#------------------------------------------------------------------------------
#$Date: 2021-06-05 21:51:37 +0300 (Sat, 05 Jun 2021) $
#$Revision: 266076 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/69/7706973.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_7706973
loop_
_publ_author_name
'Reczyński, Mateusz'
'Akaki, Mitsuru'
'Fukuda, Takamitsu'
'Sawada, Yuya'
'Nishii, Kengo'
'Hagiwara, Masayuki'
'Nitek, Wojciech'
'Sieklucka, Barbara'
'Nowicka, Beata'
_publ_section_title
;
 Hepta-coordinated Ni(II) assemblies - structure and magnetic studies.
;
_journal_issue                   15
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5251
_journal_page_last               5261
_journal_paper_doi               10.1039/d1dt00479d
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety         'C11 H21 Cl N8 Ni O8'
_chemical_formula_sum            'C11 H21 Cl N8 Ni O8'
_chemical_formula_weight         487.52
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_date             2018-07-26T00:01:08-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_audit_update_record
;
2021-03-14 deposited with the CCDC.	2021-03-24 downloaded from the CCDC.
;
_cell_angle_alpha                114.8010(10)
_cell_angle_beta                 93.9460(10)
_cell_angle_gamma                103.7760(10)
_cell_formula_units_Z            2
_cell_length_a                   6.91300(10)
_cell_length_b                   12.3410(2)
_cell_length_c                   12.6390(2)
_cell_measurement_reflns_used    4125
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      27.485
_cell_measurement_theta_min      0.998
_cell_volume                     933.10(3)
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
_computing_data_collection       'Collect (Bruker AXS BV, 1997-2004)'
_computing_data_reduction
'HKL Denzo and Scalepack (Otwinowski & Minor 1997)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device       '95mm CCD camera on κ-goniostat'
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       CCD
_diffrn_orient_matrix_type       'by Bruker AXS Collect from scalepack cell'
_diffrn_orient_matrix_UB_11      0.0695474
_diffrn_orient_matrix_UB_12      0.0775251
_diffrn_orient_matrix_UB_13      0.0748127
_diffrn_orient_matrix_UB_21      0.0204615
_diffrn_orient_matrix_UB_22      -0.0521111
_diffrn_orient_matrix_UB_23      0.0402363
_diffrn_orient_matrix_UB_31      0.1333014
_diffrn_orient_matrix_UB_32      -0.0010967
_diffrn_orient_matrix_UB_33      -0.0258669
_diffrn_radiation_monochromator  'horizonally mounted graphite crystal'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0113
_diffrn_reflns_av_unetI/netI     0.0233
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            7571
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.451
_diffrn_reflns_theta_min         3.091
_exptl_absorpt_coefficient_mu    1.244
_exptl_absorpt_correction_T_max  1
_exptl_absorpt_correction_T_min  0.9206
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(DENZO-SMN; Otwinowski & Minor, 1997)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.735
_exptl_crystal_description       prism
_exptl_crystal_F_000             504
_exptl_crystal_size_max          0.474
_exptl_crystal_size_mid          0.258
_exptl_crystal_size_min          0.155
_refine_diff_density_max         0.371
_refine_diff_density_min         -0.41
_refine_diff_density_rms         0.054
_refine_ls_extinction_coef       0.0390(14)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     313
_refine_ls_number_reflns         4237
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.031
_refine_ls_R_factor_all          0.0231
_refine_ls_R_factor_gt           0.0217
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0161P)²+0.7484P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0523
_refine_ls_wR_factor_ref         0.0532
_reflns_Friedel_coverage         0
_reflns_number_gt                4058
_reflns_number_total             4237
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1dt00479d2.cif
_cod_data_source_block           bn_niclapsc_100
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 7706973--7706975.cif.
;
_cod_database_code               7706973
_shelx_estimated_absorpt_t_min   0.59
_shelx_estimated_absorpt_t_max   0.831
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C0 C 0.2403(2) 0.49120(13) -0.06528(12) 0.0120(3) Uani 1 1 d . . . . .
H0 H 0.235 0.4861 -0.1426 0.014 Uiso 1 1 calc R U . . .
C1 C 0.3389(2) 0.60436(13) 0.03361(12) 0.0110(2) Uani 1 1 d . . . . .
H1 H 0.4008 0.6769 0.025 0.013 Uiso 1 1 calc R U . . .
C2 C 0.1496(2) 0.38571(13) -0.05164(11) 0.0110(2) Uani 1 1 d . . . . .
H2 H 0.0834 0.3081 -0.1187 0.013 Uiso 1 1 calc R U . . .
C3 C 0.34419(19) 0.60811(12) 0.14570(11) 0.0088(2) Uani 1 1 d . . . . .
C4 C 0.15857(19) 0.39707(12) 0.06363(11) 0.0087(2) Uani 1 1 d . . . . .
C5 C 0.4486(2) 0.71978(12) 0.25916(11) 0.0095(2) Uani 1 1 d . . . . .
C6 C 0.06487(19) 0.29527(12) 0.09402(11) 0.0090(2) Uani 1 1 d . . . . .
C7 C 0.5522(2) 0.84200(13) 0.26172(12) 0.0142(3) Uani 1 1 d . . . . .
H7A H 0.5567 0.9101 0.3393 0.021 Uiso 1 1 calc R U . . .
H7B H 0.4771 0.8517 0.1993 0.021 Uiso 1 1 calc R U . . .
H7C H 0.6907 0.8443 0.2483 0.021 Uiso 1 1 calc R U . . .
C8 C -0.0411(2) 0.16584(12) -0.00038(12) 0.0136(3) Uani 1 1 d . . . . .
H8A H -0.0069 0.1575 -0.0769 0.02 Uiso 1 1 calc R U . . .
H8B H -0.1882 0.1498 -0.0056 0.02 Uiso 1 1 calc R U . . .
H8C H 0.0022 0.1054 0.0194 0.02 Uiso 1 1 calc R U . . .
C9 C 0.50139(19) 0.74417(12) 0.54795(11) 0.0086(2) Uani 1 1 d . . . . .
C10 C 0.02595(19) 0.27770(12) 0.36344(11) 0.0093(2) Uani 1 1 d . . . . .
N0 N 0.25480(16) 0.50592(10) 0.15809(9) 0.0083(2) Uani 1 1 d . . . . .
N1 N 0.43897(17) 0.69729(10) 0.34976(10) 0.0088(2) Uani 1 1 d . . . . .
N2 N 0.08618(16) 0.32936(10) 0.20712(9) 0.0082(2) Uani 1 1 d . . . . .
N3 N 0.52954(18) 0.78429(11) 0.46164(10) 0.0103(2) Uani 1 1 d . . . . .
N4 N 0.00655(18) 0.24206(11) 0.24328(10) 0.0103(2) Uani 1 1 d . . . . .
N5 N 0.59653(18) 0.82913(11) 0.65733(10) 0.0114(2) Uani 1 1 d . . . . .
N6 N -0.06986(19) 0.18522(11) 0.38815(11) 0.0128(2) Uani 1 1 d . . . . .
O1 O 0.39341(14) 0.63638(8) 0.52144(8) 0.00977(18) Uani 1 1 d . . . . .
O2 O 0.12487(15) 0.38424(9) 0.43827(8) 0.01171(19) Uani 1 1 d . . . . .
O3 O 0.52499(15) 0.46389(9) 0.32281(9) 0.01054(19) Uani 1 1 d . . . . .
O4 O 0.00825(15) 0.56744(9) 0.34871(9) 0.01045(19) Uani 1 1 d . . . . .
Ni1 Ni 0.27089(2) 0.52045(2) 0.32463(2) 0.00736(6) Uani 1 1 d . . . . .
N7 N 0.10065(18) 0.89343(10) 0.37220(10) 0.0116(2) Uani 1 1 d . . . . .
O6 O 0.22242(19) 0.95930(10) 0.46892(10) 0.0250(3) Uani 1 1 d . . . . .
O7 O 0.10082(18) 0.92743(10) 0.29212(9) 0.0207(2) Uani 1 1 d . . . . .
O8 O -0.02381(16) 0.79222(9) 0.35587(9) 0.0160(2) Uani 1 1 d . . . . .
O5 O 0.31399(17) -0.01975(10) -0.14085(9) 0.0156(2) Uani 1 1 d . . . . .
Cl1 Cl 0.48125(5) 0.20891(3) 0.10800(3) 0.01313(8) Uani 1 1 d . . . . .
H3 H 0.600(3) 0.8532(19) 0.4764(16) 0.019(5) Uiso 1 1 d . . . . .
H3A H 0.553(3) 0.450(2) 0.376(2) 0.031(6) Uiso 1 1 d . . . . .
H3B H 0.522(3) 0.402(2) 0.262(2) 0.031(6) Uiso 1 1 d . . . . .
H4 H -0.068(3) 0.1729(18) 0.1971(16) 0.014(4) Uiso 1 1 d . . . . .
H4A H 0.007(3) 0.633(2) 0.3475(19) 0.032(6) Uiso 1 1 d . . . . .
H4B H -0.033(3) 0.572(2) 0.409(2) 0.029(5) Uiso 1 1 d . . . . .
H5A H 0.676(3) 0.8962(19) 0.6677(17) 0.020(5) Uiso 1 1 d . . . . .
H5B H 0.582(3) 0.8105(18) 0.7158(18) 0.022(5) Uiso 1 1 d . . . . .
H6A H -0.051(3) 0.1933(17) 0.4579(18) 0.017(4) Uiso 1 1 d . . . . .
H6B H -0.134(3) 0.117(2) 0.3324(19) 0.023(5) Uiso 1 1 d . . . . .
H1WA H 0.344(3) 0.047(2) -0.075(2) 0.034(6) Uiso 1 1 d . . . . .
H1WB H 0.383(4) -0.060(2) -0.133(2) 0.036(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 0 '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 0.006 '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'
Ni Ni 0.3393 1.1124 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
-1 0 0 0.09
1 -2 0 0.1
0 1 0 0.08
0 0 -1 0.065
0 0 1 0.09
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
C2 C0 C1 120.49(12) . . ?
C2 C0 H0 119.8 . . ?
C1 C0 H0 119.8 . . ?
C0 C1 C3 118.12(12) . . ?
C0 C1 H1 120.9 . . ?
C3 C1 H1 120.9 . . ?
C0 C2 C4 118.14(12) . . ?
C0 C2 H2 120.9 . . ?
C4 C2 H2 120.9 . . ?
N0 C3 C1 120.98(12) . . ?
N0 C3 C5 114.23(11) . . ?
C1 C3 C5 124.77(12) . . ?
N0 C4 C2 120.97(12) . . ?
N0 C4 C6 113.94(11) . . ?
C2 C4 C6 125.08(12) . . ?
N1 C5 C3 112.63(11) . . ?
N1 C5 C7 126.13(12) . . ?
C3 C5 C7 121.23(11) . . ?
N2 C6 C4 113.94(11) . . ?
N2 C6 C8 124.73(12) . . ?
C4 C6 C8 121.33(11) . . ?
C5 C7 H7A 109.5 . . ?
C5 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C5 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
O1 C9 N5 124.83(12) . . ?
O1 C9 N3 120.66(12) . . ?
N5 C9 N3 114.51(12) . . ?
O2 C10 N6 125.10(12) . . ?
O2 C10 N4 121.86(12) . . ?
N6 C10 N4 113.03(12) . . ?
C4 N0 C3 121.28(11) . . ?
C4 N0 Ni1 120.60(9) . . ?
C3 N0 Ni1 118.12(9) . . ?
C5 N1 N3 122.80(11) . . ?
C5 N1 Ni1 119.06(9) . . ?
N3 N1 Ni1 118.12(8) . . ?
C6 N2 N4 118.07(11) . . ?
C6 N2 Ni1 116.82(9) . . ?
N4 N2 Ni1 124.90(8) . . ?
N1 N3 C9 114.91(11) . . ?
N1 N3 H3 122.4(13) . . ?
C9 N3 H3 122.5(13) . . ?
N2 N4 C10 118.56(11) . . ?
N2 N4 H4 122.0(13) . . ?
C10 N4 H4 118.7(13) . . ?
C9 N5 H5A 119.8(13) . . ?
C9 N5 H5B 119.0(13) . . ?
H5A N5 H5B 121.0(18) . . ?
C10 N6 H6A 120.4(13) . . ?
C10 N6 H6B 118.6(14) . . ?
H6A N6 H6B 120.3(18) . . ?
C9 O1 Ni1 113.19(8) . . ?
Ni1 O3 H3A 114.7(16) . . ?
Ni1 O3 H3B 114.6(15) . . ?
H3A O3 H3B 106(2) . . ?
Ni1 O4 H4A 115.7(15) . . ?
Ni1 O4 H4B 116.9(15) . . ?
H4A O4 H4B 105(2) . . ?
N0 Ni1 O3 94.56(4) . . ?
N0 Ni1 O4 94.59(4) . . ?
O3 Ni1 O4 170.11(4) . . ?
N0 Ni1 N1 75.82(4) . . ?
O3 Ni1 N1 91.77(4) . . ?
O4 Ni1 N1 94.10(4) . . ?
N0 Ni1 N2 74.49(4) . . ?
O3 Ni1 N2 90.89(4) . . ?
O4 Ni1 N2 87.95(4) . . ?
N1 Ni1 N2 150.31(4) . . ?
N0 Ni1 O1 148.84(4) . . ?
O3 Ni1 O1 84.80(4) . . ?
O4 Ni1 O1 89.30(4) . . ?
N1 Ni1 O1 73.07(4) . . ?
N2 Ni1 O1 136.62(4) . . ?
O7 N7 O6 120.48(12) . . ?
O7 N7 O8 119.88(12) . . ?
O6 N7 O8 119.65(11) . . ?
H1WA O5 H1WB 106(2) . . ?
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
C0 C2 1.3900(19) . ?
C0 C1 1.3936(19) . ?
C0 H0 0.95 . ?
C1 C3 1.3955(18) . ?
C1 H1 0.95 . ?
C2 C4 1.3993(17) . ?
C2 H2 0.95 . ?
C3 N0 1.3435(16) . ?
C3 C5 1.4841(18) . ?
C4 N0 1.3387(17) . ?
C4 C6 1.4823(17) . ?
C5 N1 1.2888(17) . ?
C5 C7 1.4935(18) . ?
C6 N2 1.2957(17) . ?
C6 C8 1.4951(18) . ?
C7 H7A 0.98 . ?
C7 H7B 0.98 . ?
C7 H7C 0.98 . ?
C8 H8A 0.98 . ?
C8 H8B 0.98 . ?
C8 H8C 0.98 . ?
C9 O1 1.2481(16) . ?
C9 N5 1.3317(17) . ?
C9 N3 1.3818(16) . ?
C10 O2 1.2371(16) . ?
C10 N6 1.3440(17) . ?
C10 N4 1.3790(17) . ?
N0 Ni1 2.0289(11) . ?
N1 N3 1.3522(15) . ?
N1 Ni1 2.0914(11) . ?
N2 N4 1.3557(15) . ?
N2 Ni1 2.1826(11) . ?
N3 H3 0.81(2) . ?
N4 H4 0.815(19) . ?
N5 H5A 0.83(2) . ?
N5 H5B 0.87(2) . ?
N6 H6A 0.84(2) . ?
N6 H6B 0.83(2) . ?
O1 Ni1 2.2581(9) . ?
O3 Ni1 2.0369(10) . ?
O3 H3A 0.79(2) . ?
O3 H3B 0.82(2) . ?
O4 Ni1 2.0383(10) . ?
O4 H4A 0.82(2) . ?
O4 H4B 0.81(2) . ?
N7 O7 1.2478(15) . ?
N7 O6 1.2501(16) . ?
N7 O8 1.2612(15) . ?
O5 H1WA 0.86(2) . ?
O5 H1WB 0.80(3) . ?
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
C1 H1 Cl1 0.95 2.67 3.5301(13) 151.6 2_665
C7 H7A O6 0.98 2.42 3.2369(18) 140.8 2_676
C7 H7B O5 0.98 2.63 3.1688(17) 114.6 2_665
C8 H8A O7 0.98 2.44 3.3309(17) 150.7 2_565
C8 H8B Cl1 0.98 2.86 3.7292(14) 148.2 1_455
N3 H3 O6 0.81(2) 2.13(2) 2.9330(15) 174.5(18) 2_676
O3 H3A O1 0.79(2) 2.05(2) 2.8192(13) 164(2) 2_666
O3 H3B Cl1 0.82(2) 2.29(2) 3.1034(10) 170(2) .
N4 H4 O5 0.815(19) 2.038(19) 2.8006(16) 155.6(17) 2
O4 H4A O8 0.82(2) 1.99(2) 2.7995(14) 173(2) .
O4 H4B O2 0.81(2) 1.97(2) 2.7761(14) 169(2) 2_566
N5 H5A O7 0.83(2) 2.18(2) 3.0038(16) 175.2(18) 2_676
N5 H5B Cl1 0.87(2) 2.40(2) 3.2519(12) 169.7(17) 2_666
N6 H6A O6 0.84(2) 2.521(19) 3.1025(16) 127.2(15) 2_566
N6 H6A O8 0.84(2) 2.30(2) 3.1358(16) 174.8(17) 2_566
N6 H6B O5 0.83(2) 2.30(2) 3.0109(16) 144.3(18) 2
O5 H1WA Cl1 0.86(2) 2.27(2) 3.1132(11) 168(2) .
O5 H1WB Cl1 0.80(3) 2.37(3) 3.1514(12) 167(2) 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
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C2 C0 C1 C3 0.2(2) . . . . ?
C1 C0 C2 C4 0.7(2) . . . . ?
C0 C1 C3 N0 -0.74(19) . . . . ?
C0 C1 C3 C5 177.87(12) . . . . ?
C0 C2 C4 N0 -1.14(19) . . . . ?
C0 C2 C4 C6 178.08(12) . . . . ?
N0 C3 C5 N1 1.75(16) . . . . ?
C1 C3 C5 N1 -176.94(12) . . . . ?
N0 C3 C5 C7 -178.75(12) . . . . ?
C1 C3 C5 C7 2.6(2) . . . . ?
N0 C4 C6 N2 2.00(16) . . . . ?
C2 C4 C6 N2 -177.27(12) . . . . ?
N0 C4 C6 C8 -177.32(12) . . . . ?
C2 C4 C6 C8 3.4(2) . . . . ?
C2 C4 N0 C3 0.67(19) . . . . ?
C6 C4 N0 C3 -178.63(11) . . . . ?
C2 C4 N0 Ni1 -178.94(9) . . . . ?
C6 C4 N0 Ni1 1.75(15) . . . . ?
C1 C3 N0 C4 0.29(19) . . . . ?
C5 C3 N0 C4 -178.45(11) . . . . ?
C1 C3 N0 Ni1 179.92(9) . . . . ?
C5 C3 N0 Ni1 1.17(14) . . . . ?
C3 C5 N1 N3 177.67(11) . . . . ?
C7 C5 N1 N3 -1.8(2) . . . . ?
C3 C5 N1 Ni1 -3.86(15) . . . . ?
C7 C5 N1 Ni1 176.67(10) . . . . ?
C4 C6 N2 N4 -179.50(11) . . . . ?
C8 C6 N2 N4 -0.20(19) . . . . ?
C4 C6 N2 Ni1 -4.53(14) . . . . ?
C8 C6 N2 Ni1 174.76(10) . . . . ?
C5 N1 N3 C9 179.29(12) . . . . ?
Ni1 N1 N3 C9 0.81(15) . . . . ?
O1 C9 N3 N1 -2.41(18) . . . . ?
N5 C9 N3 N1 177.92(11) . . . . ?
C6 N2 N4 C10 -179.14(12) . . . . ?
Ni1 N2 N4 C10 6.34(16) . . . . ?
O2 C10 N4 N2 -4.86(19) . . . . ?
N6 C10 N4 N2 176.03(11) . . . . ?
N5 C9 O1 Ni1 -177.72(10) . . . . ?
N3 C9 O1 Ni1 2.64(15) . . . . ?
