#------------------------------------------------------------------------------
#$Date: 2017-07-11 14:10:40 +0200 (Tue 11 de Jul de 2017) $
#$Revision: 198633 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/20/7052068.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_7052068
loop_
_publ_author_name
'Yohan D. M. Champouret'
'Jean-Didier Maréchal'
'Rajinder K. Chaggar'
'John Fawcett'
'Kuldip Singh'
'Feliu Maseras'
'Gregory A. Solan'
_publ_section_title
;
 Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe,
 Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene
 oligomerisation studies
;
_journal_issue                   1
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              75
_journal_paper_doi               10.1039/b610562a
_journal_volume                  31
_journal_year                    2007
_chemical_formula_sum            'C29 H30 Cl2 N4 Zn'
_chemical_formula_weight         570.84
_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                94.301(3)
_cell_angle_beta                 101.922(3)
_cell_angle_gamma                96.325(3)
_cell_formula_units_Z            2
_cell_length_a                   10.2739(19)
_cell_length_b                   10.5553(19)
_cell_length_c                   12.623(2)
_cell_measurement_reflns_used    789
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      24.184
_cell_measurement_theta_min      2.335
_cell_volume                     1324.5(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_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  0.0362
_diffrn_reflns_av_sigmaI/netI    0.0577
_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       -15
_diffrn_reflns_number            10435
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         1.66
_exptl_absorpt_coefficient_mu    1.155
_exptl_absorpt_correction_T_max  0.862
_exptl_absorpt_correction_T_min  0.595
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
;
absorption correction based on 5541 reflections(SADABS);Rint 0.0430 before
correction and 0.0320 after.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.431
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             592
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.13
_refine_diff_density_max         0.666
_refine_diff_density_min         -0.281
_refine_diff_density_rms         0.074
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.003
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     330
_refine_ls_number_reflns         5134
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.003
_refine_ls_R_factor_all          0.0567
_refine_ls_R_factor_gt           0.0440
_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)+(0.0499P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1004
_refine_ls_wR_factor_ref         0.1055
_reflns_number_gt                4106
_reflns_number_total             5134
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b610562a.txt
_cod_data_source_block           06003
_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 

The following automatic conversions were performed:

'_refine_ls_hydrogen_treatment' value 'constrained' was replaced with
the value 'constr' as specified in the replacement file
'src/cod-tools/trunk/data/replacement-values/replacement_values.lst'.

Automatic conversion script
Id: cif_fix_values 5376 2017-05-30 11:51:03Z andrius 
;
_cod_original_cell_volume        1324.4(4)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7052068
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
N1 N 0.7519(3) 0.9442(2) 0.5475(2) 0.0347(6) Uani 1 1 d . . .
N2 N 0.5462(2) 0.7685(2) 0.52198(18) 0.0297(5) Uani 1 1 d . . .
N3 N 0.5701(2) 0.6272(2) 0.69226(18) 0.0272(5) Uani 1 1 d . . .
N4 N 0.6639(2) 0.5844(2) 0.96969(19) 0.0337(6) Uani 1 1 d . . .
Cl1 Cl 0.87651(7) 0.68564(7) 0.60953(6) 0.03588(19) Uani 1 1 d . . .
Cl2 Cl 0.71219(9) 0.92535(7) 0.79725(6) 0.0467(2) Uani 1 1 d . . .
Zn1 Zn 0.71122(3) 0.79279(3) 0.65066(3) 0.03105(12) Uani 1 1 d . . .
C1 C 0.8610(3) 1.0297(3) 0.5678(3) 0.0412(8) Uani 1 1 d . . .
H1 H 0.9278 1.0260 0.6315 0.049 Uiso 1 1 calc R . .
C2 C 0.8819(4) 1.1242(3) 0.5002(3) 0.0454(8) Uani 1 1 d . . .
H2 H 0.9614 1.1837 0.5165 0.054 Uiso 1 1 calc R . .
C3 C 0.7834(4) 1.1284(3) 0.4089(3) 0.0486(9) Uani 1 1 d . . .
H3 H 0.7941 1.1922 0.3610 0.058 Uiso 1 1 calc R . .
C4 C 0.6701(4) 1.0411(3) 0.3867(3) 0.0431(8) Uani 1 1 d . . .
H4 H 0.6016 1.0439 0.3238 0.052 Uiso 1 1 calc R . .
C5 C 0.6567(3) 0.9479(3) 0.4579(2) 0.0344(7) Uani 1 1 d . . .
C6 C 0.5418(3) 0.8464(3) 0.4423(2) 0.0326(7) Uani 1 1 d . . .
C7 C 0.4347(3) 0.8302(3) 0.3531(2) 0.0413(8) Uani 1 1 d . . .
H7 H 0.4304 0.8872 0.2980 0.050 Uiso 1 1 calc R . .
C8 C 0.3346(3) 0.7294(3) 0.3462(2) 0.0426(8) Uani 1 1 d . . .
H8 H 0.2612 0.7159 0.2852 0.051 Uiso 1 1 calc R . .
C9 C 0.3402(3) 0.6486(3) 0.4269(2) 0.0375(7) Uani 1 1 d . . .
H9 H 0.2720 0.5786 0.4220 0.045 Uiso 1 1 calc R . .
C10 C 0.4488(3) 0.6717(3) 0.5164(2) 0.0306(7) Uani 1 1 d . . .
C11 C 0.4606(3) 0.5951(3) 0.6109(2) 0.0301(6) Uani 1 1 d . . .
C12 C 0.3614(3) 0.4962(3) 0.6145(2) 0.0358(7) Uani 1 1 d . . .
H12 H 0.2868 0.4742 0.5550 0.043 Uiso 1 1 calc R . .
C13 C 0.3725(3) 0.4307(3) 0.7049(3) 0.0385(7) Uani 1 1 d . . .
H13 H 0.3068 0.3612 0.7083 0.046 Uiso 1 1 calc R . .
C14 C 0.4795(3) 0.4668(3) 0.7906(2) 0.0345(7) Uani 1 1 d . . .
H14 H 0.4867 0.4247 0.8551 0.041 Uiso 1 1 calc R . .
C15 C 0.5769(3) 0.5650(3) 0.7826(2) 0.0298(6) Uani 1 1 d . . .
C16 C 0.6946(3) 0.5955(3) 0.8772(2) 0.0311(7) Uani 1 1 d . . .
C17 C 0.8309(3) 0.6186(3) 0.8584(2) 0.0402(8) Uani 1 1 d . . .
H17A H 0.8521 0.7093 0.8488 0.060 Uiso 1 1 calc R . .
H17B H 0.8368 0.5658 0.7927 0.060 Uiso 1 1 calc R . .
H17C H 0.8949 0.5961 0.9209 0.060 Uiso 1 1 calc R . .
C18 C 0.7675(3) 0.5924(3) 1.0661(2) 0.0353(7) Uani 1 1 d . . .
C19 C 0.8321(3) 0.7115(3) 1.1183(3) 0.0398(8) Uani 1 1 d . . .
C20 C 0.9276(3) 0.7116(3) 1.2143(3) 0.0466(8) Uani 1 1 d . . .
H20 H 0.9743 0.7908 1.2506 0.056 Uiso 1 1 calc R . .
C21 C 0.9559(3) 0.5990(3) 1.2577(3) 0.0457(8) Uani 1 1 d . . .
H21 H 1.0226 0.6015 1.3227 0.055 Uiso 1 1 calc R . .
C22 C 0.8879(3) 0.4827(3) 1.2073(3) 0.0429(8) Uani 1 1 d . . .
H22 H 0.9072 0.4060 1.2387 0.051 Uiso 1 1 calc R . .
C23 C 0.7924(3) 0.4768(3) 1.1119(2) 0.0383(7) Uani 1 1 d . . .
C24 C 0.7135(4) 0.3501(3) 1.0568(3) 0.0456(9) Uani 1 1 d . . .
H24 H 0.6232 0.3694 1.0194 0.055 Uiso 1 1 calc R . .
C25 C 0.7773(5) 0.2910(3) 0.9687(3) 0.0613(11) Uani 1 1 d . . .
H25A H 0.7856 0.3522 0.9150 0.092 Uiso 1 1 calc R . .
H25B H 0.7206 0.2125 0.9325 0.092 Uiso 1 1 calc R . .
H25C H 0.8664 0.2705 1.0020 0.092 Uiso 1 1 calc R . .
C26 C 0.6898(4) 0.2530(3) 1.1360(3) 0.0558(10) Uani 1 1 d . . .
H26A H 0.6201 0.1838 1.0989 0.084 Uiso 1 1 calc R . .
H26B H 0.6607 0.2952 1.1974 0.084 Uiso 1 1 calc R . .
H26C H 0.7732 0.2174 1.1629 0.084 Uiso 1 1 calc R . .
C27 C 0.7926(4) 0.8354(3) 1.0743(3) 0.0471(9) Uani 1 1 d . . .
H27 H 0.7790 0.8221 0.9933 0.057 Uiso 1 1 calc R . .
C28 C 0.6586(4) 0.8611(4) 1.0998(4) 0.0692(12) Uani 1 1 d . . .
H28A H 0.6672 0.8715 1.1789 0.104 Uiso 1 1 calc R . .
H28B H 0.5899 0.7889 1.0678 0.104 Uiso 1 1 calc R . .
H28C H 0.6326 0.9396 1.0692 0.104 Uiso 1 1 calc R . .
C29 C 0.8963(4) 0.9509(4) 1.1127(3) 0.0692(12) Uani 1 1 d . . .
H29A H 0.8995 0.9773 1.1894 0.104 Uiso 1 1 calc R . .
H29B H 0.8724 1.0212 1.0690 0.104 Uiso 1 1 calc R . .
H29C H 0.9843 0.9294 1.1046 0.104 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'
Cl Cl 0.1484 0.1585 '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
C1 N1 C5 119.2(3) . . ?
C1 N1 Zn1 125.2(2) . . ?
C5 N1 Zn1 115.7(2) . . ?
C10 N2 C6 120.9(2) . . ?
C10 N2 Zn1 119.63(18) . . ?
C6 N2 Zn1 119.4(2) . . ?
C11 N3 C15 117.7(2) . . ?
C11 N3 Zn1 110.82(18) . . ?
C15 N3 Zn1 131.43(18) . . ?
C16 N4 C18 120.0(3) . . ?
N2 Zn1 N1 75.18(9) . . ?
N2 Zn1 Cl2 119.32(7) . . ?
N1 Zn1 Cl2 95.59(7) . . ?
N2 Zn1 Cl1 110.85(7) . . ?
N1 Zn1 Cl1 92.49(7) . . ?
Cl2 Zn1 Cl1 129.60(3) . . ?
N2 Zn1 N3 75.69(9) . . ?
N1 Zn1 N3 150.70(9) . . ?
Cl2 Zn1 N3 95.82(6) . . ?
Cl1 Zn1 N3 100.75(6) . . ?
N1 C1 C2 123.1(3) . . ?
N1 C1 H1 118.5 . . ?
C2 C1 H1 118.5 . . ?
C3 C2 C1 117.6(3) . . ?
C3 C2 H2 121.2 . . ?
C1 C2 H2 121.2 . . ?
C4 C3 C2 120.3(3) . . ?
C4 C3 H3 119.9 . . ?
C2 C3 H3 119.9 . . ?
C3 C4 C5 118.9(3) . . ?
C3 C4 H4 120.5 . . ?
C5 C4 H4 120.5 . . ?
N1 C5 C4 121.0(3) . . ?
N1 C5 C6 114.5(3) . . ?
C4 C5 C6 124.5(3) . . ?
N2 C6 C7 120.9(3) . . ?
N2 C6 C5 115.2(3) . . ?
C7 C6 C5 123.8(3) . . ?
C8 C7 C6 118.5(3) . . ?
C8 C7 H7 120.8 . . ?
C6 C7 H7 120.8 . . ?
C9 C8 C7 120.6(3) . . ?
C9 C8 H8 119.7 . . ?
C7 C8 H8 119.7 . . ?
C8 C9 C10 118.5(3) . . ?
C8 C9 H9 120.8 . . ?
C10 C9 H9 120.8 . . ?
N2 C10 C9 120.7(3) . . ?
N2 C10 C11 116.4(2) . . ?
C9 C10 C11 122.9(3) . . ?
N3 C11 C12 122.4(3) . . ?
N3 C11 C10 117.1(3) . . ?
C12 C11 C10 120.5(3) . . ?
C13 C12 C11 119.1(3) . . ?
C13 C12 H12 120.5 . . ?
C11 C12 H12 120.5 . . ?
C14 C13 C12 119.2(3) . . ?
C14 C13 H13 120.4 . . ?
C12 C13 H13 120.4 . . ?
C13 C14 C15 119.6(3) . . ?
C13 C14 H14 120.2 . . ?
C15 C14 H14 120.2 . . ?
N3 C15 C14 122.0(3) . . ?
N3 C15 C16 121.1(2) . . ?
C14 C15 C16 116.8(3) . . ?
N4 C16 C17 125.8(3) . . ?
N4 C16 C15 113.6(3) . . ?
C17 C16 C15 120.1(3) . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C19 C18 C23 121.5(3) . . ?
C19 C18 N4 120.9(3) . . ?
C23 C18 N4 117.3(3) . . ?
C20 C19 C18 117.5(3) . . ?
C20 C19 C27 121.8(3) . . ?
C18 C19 C27 120.7(3) . . ?
C21 C20 C19 121.4(3) . . ?
C21 C20 H20 119.3 . . ?
C19 C20 H20 119.3 . . ?
C20 C21 C22 120.4(3) . . ?
C20 C21 H21 119.8 . . ?
C22 C21 H21 119.8 . . ?
C23 C22 C21 120.7(3) . . ?
C23 C22 H22 119.6 . . ?
C21 C22 H22 119.6 . . ?
C22 C23 C18 118.4(3) . . ?
C22 C23 C24 121.6(3) . . ?
C18 C23 C24 120.1(3) . . ?
C26 C24 C23 113.6(3) . . ?
C26 C24 C25 110.3(3) . . ?
C23 C24 C25 112.2(3) . . ?
C26 C24 H24 106.8 . . ?
C23 C24 H24 106.8 . . ?
C25 C24 H24 106.8 . . ?
C24 C25 H25A 109.5 . . ?
C24 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C24 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C24 C26 H26A 109.5 . . ?
C24 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C24 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C29 C27 C19 114.8(3) . . ?
C29 C27 C28 110.3(3) . . ?
C19 C27 C28 110.0(3) . . ?
C29 C27 H27 107.1 . . ?
C19 C27 H27 107.1 . . ?
C28 C27 H27 107.1 . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
C27 C29 H29A 109.5 . . ?
C27 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C27 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
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
N1 C1 1.327(4) . ?
N1 C5 1.341(4) . ?
N1 Zn1 2.193(2) . ?
N2 C10 1.336(4) . ?
N2 C6 1.343(3) . ?
N2 Zn1 2.069(2) . ?
N3 C11 1.350(3) . ?
N3 C15 1.351(3) . ?
N3 Zn1 2.308(2) . ?
N4 C16 1.281(4) . ?
N4 C18 1.432(4) . ?
Cl1 Zn1 2.2654(9) . ?
Cl2 Zn1 2.2322(9) . ?
C1 C2 1.387(4) . ?
C1 H1 0.9500 . ?
C2 C3 1.375(5) . ?
C2 H2 0.9500 . ?
C3 C4 1.369(5) . ?
C3 H3 0.9500 . ?
C4 C5 1.395(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.474(4) . ?
C6 C7 1.388(4) . ?
C7 C8 1.381(5) . ?
C7 H7 0.9500 . ?
C8 C9 1.373(4) . ?
C8 H8 0.9500 . ?
C9 C10 1.400(4) . ?
C9 H9 0.9500 . ?
C10 C11 1.482(4) . ?
C11 C12 1.386(4) . ?
C12 C13 1.370(4) . ?
C12 H12 0.9500 . ?
C13 C14 1.370(4) . ?
C13 H13 0.9500 . ?
C14 C15 1.384(4) . ?
C14 H14 0.9500 . ?
C15 C16 1.501(4) . ?
C16 C17 1.465(4) . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 C19 1.402(4) . ?
C18 C23 1.415(4) . ?
C19 C20 1.392(4) . ?
C19 C27 1.522(4) . ?
C20 C21 1.380(5) . ?
C20 H20 0.9500 . ?
C21 C22 1.382(4) . ?
C21 H21 0.9500 . ?
C22 C23 1.380(4) . ?
C22 H22 0.9500 . ?
C23 C24 1.523(4) . ?
C24 C26 1.519(4) . ?
C24 C25 1.530(5) . ?
C24 H24 1.0000 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 C29 1.506(5) . ?
C27 C28 1.525(5) . ?
C27 H27 1.0000 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
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
C10 N2 Zn1 N1 177.8(2) . . . . ?
C6 N2 Zn1 N1 1.2(2) . . . . ?
C10 N2 Zn1 Cl2 -94.0(2) . . . . ?
C6 N2 Zn1 Cl2 89.3(2) . . . . ?
C10 N2 Zn1 Cl1 90.9(2) . . . . ?
C6 N2 Zn1 Cl1 -85.8(2) . . . . ?
C10 N2 Zn1 N3 -5.4(2) . . . . ?
C6 N2 Zn1 N3 178.0(2) . . . . ?
C1 N1 Zn1 N2 -179.8(3) . . . . ?
C5 N1 Zn1 N2 0.4(2) . . . . ?
C1 N1 Zn1 Cl2 61.3(2) . . . . ?
C5 N1 Zn1 Cl2 -118.5(2) . . . . ?
C1 N1 Zn1 Cl1 -68.9(2) . . . . ?
C5 N1 Zn1 Cl1 111.3(2) . . . . ?
C1 N1 Zn1 N3 173.8(2) . . . . ?
C5 N1 Zn1 N3 -6.0(3) . . . . ?
C11 N3 Zn1 N2 4.01(18) . . . . ?
C15 N3 Zn1 N2 -172.7(3) . . . . ?
C11 N3 Zn1 N1 10.4(3) . . . . ?
C15 N3 Zn1 N1 -166.4(2) . . . . ?
C11 N3 Zn1 Cl2 122.82(17) . . . . ?
C15 N3 Zn1 Cl2 -53.9(2) . . . . ?
C11 N3 Zn1 Cl1 -104.99(17) . . . . ?
C15 N3 Zn1 Cl1 78.3(2) . . . . ?
C5 N1 C1 C2 0.1(5) . . . . ?
Zn1 N1 C1 C2 -179.7(2) . . . . ?
N1 C1 C2 C3 0.5(5) . . . . ?
C1 C2 C3 C4 -0.4(5) . . . . ?
C2 C3 C4 C5 -0.2(5) . . . . ?
C1 N1 C5 C4 -0.8(4) . . . . ?
Zn1 N1 C5 C4 179.0(2) . . . . ?
C1 N1 C5 C6 178.5(3) . . . . ?
Zn1 N1 C5 C6 -1.7(3) . . . . ?
C3 C4 C5 N1 0.9(5) . . . . ?
C3 C4 C5 C6 -178.4(3) . . . . ?
C10 N2 C6 C7 1.3(4) . . . . ?
Zn1 N2 C6 C7 177.9(2) . . . . ?
C10 N2 C6 C5 -179.1(2) . . . . ?
Zn1 N2 C6 C5 -2.5(3) . . . . ?
N1 C5 C6 N2 2.7(4) . . . . ?
C4 C5 C6 N2 -178.0(3) . . . . ?
N1 C5 C6 C7 -177.7(3) . . . . ?
C4 C5 C6 C7 1.5(5) . . . . ?
N2 C6 C7 C8 -2.1(4) . . . . ?
C5 C6 C7 C8 178.3(3) . . . . ?
C6 C7 C8 C9 1.1(5) . . . . ?
C7 C8 C9 C10 0.7(5) . . . . ?
C6 N2 C10 C9 0.5(4) . . . . ?
Zn1 N2 C10 C9 -176.1(2) . . . . ?
C6 N2 C10 C11 -177.5(2) . . . . ?
Zn1 N2 C10 C11 5.9(3) . . . . ?
C8 C9 C10 N2 -1.5(4) . . . . ?
C8 C9 C10 C11 176.4(3) . . . . ?
C15 N3 C11 C12 -4.2(4) . . . . ?
Zn1 N3 C11 C12 178.5(2) . . . . ?
C15 N3 C11 C10 174.8(2) . . . . ?
Zn1 N3 C11 C10 -2.4(3) . . . . ?
N2 C10 C11 N3 -1.8(4) . . . . ?
C9 C10 C11 N3 -179.8(3) . . . . ?
N2 C10 C11 C12 177.2(3) . . . . ?
C9 C10 C11 C12 -0.7(4) . . . . ?
N3 C11 C12 C13 1.8(4) . . . . ?
C10 C11 C12 C13 -177.2(3) . . . . ?
C11 C12 C13 C14 1.7(5) . . . . ?
C12 C13 C14 C15 -2.6(5) . . . . ?
C11 N3 C15 C14 3.3(4) . . . . ?
Zn1 N3 C15 C14 179.9(2) . . . . ?
C11 N3 C15 C16 -179.6(2) . . . . ?
Zn1 N3 C15 C16 -3.0(4) . . . . ?
C13 C14 C15 N3 0.1(4) . . . . ?
C13 C14 C15 C16 -177.2(3) . . . . ?
C18 N4 C16 C17 -1.1(5) . . . . ?
C18 N4 C16 C15 171.1(2) . . . . ?
N3 C15 C16 N4 146.3(3) . . . . ?
C14 C15 C16 N4 -36.4(4) . . . . ?
N3 C15 C16 C17 -41.0(4) . . . . ?
C14 C15 C16 C17 136.3(3) . . . . ?
C16 N4 C18 C19 80.7(4) . . . . ?
C16 N4 C18 C23 -105.4(3) . . . . ?
C23 C18 C19 C20 3.5(5) . . . . ?
N4 C18 C19 C20 177.3(3) . . . . ?
C23 C18 C19 C27 -173.1(3) . . . . ?
N4 C18 C19 C27 0.6(5) . . . . ?
C18 C19 C20 C21 -1.3(5) . . . . ?
C27 C19 C20 C21 175.3(3) . . . . ?
C19 C20 C21 C22 -1.0(5) . . . . ?
C20 C21 C22 C23 1.1(5) . . . . ?
C21 C22 C23 C18 1.1(5) . . . . ?
C21 C22 C23 C24 -178.2(3) . . . . ?
C19 C18 C23 C22 -3.5(5) . . . . ?
N4 C18 C23 C22 -177.4(3) . . . . ?
C19 C18 C23 C24 175.8(3) . . . . ?
N4 C18 C23 C24 1.9(4) . . . . ?
C22 C23 C24 C26 31.4(4) . . . . ?
C18 C23 C24 C26 -147.9(3) . . . . ?
C22 C23 C24 C25 -94.5(4) . . . . ?
C18 C23 C24 C25 86.2(4) . . . . ?
C20 C19 C27 C29 23.1(5) . . . . ?
C18 C19 C27 C29 -160.4(3) . . . . ?
C20 C19 C27 C28 -102.0(4) . . . . ?
C18 C19 C27 C28 74.5(4) . . . . ?
