#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:05:18 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179714 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/16/7001605.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_7001605
loop_
_publ_author_name
'Zhang, Mei-Li'
'Li, Dong-Sheng'
'Wang, Ji-Jiang'
'Fu, Feng'
'Du, Miao'
'Zou, Kun'
'Gao, Xiao-Ming'
_publ_section_title
;
 Structural diversity and properties of ZnII and CdII complexes with a
 flexible dicarboxylate building block 1,3-phenylenediacetate and
 various heterocyclic co-ligands
;
_journal_issue                   27
_journal_name_full               'Dalton Transactions'
_journal_page_first              5355
_journal_page_last               5364
_journal_paper_doi               10.1039/b901418g
_journal_year                    2009
_chemical_formula_sum            'C44 H48 N4 O16 Zn2'
_chemical_formula_weight         1019.60
_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
_cell_angle_alpha                72.196(7)
_cell_angle_beta                 65.119(7)
_cell_angle_gamma                68.308(7)
_cell_formula_units_Z            1
_cell_length_a                   10.483(7)
_cell_length_b                   11.138(7)
_cell_length_c                   12.130(8)
_cell_measurement_reflns_used    3195
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.41
_cell_measurement_theta_min      2.40
_cell_volume                     1174.7(13)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.967
_diffrn_measured_fraction_theta_max 0.967
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.0296
_diffrn_reflns_av_sigmaI/netI    0.0416
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            8383
_diffrn_reflns_theta_full        25.50
_diffrn_reflns_theta_max         25.50
_diffrn_reflns_theta_min         2.40
_exptl_absorpt_coefficient_mu    1.094
_exptl_absorpt_correction_T_max  0.689
_exptl_absorpt_correction_T_min  0.591
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.441
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             528
_exptl_crystal_size_max          0.49
_exptl_crystal_size_mid          0.47
_exptl_crystal_size_min          0.34
_refine_diff_density_max         0.570
_refine_diff_density_min         -0.375
_refine_diff_density_rms         0.057
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     298
_refine_ls_number_reflns         4239
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.100
_refine_ls_R_factor_all          0.0552
_refine_ls_R_factor_gt           0.0407
_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)+(0.0636P)²+0.1896P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1047
_refine_ls_wR_factor_ref         0.1145
_reflns_number_gt                3339
_reflns_number_total             4239
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b901418g.txt
_cod_data_source_block           a
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        1174.7(14)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7001605
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Zn1 Zn 0.63690(3) 0.81921(3) 0.26934(3) 0.05303(16) Uani 1 1 d . . .
O1 O 0.8309(2) 0.7406(2) 0.2829(2) 0.0582(5) Uani 1 1 d . . .
O2 O 0.7371(2) 0.8494(2) 0.4352(2) 0.0706(6) Uani 1 1 d . . .
O3 O 1.4217(2) 0.9852(2) -0.2045(2) 0.0648(6) Uani 1 1 d . . .
O4 O 1.2746(3) 1.0981(2) -0.0602(2) 0.0830(8) Uani 1 1 d . . .
N1 N 0.4632(2) 0.7880(2) 0.4288(2) 0.0495(6) Uani 1 1 d . . .
N2 N 0.5922(3) 0.6725(2) 0.2292(2) 0.0527(6) Uani 1 1 d . . .
C1 C 1.0856(3) 0.8007(3) 0.3209(3) 0.0489(7) Uani 1 1 d . . .
C2 C 1.1726(3) 0.7950(3) 0.1985(3) 0.0531(7) Uani 1 1 d . . .
H2 H 1.1682 0.7373 0.1596 0.064 Uiso 1 1 calc R . .
C3 C 1.2668(3) 0.8744(3) 0.1327(3) 0.0561(8) Uani 1 1 d . . .
C4 C 1.2718(4) 0.9586(3) 0.1927(3) 0.0641(9) Uani 1 1 d . . .
H4 H 1.3357 1.0107 0.1507 0.077 Uiso 1 1 calc R . .
C5 C 1.1843(4) 0.9667(4) 0.3129(3) 0.0687(9) Uani 1 1 d . . .
H5 H 1.1873 1.0255 0.3516 0.082 Uiso 1 1 calc R . .
C6 C 1.0914(4) 0.8875(3) 0.3768(3) 0.0603(8) Uani 1 1 d . . .
H6 H 1.0323 0.8931 0.4586 0.072 Uiso 1 1 calc R . .
C7 C 0.8395(3) 0.7736(3) 0.3708(3) 0.0494(7) Uani 1 1 d . . .
C8 C 0.9836(3) 0.7137(3) 0.3919(3) 0.0574(8) Uani 1 1 d . . .
H8A H 1.0301 0.6288 0.3662 0.069 Uiso 1 1 calc R . .
H8B H 0.9661 0.6999 0.4794 0.069 Uiso 1 1 calc R . .
C9 C 1.3495(3) 0.9915(3) -0.0919(3) 0.0590(8) Uani 1 1 d . . .
C10 C 1.3633(4) 0.8646(3) 0.0000(3) 0.0767(11) Uani 1 1 d . . .
H10A H 1.3410 0.8022 -0.0252 0.092 Uiso 1 1 calc R . .
H10B H 1.4645 0.8293 -0.0040 0.092 Uiso 1 1 calc R . .
C11 C 0.3984(3) 0.8475(3) 0.5249(3) 0.0635(9) Uani 1 1 d . . .
H11 H 0.4313 0.9149 0.5239 0.076 Uiso 1 1 calc R . .
C12 C 0.2833(4) 0.8143(4) 0.6280(4) 0.0724(10) Uani 1 1 d . . .
H12 H 0.2396 0.8593 0.6938 0.087 Uiso 1 1 calc R . .
C13 C 0.2359(4) 0.7150(4) 0.6305(3) 0.0686(9) Uani 1 1 d . . .
H13 H 0.1597 0.6908 0.6991 0.082 Uiso 1 1 calc R . .
C14 C 0.3008(3) 0.6491(3) 0.5310(3) 0.0533(7) Uani 1 1 d . . .
C15 C 0.2567(4) 0.5446(3) 0.5251(4) 0.0639(9) Uani 1 1 d . . .
H15 H 0.1825 0.5154 0.5921 0.077 Uiso 1 1 calc R . .
C16 C 0.3196(4) 0.4883(3) 0.4255(4) 0.0635(9) Uani 1 1 d . . .
H16 H 0.2881 0.4209 0.4245 0.076 Uiso 1 1 calc R . .
C17 C 0.4349(3) 0.5291(3) 0.3199(3) 0.0558(8) Uani 1 1 d . . .
C18 C 0.5045(4) 0.4748(4) 0.2132(4) 0.0734(10) Uani 1 1 d . . .
H18 H 0.4761 0.4081 0.2069 0.088 Uiso 1 1 calc R . .
C19 C 0.6142(5) 0.5192(4) 0.1180(4) 0.0803(11) Uani 1 1 d . . .
H19 H 0.6607 0.4837 0.0460 0.096 Uiso 1 1 calc R . .
C20 C 0.6555(4) 0.6184(4) 0.1301(3) 0.0684(9) Uani 1 1 d . . .
H20 H 0.7313 0.6476 0.0652 0.082 Uiso 1 1 calc R . .
C21 C 0.4823(3) 0.6295(3) 0.3241(3) 0.0472(7) Uani 1 1 d . . .
C22 C 0.4143(3) 0.6896(3) 0.4302(3) 0.0466(7) Uani 1 1 d . . .
O5 O 0.9870(4) 0.7621(4) 0.8975(3) 0.1470(16) Uani 1 1 d D . .
H1W H 1.0206 0.7165 0.9529 0.221 Uiso 1 1 d RD . .
H2W H 0.9168 0.8254 0.9230 0.221 Uiso 1 1 d RD . .
O6 O 0.8789(4) 0.6557(4) 0.7914(5) 0.1572(16) Uani 1 1 d D . .
H3W H 0.8182 0.7065 0.7588 0.236 Uiso 1 1 d RD . .
H4W H 0.9161 0.6964 0.8110 0.236 Uiso 1 1 d RD . .
O7 O 0.6596(3) 0.7856(3) 0.6913(3) 0.0852(8) Uani 1 1 d D . .
H5W H 0.6996 0.8128 0.6172 0.128 Uiso 1 1 d RD . .
H6W H 0.5846 0.8419 0.7232 0.128 Uiso 1 1 d RD . .
O8 O 0.9478(4) 0.3995(3) 0.9000(3) 0.1129(11) Uani 1 1 d D . .
H7W H 1.0211 0.3581 0.8495 0.169 Uiso 1 1 d RD . .
H8W H 0.9167 0.4757 0.8644 0.169 Uiso 1 1 d RD . .
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
_geom_angle_publ_flag
O1 Zn1 O3 117.81(9) . 2_775 ?
O1 Zn1 N1 115.87(10) . . ?
O3 Zn1 N1 104.82(9) 2_775 . ?
O1 Zn1 N2 105.35(10) . . ?
O3 Zn1 N2 126.89(11) 2_775 . ?
N1 Zn1 N2 80.48(10) . . ?
O1 Zn1 O4 94.13(10) . 2_775 ?
O3 Zn1 O4 59.17(9) 2_775 2_775 ?
N1 Zn1 O4 149.92(11) . 2_775 ?
N2 Zn1 O4 89.80(11) . 2_775 ?
O1 Zn1 C9 108.12(10) . 2_775 ?
O3 Zn1 C9 30.02(10) 2_775 2_775 ?
N1 Zn1 C9 130.30(10) . 2_775 ?
N2 Zn1 C9 109.57(12) . 2_775 ?
O4 Zn1 C9 29.16(10) 2_775 2_775 ?
C7 O1 Zn1 112.06(19) . . ?
C9 O3 Zn1 96.5(2) . 2_775 ?
C9 O4 Zn1 84.1(2) . 2_775 ?
C11 N1 C22 118.4(3) . . ?
C11 N1 Zn1 129.4(2) . . ?
C22 N1 Zn1 112.27(19) . . ?
C20 N2 C21 118.6(3) . . ?
C20 N2 Zn1 129.7(2) . . ?
C21 N2 Zn1 111.7(2) . . ?
C6 C1 C2 118.9(3) . . ?
C6 C1 C8 120.4(3) . . ?
C2 C1 C8 120.7(3) . . ?
C1 C2 C3 121.1(3) . . ?
C1 C2 H2 119.5 . . ?
C3 C2 H2 119.5 . . ?
C4 C3 C2 118.3(3) . . ?
C4 C3 C10 121.4(3) . . ?
C2 C3 C10 120.3(3) . . ?
C5 C4 C3 121.1(3) . . ?
C5 C4 H4 119.5 . . ?
C3 C4 H4 119.5 . . ?
C4 C5 C6 119.9(3) . . ?
C4 C5 H5 120.1 . . ?
C6 C5 H5 120.1 . . ?
C1 C6 C5 120.7(3) . . ?
C1 C6 H6 119.6 . . ?
C5 C6 H6 119.6 . . ?
O2 C7 O1 122.5(3) . . ?
O2 C7 C8 121.4(3) . . ?
O1 C7 C8 116.1(3) . . ?
C7 C8 C1 111.6(2) . . ?
C7 C8 H8A 109.3 . . ?
C1 C8 H8A 109.3 . . ?
C7 C8 H8B 109.3 . . ?
C1 C8 H8B 109.3 . . ?
H8A C8 H8B 108.0 . . ?
O4 C9 O3 120.2(3) . . ?
O4 C9 C10 122.5(3) . . ?
O3 C9 C10 117.3(3) . . ?
O4 C9 Zn1 66.77(19) . 2_775 ?
O3 C9 Zn1 53.46(16) . 2_775 ?
C10 C9 Zn1 170.5(2) . 2_775 ?
C3 C10 C9 115.8(3) . . ?
C3 C10 H10A 108.3 . . ?
C9 C10 H10A 108.3 . . ?
C3 C10 H10B 108.3 . . ?
C9 C10 H10B 108.3 . . ?
H10A C10 H10B 107.4 . . ?
N1 C11 C12 123.2(3) . . ?
N1 C11 H11 118.4 . . ?
C12 C11 H11 118.4 . . ?
C13 C12 C11 118.6(3) . . ?
C13 C12 H12 120.7 . . ?
C11 C12 H12 120.7 . . ?
C12 C13 C14 120.4(3) . . ?
C12 C13 H13 119.8 . . ?
C14 C13 H13 119.8 . . ?
C13 C14 C22 117.6(3) . . ?
C13 C14 C15 124.1(3) . . ?
C22 C14 C15 118.3(3) . . ?
C16 C15 C14 121.4(3) . . ?
C16 C15 H15 119.3 . . ?
C14 C15 H15 119.3 . . ?
C15 C16 C17 121.5(3) . . ?
C15 C16 H16 119.2 . . ?
C17 C16 H16 119.2 . . ?
C18 C17 C21 117.4(3) . . ?
C18 C17 C16 124.3(3) . . ?
C21 C17 C16 118.3(3) . . ?
C19 C18 C17 120.1(3) . . ?
C19 C18 H18 119.9 . . ?
C17 C18 H18 119.9 . . ?
C18 C19 C20 118.9(3) . . ?
C18 C19 H19 120.6 . . ?
C20 C19 H19 120.6 . . ?
N2 C20 C19 122.9(3) . . ?
N2 C20 H20 118.6 . . ?
C19 C20 H20 118.6 . . ?
N2 C21 C17 122.1(3) . . ?
N2 C21 C22 117.9(3) . . ?
C17 C21 C22 119.9(3) . . ?
N1 C22 C14 121.9(3) . . ?
N1 C22 C21 117.6(2) . . ?
C14 C22 C21 120.5(3) . . ?
H1W O5 H2W 110.7 . . ?
H3W O6 H4W 111.6 . . ?
H5W O7 H6W 111.2 . . ?
H7W O8 H8W 109.6 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Zn1 O1 1.951(2) . ?
Zn1 O3 2.028(3) 2_775 ?
Zn1 N1 2.067(3) . ?
Zn1 N2 2.090(3) . ?
Zn1 O4 2.316(3) 2_775 ?
Zn1 C9 2.507(3) 2_775 ?
O1 C7 1.275(4) . ?
O2 C7 1.226(4) . ?
O3 C9 1.262(4) . ?
O3 Zn1 2.028(3) 2_775 ?
O4 C9 1.228(4) . ?
O4 Zn1 2.316(3) 2_775 ?
N1 C11 1.316(4) . ?
N1 C22 1.365(4) . ?
N2 C20 1.313(4) . ?
N2 C21 1.356(4) . ?
C1 C6 1.370(5) . ?
C1 C2 1.383(4) . ?
C1 C8 1.518(4) . ?
C2 C3 1.395(4) . ?
C2 H2 0.9300 . ?
C3 C4 1.377(5) . ?
C3 C10 1.511(5) . ?
C4 C5 1.367(5) . ?
C4 H4 0.9300 . ?
C5 C6 1.382(5) . ?
C5 H5 0.9300 . ?
C6 H6 0.9300 . ?
C7 C8 1.507(4) . ?
C8 H8A 0.9700 . ?
C8 H8B 0.9700 . ?
C9 C10 1.511(5) . ?
C9 Zn1 2.507(3) 2_775 ?
C10 H10A 0.9700 . ?
C10 H10B 0.9700 . ?
C11 C12 1.391(5) . ?
C11 H11 0.9300 . ?
C12 C13 1.358(5) . ?
C12 H12 0.9300 . ?
C13 C14 1.393(5) . ?
C13 H13 0.9300 . ?
C14 C22 1.397(4) . ?
C14 C15 1.432(5) . ?
C15 C16 1.332(5) . ?
C15 H15 0.9300 . ?
C16 C17 1.434(5) . ?
C16 H16 0.9300 . ?
C17 C18 1.389(5) . ?
C17 C21 1.402(4) . ?
C18 C19 1.362(5) . ?
C18 H18 0.9300 . ?
C19 C20 1.392(5) . ?
C19 H19 0.9300 . ?
C20 H20 0.9300 . ?
C21 C22 1.419(4) . ?
O5 H1W 0.8325 . ?
O5 H2W 0.8319 . ?
O6 H3W 0.8304 . ?
O6 H4W 0.8294 . ?
O7 H5W 0.8283 . ?
O7 H6W 0.8304 . ?
O8 H7W 0.8325 . ?
O8 H8W 0.8384 . ?
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
O5 H1W O8 0.83 1.93 2.746(5) 165.7 2_767
O5 H2W O4 0.83 2.08 2.830(4) 150.2 2_776
O6 H3W O7 0.83 1.96 2.768(5) 165.3 .
O6 H4W O5 0.83 1.93 2.738(7) 165.1 .
O7 H5W O2 0.83 2.01 2.788(4) 156.5 .
O7 H6W O3 0.83 1.95 2.780(4) 174.0 1_456
O8 H7W O1 0.83 1.98 2.801(4) 169.4 2_766
O8 H8W O6 0.84 1.89 2.717(6) 167.0 .
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
_geom_torsion_publ_flag
O3 Zn1 O1 C7 71.7(2) 2_775 . . . ?
N1 Zn1 O1 C7 -53.6(2) . . . . ?
N2 Zn1 O1 C7 -140.27(19) . . . . ?
O4 Zn1 O1 C7 128.8(2) 2_775 . . . ?
C9 Zn1 O1 C7 102.6(2) 2_775 . . . ?
O1 Zn1 N1 C11 79.3(3) . . . . ?
O3 Zn1 N1 C11 -52.3(3) 2_775 . . . ?
N2 Zn1 N1 C11 -178.1(3) . . . . ?
O4 Zn1 N1 C11 -105.4(3) 2_775 . . . ?
C9 Zn1 N1 C11 -70.5(3) 2_775 . . . ?
O1 Zn1 N1 C22 -99.8(2) . . . . ?
O3 Zn1 N1 C22 128.54(19) 2_775 . . . ?
N2 Zn1 N1 C22 2.72(19) . . . . ?
O4 Zn1 N1 C22 75.5(3) 2_775 . . . ?
C9 Zn1 N1 C22 110.4(2) 2_775 . . . ?
O1 Zn1 N2 C20 -66.6(3) . . . . ?
O3 Zn1 N2 C20 77.6(3) 2_775 . . . ?
N1 Zn1 N2 C20 179.0(3) . . . . ?
O4 Zn1 N2 C20 27.6(3) 2_775 . . . ?
C9 Zn1 N2 C20 49.5(3) 2_775 . . . ?
O1 Zn1 N2 C21 112.0(2) . . . . ?
O3 Zn1 N2 C21 -103.8(2) 2_775 . . . ?
N1 Zn1 N2 C21 -2.34(19) . . . . ?
O4 Zn1 N2 C21 -153.7(2) 2_775 . . . ?
C9 Zn1 N2 C21 -131.87(19) 2_775 . . . ?
C6 C1 C2 C3 1.0(4) . . . . ?
C8 C1 C2 C3 -179.8(3) . . . . ?
C1 C2 C3 C4 0.3(5) . . . . ?
C1 C2 C3 C10 178.7(3) . . . . ?
C2 C3 C4 C5 -1.5(5) . . . . ?
C10 C3 C4 C5 -179.9(3) . . . . ?
C3 C4 C5 C6 1.5(5) . . . . ?
C2 C1 C6 C5 -1.0(5) . . . . ?
C8 C1 C6 C5 179.8(3) . . . . ?
C4 C5 C6 C1 -0.2(5) . . . . ?
Zn1 O1 C7 O2 -2.1(3) . . . . ?
Zn1 O1 C7 C8 177.73(18) . . . . ?
O2 C7 C8 C1 -87.9(4) . . . . ?
O1 C7 C8 C1 92.3(3) . . . . ?
C6 C1 C8 C7 94.7(4) . . . . ?
C2 C1 C8 C7 -84.5(4) . . . . ?
Zn1 O4 C9 O3 -1.0(3) 2_775 . . . ?
Zn1 O4 C9 C10 177.3(3) 2_775 . . . ?
Zn1 O3 C9 O4 1.1(4) 2_775 . . . ?
Zn1 O3 C9 C10 -177.2(3) 2_775 . . . ?
C4 C3 C10 C9 -56.5(5) . . . . ?
C2 C3 C10 C9 125.1(4) . . . . ?
O4 C9 C10 C3 6.1(6) . . . . ?
O3 C9 C10 C3 -175.6(3) . . . . ?
Zn1 C9 C10 C3 170.9(14) 2_775 . . . ?
C22 N1 C11 C12 0.4(5) . . . . ?
Zn1 N1 C11 C12 -178.7(3) . . . . ?
N1 C11 C12 C13 0.7(6) . . . . ?
C11 C12 C13 C14 -0.7(6) . . . . ?
C12 C13 C14 C22 -0.2(5) . . . . ?
C12 C13 C14 C15 -179.1(3) . . . . ?
C13 C14 C15 C16 177.6(3) . . . . ?
C22 C14 C15 C16 -1.2(5) . . . . ?
C14 C15 C16 C17 0.3(5) . . . . ?
C15 C16 C17 C18 -179.7(3) . . . . ?
C15 C16 C17 C21 1.0(5) . . . . ?
C21 C17 C18 C19 0.0(5) . . . . ?
C16 C17 C18 C19 -179.3(4) . . . . ?
C17 C18 C19 C20 0.5(6) . . . . ?
C21 N2 C20 C19 0.4(5) . . . . ?
Zn1 N2 C20 C19 178.9(3) . . . . ?
C18 C19 C20 N2 -0.8(6) . . . . ?
C20 N2 C21 C17 0.2(4) . . . . ?
Zn1 N2 C21 C17 -178.6(2) . . . . ?
C20 N2 C21 C22 -179.6(3) . . . . ?
Zn1 N2 C21 C22 1.6(3) . . . . ?
C18 C17 C21 N2 -0.4(4) . . . . ?
C16 C17 C21 N2 178.9(3) . . . . ?
C18 C17 C21 C22 179.4(3) . . . . ?
C16 C17 C21 C22 -1.3(4) . . . . ?
C11 N1 C22 C14 -1.4(4) . . . . ?
Zn1 N1 C22 C14 177.8(2) . . . . ?
C11 N1 C22 C21 178.0(3) . . . . ?
Zn1 N1 C22 C21 -2.7(3) . . . . ?
C13 C14 C22 N1 1.3(4) . . . . ?
C15 C14 C22 N1 -179.7(3) . . . . ?
C13 C14 C22 C21 -178.1(3) . . . . ?
C15 C14 C22 C21 0.9(4) . . . . ?
N2 C21 C22 N1 0.7(4) . . . . ?
C17 C21 C22 N1 -179.1(3) . . . . ?
N2 C21 C22 C14 -179.8(3) . . . . ?
C17 C21 C22 C14 0.4(4) . . . . ?
