#------------------------------------------------------------------------------
#$Date: 2016-03-26 21:20:38 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180473 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/42/7214251.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_7214251
loop_
_publ_author_name
'Wu, Jing-Yun'
'Yuan, Pin-Ting'
'Hsiao, Cheng-Chu'
_publ_section_title
;
 Positional isomerism of unsymmetrical semirigid ligands toward the
 construction of discrete and infinite coordination architectures of
 zinc(ii) and cadmium(ii) complexes
;
_journal_issue                   15
_journal_name_full               CrystEngComm
_journal_page_first              3128
_journal_paper_doi               10.1039/c3ce42398k
_journal_volume                  16
_journal_year                    2014
_chemical_formula_sum            'C60 H38 Cl2 N8 O16 Zn2'
_chemical_formula_weight         1328.62
_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                107.884(2)
_cell_angle_beta                 90.393(2)
_cell_angle_gamma                95.349(2)
_cell_formula_units_Z            1
_cell_length_a                   9.1510(3)
_cell_length_b                   12.4798(4)
_cell_length_c                   12.9559(3)
_cell_measurement_reflns_used    0
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      0
_cell_measurement_theta_min      0
_cell_volume                     1400.99(7)
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
_computing_data_collection       'Collect (Nonius BV, 1997-2000)'
_computing_data_reduction
'HKL Denzo and Scalepack (Otwinowski&Minor 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1986)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       'CCD rotation images, thick slices'
_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  0.0323
_diffrn_reflns_av_sigmaI/netI    0.0583
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            9845
_diffrn_reflns_theta_full        25.16
_diffrn_reflns_theta_max         25.16
_diffrn_reflns_theta_min         1.72
_exptl_absorpt_coefficient_mu    1.033
_exptl_absorpt_correction_T_max  0.9502
_exptl_absorpt_correction_T_min  0.6828
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.575
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             676
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.329
_refine_diff_density_min         -0.360
_refine_diff_density_rms         0.092
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.074
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     398
_refine_ls_number_reflns         4957
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.074
_refine_ls_R_factor_all          0.0673
_refine_ls_R_factor_gt           0.0426
_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)+(0.0629P)²+0.4845P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1003
_refine_ls_wR_factor_ref         0.1332
_reflns_number_gt                3639
_reflns_number_total             4957
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ce42398k2.cif
_cod_data_source_block           cpd_2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/current/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 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7214251
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
Zn1 Zn 0.75328(5) 0.79455(4) 0.55532(3) 0.03783(17) Uani 1 1 d .
Cl1 Cl 0.59953(12) 0.80764(9) 0.42695(8) 0.0488(3) Uani 1 1 d .
O1 O 1.4008(4) 0.7655(3) 0.7486(2) 0.0649(9) Uani 1 1 d .
O2 O 1.1952(4) 1.0950(3) 0.7915(2) 0.0647(10) Uani 1 1 d .
O3 O 1.1278(3) 1.1781(3) 1.2361(2) 0.0514(8) Uani 1 1 d .
O4 O 1.2874(3) 1.0950(2) 1.3052(2) 0.0437(7) Uani 1 1 d .
O5 O 0.5858(4) 0.6695(3) 0.9327(3) 0.0791(12) Uani 1 1 d .
O6 O 0.6905(5) 0.3063(3) 0.7830(3) 0.0800(12) Uani 1 1 d .
O7 O 1.0057(5) 0.2956(3) 1.1313(3) 0.0783(12) Uani 1 1 d .
H7 H 1.0398 0.2651 1.1726 0.117 Uiso 1 1 calc R
O8 O 0.9999(5) 0.4386(3) 1.2822(3) 0.0889(13) Uani 1 1 d .
N1 N 1.3049(4) 0.9283(3) 0.7433(2) 0.0400(8) Uani 1 1 d .
N2 N 0.9578(4) 0.8313(3) 0.5080(2) 0.0366(8) Uani 1 1 d .
N3 N 0.6202(4) 0.4875(3) 0.8335(3) 0.0448(9) Uani 1 1 d .
N4 N 0.7300(4) 0.6326(3) 0.5609(3) 0.0408(8) Uani 1 1 d .
C1 C 1.3511(5) 0.8529(4) 0.7942(3) 0.0420(10) Uani 1 1 d .
C2 C 1.2441(5) 1.0189(4) 0.8152(3) 0.0421(10) Uani 1 1 d .
C3 C 1.2560(4) 1.0013(3) 0.9242(3) 0.0369(9) Uani 1 1 d .
C4 C 1.2181(5) 1.0686(3) 1.0240(3) 0.0416(10) Uani 1 1 d .
H4 H 1.1703 1.1329 1.0311 0.050 Uiso 1 1 calc R
C5 C 1.2544(4) 1.0364(3) 1.1141(3) 0.0362(9) Uani 1 1 d .
C6 C 1.3241(5) 0.9384(3) 1.1018(3) 0.0423(10) Uani 1 1 d .
H6 H 1.3479 0.9188 1.1630 0.051 Uiso 1 1 calc R
C7 C 1.3587(5) 0.8695(3) 0.9999(3) 0.0445(10) Uani 1 1 d .
H7A H 1.4034 0.8035 0.9916 0.053 Uiso 1 1 calc R
C8 C 1.3234(4) 0.9037(3) 0.9122(3) 0.0361(9) Uani 1 1 d .
C9 C 1.2179(5) 1.1091(3) 1.2260(3) 0.0387(10) Uani 1 1 d .
C10 C 1.3404(5) 0.9233(4) 0.6318(3) 0.0461(11) Uani 1 1 d .
H10A H 1.4117 0.8690 0.6066 0.055 Uiso 1 1 calc R
H10B H 1.3865 0.9967 0.6326 0.055 Uiso 1 1 calc R
C11 C 1.0750(4) 0.8552(3) 0.5766(3) 0.0374(9) Uani 1 1 d .
H11 H 1.0623 0.8466 0.6449 0.045 Uiso 1 1 calc R
C12 C 1.2118(4) 0.8912(3) 0.5522(3) 0.0354(9) Uani 1 1 d .
C13 C 1.2294(5) 0.9015(3) 0.4492(3) 0.0411(10) Uani 1 1 d .
H13 H 1.3209 0.9258 0.4291 0.049 Uiso 1 1 calc R
C14 C 1.1117(5) 0.8757(4) 0.3774(3) 0.0451(11) Uani 1 1 d .
H14 H 1.1229 0.8806 0.3077 0.054 Uiso 1 1 calc R
C15 C 0.9777(5) 0.8428(3) 0.4092(3) 0.0414(10) Uani 1 1 d .
H15 H 0.8973 0.8278 0.3608 0.050 Uiso 1 1 calc R
C16 C 0.6370(5) 0.5819(4) 0.9246(3) 0.0490(11) Uani 1 1 d .
C17 C 0.6912(5) 0.3980(4) 0.8484(4) 0.0512(12) Uani 1 1 d .
C18 C 0.7599(5) 0.4421(3) 0.9588(3) 0.0430(10) Uani 1 1 d .
C19 C 0.8412(5) 0.3893(4) 1.0150(3) 0.0454(11) Uani 1 1 d .
H19 H 0.8638 0.3154 0.9834 0.054 Uiso 1 1 calc R
C20 C 0.8880(5) 0.4497(4) 1.1198(3) 0.0438(10) Uani 1 1 d .
C21 C 0.8568(6) 0.5602(4) 1.1659(4) 0.0581(13) Uani 1 1 d .
H21 H 0.8907 0.5995 1.2364 0.070 Uiso 1 1 calc R
C22 C 0.7764(6) 0.6133(4) 1.1093(4) 0.0614(14) Uani 1 1 d .
H22 H 0.7558 0.6878 1.1402 0.074 Uiso 1 1 calc R
C23 C 0.7279(5) 0.5522(3) 1.0054(3) 0.0454(11) Uani 1 1 d .
C24 C 0.9710(5) 0.3962(4) 1.1873(4) 0.0522(12) Uani 1 1 d .
C25 C 0.5329(5) 0.4798(4) 0.7362(3) 0.0483(11) Uani 1 1 d .
H25A H 0.4620 0.5352 0.7550 0.058 Uiso 1 1 calc R
H25B H 0.4789 0.4054 0.7101 0.058 Uiso 1 1 calc R
C26 C 0.6489(5) 0.6070(4) 0.6374(3) 0.0427(10) Uani 1 1 d .
H26 H 0.6062 0.6650 0.6875 0.051 Uiso 1 1 calc R
C27 C 0.6254(5) 0.4997(3) 0.6460(3) 0.0409(10) Uani 1 1 d .
C28 C 0.6898(6) 0.4144(4) 0.5711(4) 0.0559(12) Uani 1 1 d .
H28 H 0.6769 0.3406 0.5741 0.067 Uiso 1 1 calc R
C29 C 0.7730(6) 0.4396(4) 0.4923(4) 0.0608(13) Uani 1 1 d .
H29 H 0.8161 0.3829 0.4411 0.073 Uiso 1 1 calc R
C30 C 0.7924(5) 0.5492(4) 0.4896(3) 0.0491(11) Uani 1 1 d .
H30 H 0.8504 0.5658 0.4368 0.059 Uiso 1 1 calc R
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'
Cl Cl 0.1484 0.1585 '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 N2 110.74(12) 2_777 .
O4 Zn1 N4 112.38(12) 2_777 .
N2 Zn1 N4 109.83(13) . .
O4 Zn1 Cl1 109.22(8) 2_777 .
N2 Zn1 Cl1 105.77(9) . .
N4 Zn1 Cl1 108.66(10) . .
C9 O4 Zn1 112.2(2) . 2_777
C24 O7 H7 109.5 . .
C2 N1 C1 112.4(3) . .
C2 N1 C10 123.4(3) . .
C1 N1 C10 123.4(3) . .
C11 N2 C15 117.6(4) . .
C11 N2 Zn1 121.6(3) . .
C15 N2 Zn1 120.5(3) . .
C16 N3 C17 111.5(3) . .
C16 N3 C25 124.2(3) . .
C17 N3 C25 124.2(3) . .
C30 N4 C26 118.1(4) . .
C30 N4 Zn1 122.2(3) . .
C26 N4 Zn1 119.7(3) . .
O1 C1 N1 124.9(4) . .
O1 C1 C8 129.3(4) . .
N1 C1 C8 105.8(3) . .
O2 C2 N1 125.4(4) . .
O2 C2 C3 129.0(4) . .
N1 C2 C3 105.6(3) . .
C4 C3 C8 122.0(3) . .
C4 C3 C2 129.6(4) . .
C8 C3 C2 108.3(3) . .
C3 C4 C5 117.2(4) . .
C3 C4 H4 121.4 . .
C5 C4 H4 121.4 . .
C4 C5 C6 120.6(3) . .
C4 C5 C9 119.2(3) . .
C6 C5 C9 120.2(3) . .
C7 C6 C5 121.6(4) . .
C7 C6 H6 119.2 . .
C5 C6 H6 119.2 . .
C8 C7 C6 116.7(4) . .
C8 C7 H7A 121.6 . .
C6 C7 H7A 121.6 . .
C7 C8 C3 121.8(3) . .
C7 C8 C1 130.3(4) . .
C3 C8 C1 107.9(3) . .
O3 C9 O4 123.8(4) . .
O3 C9 C5 120.1(3) . .
O4 C9 C5 116.1(4) . .
N1 C10 C12 115.0(3) . .
N1 C10 H10A 108.5 . .
C12 C10 H10A 108.5 . .
N1 C10 H10B 108.5 . .
C12 C10 H10B 108.5 . .
H10A C10 H10B 107.5 . .
N2 C11 C12 123.8(4) . .
N2 C11 H11 118.1 . .
C12 C11 H11 118.1 . .
C11 C12 C13 117.3(4) . .
C11 C12 C10 123.2(3) . .
C13 C12 C10 119.4(4) . .
C14 C13 C12 119.7(4) . .
C14 C13 H13 120.1 . .
C12 C13 H13 120.1 . .
C15 C14 C13 119.3(4) . .
C15 C14 H14 120.4 . .
C13 C14 H14 120.4 . .
N2 C15 C14 122.2(4) . .
N2 C15 H15 118.9 . .
C14 C15 H15 118.9 . .
O5 C16 N3 124.5(4) . .
O5 C16 C23 128.8(4) . .
N3 C16 C23 106.7(3) . .
O6 C17 N3 124.8(4) . .
O6 C17 C18 129.7(4) . .
N3 C17 C18 105.5(4) . .
C19 C18 C23 121.2(4) . .
C19 C18 C17 129.8(4) . .
C23 C18 C17 109.0(4) . .
C18 C19 C20 117.7(4) . .
C18 C19 H19 121.2 . .
C20 C19 H19 121.2 . .
C19 C20 C21 121.0(4) . .
C19 C20 C24 120.6(4) . .
C21 C20 C24 118.3(4) . .
C22 C21 C20 121.3(4) . .
C22 C21 H21 119.4 . .
C20 C21 H21 119.4 . .
C23 C22 C21 117.5(4) . .
C23 C22 H22 121.2 . .
C21 C22 H22 121.2 . .
C22 C23 C18 121.3(4) . .
C22 C23 C16 131.3(4) . .
C18 C23 C16 107.4(4) . .
O8 C24 O7 123.5(4) . .
O8 C24 C20 124.2(4) . .
O7 C24 C20 112.3(4) . .
N3 C25 C27 112.9(4) . .
N3 C25 H25A 109.0 . .
C27 C25 H25A 109.0 . .
N3 C25 H25B 109.0 . .
C27 C25 H25B 109.0 . .
H25A C25 H25B 107.8 . .
N4 C26 C27 123.6(4) . .
N4 C26 H26 118.2 . .
C27 C26 H26 118.2 . .
C26 C27 C28 117.6(4) . .
C26 C27 C25 119.4(4) . .
C28 C27 C25 123.0(4) . .
C29 C28 C27 119.4(4) . .
C29 C28 H28 120.3 . .
C27 C28 H28 120.3 . .
C28 C29 C30 119.7(4) . .
C28 C29 H29 120.2 . .
C30 C29 H29 120.2 . .
N4 C30 C29 121.8(4) . .
N4 C30 H30 119.1 . .
C29 C30 H30 119.1 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 O4 1.969(3) 2_777
Zn1 N2 2.029(3) .
Zn1 N4 2.036(3) .
Zn1 Cl1 2.2248(11) .
O1 C1 1.202(5) .
O2 C2 1.205(5) .
O3 C9 1.227(5) .
O4 C9 1.269(4) .
O4 Zn1 1.969(3) 2_777
O5 C16 1.205(5) .
O6 C17 1.196(5) .
O7 C24 1.313(5) .
O7 H7 0.8200 .
O8 C24 1.196(5) .
N1 C2 1.391(5) .
N1 C1 1.396(5) .
N1 C10 1.466(5) .
N2 C11 1.339(5) .
N2 C15 1.343(5) .
N3 C16 1.384(5) .
N3 C17 1.405(5) .
N3 C25 1.460(5) .
N4 C30 1.338(5) .
N4 C26 1.341(5) .
C1 C8 1.498(5) .
C2 C3 1.499(5) .
C3 C4 1.375(5) .
C3 C8 1.384(5) .
C4 C5 1.394(5) .
C4 H4 0.9300 .
C5 C6 1.397(5) .
C5 C9 1.515(5) .
C6 C7 1.393(5) .
C6 H6 0.9300 .
C7 C8 1.377(5) .
C7 H7A 0.9300 .
C10 C12 1.501(5) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 C12 1.363(5) .
C11 H11 0.9300 .
C12 C13 1.388(5) .
C13 C14 1.366(6) .
C13 H13 0.9300 .
C14 C15 1.364(6) .
C14 H14 0.9300 .
C15 H15 0.9300 .
C16 C23 1.486(6) .
C17 C18 1.478(6) .
C18 C19 1.377(5) .
C18 C23 1.381(5) .
C19 C20 1.377(5) .
C19 H19 0.9300 .
C20 C21 1.382(6) .
C20 C24 1.494(6) .
C21 C22 1.379(6) .
C21 H21 0.9300 .
C22 C23 1.374(6) .
C22 H22 0.9300 .
C25 C27 1.516(6) .
C25 H25A 0.9700 .
C25 H25B 0.9700 .
C26 C27 1.375(5) .
C26 H26 0.9300 .
C27 C28 1.383(6) .
C28 C29 1.372(6) .
C28 H28 0.9300 .
C29 C30 1.374(6) .
C29 H29 0.9300 .
C30 H30 0.9300 .
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 N2 C11 47.2(3) 2_777
N4 Zn1 N2 C11 -77.5(3) .
Cl1 Zn1 N2 C11 165.4(3) .
O4 Zn1 N2 C15 -126.5(3) 2_777
N4 Zn1 N2 C15 108.7(3) .
Cl1 Zn1 N2 C15 -8.3(3) .
O4 Zn1 N4 C30 -159.6(3) 2_777
N2 Zn1 N4 C30 -35.8(4) .
Cl1 Zn1 N4 C30 79.4(3) .
O4 Zn1 N4 C26 21.0(3) 2_777
N2 Zn1 N4 C26 144.7(3) .
Cl1 Zn1 N4 C26 -100.0(3) .
C2 N1 C1 O1 176.3(4) .
C10 N1 C1 O1 -14.0(7) .
C2 N1 C1 C8 -2.9(5) .
C10 N1 C1 C8 166.7(4) .
C1 N1 C2 O2 -179.5(5) .
C10 N1 C2 O2 10.8(7) .
C1 N1 C2 C3 1.5(5) .
C10 N1 C2 C3 -168.1(4) .
O2 C2 C3 C4 -1.9(8) .
N1 C2 C3 C4 177.0(4) .
O2 C2 C3 C8 -178.3(5) .
N1 C2 C3 C8 0.6(5) .
C8 C3 C4 C5 1.9(6) .
C2 C3 C4 C5 -174.1(4) .
C3 C4 C5 C6 -1.1(6) .
C3 C4 C5 C9 178.7(4) .
C4 C5 C6 C7 -0.4(7) .
C9 C5 C6 C7 179.7(4) .
C5 C6 C7 C8 1.2(6) .
C6 C7 C8 C3 -0.4(6) .
C6 C7 C8 C1 176.9(4) .
C4 C3 C8 C7 -1.2(7) .
C2 C3 C8 C7 175.6(4) .
C4 C3 C8 C1 -179.1(4) .
C2 C3 C8 C1 -2.3(5) .
O1 C1 C8 C7 6.4(8) .
N1 C1 C8 C7 -174.5(4) .
O1 C1 C8 C3 -176.0(5) .
N1 C1 C8 C3 3.2(5) .
Zn1 O4 C9 O3 -4.9(5) 2_777
Zn1 O4 C9 C5 173.7(3) 2_777
C4 C5 C9 O3 17.6(6) .
C6 C5 C9 O3 -162.6(4) .
C4 C5 C9 O4 -161.1(4) .
C6 C5 C9 O4 18.8(6) .
C2 N1 C10 C12 -78.8(5) .
C1 N1 C10 C12 112.7(4) .
C15 N2 C11 C12 0.7(6) .
Zn1 N2 C11 C12 -173.2(3) .
N2 C11 C12 C13 -1.2(6) .
N2 C11 C12 C10 176.8(4) .
N1 C10 C12 C11 -8.1(6) .
N1 C10 C12 C13 169.8(4) .
C11 C12 C13 C14 0.0(6) .
C10 C12 C13 C14 -178.0(4) .
C12 C13 C14 C15 1.5(6) .
C11 N2 C15 C14 1.0(6) .
Zn1 N2 C15 C14 175.0(3) .
C13 C14 C15 N2 -2.1(6) .
C17 N3 C16 O5 -179.5(5) .
C25 N3 C16 O5 -2.6(7) .
C17 N3 C16 C23 0.7(5) .
C25 N3 C16 C23 177.6(4) .
C16 N3 C17 O6 178.2(5) .
C25 N3 C17 O6 1.3(8) .
C16 N3 C17 C18 -0.8(5) .
C25 N3 C17 C18 -177.7(4) .
O6 C17 C18 C19 0.2(9) .
N3 C17 C18 C19 179.1(4) .
O6 C17 C18 C23 -178.4(5) .
N3 C17 C18 C23 0.6(5) .
C23 C18 C19 C20 0.8(7) .
C17 C18 C19 C20 -177.6(4) .
C18 C19 C20 C21 -1.3(7) .
C18 C19 C20 C24 177.3(4) .
C19 C20 C21 C22 0.8(8) .
C24 C20 C21 C22 -177.8(5) .
C20 C21 C22 C23 0.2(8) .
C21 C22 C23 C18 -0.7(7) .
C21 C22 C23 C16 178.1(5) .
C19 C18 C23 C22 0.2(7) .
C17 C18 C23 C22 178.9(4) .
C19 C18 C23 C16 -178.8(4) .
C17 C18 C23 C16 -0.2(5) .
O5 C16 C23 C22 0.9(9) .
N3 C16 C23 C22 -179.3(5) .
O5 C16 C23 C18 179.9(5) .
N3 C16 C23 C18 -0.3(5) .
C19 C20 C24 O8 -170.8(5) .
C21 C20 C24 O8 7.8(8) .
C19 C20 C24 O7 7.5(6) .
C21 C20 C24 O7 -173.9(4) .
C16 N3 C25 C27 99.6(5) .
C17 N3 C25 C27 -83.8(5) .
C30 N4 C26 C27 -0.6(6) .
Zn1 N4 C26 C27 178.9(3) .
N4 C26 C27 C28 0.1(6) .
N4 C26 C27 C25 179.5(4) .
N3 C25 C27 C26 -92.6(5) .
N3 C25 C27 C28 86.7(5) .
C26 C27 C28 C29 -0.1(7) .
C25 C27 C28 C29 -179.5(4) .
C27 C28 C29 C30 0.6(7) .
C26 N4 C30 C29 1.1(6) .
Zn1 N4 C30 C29 -178.3(3) .
C28 C29 C30 N4 -1.2(8) .
