#------------------------------------------------------------------------------
#$Date: 2016-03-26 17:43:04 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180401 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/70/7207098.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_7207098
loop_
_publ_author_name
'Jin, Rui-Fang'
'Yang, Shi-Yao'
'Li, Hui-Min'
'Long, La-Sheng'
'Huang, Rong-Bin'
'Zheng, Lan-Sun'
_publ_section_title
;
 Effect of ionic radius on the assemblies of first row transition
 metal--5-tert-butylisophthalates--(2,2′-bipyridine or
 phenanthroline) coordination compounds
;
_journal_issue                   4
_journal_name_full               CrystEngComm
_journal_page_first              1301
_journal_paper_doi               10.1039/c1ce05959a
_journal_volume                  14
_journal_year                    2012
_chemical_formula_moiety         '2(C24 H22 N2 O5 Zn), H2 O'
_chemical_formula_sum            'C48 H46 N4 O11 Zn2'
_chemical_formula_weight         985.63
_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                 96.34(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   22.638(5)
_cell_length_b                   9.995(2)
_cell_length_c                   19.913(4)
_cell_measurement_reflns_used    19003
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      54.99
_cell_measurement_theta_min      6.18
_cell_volume                     4478.1(16)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       'PROCESS-AUTO (Rigaku Corporation,1998)'
_computing_data_reduction
'teXsan (Molecular Structure Corporation & Rigaku Corporation, 1999)'
_computing_molecular_graphics    'ORTEP-II (Johnson, 1976)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID imaging plate'
_diffrn_measurement_method       'omega 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  0.1278
_diffrn_reflns_av_sigmaI/netI    0.0826
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            32712
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.10
_exptl_absorpt_coefficient_mu    1.138
_exptl_absorpt_correction_T_max  0.8756
_exptl_absorpt_correction_T_min  0.7641
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Tompa_analytical (Rigaku Corporation, 1999)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.462
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2040
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.964
_refine_diff_density_min         -1.488
_refine_diff_density_rms         0.138
_refine_ls_extinction_coef       0.0036(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.150
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     301
_refine_ls_number_reflns         5116
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.150
_refine_ls_R_factor_all          0.1138
_refine_ls_R_factor_gt           0.0719
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1033P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1746
_refine_ls_wR_factor_ref         0.2172
_reflns_number_gt                3161
_reflns_number_total             5116
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1ce05959a.txt
_cod_data_source_block           ZnPhen-{[Zn(phen)(tbip)(H2O)].0.5H2O}n
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        4478.2(16)
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7207098
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
Zn1 Zn 0.40182(2) 0.64085(5) 0.55479(2) 0.0373(2) Uani 1 1 d .
O1 O 0.34381(14) 0.5307(3) 0.48837(15) 0.0443(8) Uani 1 1 d .
O1W O 0.46154(14) 0.4843(3) 0.57880(16) 0.0443(8) Uani 1 1 d .
H1WA H 0.4716 0.4834 0.6207 0.053 Uiso 1 1 calc R
H1WB H 0.4921 0.4923 0.5578 0.053 Uiso 1 1 d R
O2 O 0.42472(14) 0.5883(4) 0.44195(15) 0.0426(8) Uani 1 1 d .
O2W O 0.5000 0.7215(7) 0.2500 0.097(2) Uani 1 2 d SD
H2WA H 0.521(3) 0.647(4) 0.263(4) 0.117 Uiso 1 1 d D
O3 O 0.43553(15) 0.4826(4) 0.20074(17) 0.0594(11) Uani 1 1 d .
O4 O 0.36055(14) 0.3764(3) 0.13902(15) 0.0419(8) Uani 1 1 d .
N1 N 0.46430(17) 0.7920(4) 0.59249(19) 0.0406(9) Uani 1 1 d .
N2 N 0.36241(18) 0.8247(4) 0.50969(18) 0.0406(10) Uani 1 1 d .
C1 C 0.3458(2) 0.4761(5) 0.3723(2) 0.0380(11) Uani 1 1 d .
C2 C 0.37760(19) 0.4732(4) 0.3162(2) 0.0356(10) Uani 1 1 d .
H2A H 0.4173 0.5055 0.3198 0.043 Uiso 1 1 calc R
C3 C 0.3514(2) 0.4235(5) 0.2551(2) 0.0382(11) Uani 1 1 d .
C4 C 0.2924(2) 0.3799(5) 0.2496(2) 0.0401(11) Uani 1 1 d .
H4A H 0.2747 0.3461 0.2075 0.048 Uiso 1 1 calc R
C5 C 0.2588(2) 0.3846(5) 0.3044(2) 0.0375(11) Uani 1 1 d .
C6 C 0.2873(2) 0.4322(5) 0.3656(2) 0.0390(11) Uani 1 1 d .
H6A H 0.2658 0.4347 0.4039 0.047 Uiso 1 1 calc R
C7 C 0.3739(2) 0.5346(5) 0.4381(2) 0.0372(11) Uani 1 1 d .
C8 C 0.3854(2) 0.4279(5) 0.1935(2) 0.0399(11) Uani 1 1 d .
C9 C 0.1937(2) 0.3451(5) 0.2988(2) 0.0445(12) Uani 1 1 d .
C10 C 0.1698(2) 0.2954(6) 0.2274(2) 0.0529(14) Uani 1 1 d .
H10A H 0.1938 0.2197 0.2148 0.079 Uiso 1 1 calc R
H10B H 0.1720 0.3681 0.1947 0.079 Uiso 1 1 calc R
H10C H 0.1283 0.2669 0.2273 0.079 Uiso 1 1 calc R
C11 C 0.1568(2) 0.4705(6) 0.3132(3) 0.0577(15) Uani 1 1 d .
H11A H 0.1615 0.5390 0.2790 0.087 Uiso 1 1 calc R
H11B H 0.1707 0.5057 0.3580 0.087 Uiso 1 1 calc R
H11C H 0.1147 0.4459 0.3115 0.087 Uiso 1 1 calc R
C12 C 0.1843(2) 0.2348(6) 0.3499(3) 0.0556(14) Uani 1 1 d .
H12A H 0.2048 0.1533 0.3381 0.083 Uiso 1 1 calc R
H12B H 0.1417 0.2165 0.3492 0.083 Uiso 1 1 calc R
H12C H 0.2003 0.2641 0.3953 0.083 Uiso 1 1 calc R
C13 C 0.5125(2) 0.7756(6) 0.6364(3) 0.0535(14) Uani 1 1 d .
H13A H 0.5217 0.6880 0.6529 0.064 Uiso 1 1 calc R
C14 C 0.5501(3) 0.8797(6) 0.6594(3) 0.0668(18) Uani 1 1 d .
H14A H 0.5842 0.8631 0.6905 0.080 Uiso 1 1 calc R
C15 C 0.5371(2) 1.0066(6) 0.6364(3) 0.0671(17) Uani 1 1 d .
H15A H 0.5624 1.0790 0.6515 0.080 Uiso 1 1 calc R
C16 C 0.4862(2) 1.0296(5) 0.5903(3) 0.0490(13) Uani 1 1 d .
C17 C 0.4686(3) 1.1588(5) 0.5645(3) 0.0604(16) Uani 1 1 d .
H17A H 0.4929 1.2343 0.5769 0.072 Uiso 1 1 calc R
C18 C 0.4178(3) 1.1750(6) 0.5226(3) 0.0616(16) Uani 1 1 d .
H18A H 0.4072 1.2616 0.5057 0.074 Uiso 1 1 calc R
C19 C 0.3800(2) 1.0650(5) 0.5035(3) 0.0502(13) Uani 1 1 d .
C20 C 0.3245(3) 1.0761(7) 0.4617(3) 0.0630(16) Uani 1 1 d .
H20A H 0.3112 1.1612 0.4451 0.076 Uiso 1 1 calc R
C21 C 0.2904(3) 0.9645(6) 0.4455(3) 0.0570(15) Uani 1 1 d .
H21A H 0.2535 0.9716 0.4179 0.068 Uiso 1 1 calc R
C22 C 0.3113(2) 0.8398(5) 0.4705(2) 0.0478(13) Uani 1 1 d .
H22A H 0.2878 0.7627 0.4589 0.057 Uiso 1 1 calc R
C23 C 0.3963(2) 0.9354(5) 0.5259(2) 0.0415(11) Uani 1 1 d .
C24 C 0.4510(2) 0.9170(5) 0.5706(2) 0.0415(11) 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
O4 Zn1 O1 99.58(13) 6_566 .
O4 Zn1 O1W 95.36(13) 6_566 .
O1 Zn1 O1W 95.55(13) . .
O4 Zn1 N1 96.72(14) 6_566 .
O1 Zn1 N1 160.46(14) . .
O1W Zn1 N1 93.57(14) . .
O4 Zn1 N2 101.98(14) 6_566 .
O1 Zn1 N2 89.04(14) . .
O1W Zn1 N2 161.07(14) . .
N1 Zn1 N2 77.05(15) . .
O4 Zn1 O2 157.10(13) 6_566 .
O1 Zn1 O2 58.53(12) . .
O1W Zn1 O2 81.38(12) . .
N1 Zn1 O2 106.08(13) . .
N2 Zn1 O2 85.45(13) . .
O4 Zn1 C7 128.82(15) 6_566 .
O1 Zn1 C7 29.39(13) . .
O1W Zn1 C7 89.18(14) . .
N1 Zn1 C7 133.92(15) . .
N2 Zn1 C7 85.86(14) . .
O2 Zn1 C7 29.17(12) . .
C7 O1 Zn1 97.4(3) . .
Zn1 O1W H1WA 109.5 . .
Zn1 O1W H1WB 111.0 . .
H1WA O1W H1WB 110.1 . .
C7 O2 Zn1 82.0(3) . .
C8 O4 Zn1 122.8(3) . 6_565
C13 N1 C24 117.7(4) . .
C13 N1 Zn1 127.1(4) . .
C24 N1 Zn1 115.1(3) . .
C22 N2 C23 118.4(4) . .
C22 N2 Zn1 128.6(4) . .
C23 N2 Zn1 113.0(3) . .
C6 C1 C2 119.2(4) . .
C6 C1 C7 120.8(4) . .
C2 C1 C7 119.9(4) . .
C3 C2 C1 120.1(4) . .
C3 C2 H2A 119.9 . .
C1 C2 H2A 119.9 . .
C2 C3 C4 119.6(4) . .
C2 C3 C8 119.4(4) . .
C4 C3 C8 120.7(4) . .
C5 C4 C3 121.7(4) . .
C5 C4 H4A 119.2 . .
C3 C4 H4A 119.2 . .
C4 C5 C6 117.0(4) . .
C4 C5 C9 122.8(4) . .
C6 C5 C9 120.2(4) . .
C1 C6 C5 122.4(4) . .
C1 C6 H6A 118.8 . .
C5 C6 H6A 118.8 . .
O2 C7 O1 121.9(4) . .
O2 C7 C1 120.6(4) . .
O1 C7 C1 117.4(4) . .
O2 C7 Zn1 68.8(2) . .
O1 C7 Zn1 53.2(2) . .
C1 C7 Zn1 169.4(3) . .
O3 C8 O4 125.7(4) . .
O3 C8 C3 117.0(4) . .
O4 C8 C3 117.4(4) . .
C5 C9 C12 110.1(4) . .
C5 C9 C10 113.0(4) . .
C12 C9 C10 108.6(4) . .
C5 C9 C11 108.4(4) . .
C12 C9 C11 109.9(5) . .
C10 C9 C11 106.7(4) . .
C9 C10 H10A 109.5 . .
C9 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C9 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C9 C11 H11A 109.5 . .
C9 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
C9 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
C9 C12 H12A 109.5 . .
C9 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C9 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
N1 C13 C14 123.5(5) . .
N1 C13 H13A 118.3 . .
C14 C13 H13A 118.3 . .
C15 C14 C13 118.9(5) . .
C15 C14 H14A 120.6 . .
C13 C14 H14A 120.6 . .
C14 C15 C16 119.9(5) . .
C14 C15 H15A 120.1 . .
C16 C15 H15A 120.1 . .
C24 C16 C15 116.5(5) . .
C24 C16 C17 119.6(5) . .
C15 C16 C17 123.8(5) . .
C18 C17 C16 120.8(5) . .
C18 C17 H17A 119.6 . .
C16 C17 H17A 119.6 . .
C17 C18 C19 121.3(5) . .
C17 C18 H18A 119.4 . .
C19 C18 H18A 119.4 . .
C23 C19 C18 119.9(5) . .
C23 C19 C20 116.0(5) . .
C18 C19 C20 124.1(5) . .
C21 C20 C19 120.5(5) . .
C21 C20 H20A 119.7 . .
C19 C20 H20A 119.7 . .
C20 C21 C22 118.5(5) . .
C20 C21 H21A 120.7 . .
C22 C21 H21A 120.7 . .
N2 C22 C21 123.1(5) . .
N2 C22 H22A 118.5 . .
C21 C22 H22A 118.5 . .
N2 C23 C19 123.4(5) . .
N2 C23 C24 117.4(4) . .
C19 C23 C24 119.2(5) . .
N1 C24 C16 123.5(5) . .
N1 C24 C23 117.4(4) . .
C16 C24 C23 119.1(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O4 2.015(3) 6_566
Zn1 O1 2.074(3) .
Zn1 O1W 2.088(3) .
Zn1 N1 2.148(4) .
Zn1 N2 2.191(4) .
Zn1 O2 2.419(3) .
Zn1 C7 2.569(5) .
O1 C7 1.271(5) .
O1W H1WA 0.8400 .
O1W H1WB 0.8499 .
O2 C7 1.264(5) .
O2W H2WA 0.91(5) .
O3 C8 1.253(5) .
O4 C8 1.275(5) .
O4 Zn1 2.015(3) 6_565
N1 C13 1.332(6) .
N1 C24 1.346(6) .
N2 C22 1.332(6) .
N2 C23 1.365(6) .
C1 C6 1.388(6) .
C1 C2 1.395(6) .
C1 C7 1.510(6) .
C2 C3 1.384(6) .
C2 H2A 0.9500 .
C3 C4 1.398(6) .
C3 C8 1.520(6) .
C4 C5 1.397(6) .
C4 H4A 0.9500 .
C5 C6 1.398(6) .
C5 C9 1.517(7) .
C6 H6A 0.9500 .
C9 C12 1.532(7) .
C9 C10 1.547(6) .
C9 C11 1.551(7) .
C10 H10A 0.9800 .
C10 H10B 0.9800 .
C10 H10C 0.9800 .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 C14 1.389(7) .
C13 H13A 0.9500 .
C14 C15 1.369(8) .
C14 H14A 0.9500 .
C15 C16 1.411(8) .
C15 H15A 0.9500 .
C16 C24 1.410(7) .
C16 C17 1.430(7) .
C17 C18 1.356(8) .
C17 H17A 0.9500 .
C18 C19 1.419(8) .
C18 H18A 0.9500 .
C19 C23 1.406(7) .
C19 C20 1.431(7) .
C20 C21 1.375(8) .
C20 H20A 0.9500 .
C21 C22 1.405(7) .
C21 H21A 0.9500 .
C22 H22A 0.9500 .
C23 C24 1.455(7) .
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
O1W H1WA O3 0.84 1.90 2.582(5) 137.5 6_566
O1W H1WB O2 0.85 2.05 2.750(5) 139.5 5_666
O2W H2WA O3 0.91(5) 2.01(5) 2.912(7) 175(9) 2_655
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
O4 Zn1 O1 C7 -174.8(3) 6_566
O1W Zn1 O1 C7 -78.4(3) .
N1 Zn1 O1 C7 39.1(5) .
N2 Zn1 O1 C7 83.2(3) .
O2 Zn1 O1 C7 -2.0(3) .
O4 Zn1 O2 C7 20.6(5) 6_566
O1 Zn1 O2 C7 2.0(3) .
O1W Zn1 O2 C7 104.0(3) .
N1 Zn1 O2 C7 -164.8(3) .
N2 Zn1 O2 C7 -89.7(3) .
O4 Zn1 N1 C13 74.9(4) 6_566
O1 Zn1 N1 C13 -138.6(5) .
O1W Zn1 N1 C13 -20.9(4) .
N2 Zn1 N1 C13 175.7(5) .
O2 Zn1 N1 C13 -103.0(4) .
C7 Zn1 N1 C13 -113.2(4) .
O4 Zn1 N1 C24 -102.3(3) 6_566
O1 Zn1 N1 C24 44.1(6) .
O1W Zn1 N1 C24 161.9(3) .
N2 Zn1 N1 C24 -1.5(3) .
O2 Zn1 N1 C24 79.8(3) .
C7 Zn1 N1 C24 69.6(4) .
O4 Zn1 N2 C22 -83.6(4) 6_566
O1 Zn1 N2 C22 15.9(4) .
O1W Zn1 N2 C22 120.4(5) .
N1 Zn1 N2 C22 -177.9(4) .
O2 Zn1 N2 C22 74.4(4) .
C7 Zn1 N2 C22 45.2(4) .
O4 Zn1 N2 C23 95.8(3) 6_566
O1 Zn1 N2 C23 -164.6(3) .
O1W Zn1 N2 C23 -60.2(6) .
N1 Zn1 N2 C23 1.5(3) .
O2 Zn1 N2 C23 -106.1(3) .
C7 Zn1 N2 C23 -135.4(3) .
C6 C1 C2 C3 -1.9(7) .
C7 C1 C2 C3 -178.0(4) .
C1 C2 C3 C4 1.8(7) .
C1 C2 C3 C8 176.8(4) .
C2 C3 C4 C5 -0.2(7) .
C8 C3 C4 C5 -175.0(4) .
C3 C4 C5 C6 -1.4(7) .
C3 C4 C5 C9 176.5(5) .
C2 C1 C6 C5 0.2(7) .
C7 C1 C6 C5 176.3(4) .
C4 C5 C6 C1 1.4(7) .
C9 C5 C6 C1 -176.6(4) .
Zn1 O2 C7 O1 -3.3(4) .
Zn1 O2 C7 C1 174.7(4) .
Zn1 O1 C7 O2 3.8(5) .
Zn1 O1 C7 C1 -174.2(3) .
C6 C1 C7 O2 -171.9(4) .
C2 C1 C7 O2 4.2(7) .
C6 C1 C7 O1 6.2(7) .
C2 C1 C7 O1 -177.7(4) .
C6 C1 C7 Zn1 -20(2) .
C2 C1 C7 Zn1 156.3(16) .
O4 Zn1 C7 O2 -169.9(2) 6_566
O1 Zn1 C7 O2 -176.5(4) .
O1W Zn1 C7 O2 -73.6(3) .
N1 Zn1 C7 O2 20.5(3) .
N2 Zn1 C7 O2 88.1(3) .
O4 Zn1 C7 O1 6.6(3) 6_566
O1W Zn1 C7 O1 102.9(3) .
N1 Zn1 C7 O1 -163.0(3) .
N2 Zn1 C7 O1 -95.4(3) .
O2 Zn1 C7 O1 176.5(4) .
O4 Zn1 C7 C1 35.7(19) 6_566
O1 Zn1 C7 C1 29.1(17) .
O1W Zn1 C7 C1 131.9(18) .
N1 Zn1 C7 C1 -133.9(18) .
N2 Zn1 C7 C1 -66.3(18) .
O2 Zn1 C7 C1 -154(2) .
Zn1 O4 C8 O3 5.7(7) 6_565
Zn1 O4 C8 C3 -174.7(3) 6_565
C2 C3 C8 O3 -3.0(7) .
C4 C3 C8 O3 171.9(5) .
C2 C3 C8 O4 177.3(4) .
C4 C3 C8 O4 -7.8(7) .
C4 C5 C9 C12 123.5(5) .
C6 C5 C9 C12 -58.6(6) .
C4 C5 C9 C10 1.9(7) .
C6 C5 C9 C10 179.8(4) .
C4 C5 C9 C11 -116.2(5) .
C6 C5 C9 C11 61.7(6) .
C24 N1 C13 C14 -1.4(8) .
Zn1 N1 C13 C14 -178.6(4) .
N1 C13 C14 C15 0.5(10) .
C13 C14 C15 C16 0.1(10) .
C14 C15 C16 C24 0.2(9) .
C14 C15 C16 C17 178.9(6) .
C24 C16 C17 C18 1.6(9) .
C15 C16 C17 C18 -177.0(6) .
C16 C17 C18 C19 0.7(9) .
C17 C18 C19 C23 -2.6(9) .
C17 C18 C19 C20 177.3(6) .
C23 C19 C20 C21 -0.1(8) .
C18 C19 C20 C21 -179.9(5) .
C19 C20 C21 C22 -0.3(8) .
C23 N2 C22 C21 -0.5(7) .
Zn1 N2 C22 C21 178.9(4) .
C20 C21 C22 N2 0.6(8) .
C22 N2 C23 C19 0.0(7) .
Zn1 N2 C23 C19 -179.4(4) .
C22 N2 C23 C24 178.1(4) .
Zn1 N2 C23 C24 -1.4(5) .
C18 C19 C23 N2 -179.9(5) .
C20 C19 C23 N2 0.2(8) .
C18 C19 C23 C24 2.1(7) .
C20 C19 C23 C24 -177.8(4) .
C13 N1 C24 C16 1.8(7) .
Zn1 N1 C24 C16 179.3(4) .
C13 N1 C24 C23 -176.2(4) .
Zn1 N1 C24 C23 1.3(5) .
C15 C16 C24 N1 -1.2(8) .
C17 C16 C24 N1 -179.9(5) .
C15 C16 C24 C23 176.8(5) .
C17 C16 C24 C23 -2.0(7) .
N2 C23 C24 N1 0.1(6) .
C19 C23 C24 N1 178.2(4) .
N2 C23 C24 C16 -178.0(4) .
C19 C23 C24 C16 0.1(7) .
