#------------------------------------------------------------------------------
#$Date: 2016-03-26 19:24:35 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180433 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/02/7210243.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_7210243
loop_
_publ_author_name
'Guo, Feng'
'Zhu, Baoyong'
'Liu, Mingli'
'Zhang, Xiuling'
'Zhang, Jian'
'Zhao, Jiongpeng'
_publ_section_title
;
 Tuning structural topologies of four Ni(ii) coordination polymers through
 modifying the substitute group of organic ligand
;
_journal_issue                   31
_journal_name_full               CrystEngComm
_journal_page_first              6191
_journal_paper_doi               10.1039/c3ce40157j
_journal_volume                  15
_journal_year                    2013
_chemical_formula_sum            'C25 H20 N8 Ni O7'
_chemical_formula_weight         603.20
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/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                90.000
_cell_angle_beta                 100.421(8)
_cell_angle_gamma                90.000
_cell_formula_units_Z            4
_cell_length_a                   8.405(3)
_cell_length_b                   17.494(5)
_cell_length_c                   17.621(4)
_cell_measurement_temperature    293(2)
_cell_volume                     2548.2(13)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       SMART(Bruker,1998)
_computing_data_reduction        SAINT(Bruker,1998)
_computing_molecular_graphics    'SHELXTL (Bruker,1998)'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0191
_diffrn_reflns_av_sigmaI/netI    0.0225
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            15574
_diffrn_reflns_theta_full        27.51
_diffrn_reflns_theta_max         27.51
_diffrn_reflns_theta_min         1.65
_exptl_absorpt_coefficient_mu    0.825
_exptl_absorpt_correction_T_max  0.8266
_exptl_absorpt_correction_T_min  0.7783
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.572
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1240
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.24
_refine_diff_density_max         0.294
_refine_diff_density_min         -0.650
_refine_diff_density_rms         0.052
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     378
_refine_ls_number_reflns         5808
_refine_ls_number_restraints     5
_refine_ls_restrained_S_all      1.034
_refine_ls_R_factor_all          0.0461
_refine_ls_R_factor_gt           0.0345
_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)+(0.0506P)²+1.2318P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0942
_refine_ls_wR_factor_ref         0.1020
_reflns_number_gt                4628
_reflns_number_total             5808
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ce40157j.txt
_cod_data_source_block           Ni_2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from
2011-04-26.

'_exptl_absorpt_correction_type' value 'MULTI-SCAN'
changed to 'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_cell_volume        2548.2(18)
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7210243
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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
Ni1 Ni 0.79964(3) 0.248466(13) 0.762091(13) 0.02854(9) Uani 1 1 d .
O2 O 1.16659(19) 0.30186(10) 0.85119(9) 0.0537(4) Uani 1 1 d .
O1 O 0.95390(17) 0.23104(9) 0.86569(8) 0.0397(3) Uani 1 1 d .
N8 N 0.6023(2) 0.43097(10) 0.87281(9) 0.0373(4) Uani 1 1 d .
N2 N 0.5179(2) 0.10571(10) 0.88101(10) 0.0354(4) Uani 1 1 d .
C6 C 1.4348(2) 0.21204(11) 1.05569(11) 0.0320(4) Uani 1 1 d .
C2 C 1.1895(2) 0.22043(12) 0.95977(11) 0.0330(4) Uani 1 1 d .
O7 O 0.9719(2) 0.31915(11) 0.72037(10) 0.0513(4) Uani 1 1 d D
O3 O 1.6992(2) 0.25029(9) 1.04173(10) 0.0476(4) Uani 1 1 d .
O4 O 1.6402(2) 0.23555(10) 1.16020(9) 0.0493(4) Uani 1 1 d .
C18 C 0.5082(2) 0.05285(12) 0.94153(12) 0.0358(4) Uani 1 1 d U
N4 N 0.9645(2) 0.06622(10) 0.64062(11) 0.0426(4) Uani 1 1 d .
C7 C 1.3493(2) 0.24159(11) 0.98694(11) 0.0328(4) Uani 1 1 d .
H7 H 1.3997 0.2760 0.9587 0.039 Uiso 1 1 calc R
C5 C 1.3614(2) 0.15877(11) 1.09622(11) 0.0359(4) Uani 1 1 d .
H5 H 1.4154 0.1393 1.1430 0.043 Uiso 1 1 calc R
C4 C 1.2064(3) 0.13516(12) 1.06583(12) 0.0379(4) Uani 1 1 d .
C24 C 0.5493(3) 0.46566(11) 0.93696(12) 0.0363(4) Uani 1 1 d .
O6 O 0.9998(3) 0.05334(15) 1.08252(14) 0.0950(9) Uani 1 1 d .
N1 N 0.6271(2) 0.18389(10) 0.80595(10) 0.0356(4) Uani 1 1 d .
N7 N 0.7083(2) 0.34747(9) 0.80235(9) 0.0361(4) Uani 1 1 d .
C8 C 1.6083(2) 0.23510(11) 1.08788(11) 0.0333(4) Uani 1 1 d .
O5 O 1.2231(3) 0.04219(14) 1.15936(14) 0.0912(8) Uani 1 1 d .
N6 N 0.3721(3) 0.00682(12) 0.93874(13) 0.0561(5) Uani 1 1 d U
H6 H 0.2922 0.0110 0.9009 0.067 Uiso 1 1 calc R
N3 N 0.8996(2) 0.15205(10) 0.72113(10) 0.0369(4) Uani 1 1 d .
C3 C 1.1177(2) 0.16590(12) 0.99937(12) 0.0386(5) Uani 1 1 d .
H3 H 1.0118 0.1503 0.9815 0.046 Uiso 1 1 calc R
C26 C 0.5270(3) 0.46399(13) 1.07075(13) 0.0488(6) Uani 1 1 d .
H26 H 0.5455 0.4395 1.1184 0.059 Uiso 1 1 calc R
N5 N 1.1379(2) 0.07270(12) 1.10561(12) 0.0521(5) Uani 1 1 d .
C20 C 0.3652(3) -0.04568(13) 0.99674(13) 0.0438(5) Uani 1 1 d U
H20 H 0.2743 -0.0765 0.9942 0.053 Uiso 1 1 calc R
C14 C 0.9583(3) -0.07546(13) 0.48530(15) 0.0537(6) Uani 1 1 d .
H14 H 0.9304 -0.1264 0.4752 0.064 Uiso 1 1 calc R
C25 C 0.5760(3) 0.42989(13) 1.00799(13) 0.0468(5) Uani 1 1 d .
H25 H 0.6272 0.3826 1.0137 0.056 Uiso 1 1 calc R
C17 C 0.3971(3) 0.12852(15) 0.82234(14) 0.0500(6) Uani 1 1 d .
H17 H 0.2890 0.1140 0.8151 0.060 Uiso 1 1 calc R
C12 C 0.9852(3) 0.03234(13) 0.56945(14) 0.0445(5) Uani 1 1 d .
C9 C 0.9420(3) 0.08483(13) 0.76022(13) 0.0458(5) Uani 1 1 d .
H9 H 0.9442 0.0775 0.8127 0.055 Uiso 1 1 calc R
C11 C 0.9153(3) 0.13868(12) 0.64941(12) 0.0385(5) Uani 1 1 d .
H11 H 0.8952 0.1745 0.6098 0.046 Uiso 1 1 calc R
C21 C 0.6645(3) 0.41167(13) 0.75942(13) 0.0460(5) Uani 1 1 d .
H21 H 0.6775 0.4186 0.7086 0.055 Uiso 1 1 calc R
C15 C 0.6529(3) 0.14161(13) 0.86838(13) 0.0417(5) Uani 1 1 d .
H15 H 0.7532 0.1369 0.9005 0.050 Uiso 1 1 calc R
C1 C 1.0960(2) 0.25432(11) 0.88578(11) 0.0329(4) Uani 1 1 d .
C16 C 0.4652(3) 0.17596(13) 0.77718(14) 0.0455(5) Uani 1 1 d .
H16 H 0.4104 0.1998 0.7329 0.055 Uiso 1 1 calc R
C22 C 0.6696(3) 0.36084(12) 0.87006(12) 0.0387(5) Uani 1 1 d .
H22 H 0.6863 0.3265 0.9110 0.046 Uiso 1 1 calc R
C13 C 0.9428(3) -0.04365(13) 0.55505(15) 0.0528(6) Uani 1 1 d .
H13 H 0.9043 -0.0727 0.5921 0.063 Uiso 1 1 calc R
C23 C 0.5999(3) 0.46345(13) 0.80150(13) 0.0516(6) Uani 1 1 d .
H23 H 0.5613 0.5117 0.7855 0.062 Uiso 1 1 calc R
C10 C 0.9796(3) 0.03165(13) 0.71186(14) 0.0505(6) Uani 1 1 d .
H10 H 1.0100 -0.0186 0.7239 0.061 Uiso 1 1 calc R
H7A H 1.051(3) 0.3183(18) 0.7570(12) 0.081(10) Uiso 1 1 d D
H7B H 1.000(4) 0.307(3) 0.6788(12) 0.142(18) Uiso 1 1 d 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'
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'
H H 0.0000 0.0000 '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 Ni1 O1 178.26(6) 4_465 .
O4 Ni1 N7 87.81(7) 4_465 .
O1 Ni1 N7 91.90(7) . .
O4 Ni1 N3 92.75(7) 4_465 .
O1 Ni1 N3 87.61(7) . .
N7 Ni1 N3 177.56(7) . .
O4 Ni1 N1 90.57(8) 4_465 .
O1 Ni1 N1 87.71(7) . .
N7 Ni1 N1 90.01(7) . .
N3 Ni1 N1 92.36(7) . .
O4 Ni1 O7 89.78(8) 4_465 .
O1 Ni1 O7 91.92(7) . .
N7 Ni1 O7 87.14(8) . .
N3 Ni1 O7 90.49(8) . .
N1 Ni1 O7 177.12(7) . .
C1 O1 Ni1 128.16(13) . .
C22 N8 C23 106.16(17) . .
C22 N8 C24 127.35(17) . .
C23 N8 C24 126.46(18) . .
C15 N2 C17 105.66(18) . .
C15 N2 C18 126.09(18) . .
C17 N2 C18 128.20(18) . .
C5 C6 C7 119.37(18) . .
C5 C6 C8 118.23(17) . .
C7 C6 C8 122.39(18) . .
C3 C2 C7 119.47(18) . .
C3 C2 C1 119.86(18) . .
C7 C2 C1 120.64(18) . .
Ni1 O7 H7A 102(2) . .
Ni1 O7 H7B 118(3) . .
H7A O7 H7B 111(2) . .
C8 O4 Ni1 150.92(16) . 4_666
C20 C18 N6 119.1(2) 3_657 .
C20 C18 N2 120.48(18) 3_657 .
N6 C18 N2 120.45(19) . .
C11 N4 C10 106.68(18) . .
C11 N4 C12 125.40(18) . .
C10 N4 C12 127.79(19) . .
C6 C7 C2 120.99(19) . .
C6 C7 H7 119.5 . .
C2 C7 H7 119.5 . .
C4 C5 C6 118.62(18) . .
C4 C5 H5 120.7 . .
C6 C5 H5 120.7 . .
C3 C4 C5 122.73(19) . .
C3 C4 N5 119.75(19) . .
C5 C4 N5 117.48(18) . .
C25 C24 C26 119.27(19) . 3_667
C25 C24 N8 120.23(18) . .
C26 C24 N8 120.49(19) 3_667 .
C15 N1 C16 104.82(17) . .
C15 N1 Ni1 126.43(14) . .
C16 N1 Ni1 128.75(15) . .
C22 N7 C21 105.68(18) . .
C22 N7 Ni1 128.92(14) . .
C21 N7 Ni1 125.24(14) . .
O3 C8 O4 128.4(2) . .
O3 C8 C6 118.34(18) . .
O4 C8 C6 113.26(19) . .
C20 N6 C18 120.1(2) . .
C20 N6 H6 119.9 . .
C18 N6 H6 119.9 . .
C11 N3 C9 105.47(18) . .
C11 N3 Ni1 126.67(14) . .
C9 N3 Ni1 127.29(14) . .
C4 C3 C2 118.63(19) . .
C4 C3 H3 120.7 . .
C2 C3 H3 120.7 . .
C24 C26 C25 120.3(2) 3_667 .
C24 C26 H26 119.8 3_667 .
C25 C26 H26 119.8 . .
O5 N5 O6 122.7(2) . .
O5 N5 C4 118.4(2) . .
O6 N5 C4 118.9(2) . .
C18 C20 N6 120.80(19) 3_657 .
C18 C20 H20 119.6 3_657 .
N6 C20 H20 119.6 . .
C12 C14 C13 120.3(2) 3_756 .
C12 C14 H14 119.8 3_756 .
C13 C14 H14 119.8 . .
C24 C25 C26 120.4(2) . .
C24 C25 H25 119.8 . .
C26 C25 H25 119.8 . .
C16 C17 N2 106.81(19) . .
C16 C17 H17 126.6 . .
N2 C17 H17 126.6 . .
C14 C12 C13 120.5(2) 3_756 .
C14 C12 N4 120.1(2) 3_756 .
C13 C12 N4 119.4(2) . .
C10 C9 N3 110.2(2) . .
C10 C9 H9 124.9 . .
N3 C9 H9 124.9 . .
N3 C11 N4 111.29(18) . .
N3 C11 H11 124.4 . .
N4 C11 H11 124.4 . .
C23 C21 N7 110.08(19) . .
C23 C21 H21 125.0 . .
N7 C21 H21 125.0 . .
N1 C15 N2 112.62(19) . .
N1 C15 H15 123.7 . .
N2 C15 H15 123.7 . .
O2 C1 O1 126.49(19) . .
O2 C1 C2 117.66(18) . .
O1 C1 C2 115.85(18) . .
C17 C16 N1 110.1(2) . .
C17 C16 H16 125.0 . .
N1 C16 H16 125.0 . .
N7 C22 N8 111.54(18) . .
N7 C22 H22 124.2 . .
N8 C22 H22 124.2 . .
C14 C13 C12 119.2(2) . .
C14 C13 H13 120.4 . .
C12 C13 H13 120.4 . .
C21 C23 N8 106.54(19) . .
C21 C23 H23 126.7 . .
N8 C23 H23 126.7 . .
C9 C10 N4 106.36(19) . .
C9 C10 H10 126.8 . .
N4 C10 H10 126.8 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ni1 O4 2.0561(16) 4_465
Ni1 O1 2.0616(15) .
Ni1 N7 2.0711(17) .
Ni1 N3 2.0715(18) .
Ni1 N1 2.0936(18) .
Ni1 O7 2.1331(18) .
O2 C1 1.243(2) .
O1 C1 1.251(3) .
N8 C22 1.356(3) .
N8 C23 1.376(3) .
N8 C24 1.424(3) .
N2 C15 1.350(3) .
N2 C17 1.371(3) .
N2 C18 1.425(3) .
C6 C5 1.385(3) .
C6 C7 1.392(3) .
C6 C8 1.520(3) .
C2 C3 1.383(3) .
C2 C7 1.392(3) .
C2 C1 1.516(3) .
O7 H7A 0.838(10) .
O7 H7B 0.837(10) .
O3 C8 1.241(3) .
O4 C8 1.254(2) .
O4 Ni1 2.0561(16) 4_666
C18 C20 1.383(3) 3_657
C18 N6 1.392(3) .
N4 C11 1.351(3) .
N4 C10 1.378(3) .
N4 C12 1.426(3) .
C7 H7 0.9300 .
C5 C4 1.379(3) .
C5 H5 0.9300 .
C4 C3 1.379(3) .
C4 N5 1.471(3) .
C24 C25 1.381(3) .
C24 C26 1.383(3) 3_667
O6 N5 1.206(3) .
N1 C15 1.311(3) .
N1 C16 1.370(3) .
N7 C22 1.313(3) .
N7 C21 1.367(3) .
O5 N5 1.204(3) .
N6 C20 1.383(3) .
N6 H6 0.8600 .
N3 C11 1.315(3) .
N3 C9 1.377(3) .
C3 H3 0.9300 .
C26 C24 1.383(3) 3_667
C26 C25 1.383(3) .
C26 H26 0.9300 .
C20 C18 1.383(3) 3_657
C20 H20 0.9300 .
C14 C12 1.375(3) 3_756
C14 C13 1.377(3) .
C14 H14 0.9300 .
C25 H25 0.9300 .
C17 C16 1.347(3) .
C17 H17 0.9300 .
C12 C14 1.375(3) 3_756
C12 C13 1.388(3) .
C9 C10 1.337(3) .
C9 H9 0.9300 .
C11 H11 0.9300 .
C21 C23 1.346(3) .
C21 H21 0.9300 .
C15 H15 0.9300 .
C16 H16 0.9300 .
C22 H22 0.9300 .
C13 H13 0.9300 .
C23 H23 0.9300 .
C10 H10 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
_geom_torsion_site_symmetry_4
O4 Ni1 O1 C1 -171(2) 4_465 .
N7 Ni1 O1 C1 -90.34(18) . .
N3 Ni1 O1 C1 87.26(18) . .
N1 Ni1 O1 C1 179.72(18) . .
O7 Ni1 O1 C1 -3.15(18) . .
C15 N2 C18 C20 13.6(3) . 3_657
C17 N2 C18 C20 -169.3(2) . 3_657
C15 N2 C18 N6 -165.4(2) . .
C17 N2 C18 N6 11.7(3) . .
C5 C6 C7 C2 2.2(3) . .
C8 C6 C7 C2 -178.74(18) . .
C3 C2 C7 C6 -3.8(3) . .
C1 C2 C7 C6 178.56(18) . .
C7 C6 C5 C4 1.7(3) . .
C8 C6 C5 C4 -177.35(19) . .
C6 C5 C4 C3 -4.3(3) . .
C6 C5 C4 N5 173.59(19) . .
C22 N8 C24 C25 5.3(3) . .
C23 N8 C24 C25 -172.4(2) . .
C22 N8 C24 C26 -175.8(2) . 3_667
C23 N8 C24 C26 6.5(3) . 3_667
O4 Ni1 N1 C15 167.82(18) 4_465 .
O1 Ni1 N1 C15 -12.47(18) . .
N7 Ni1 N1 C15 -104.37(18) . .
N3 Ni1 N1 C15 75.05(18) . .
O7 Ni1 N1 C15 -95.2(13) . .
O4 Ni1 N1 C16 -12.17(19) 4_465 .
O1 Ni1 N1 C16 167.54(19) . .
N7 Ni1 N1 C16 75.64(19) . .
N3 Ni1 N1 C16 -104.95(19) . .
O7 Ni1 N1 C16 84.8(13) . .
O4 Ni1 N7 C22 136.47(19) 4_465 .
O1 Ni1 N7 C22 -41.81(19) . .
N3 Ni1 N7 C22 -120.2(15) . .
N1 Ni1 N7 C22 45.90(19) . .
O7 Ni1 N7 C22 -133.64(19) . .
O4 Ni1 N7 C21 -38.28(18) 4_465 .
O1 Ni1 N7 C21 143.44(18) . .
N3 Ni1 N7 C21 65.1(15) . .
N1 Ni1 N7 C21 -128.85(19) . .
O7 Ni1 N7 C21 51.61(18) . .
Ni1 O4 C8 O3 -0.6(5) 4_666 .
Ni1 O4 C8 C6 179.0(2) 4_666 .
C5 C6 C8 O3 145.87(19) . .
C7 C6 C8 O3 -33.2(3) . .
C5 C6 C8 O4 -33.7(3) . .
C7 C6 C8 O4 147.27(19) . .
C20 C18 N6 C20 -0.6(4) 3_657 .
N2 C18 N6 C20 178.41(19) . .
O4 Ni1 N3 C11 31.84(19) 4_465 .
O1 Ni1 N3 C11 -149.86(18) . .
N7 Ni1 N3 C11 -71.4(15) . .
N1 Ni1 N3 C11 122.53(18) . .
O7 Ni1 N3 C11 -57.96(18) . .
O4 Ni1 N3 C9 -138.24(19) 4_465 .
O1 Ni1 N3 C9 40.05(19) . .
N7 Ni1 N3 C9 118.5(15) . .
N1 Ni1 N3 C9 -47.56(19) . .
O7 Ni1 N3 C9 131.95(19) . .
C5 C4 C3 C2 2.8(3) . .
N5 C4 C3 C2 -175.1(2) . .
C7 C2 C3 C4 1.3(3) . .
C1 C2 C3 C4 178.98(19) . .
C3 C4 N5 O5 173.3(3) . .
C5 C4 N5 O5 -4.6(3) . .
C3 C4 N5 O6 -5.6(4) . .
C5 C4 N5 O6 176.5(3) . .
C18 N6 C20 C18 0.6(4) . 3_657
C26 C24 C25 C26 0.0(4) 3_667 .
N8 C24 C25 C26 178.9(2) . .
C24 C26 C25 C24 0.0(4) 3_667 .
C15 N2 C17 C16 0.7(3) . .
C18 N2 C17 C16 -176.9(2) . .
C11 N4 C12 C14 35.6(4) . 3_756
C10 N4 C12 C14 -148.9(3) . 3_756
C11 N4 C12 C13 -142.3(2) . .
C10 N4 C12 C13 33.2(4) . .
C11 N3 C9 C10 -1.1(3) . .
Ni1 N3 C9 C10 170.62(17) . .
C9 N3 C11 N4 0.4(2) . .
Ni1 N3 C11 N4 -171.40(14) . .
C10 N4 C11 N3 0.4(3) . .
C12 N4 C11 N3 176.7(2) . .
C22 N7 C21 C23 0.1(3) . .
Ni1 N7 C21 C23 175.87(17) . .
C16 N1 C15 N2 1.1(3) . .
Ni1 N1 C15 N2 -178.92(13) . .
C17 N2 C15 N1 -1.1(3) . .
C18 N2 C15 N1 176.54(18) . .
Ni1 O1 C1 O2 10.7(3) . .
Ni1 O1 C1 C2 -169.21(13) . .
C3 C2 C1 O2 -178.4(2) . .
C7 C2 C1 O2 -0.7(3) . .
C3 C2 C1 O1 1.5(3) . .
C7 C2 C1 O1 179.20(19) . .
N2 C17 C16 N1 -0.1(3) . .
C15 N1 C16 C17 -0.6(3) . .
Ni1 N1 C16 C17 179.38(16) . .
C21 N7 C22 N8 0.1(2) . .
Ni1 N7 C22 N8 -175.44(14) . .
C23 N8 C22 N7 -0.3(3) . .
C24 N8 C22 N7 -178.37(19) . .
C12 C14 C13 C12 -0.1(4) 3_756 .
C14 C12 C13 C14 0.1(4) 3_756 .
N4 C12 C13 C14 178.0(2) . .
N7 C21 C23 N8 -0.3(3) . .
C22 N8 C23 C21 0.3(3) . .
C24 N8 C23 C21 178.4(2) . .
N3 C9 C10 N4 1.4(3) . .
C11 N4 C10 C9 -1.1(3) . .
C12 N4 C10 C9 -177.2(2) . .
