.3(7) . .
O7 Zn1 Zn2 O8 108.90(18) . .
O4 Zn1 Zn2 O8 -111.89(18) . .
O2 Zn1 Zn2 O8 -4.16(18) . .
