#------------------------------------------------------------------------------
#$Date: 2016-03-26 23:11:40 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180531 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/00/7220033.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_7220033
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         'C25 H27 N O10 Zn2'
_chemical_formula_sum            'C25 H27 N O10 Zn2'
_chemical_formula_weight         632.22
_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                107.863(5)
_cell_angle_beta                 95.831(5)
_cell_angle_gamma                92.552(5)
_cell_formula_units_Z            2
_cell_length_a                   10.134(5)
_cell_length_b                   11.529(5)
_cell_length_c                   11.698(5)
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      1.8
_cell_volume                     1290.0(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 0.941
_diffrn_measured_fraction_theta_max 0.910
_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     0.71069
_diffrn_reflns_av_R_equivalents  0.0318
_diffrn_reflns_av_sigmaI/netI    0.0535
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            11338
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         27.53
_diffrn_reflns_theta_min         1.84
_exptl_absorpt_coefficient_mu    1.918
_exptl_absorpt_correction_T_max  0.8314
_exptl_absorpt_correction_T_min  0.6457
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.628
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             648
_exptl_crystal_recrystallization_method Solvothermal
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.897
_refine_diff_density_min         -0.513
_refine_diff_density_rms         0.080
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     349
_refine_ls_number_reflns         5400
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.051
_refine_ls_R_factor_all          0.0675
_refine_ls_R_factor_gt           0.0433
_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)+(0.0446P)²+0.4693P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0944
_refine_ls_wR_factor_ref         0.1046
_reflns_number_gt                3872
_reflns_number_total             5400
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5ce00264h2.cif
_cod_data_source_block           compound1
_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               7220033
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 0.5260(4) 0.2717(3) 0.3549(3) 0.0319(8) Uani 1 1 d .
C2 C 0.5386(3) 0.1727(3) 0.4136(3) 0.0283(8) Uani 1 1 d .
C3 C 0.6645(4) 0.1502(3) 0.4626(3) 0.0354(9) Uani 1 1 d .
H3 H 0.7401 0.1958 0.4567 0.042 Uiso 1 1 calc R
C4 C 0.6766(4) 0.0631(3) 0.5180(4) 0.0369(9) Uani 1 1 d .
H4 H 0.7600 0.0512 0.5518 0.044 Uiso 1 1 calc R
C5 C 0.5629(3) -0.0102(3) 0.5249(3) 0.0280(8) Uani 1 1 d .
C6 C 0.4275(4) 0.1044(3) 0.4202(3) 0.0322(8) Uani 1 1 d .
H6 H 0.3446 0.1197 0.3884 0.039 Uiso 1 1 calc R
C7 C 0.7574(5) 0.2697(4) 0.1056(4) 0.0456(11) Uani 1 1 d D
C8 C 0.8346(4) 0.1623(3) 0.0472(4) 0.0408(10) Uani 1 1 d D
C9 C 0.9593(4) 0.1509(3) 0.0998(4) 0.0417(10) Uani 1 1 d .
H9 H 0.9980 0.2129 0.1683 0.050 Uiso 1 1 calc R
C10 C 1.0302(4) 0.0467(3) 0.0518(3) 0.0387(10) Uani 1 1 d .
C11 C 0.8428(4) -0.0321(4) -0.1055(4) 0.0478(11) Uani 1 1 d .
H11 H 0.8030 -0.0928 -0.1744 0.057 Uiso 1 1 calc R
C12 C 0.7778(4) 0.0694(4) -0.0579(4) 0.0488(11) Uani 1 1 d .
H12 H 0.6948 0.0774 -0.0954 0.059 Uiso 1 1 calc R
C13 C 0.8182(3) 0.6626(3) 0.3724(3) 0.0305(8) Uani 1 1 d .
C14 C 0.8929(3) 0.7852(3) 0.4387(3) 0.0277(8) Uani 1 1 d .
C15 C 0.9402(4) 0.8158(3) 0.5628(3) 0.0370(9) Uani 1 1 d .
H15 H 0.9280 0.7595 0.6039 0.044 Uiso 1 1 calc R
C16 C 1.0040(4) 0.9283(3) 0.6225(3) 0.0371(9) Uani 1 1 d .
H16 H 1.0356 0.9476 0.7041 0.044 Uiso 1 1 calc R
C17 C 0.9772(3) 0.9843(3) 0.4376(3) 0.0283(8) Uani 1 1 d .
C18 C 0.9113(4) 0.8663(3) 0.3782(3) 0.0312(8) Uani 1 1 d .
H18 H 0.8802 0.8446 0.2963 0.037 Uiso 1 1 calc R
C19 C 0.4777(4) 0.6115(4) 0.2045(4) 0.0501(11) Uani 1 1 d .
H19A H 0.4989 0.5961 0.1224 0.060 Uiso 1 1 calc R
H19B H 0.5347 0.6818 0.2560 0.060 Uiso 1 1 calc R
C20 C 0.3391(5) 0.6407(4) 0.2087(6) 0.0788(18) Uani 1 1 d .
H20A H 0.3296 0.6922 0.2899 0.095 Uiso 1 1 calc R
H20B H 0.3186 0.6880 0.1543 0.095 Uiso 1 1 calc R
C21 C 0.1774(5) 0.3524(5) 0.0039(4) 0.0657(14) Uani 1 1 d .
H21A H 0.0844 0.3346 0.0100 0.079 Uiso 1 1 calc R
H21B H 0.1908 0.3211 -0.0808 0.079 Uiso 1 1 calc R
C22 C 0.2086(6) 0.4843(5) 0.0467(5) 0.0788(17) Uani 1 1 d .
H22A H 0.2829 0.5038 0.0078 0.095 Uiso 1 1 calc R
H22B H 0.1327 0.5231 0.0218 0.095 Uiso 1 1 calc R
C23 C 0.1344(5) 0.5373(4) 0.3557(4) 0.0527(12) Uani 1 1 d .
H23A H 0.1804 0.6070 0.4187 0.063 Uiso 1 1 calc R
H23B H 0.0454 0.5252 0.3760 0.063 Uiso 1 1 calc R
C24 C 0.1261(6) 0.5615(6) 0.2398(5) 0.095(2) Uani 1 1 d .
H24A H 0.0496 0.5130 0.1878 0.114 Uiso 1 1 calc R
H24B H 0.1105 0.6469 0.2537 0.114 Uiso 1 1 calc R
C25 C 0.3974(6) 0.0535(5) -0.1521(5) 0.095(2) Uani 1 1 d .
H25A H 0.3055 0.0391 -0.1859 0.142 Uiso 1 1 calc R
H25B H 0.4238 -0.0148 -0.1271 0.142 Uiso 1 1 calc R
H25C H 0.4512 0.0634 -0.2120 0.142 Uiso 1 1 calc R
N1 N 0.2420(3) 0.5358(3) 0.1766(3) 0.0364(8) Uani 1 1 d .
O1 O 0.4152(3) 0.2731(2) 0.2965(3) 0.0417(7) Uani 1 1 d .
O2 O 0.6270(3) 0.3433(2) 0.3682(3) 0.0451(7) Uani 1 1 d .
O3 O 0.6388(3) 0.2683(3) 0.0666(3) 0.0736(10) Uani 1 1 d .
O4 O 0.8147(3) 0.3537(2) 0.1906(3) 0.0481(7) Uani 1 1 d .
O5 O 0.7899(3) 0.6324(2) 0.2609(2) 0.0413(7) Uani 1 1 d .
O6 O 0.7848(3) 0.5919(2) 0.4302(2) 0.0373(6) Uani 1 1 d .
O7 O 0.5056(2) 0.5096(2) 0.2418(3) 0.0407(7) Uani 1 1 d .
O8 O 0.2573(3) 0.2919(3) 0.0710(3) 0.0511(8) Uani 1 1 d D
O9 O 0.2034(3) 0.4317(3) 0.3499(2) 0.0485(7) Uani 1 1 d D
O10 O 0.4138(4) 0.1561(4) -0.0554(4) 0.130(2) Uani 1 1 d D
H03 H 0.4916 0.1840 -0.0435 0.195 Uiso 1 1 calc RD
Zn1 Zn 0.68104(4) 0.45890(3) 0.27690(4) 0.03126(13) Uani 1 1 d .
Zn2 Zn 0.35004(4) 0.40179(3) 0.23421(4) 0.03017(13) Uani 1 1 d .
H01 H 0.314(3) 0.243(3) 0.029(3) 0.045 Uiso 1 1 d D
H02 H 0.201(4) 0.419(3) 0.4209(18) 0.045 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
O2 C1 O1 126.7(3) . .
O2 C1 C2 116.8(3) . .
O1 C1 C2 116.4(3) . .
C6 C2 C3 119.7(3) . .
C6 C2 C1 119.9(3) . .
C3 C2 C1 120.4(3) . .
C4 C3 C2 120.9(3) . .
C4 C3 H3 119.6 . .
C2 C3 H3 119.6 . .
C3 C4 C5 120.6(3) . .
C3 C4 H4 119.7 . .
C5 C4 H4 119.7 . .
C5 C5 C4 119.1(4) 2_656 .
C5 C5 C6 118.9(4) 2_656 2_656
C4 C5 C6 122.0(3) . 2_656
C2 C6 C5 120.8(3) . 2_656
C2 C6 H6 119.6 . .
C5 C6 H6 119.6 2_656 .
O4 C7 O3 122.9(4) . .
O4 C7 C8 118.4(4) . .
O3 C7 C8 118.6(4) . .
C9 C8 C12 119.0(3) . .
C9 C8 C7 120.3(4) . .
C12 C8 C7 120.7(4) . .
C8 C9 C10 121.5(4) . .
C8 C9 H9 119.3 . .
C10 C9 H9 119.3 . .
C10 C10 C11 119.0(4) 2_755 2_755
C10 C10 C9 118.5(5) 2_755 .
C11 C10 C9 122.5(4) 2_755 .
C12 C11 C10 121.1(4) . 2_755
C12 C11 H11 119.5 . .
C10 C11 H11 119.5 2_755 .
C11 C12 C8 120.9(4) . .
C11 C12 H12 119.6 . .
C8 C12 H12 119.6 . .
O5 C13 O6 120.5(3) . .
O5 C13 C14 119.3(3) . .
O6 C13 C14 120.2(3) . .
O5 C13 Zn1 64.82(19) . .
O6 C13 Zn1 55.80(18) . .
C14 C13 Zn1 174.9(2) . .
C18 C14 C15 120.4(3) . .
C18 C14 C13 119.1(3) . .
C15 C14 C13 120.5(3) . .
C16 C15 C14 119.9(3) . .
C16 C15 H15 120.0 . .
C14 C15 H15 120.0 . .
C15 C16 C17 121.1(3) . 2_776
C15 C16 H16 119.4 . .
C17 C16 H16 119.4 2_776 .
C16 C17 C17 119.0(4) 2_776 2_776
C16 C17 C18 122.6(3) 2_776 .
C17 C17 C18 118.4(4) 2_776 .
C14 C18 C17 121.2(3) . .
C14 C18 H18 119.4 . .
C17 C18 H18 119.4 . .
O7 C19 C20 113.4(3) . .
O7 C19 H19A 108.9 . .
C20 C19 H19A 108.9 . .
O7 C19 H19B 108.9 . .
C20 C19 H19B 108.9 . .
H19A C19 H19B 107.7 . .
N1 C20 C19 115.2(4) . .
N1 C20 H20A 108.5 . .
C19 C20 H20A 108.5 . .
N1 C20 H20B 108.5 . .
C19 C20 H20B 108.5 . .
H20A C20 H20B 107.5 . .
O8 C21 C22 112.2(4) . .
O8 C21 H21A 109.2 . .
C22 C21 H21A 109.2 . .
O8 C21 H21B 109.2 . .
C22 C21 H21B 109.2 . .
H21A C21 H21B 107.9 . .
N1 C22 C21 114.5(4) . .
N1 C22 H22A 108.6 . .
C21 C22 H22A 108.6 . .
N1 C22 H22B 108.6 . .
C21 C22 H22B 108.6 . .
H22A C22 H22B 107.6 . .
O9 C23 C24 110.5(4) . .
O9 C23 H23A 109.6 . .
C24 C23 H23A 109.6 . .
O9 C23 H23B 109.6 . .
C24 C23 H23B 109.6 . .
H23A C23 H23B 108.1 . .
N1 C24 C23 115.3(4) . .
N1 C24 H24A 108.5 . .
C23 C24 H24A 108.5 . .
N1 C24 H24B 108.5 . .
C23 C24 H24B 108.5 . .
H24A C24 H24B 107.5 . .
O10 C25 H25A 109.5 . .
O10 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
O10 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
C24 N1 C22 112.8(4) . .
C24 N1 C20 112.6(4) . .
C22 N1 C20 111.8(4) . .
C24 N1 Zn2 109.7(3) . .
C22 N1 Zn2 106.2(3) . .
C20 N1 Zn2 103.0(2) . .
C1 O1 Zn2 128.3(2) . .
C1 O2 Zn1 132.5(3) . .
C7 O4 Zn1 109.7(3) . .
C13 O5 Zn1 86.0(2) . .
C13 O6 Zn1 94.5(2) . .
C19 O7 Zn1 126.1(2) . .
C19 O7 Zn2 114.2(2) . .
Zn1 O7 Zn2 119.14(12) . .
C21 O8 Zn2 115.1(3) . .
C21 O8 H01 115(3) . .
Zn2 O8 H01 111(3) . .
C23 O9 Zn2 114.8(2) . .
C23 O9 H02 107(3) . .
Zn2 O9 H02 131(3) . .
C25 O10 H03 109.5 . .
O7 Zn1 O4 139.09(13) . .
O7 Zn1 O2 97.62(11) . .
O4 Zn1 O2 95.25(12) . .
O7 Zn1 O6 109.64(11) . .
O4 Zn1 O6 107.63(12) . .
O2 Zn1 O6 95.16(11) . .
O7 Zn1 O5 93.70(10) . .
O4 Zn1 O5 91.42(11) . .
O2 Zn1 O5 153.85(11) . .
O6 Zn1 O5 58.76(9) . .
O7 Zn1 C13 102.31(11) . .
O4 Zn1 C13 101.66(12) . .
O2 Zn1 C13 124.82(12) . .
O6 Zn1 C13 29.65(10) . .
O5 Zn1 C13 29.13(10) . .
O7 Zn2 O1 105.77(11) . .
O7 Zn2 O8 120.39(12) . .
O1 Zn2 O8 97.82(12) . .
O7 Zn2 O9 127.62(12) . .
O1 Zn2 O9 90.83(11) . .
O8 Zn2 O9 105.34(13) . .
O7 Zn2 N1 84.27(11) . .
O1 Zn2 N1 168.94(11) . .
O8 Zn2 N1 80.53(12) . .
O9 Zn2 N1 79.16(11) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O2 1.251(4) .
C1 O1 1.258(4) .
C1 C2 1.506(5) .
C2 C6 1.367(5) .
C2 C3 1.413(5) .
C3 C4 1.356(5) .
C3 H3 0.9300 .
C4 C5 1.422(5) .
C4 H4 0.9300 .
C5 C5 1.407(7) 2_656
C5 C6 1.423(5) 2_656
C6 C5 1.423(5) 2_656
C6 H6 0.9300 .
C7 O4 1.227(5) .
C7 O3 1.239(5) .
C7 C8 1.513(5) .
C8 C9 1.378(6) .
C8 C12 1.409(5) .
C9 C10 1.422(5) .
C9 H9 0.9300 .
C10 C10 1.412(7) 2_755
C10 C11 1.413(6) 2_755
C11 C12 1.363(5) .
C11 C10 1.413(6) 2_755
C11 H11 0.9300 .
C12 H12 0.9300 .
C13 O5 1.242(4) .
C13 O6 1.263(4) .
C13 C14 1.512(4) .
C13 Zn1 2.545(4) .
C14 C18 1.352(5) .
C14 C15 1.411(5) .
C15 C16 1.365(5) .
C15 H15 0.9300 .
C16 C17 1.411(5) 2_776
C16 H16 0.9300 .
C17 C16 1.411(5) 2_776
C17 C17 1.414(7) 2_776
C17 C18 1.423(5) .
C18 H18 0.9300 .
C19 O7 1.403(4) .
C19 C20 1.461(6) .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C20 N1 1.453(5) .
C20 H20A 0.9700 .
C20 H20B 0.9700 .
C21 O8 1.420(5) .
C21 C22 1.457(6) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 N1 1.449(6) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 O9 1.417(5) .
C23 C24 1.461(6) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
C24 N1 1.445(5) .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 O10 1.353(6) .
C25 H25A 0.9600 .
C25 H25B 0.9600 .
C25 H25C 0.9600 .
N1 Zn2 2.164(3) .
O1 Zn2 1.954(2) .
O2 Zn1 2.036(2) .
O4 Zn1 1.999(3) .
O5 Zn1 2.309(3) .
O6 Zn1 2.112(3) .
O7 Zn1 1.940(3) .
O7 Zn2 1.941(3) .
O8 Zn2 2.045(3) .
O8 H01 0.898(10) .
O9 Zn2 2.080(3) .
O9 H02 0.893(10) .
O10 H03 0.8200 .
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
O8 H01 O10 0.898(10) 1.639(11) 2.535(5) 177(4) .
O9 H02 O6 0.893(10) 1.773(12) 2.660(4) 172(4) 2_666
O10 H03 O3 0.82 1.88 2.618(6) 148.8 .
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
O2 C1 C2 C6 169.1(3) . .
O1 C1 C2 C6 -11.6(5) . .
O2 C1 C2 C3 -10.6(5) . .
O1 C1 C2 C3 168.7(3) . .
C6 C2 C3 C4 -1.2(6) . .
C1 C2 C3 C4 178.5(3) . .
C2 C3 C4 C5 1.9(6) . .
C3 C4 C5 C5 -1.0(6) . 2_656
C3 C4 C5 C6 178.4(4) . 2_656
C3 C2 C6 C5 -0.4(5) . 2_656
C1 C2 C6 C5 179.9(3) . 2_656
O4 C7 C8 C9 9.6(6) . .
O3 C7 C8 C9 -169.5(4) . .
O4 C7 C8 C12 -173.7(4) . .
O3 C7 C8 C12 7.2(6) . .
C12 C8 C9 C10 -1.4(6) . .
C7 C8 C9 C10 175.5(3) . .
C8 C9 C10 C10 -0.3(7) . 2_755
C8 C9 C10 C11 -178.8(4) . 2_755
C10 C11 C12 C8 -0.8(7) 2_755 .
C9 C8 C12 C11 1.9(6) . .
C7 C8 C12 C11 -174.9(4) . .
O5 C13 C14 C18 9.1(5) . .
O6 C13 C14 C18 -170.8(3) . .
Zn1 C13 C14 C18 -135(3) . .
O5 C13 C14 C15 -172.4(3) . .
O6 C13 C14 C15 7.7(5) . .
Zn1 C13 C14 C15 44(3) . .
C18 C14 C15 C16 0.5(6) . .
C13 C14 C15 C16 -178.0(3) . .
C14 C15 C16 C17 0.5(6) . 2_776
C15 C14 C18 C17 -0.6(5) . .
C13 C14 C18 C17 178.0(3) . .
C16 C17 C18 C14 -178.9(4) 2_776 .
C17 C17 C18 C14 -0.5(6) 2_776 .
O7 C19 C20 N1 -36.1(7) . .
O8 C21 C22 N1 -36.5(7) . .
O9 C23 C24 N1 -36.8(7) . .
C23 C24 N1 C22 142.4(5) . .
C23 C24 N1 C20 -89.9(6) . .
C23 C24 N1 Zn2 24.2(6) . .
C21 C22 N1 C24 -84.5(6) . .
C21 C22 N1 C20 147.4(5) . .
C21 C22 N1 Zn2 35.7(6) . .
C19 C20 N1 C24 148.7(5) . .
C19 C20 N1 C22 -83.0(6) . .
C19 C20 N1 Zn2 30.6(5) . .
O2 C1 O1 Zn2 -13.2(6) . .
C2 C1 O1 Zn2 167.6(2) . .
O1 C1 O2 Zn1 -18.0(6) . .
C2 C1 O2 Zn1 161.3(2) . .
O3 C7 O4 Zn1 14.0(5) . .
C8 C7 O4 Zn1 -165.1(3) . .
O6 C13 O5 Zn1 3.2(3) . .
C14 C13 O5 Zn1 -176.7(3) . .
O5 C13 O6 Zn1 -3.5(4) . .
C14 C13 O6 Zn1 176.4(3) . .
C20 C19 O7 Zn1 -168.2(3) . .
C20 C19 O7 Zn2 20.5(5) . .
C22 C21 O8 Zn2 17.4(5) . .
C24 C23 O9 Zn2 31.4(5) . .
C19 O7 Zn1 O4 -88.9(4) . .
Zn2 O7 Zn1 O4 81.9(2) . .
C19 O7 Zn1 O2 163.9(3) . .
Zn2 O7 Zn1 O2 -25.25(18) . .
C19 O7 Zn1 O6 65.6(3) . .
Zn2 O7 Zn1 O6 -123.54(15) . .
C19 O7 Zn1 O5 7.5(3) . .
Zn2 O7 Zn1 O5 178.38(15) . .
C19 O7 Zn1 C13 35.7(4) . .
Zn2 O7 Zn1 C13 -153.48(16) . .
C7 O4 Zn1 O7 -30.0(3) . .
C7 O4 Zn1 O2 78.1(3) . .
C7 O4 Zn1 O6 175.2(3) . .
C7 O4 Zn1 O5 -127.3(3) . .
C7 O4 Zn1 C13 -154.8(3) . .
C1 O2 Zn1 O7 36.1(4) . .
C1 O2 Zn1 O4 -105.0(3) . .
C1 O2 Zn1 O6 146.7(3) . .
C1 O2 Zn1 O5 150.9(3) . .
C1 O2 Zn1 C13 146.9(3) . .
C13 O6 Zn1 O7 -80.3(2) . .
C13 O6 Zn1 O4 82.6(2) . .
C13 O6 Zn1 O2 179.7(2) . .
C13 O6 Zn1 O5 1.9(2) . .
C13 O5 Zn1 O7 108.8(2) . .
C13 O5 Zn1 O4 -111.8(2) . .
C13 O5 Zn1 O2 -6.8(4) . .
C13 O5 Zn1 O6 -1.9(2) . .
O5 C13 Zn1 O7 -75.2(2) . .
O6 C13 Zn1 O7 108.2(2) . .
C14 C13 Zn1 O7 70(3) . .
O5 C13 Zn1 O4 71.4(2) . .
O6 C13 Zn1 O4 -105.2(2) . .
C14 C13 Zn1 O4 -143(3) . .
O5 C13 Zn1 O2 176.4(2) . .
O6 C13 Zn1 O2 -0.3(3) . .
C14 C13 Zn1 O2 -38(3) . .
O5 C13 Zn1 O6 176.7(3) . .
C14 C13 Zn1 O6 -38(3) . .
O6 C13 Zn1 O5 -176.7(3) . .
C14 C13 Zn1 O5 145(3) . .
C19 O7 Zn2 O1 -177.7(3) . .
Zn1 O7 Zn2 O1 10.38(19) . .
C19 O7 Zn2 O8 73.0(3) . .
Zn1 O7 Zn2 O8 -98.87(17) . .
C19 O7 Zn2 O9 -74.0(3) . .
Zn1 O7 Zn2 O9 114.06(16) . .
C19 O7 Zn2 N1 -2.5(3) . .
Zn1 O7 Zn2 N1 -174.36(17) . .
C1 O1 Zn2 O7 14.9(3) . .
C1 O1 Zn2 O8 139.6(3) . .
C1 O1 Zn2 O9 -114.8(3) . .
C1 O1 Zn2 N1 -139.8(6) . .
C21 O8 Zn2 O7 -76.0(3) . .
C21 O8 Zn2 O1 170.5(3) . .
C21 O8 Zn2 O9 77.5(3) . .
C21 O8 Zn2 N1 1.6(3) . .
C23 O9 Zn2 O7 59.3(3) . .
C23 O9 Zn2 O1 170.1(3) . .
C23 O9 Zn2 O8 -91.6(3) . .
C23 O9 Zn2 N1 -14.7(3) . .
C24 N1 Zn2 O7 -135.3(4) . .
C22 N1 Zn2 O7 102.5(3) . .
C20 N1 Zn2 O7 -15.1(3) . .
C24 N1 Zn2 O1 20.3(8) . .
C22 N1 Zn2 O1 -101.9(7) . .
C20 N1 Zn2 O1 140.4(6) . .
C24 N1 Zn2 O8 102.6(4) . .
C22 N1 Zn2 O8 -19.6(3) . .
C20 N1 Zn2 O8 -137.3(3) . .
C24 N1 Zn2 O9 -5.2(4) . .
C22 N1 Zn2 O9 -127.4(3) . .
C20 N1 Zn2 O9 114.9(3) . .
