#------------------------------------------------------------------------------
#$Date: 2016-03-22 23:13:32 +0200 (Tue, 22 Mar 2016) $
#$Revision: 179051 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/13/4301318.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_4301318
loop_
_publ_author_name
'Leire San Felices'
'Eduardo C. Escudero-Adán'
'Jordi Benet-Buchholz'
'Arjan W. Kleij'
_publ_contact_author
;
    Dr. Benet-Buchholz, Jordi
    Institute of Chemical Research of Catalonia (ICIQ)    
    X-ray Diffraction Unit
    Avgda. Paīsos Catalans 16
    E-43007 Tarragona, Spain
;
_publ_contact_author_email       jbenet@iciq.es
_publ_contact_author_fax         '+34 977 920 224'
_publ_contact_author_phone       '+34 977 920 204'
_publ_section_title
;
Isolation and Structural Characterization of a Binuclear Intermediate
Species Pertinent to Transmetalation of Zn(salphen) Complexes and the
Formation of Polynuclear Salen Structures
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              846
_journal_page_last               853
_journal_paper_doi               10.1021/ic8018265
_journal_volume                  48
_journal_year                    2009
_chemical_formula_sum            'C26 H26 Cl6 N2 Ni O5'
_chemical_formula_weight         717.90
_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                90.7480(10)
_cell_angle_beta                 95.5330(10)
_cell_angle_gamma                107.2580(10)
_cell_formula_units_Z            2
_cell_length_a                   9.2322(2)
_cell_length_b                   11.6101(3)
_cell_length_c                   14.4864(4)
_cell_measurement_reflns_used    7204
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      39.18
_cell_measurement_theta_min      2.59
_cell_volume                     1474.52(6)
_computing_cell_refinement       'Bruker-Nonius Apex v1.0-22 2002'
_computing_data_collection       'Bruker-Nonius Apex v1.0-22 2002'
_computing_data_reduction        'SAINT+ Version 7.06A Bruker-Nonius, 2004'
_computing_molecular_graphics    'Shelxtl Version 6.12 (Sheldrick, 2001)'
_computing_publication_material  'Shelxtl Version 6.12 (Sheldrick, 2001)'
_computing_structure_refinement  'Shelxtl Version 6.12 (Sheldrick, 2001)'
_computing_structure_solution    'Shelxtl Version 6.12 (Sheldrick, 2001)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 512
_diffrn_detector_type            '4K CCD area detector APEX II'
_diffrn_measured_fraction_theta_full 0.882
_diffrn_measured_fraction_theta_max 0.882
_diffrn_measurement_device_type  'Kappa 4-axis goniometer bruker-nonius'
_diffrn_measurement_method
;
 Fullsphere data collection, phi and omega scans
;
_diffrn_measurement_specimen_support
'magnetic support whith 10 micron nylon fiber cryoloop'
_diffrn_radiation_monochromator  'Multilayer Montel 200 mirrors'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0165
_diffrn_reflns_av_sigmaI/netI    0.0203
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            36349
_diffrn_reflns_theta_full        39.29
_diffrn_reflns_theta_max         39.29
_diffrn_reflns_theta_min         2.83
_diffrn_source                   'rotating anode X-ray tube'
_diffrn_source_current           70
_diffrn_source_power             50
_diffrn_source_size              '3 mm x 0.3 mm fine focus'
_diffrn_source_type              'Bruker-Nonius FR 591'
_exptl_absorpt_coefficient_mu    1.242
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8402
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
; 
 SADABS Version 2.1 2003 Bruker-Nonius
 Blessing, Acta Cryst. (1995) A51 33-38
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.617
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             732
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.199
_refine_diff_density_min         -1.235
_refine_diff_density_rms         0.068
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     371
_refine_ls_number_reflns         15411
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0347
_refine_ls_R_factor_gt           0.0306
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0451P)²+0.4183P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0828
_refine_ls_wR_factor_ref         0.0856
_reflns_number_gt                13789
_reflns_number_total             15411
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic8018265_si_002_2.cif
_cod_data_source_block           awk339_0m
_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_database_code               4301318
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
Ni1 Ni 0.283406(10) 0.778781(9) 0.031065(7) 0.01176(2) Uani 1 1 d . . .
O1 O 0.13714(6) 0.78125(6) 0.10906(4) 0.01498(9) Uani 1 1 d . . .
N1 N 0.14984(7) 0.67196(6) -0.05734(5) 0.01346(10) Uani 1 1 d . . .
C1 C -0.00896(8) 0.72885(7) 0.09389(5) 0.01308(11) Uani 1 1 d . . .
O2 O 0.41290(6) 0.88355(6) 0.12095(4) 0.01532(9) Uani 1 1 d . . .
N2 N 0.43375(7) 0.77760(6) -0.04504(5) 0.01374(10) Uani 1 1 d . . .
C2 C -0.10355(8) 0.74834(7) 0.16173(5) 0.01382(11) Uani 1 1 d . . .
O3 O -0.02507(7) 0.82349(6) 0.23484(4) 0.01665(10) Uani 1 1 d . . .
C3 C -0.25911(9) 0.69455(8) 0.15055(6) 0.01591(12) Uani 1 1 d . . .
H3 H -0.3195 0.7081 0.1966 0.019 Uiso 1 1 calc R . .
O4 O 0.54382(8) 1.03405(7) 0.25921(5) 0.02081(12) Uani 1 1 d . . .
C4 C -0.32963(9) 0.61958(8) 0.07142(6) 0.01802(13) Uani 1 1 d . . .
H4 H -0.4370 0.5831 0.0643 0.022 Uiso 1 1 calc R . .
C5 C -0.24300(9) 0.59953(8) 0.00496(6) 0.01789(13) Uani 1 1 d . . .
H5 H -0.2908 0.5492 -0.0484 0.021 Uiso 1 1 calc R . .
C6 C -0.08199(8) 0.65335(8) 0.01499(5) 0.01460(11) Uani 1 1 d . . .
C7 C 0.00249(9) 0.62824(8) -0.05566(6) 0.01562(12) Uani 1 1 d . . .
H7 H -0.0530 0.5751 -0.1060 0.019 Uiso 1 1 calc R . .
C8 C 0.22194(9) 0.64214(7) -0.13242(5) 0.01416(11) Uani 1 1 d . . .
C9 C 0.15093(10) 0.56393(8) -0.20850(6) 0.01756(12) Uani 1 1 d . . .
H9 H 0.0441 0.5250 -0.2137 0.021 Uiso 1 1 calc R . .
C10 C 0.23811(11) 0.54365(9) -0.27650(6) 0.01991(14) Uani 1 1 d . . .
H10 H 0.1905 0.4910 -0.3287 0.024 Uiso 1 1 calc R . .
C11 C 0.39506(11) 0.60013(9) -0.26853(6) 0.02148(15) Uani 1 1 d . . .
H11 H 0.4537 0.5849 -0.3150 0.026 Uiso 1 1 calc R . .
C12 C 0.46626(10) 0.67825(9) -0.19339(6) 0.01993(14) Uani 1 1 d . . .
H12 H 0.5732 0.7167 -0.1883 0.024 Uiso 1 1 calc R . .
C13 C 0.37905(9) 0.69982(7) -0.12518(5) 0.01482(11) Uani 1 1 d . . .
C14 C 0.57711(8) 0.84189(8) -0.03092(6) 0.01524(12) Uani 1 1 d . . .
H14 H 0.6416 0.8343 -0.0765 0.018 Uiso 1 1 calc R . .
C15 C 0.64431(8) 0.92194(7) 0.04667(6) 0.01490(11) Uani 1 1 d . . .
C16 C 0.80280(9) 0.98433(8) 0.05113(6) 0.01860(13) Uani 1 1 d . . .
H16 H 0.8592 0.9733 0.0020 0.022 Uiso 1 1 calc R . .
C17 C 0.87476(9) 1.06017(9) 0.12575(7) 0.02008(14) Uani 1 1 d . . .
H17 H 0.9811 1.1004 0.1289 0.024 Uiso 1 1 calc R . .
C18 C 0.79063(9) 1.07843(8) 0.19780(6) 0.01916(14) Uani 1 1 d . . .
H18 H 0.8407 1.1315 0.2493 0.023 Uiso 1 1 calc R . .
C19 C 0.63611(9) 1.02001(8) 0.19428(6) 0.01639(12) Uani 1 1 d . . .
C20 C 0.55813(8) 0.93798(7) 0.11873(5) 0.01394(11) Uani 1 1 d . . .
C21 C -0.11089(10) 0.83802(8) 0.30901(6) 0.01864(13) Uani 1 1 d . . .
H21A H -0.1528 0.7597 0.3376 0.022 Uiso 1 1 calc R . .
H21B H -0.1970 0.8675 0.2851 0.022 Uiso 1 1 calc R . .
C22 C -0.00585(13) 0.92783(10) 0.37993(7) 0.02532(17) Uani 1 1 d . . .
H22A H 0.0793 0.8981 0.4029 0.038 Uiso 1 1 calc R . .
H22B H -0.0621 0.9384 0.4318 0.038 Uiso 1 1 calc R . .
H22C H 0.0337 1.0054 0.3513 0.038 Uiso 1 1 calc R . .
C23 C 0.61598(12) 1.10352(10) 0.34244(7) 0.02504(17) Uani 1 1 d . . .
H23A H 0.6740 1.1863 0.3275 0.030 Uiso 1 1 calc R . .
H23B H 0.6875 1.0656 0.3759 0.030 Uiso 1 1 calc R . .
C24 C 0.49164(16) 1.10720(14) 0.40147(8) 0.0344(2) Uani 1 1 d . . .
H24A H 0.4220 1.1452 0.3678 0.052 Uiso 1 1 calc R . .
H24B H 0.5370 1.1540 0.4594 0.052 Uiso 1 1 calc R . .
H24C H 0.4350 1.0248 0.4157 0.052 Uiso 1 1 calc R . .
Cl1S Cl 0.32022(3) 0.58548(2) 0.219862(17) 0.02493(4) Uani 1 1 d . . .
C1S C 0.32692(10) 0.71560(8) 0.28720(6) 0.01848(13) Uani 1 1 d . . .
H1S H 0.3139 0.7801 0.2450 0.022 Uiso 1 1 calc R . .
Cl2S Cl 0.50428(3) 0.76737(3) 0.354076(19) 0.03081(5) Uani 1 1 d . . .
Cl3S Cl 0.17891(3) 0.68041(2) 0.360193(18) 0.02623(5) Uani 1 1 d . . .
Cl1T Cl 0.17359(3) 1.26348(3) 0.30867(2) 0.02910(5) Uani 1 1 d . . .
C1T C 0.15996(12) 1.36750(10) 0.39342(7) 0.02432(16) Uani 1 1 d . . .
H1T H 0.1598 1.4440 0.3626 0.029 Uiso 1 1 calc R . .
Cl2T Cl -0.01042(3) 1.31420(4) 0.44515(2) 0.04127(8) Uani 1 1 d . . .
Cl3T Cl 0.31645(4) 1.39986(6) 0.47773(3) 0.06240(15) Uani 1 1 d . . .
O1R O 0.22983(8) 1.04639(7) 0.20257(5) 0.02266(12) Uani 1 1 d . . .
H1OA H 0.161(3) 0.983(2) 0.1981(15) 0.046(5) Uiso 1 1 d . . .
H1OB H 0.302(3) 1.027(2) 0.2074(15) 0.048(6) Uiso 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'
Ni Ni 0.3393 1.1124 '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
_geom_angle_publ_flag
O2 Ni1 O1 83.43(3) . . ?
O2 Ni1 N1 178.64(3) . . ?
O1 Ni1 N1 95.31(3) . . ?
O2 Ni1 N2 95.34(3) . . ?
O1 Ni1 N2 178.70(3) . . ?
N1 Ni1 N2 85.92(3) . . ?
C1 O1 Ni1 127.13(5) . . ?
C7 N1 C8 120.74(7) . . ?
C7 N1 Ni1 125.75(6) . . ?
C8 N1 Ni1 113.48(5) . . ?
O1 C1 C6 124.67(7) . . ?
O1 C1 C2 117.99(7) . . ?
C6 C1 C2 117.34(7) . . ?
C20 O2 Ni1 126.95(5) . . ?
C14 N2 C13 120.56(7) . . ?
C14 N2 Ni1 125.91(6) . . ?
C13 N2 Ni1 113.51(5) . . ?
O3 C2 C3 125.16(7) . . ?
O3 C2 C1 113.79(6) . . ?
C3 C2 C1 121.05(7) . . ?
C2 O3 C21 116.49(6) . . ?
C2 C3 C4 120.70(7) . . ?
C19 O4 C23 117.23(7) . . ?
C5 C4 C3 119.84(7) . . ?
C4 C5 C6 120.63(8) . . ?
C1 C6 C7 121.36(7) . . ?
C1 C6 C5 120.42(7) . . ?
C7 C6 C5 118.22(7) . . ?
N1 C7 C6 125.59(7) . . ?
C9 C8 C13 120.18(7) . . ?
C9 C8 N1 126.30(7) . . ?
C13 C8 N1 113.52(7) . . ?
C10 C9 C8 119.33(8) . . ?
C9 C10 C11 120.36(9) . . ?
C12 C11 C10 120.63(8) . . ?
C11 C12 C13 119.28(8) . . ?
C12 C13 C8 120.20(8) . . ?
C12 C13 N2 126.26(7) . . ?
C8 C13 N2 113.54(6) . . ?
N2 C14 C15 125.41(7) . . ?
C20 C15 C14 121.47(7) . . ?
C20 C15 C16 120.61(8) . . ?
C14 C15 C16 117.91(7) . . ?
C17 C16 C15 120.47(8) . . ?
C16 C17 C18 119.81(8) . . ?
C19 C18 C17 120.69(8) . . ?
O4 C19 C18 125.16(8) . . ?
O4 C19 C20 113.80(7) . . ?
C18 C19 C20 121.03(8) . . ?
O2 C20 C15 124.79(7) . . ?
O2 C20 C19 117.84(7) . . ?
C15 C20 C19 117.36(7) . . ?
O3 C21 C22 108.10(7) . . ?
O4 C23 C24 107.16(9) . . ?
Cl2S C1S Cl3S 110.02(5) . . ?
Cl2S C1S Cl1S 109.24(5) . . ?
Cl3S C1S Cl1S 109.78(5) . . ?
Cl3T C1T Cl1T 110.84(6) . . ?
Cl3T C1T Cl2T 110.29(6) . . ?
Cl1T C1T Cl2T 111.07(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
Ni1 O2 1.8439(6) . ?
Ni1 O1 1.8485(6) . ?
Ni1 N1 1.8562(7) . ?
Ni1 N2 1.8569(6) . ?
O1 C1 1.3001(9) . ?
N1 C7 1.3061(10) . ?
N1 C8 1.4186(10) . ?
C1 C6 1.4155(11) . ?
C1 C2 1.4340(10) . ?
O2 C20 1.3055(9) . ?
N2 C14 1.3071(10) . ?
N2 C13 1.4167(11) . ?
C2 O3 1.3642(10) . ?
C2 C3 1.3781(11) . ?
O3 C21 1.4315(10) . ?
C3 C4 1.4105(12) . ?
O4 C19 1.3676(11) . ?
O4 C23 1.4314(12) . ?
C4 C5 1.3689(12) . ?
C5 C6 1.4234(11) . ?
C6 C7 1.4220(11) . ?
C8 C9 1.3966(12) . ?
C8 C13 1.3985(11) . ?
C9 C10 1.3903(12) . ?
C10 C11 1.3946(14) . ?
C11 C12 1.3863(14) . ?
C12 C13 1.3980(11) . ?
C14 C15 1.4172(12) . ?
C15 C20 1.4143(11) . ?
C15 C16 1.4218(11) . ?
C16 C17 1.3691(14) . ?
C17 C18 1.4093(14) . ?
C18 C19 1.3815(12) . ?
C19 C20 1.4272(12) . ?
C21 C22 1.5044(14) . ?
C23 C24 1.5061(16) . ?
Cl1S C1S 1.7697(9) . ?
C1S Cl2S 1.7538(10) . ?
C1S Cl3S 1.7638(8) . ?
Cl1T C1T 1.7501(11) . ?
C1T Cl3T 1.7453(12) . ?
C1T Cl2T 1.7551(10) . ?
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
O2 Ni1 O1 C1 175.65(7) . . . . ?
N1 Ni1 O1 C1 -4.87(7) . . . . ?
N2 Ni1 O1 C1 -165.1(13) . . . . ?
O2 Ni1 N1 C7 25.9(12) . . . . ?
O1 Ni1 N1 C7 3.45(7) . . . . ?
N2 Ni1 N1 C7 -176.99(7) . . . . ?
O2 Ni1 N1 C8 -156.0(12) . . . . ?
O1 Ni1 N1 C8 -178.42(5) . . . . ?
N2 Ni1 N1 C8 1.14(5) . . . . ?
Ni1 O1 C1 C6 3.75(11) . . . . ?
Ni1 O1 C1 C2 -176.38(5) . . . . ?
O1 Ni1 O2 C20 -176.51(7) . . . . ?
N1 Ni1 O2 C20 161.0(12) . . . . ?
N2 Ni1 O2 C20 3.92(7) . . . . ?
O2 Ni1 N2 C14 -3.51(7) . . . . ?
O1 Ni1 N2 C14 -22.7(13) . . . . ?
N1 Ni1 N2 C14 177.02(7) . . . . ?
O2 Ni1 N2 C13 177.84(5) . . . . ?
O1 Ni1 N2 C13 158.6(13) . . . . ?
N1 Ni1 N2 C13 -1.62(5) . . . . ?
O1 C1 C2 O3 1.08(10) . . . . ?
C6 C1 C2 O3 -179.04(7) . . . . ?
O1 C1 C2 C3 -179.30(7) . . . . ?
C6 C1 C2 C3 0.58(11) . . . . ?
C3 C2 O3 C21 5.84(11) . . . . ?
C1 C2 O3 C21 -174.56(7) . . . . ?
O3 C2 C3 C4 178.99(8) . . . . ?
C1 C2 C3 C4 -0.58(12) . . . . ?
C2 C3 C4 C5 0.18(13) . . . . ?
C3 C4 C5 C6 0.20(13) . . . . ?
O1 C1 C6 C7 0.24(12) . . . . ?
C2 C1 C6 C7 -179.63(7) . . . . ?
O1 C1 C6 C5 179.67(8) . . . . ?
C2 C1 C6 C5 -0.20(11) . . . . ?
C4 C5 C6 C1 -0.18(13) . . . . ?
C4 C5 C6 C7 179.27(8) . . . . ?
C8 N1 C7 C6 -178.94(7) . . . . ?
Ni1 N1 C7 C6 -0.93(12) . . . . ?
C1 C6 C7 N1 -1.70(13) . . . . ?
C5 C6 C7 N1 178.86(8) . . . . ?
C7 N1 C8 C9 -2.12(12) . . . . ?
Ni1 N1 C8 C9 179.65(7) . . . . ?
C7 N1 C8 C13 177.81(7) . . . . ?
Ni1 N1 C8 C13 -0.43(8) . . . . ?
C13 C8 C9 C10 0.34(12) . . . . ?
N1 C8 C9 C10 -179.74(8) . . . . ?
C8 C9 C10 C11 0.46(13) . . . . ?
C9 C10 C11 C12 -0.72(14) . . . . ?
C10 C11 C12 C13 0.17(14) . . . . ?
C11 C12 C13 C8 0.62(13) . . . . ?
C11 C12 C13 N2 -179.32(8) . . . . ?
C9 C8 C13 C12 -0.89(12) . . . . ?
N1 C8 C13 C12 179.18(7) . . . . ?
C9 C8 C13 N2 179.06(7) . . . . ?
N1 C8 C13 N2 -0.87(9) . . . . ?
C14 N2 C13 C12 3.01(12) . . . . ?
Ni1 N2 C13 C12 -178.27(7) . . . . ?
C14 N2 C13 C8 -176.94(7) . . . . ?
Ni1 N2 C13 C8 1.78(8) . . . . ?
C13 N2 C14 C15 -179.68(7) . . . . ?
Ni1 N2 C14 C15 1.76(12) . . . . ?
N2 C14 C15 C20 0.92(12) . . . . ?
N2 C14 C15 C16 179.62(8) . . . . ?
C20 C15 C16 C17 0.59(12) . . . . ?
C14 C15 C16 C17 -178.12(8) . . . . ?
C15 C16 C17 C18 -1.27(13) . . . . ?
C16 C17 C18 C19 0.38(13) . . . . ?
C23 O4 C19 C18 -7.76(13) . . . . ?
C23 O4 C19 C20 172.82(8) . . . . ?
C17 C18 C19 O4 -178.16(8) . . . . ?
C17 C18 C19 C20 1.22(13) . . . . ?
Ni1 O2 C20 C15 -2.56(11) . . . . ?
Ni1 O2 C20 C19 177.29(5) . . . . ?
C14 C15 C20 O2 -0.53(12) . . . . ?
C16 C15 C20 O2 -179.20(7) . . . . ?
C14 C15 C20 C19 179.62(7) . . . . ?
C16 C15 C20 C19 0.95(11) . . . . ?
O4 C19 C20 O2 -2.26(10) . . . . ?
C18 C19 C20 O2 178.29(7) . . . . ?
O4 C19 C20 C15 177.60(7) . . . . ?
C18 C19 C20 C15 -1.85(11) . . . . ?
C2 O3 C21 C22 -177.49(7) . . . . ?
C19 O4 C23 C24 179.24(9) . . . . ?
