#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/91/2019140.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2019140
loop_
_publ_author_name
'Guo, Cui-Lian'
'Yao, Xiao-Qiang'
'Cheng, Yong-Qiang'
'Liu, Yan'
_publ_section_title
;
 A three-dimensional polycatenation framework:
 catena-poly[[diaquabis(4-{4-[4-(pyridin-4-yl)phenoxy]phenyl}pyridine)nickel(II)]-μ₂-naphthalene-2,6-dicarboxylato]
;
_journal_coeditor_code           SF3203
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1022
_journal_page_last               1025
_journal_paper_doi               10.1107/S010827011302012X
_journal_volume                  69
_journal_year                    2013
_chemical_formula_iupac          '[Ni (C12 H6 O4) (C22 H16 N2 O)2 (H2 O)2]'
_chemical_formula_moiety         'C56 H42 N4 Ni O8'
_chemical_formula_sum            'C56 H42 N4 Ni O8'
_chemical_formula_weight         957.65
_chemical_name_systematic
catena-Poly[[diaquabis(4-{4-[4-(pyridin-4-yl)phenoxy]phenyl}pyridine)nickel(II)]-μ₂-naphthalene-2,6-dicarboxylato]
_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           SHELXL97
_cell_angle_alpha                90.00
_cell_angle_beta                 114.048(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.4739(6)
_cell_length_b                   15.9431(7)
_cell_length_c                   13.4291(8)
_cell_measurement_reflns_used    2556
_cell_measurement_temperature    290(2)
_cell_measurement_theta_max      28.6104
_cell_measurement_theta_min      3.0222
_cell_volume                     2243.4(2)
_computing_cell_refinement       'SAINT (Bruker, 2003)'
_computing_data_collection       'APEX2 (Bruker, 2003)'
_computing_data_reduction        'SAINT (Bruker, 2003)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      290(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEXII 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     0.71073
_diffrn_reflns_av_R_equivalents  0.0325
_diffrn_reflns_av_sigmaI/netI    0.0496
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            9294
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         3.05
_exptl_absorpt_coefficient_mu    0.497
_exptl_absorpt_correction_T_max  0.9158
_exptl_absorpt_correction_T_min  0.8900
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2003)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.418
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       diamond-like
_exptl_crystal_F_000             996
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.468
_refine_diff_density_min         -0.360
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     313
_refine_ls_number_reflns         4407
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.073
_refine_ls_R_factor_all          0.0667
_refine_ls_R_factor_gt           0.0469
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[σ²(Fo²)+(0.0526P)²+0.4401P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1134
_refine_ls_wR_factor_ref         0.1238
_reflns_number_gt                3337
_reflns_number_total             4407
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            sf3203.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2019140
_cod_database_fobs_code          2019140
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_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_symmetry_multiplicity
C C28 1.5548(2) 0.39910(19) 1.0747(2) 0.0480(7) Uani d . 1 1
H H28 1.5310 0.3429 1.0678 0.058 Uiso calc R 1 1
C C1 0.8999(2) 0.63210(17) 0.6008(2) 0.0411(7) Uani d . 1 1
H H1 0.9834 0.6509 0.6227 0.049 Uiso calc R 1 1
C C2 0.8213(2) 0.67478(17) 0.6381(2) 0.0431(7) Uani d . 1 1
H H2 0.8516 0.7217 0.6822 0.052 Uiso calc R 1 1
C C3 0.6972(2) 0.64781(17) 0.6097(2) 0.0385(6) Uani d . 1 1
C C4 0.6583(2) 0.58020(18) 0.5387(2) 0.0443(7) Uani d . 1 1
H H4 0.5749 0.5606 0.5146 0.053 Uiso calc R 1 1
C C5 0.7424(2) 0.54190(18) 0.5035(2) 0.0425(7) Uani d . 1 1
H H5 0.7130 0.4973 0.4550 0.051 Uiso calc R 1 1
C C6 0.0121(4) 1.1782(2) 0.4638(3) 0.0695(10) Uani d . 1 1
H H6 0.0204 1.2030 0.4044 0.083 Uiso calc R 1 1
C C7 0.0923(3) 1.11316(19) 0.5138(3) 0.0617(9) Uani d U 1 1
H H7 0.1542 1.0967 0.4897 0.074 Uiso calc R 1 1
C C8 0.0816(2) 1.07171(17) 0.6006(2) 0.0424(7) Uani d U 1 1
C C9 -0.0189(3) 1.0983(2) 0.6247(3) 0.0547(8) Uani d . 1 1
H H9 -0.0370 1.0706 0.6778 0.066 Uiso calc R 1 1
C C10 -0.0921(3) 1.1658(2) 0.5700(3) 0.0655(9) Uani d . 1 1
H H10 -0.1580 1.1822 0.5892 0.079 Uiso calc R 1 1
C C11 0.1694(3) 1.00347(17) 0.6605(2) 0.0428(7) Uani d . 1 1
C C12 0.1460(3) 0.95092(19) 0.7323(3) 0.0509(8) Uani d . 1 1
H H12 0.0751 0.9611 0.7476 0.061 Uiso calc R 1 1
C C13 0.2241(3) 0.8842(2) 0.7818(3) 0.0534(8) Uani d . 1 1
H H13 0.2066 0.8500 0.8301 0.064 Uiso calc R 1 1
C C14 0.3280(3) 0.8685(2) 0.7589(3) 0.0542(8) Uani d . 1 1
C C15 0.3585(3) 0.9217(2) 0.6946(3) 0.0783(12) Uani d . 1 1
H H15 0.4323 0.9128 0.6832 0.094 Uiso calc R 1 1
C C16 0.2804(3) 0.9890(2) 0.6458(3) 0.0659(10) Uani d . 1 1
H H16 0.3027 1.0253 0.6022 0.079 Uiso calc R 1 1
C C17 0.4718(3) 0.7634(2) 0.7554(3) 0.0575(9) Uani d . 1 1
C C18 0.4114(3) 0.7278(3) 0.6543(3) 0.0680(10) Uani d . 1 1
H H18 0.3229 0.7292 0.6186 0.082 Uiso calc R 1 1
C C19 0.4837(3) 0.6898(2) 0.6058(3) 0.0584(9) Uani d . 1 1
H H19 0.4433 0.6655 0.5373 0.070 Uiso calc R 1 1
C C20 0.6160(2) 0.68767(17) 0.6584(2) 0.0419(7) Uani d . 1 1
C C21 0.6722(3) 0.7247(2) 0.7604(3) 0.0536(8) Uani d . 1 1
H H21 0.7607 0.7244 0.7969 0.064 Uiso calc R 1 1
C C22 0.6007(3) 0.7619(2) 0.8091(3) 0.0589(9) Uani d . 1 1
H H22 0.6403 0.7857 0.8780 0.071 Uiso calc R 1 1
C C23 1.1790(2) 0.46317(19) 0.7315(2) 0.0367(6) Uani d . 1 1
C C24 1.3388(3) 0.5745(2) 0.8383(2) 0.0490(7) Uani d . 1 1
H H24 1.2918 0.6130 0.7851 0.059 Uiso calc R 1 1
C C25 1.2988(2) 0.49020(17) 0.8275(2) 0.0370(6) Uani d . 1 1
C C26 1.3672(2) 0.43308(19) 0.9036(2) 0.0404(7) Uani d . 1 1
H H26 1.3402 0.3775 0.8964 0.048 Uiso calc R 1 1
C C27 1.4817(2) 0.45770(17) 0.9958(2) 0.0358(6) Uani d . 1 1
N N1 0.86374(18) 0.56559(13) 0.53535(17) 0.0336(5) Uani d . 1 1
N N2 -0.0763(3) 1.20860(17) 0.4932(3) 0.0668(8) Uani d . 1 1
Ni Ni1 1.0000 0.5000 0.5000 0.02874(15) Uani d S 1 2
O O1 1.13149(16) 0.51694(11) 0.65671(14) 0.0400(5) Uani d . 1 1
O O2 1.13494(17) 0.39159(13) 0.73173(16) 0.0546(6) Uani d . 1 1
O O3 0.4003(2) 0.79838(16) 0.8081(2) 0.0760(7) Uani d . 1 1
O O4 1.06571(15) 0.61064(11) 0.45375(14) 0.0367(4) Uani d . 1 1
H H4B 1.0046 0.6333 0.4007 0.055 Uiso d R 1 1
H H4C 1.0928 0.6443 0.5075 0.055 Uiso d R 1 1
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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
C24 C28 C27 3_867 . 119.3(3)
C24 C28 H28 3_867 . 120.3
C27 C28 H28 . . 120.3
N1 C1 C2 . . 124.1(2)
N1 C1 H1 . . 118.0
C2 C1 H1 . . 118.0
C1 C2 C3 . . 120.0(3)
C1 C2 H2 . . 120.0
C3 C2 H2 . . 120.0
C2 C3 C4 . . 115.9(2)
C2 C3 C20 . . 120.4(3)
C4 C3 C20 . . 123.6(2)
C5 C4 C3 . . 120.4(2)
C5 C4 H4 . . 119.8
C3 C4 H4 . . 119.8
N1 C5 C4 . . 123.4(3)
N1 C5 H5 . . 118.3
C4 C5 H5 . . 118.3
N2 C6 C7 . . 125.3(4)
N2 C6 H6 . . 117.4
C7 C6 H6 . . 117.4
C6 C7 C8 . . 120.0(3)
C6 C7 H7 . . 120.0
C8 C7 H7 . . 120.0
C9 C8 C7 . . 114.7(3)
C9 C8 C11 . . 123.1(3)
C7 C8 C11 . . 122.2(3)
C10 C9 C8 . . 119.9(3)
C10 C9 H9 . . 120.0
C8 C9 H9 . . 120.0
N2 C10 C9 . . 125.2(3)
N2 C10 H10 . . 117.4
C9 C10 H10 . . 117.4
C12 C11 C16 . . 116.7(3)
C12 C11 C8 . . 122.8(2)
C16 C11 C8 . . 120.5(3)
C13 C12 C11 . . 122.1(3)
C13 C12 H12 . . 119.0
C11 C12 H12 . . 119.0
C14 C13 C12 . . 119.2(3)
C14 C13 H13 . . 120.4
C12 C13 H13 . . 120.4
C15 C14 C13 . . 120.3(3)
C15 C14 O3 . . 123.2(3)
C13 C14 O3 . . 116.5(3)
C14 C15 C16 . . 120.2(3)
C14 C15 H15 . . 119.9
C16 C15 H15 . . 119.9
C15 C16 C11 . . 121.2(3)
C15 C16 H16 . . 119.4
C11 C16 H16 . . 119.4
C22 C17 C18 . . 121.4(3)
C22 C17 O3 . . 118.4(3)
C18 C17 O3 . . 120.2(3)
C17 C18 C19 . . 119.3(3)
C17 C18 H18 . . 120.4
C19 C18 H18 . . 120.4
C18 C19 C20 . . 120.8(3)
C18 C19 H19 . . 119.6
C20 C19 H19 . . 119.6
C21 C20 C19 . . 117.6(3)
C21 C20 C3 . . 119.7(2)
C19 C20 C3 . . 122.6(3)
C22 C21 C20 . . 121.8(3)
C22 C21 H21 . . 119.1
C20 C21 H21 . . 119.1
C17 C22 C21 . . 119.2(3)
C17 C22 H22 . . 120.4
C21 C22 H22 . . 120.4
O2 C23 O1 . . 125.3(2)
O2 C23 C25 . . 119.0(2)
O1 C23 C25 . . 115.6(3)
C28 C24 C25 3_867 . 121.5(3)
C28 C24 H24 3_867 . 119.3
C25 C24 H24 . . 119.3
C26 C25 C24 . . 120.0(2)
C26 C25 C23 . . 119.8(3)
C24 C25 C23 . . 120.3(2)
C25 C26 C27 . . 120.6(3)
C25 C26 H26 . . 119.7
C27 C26 H26 . . 119.7
C27 C27 C28 3_867 . 120.8(3)
C27 C27 C26 3_867 . 117.9(3)
C28 C27 C26 . . 121.3(3)
C1 N1 C5 . . 116.2(2)
C1 N1 Ni1 . . 119.22(16)
C5 N1 Ni1 . . 124.43(18)
C10 N2 C6 . . 114.4(3)
O1 Ni1 O1 . 3_766 180.0
O1 Ni1 N1 . . 90.38(8)
O1 Ni1 N1 3_766 . 89.62(8)
O1 Ni1 N1 . 3_766 89.62(8)
O1 Ni1 N1 3_766 3_766 90.38(8)
N1 Ni1 N1 . 3_766 180.00(6)
O1 Ni1 O4 . 3_766 90.56(7)
O1 Ni1 O4 3_766 3_766 89.44(7)
N1 Ni1 O4 . 3_766 87.78(7)
N1 Ni1 O4 3_766 3_766 92.22(7)
O1 Ni1 O4 . . 89.44(7)
O1 Ni1 O4 3_766 . 90.56(7)
N1 Ni1 O4 . . 92.22(7)
N1 Ni1 O4 3_766 . 87.78(7)
O4 Ni1 O4 3_766 . 180.0
C23 O1 Ni1 . . 128.79(18)
C14 O3 C17 . . 116.1(2)
Ni1 O4 H4B . . 109.3
Ni1 O4 H4C . . 109.2
H4B O4 H4C . . 109.5
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
C28 C24 3_867 1.368(4)
C28 C27 . 1.405(4)
C28 H28 . 0.9300
C1 N1 . 1.331(3)
C1 C2 . 1.375(4)
C1 H1 . 0.9300
C2 C3 . 1.385(4)
C2 H2 . 0.9300
C3 C4 . 1.387(4)
C3 C20 . 1.481(4)
C4 C5 . 1.378(4)
C4 H4 . 0.9300
C5 N1 . 1.334(3)
C5 H5 . 0.9300
C6 N2 . 1.321(4)
C6 C7 . 1.367(4)
C6 H6 . 0.9300
C7 C8 . 1.388(4)
C7 H7 . 0.9300
C8 C9 . 1.386(4)
C8 C11 . 1.478(4)
C9 C10 . 1.378(4)
C9 H9 . 0.9300
C10 N2 . 1.311(4)
C10 H10 . 0.9300
C11 C12 . 1.384(4)
C11 C16 . 1.385(4)
C12 C13 . 1.376(4)
C12 H12 . 0.9300
C13 C14 . 1.369(4)
C13 H13 . 0.9300
C14 C15 . 1.354(4)
C14 O3 . 1.389(4)
C15 C16 . 1.381(4)
C15 H15 . 0.9300
C16 H16 . 0.9300
C17 C22 . 1.357(4)
C17 C18 . 1.370(5)
C17 O3 . 1.400(3)
C18 C19 . 1.385(4)
C18 H18 . 0.9300
C19 C20 . 1.390(4)
C19 H19 . 0.9300
C20 C21 . 1.386(4)
C21 C22 . 1.374(4)
C21 H21 . 0.9300
C22 H22 . 0.9300
C23 O2 . 1.249(3)
C23 O1 . 1.263(3)
C23 C25 . 1.514(4)
C24 C28 3_867 1.368(4)
C24 C25 . 1.408(4)
C24 H24 . 0.9300
C25 C26 . 1.355(4)
C26 C27 . 1.445(3)
C26 H26 . 0.9300
C27 C27 3_867 1.403(5)
N1 Ni1 . 2.0900(19)
Ni1 O1 . 2.0470(17)
Ni1 O1 3_766 2.0470(17)
Ni1 N1 3_766 2.0900(19)
Ni1 O4 3_766 2.1089(17)
Ni1 O4 . 2.1089(17)
O4 H4B . 0.8500
O4 H4C . 0.8501
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
O4 H4C N2 3_676 0.85 2.35 2.959(3) 128.7
O4 H4B O2 3_766 0.85 1.89 2.614(2) 142.5
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_site_symmetry_1
_geom_torsion_site_symmetry_4
_geom_torsion
N1 C1 C2 C3 . . 1.6(5)
C1 C2 C3 C4 . . -3.5(4)
C1 C2 C3 C20 . . 173.6(3)
C2 C3 C4 C5 . . 2.3(4)
C20 C3 C4 C5 . . -174.6(3)
C3 C4 C5 N1 . . 0.9(5)
N2 C6 C7 C8 . . 2.2(6)
C6 C7 C8 C9 . . 3.9(5)
C6 C7 C8 C11 . . -177.3(3)
C7 C8 C9 C10 . . -5.3(4)
C11 C8 C9 C10 . . 176.0(3)
C8 C9 C10 N2 . . 0.8(5)
C9 C8 C11 C12 . . 11.6(4)
C7 C8 C11 C12 . . -167.1(3)
C9 C8 C11 C16 . . -169.0(3)
C7 C8 C11 C16 . . 12.4(5)
C16 C11 C12 C13 . . -4.0(5)
C8 C11 C12 C13 . . 175.5(3)
C11 C12 C13 C14 . . -0.5(5)
C12 C13 C14 C15 . . 4.7(5)
C12 C13 C14 O3 . . -177.6(3)
C13 C14 C15 C16 . . -4.2(6)
O3 C14 C15 C16 . . 178.3(4)
C14 C15 C16 C11 . . -0.5(6)
C12 C11 C16 C15 . . 4.5(5)
C8 C11 C16 C15 . . -175.0(3)
C22 C17 C18 C19 . . -0.2(5)
O3 C17 C18 C19 . . -176.8(3)
C17 C18 C19 C20 . . -0.2(5)
C18 C19 C20 C21 . . 0.0(5)
C18 C19 C20 C3 . . -180.0(3)
C2 C3 C20 C21 . . -26.9(4)
C4 C3 C20 C21 . . 149.9(3)
C2 C3 C20 C19 . . 153.1(3)
C4 C3 C20 C19 . . -30.1(4)
C19 C20 C21 C22 . . 0.5(5)
C3 C20 C21 C22 . . -179.5(3)
C18 C17 C22 C21 . . 0.7(5)
O3 C17 C22 C21 . . 177.4(3)
C20 C21 C22 C17 . . -0.8(5)
C28 C24 C25 C26 3_867 . -0.9(4)
C28 C24 C25 C23 3_867 . 178.8(3)
O2 C23 C25 C26 . . 10.2(4)
O1 C23 C25 C26 . . -170.2(2)
O2 C23 C25 C24 . . -169.5(3)
O1 C23 C25 C24 . . 10.2(4)
C24 C25 C26 C27 . . -0.4(4)
C23 C25 C26 C27 . . 180.0(2)
C24 C28 C27 C27 3_867 3_867 1.3(5)
C24 C28 C27 C26 3_867 . -178.8(3)
C25 C26 C27 C27 . 3_867 0.8(4)
C25 C26 C27 C28 . . -179.1(3)
C2 C1 N1 C5 . . 1.7(4)
C2 C1 N1 Ni1 . . -173.3(2)
C4 C5 N1 C1 . . -2.9(4)
C4 C5 N1 Ni1 . . 171.8(2)
C9 C10 N2 C6 . . 5.1(5)
C7 C6 N2 C10 . . -6.7(5)
C1 N1 Ni1 O1 . . 38.0(2)
C5 N1 Ni1 O1 . . -136.6(2)
C1 N1 Ni1 O1 . 3_766 -142.0(2)
C5 N1 Ni1 O1 . 3_766 43.4(2)
C1 N1 Ni1 O4 . 3_766 128.5(2)
C5 N1 Ni1 O4 . 3_766 -46.0(2)
C1 N1 Ni1 O4 . . -51.5(2)
C5 N1 Ni1 O4 . . 134.0(2)
O2 C23 O1 Ni1 . . -16.5(4)
C25 C23 O1 Ni1 . . 163.91(16)
N1 Ni1 O1 C23 . . 110.7(2)
N1 Ni1 O1 C23 3_766 . -69.3(2)
O4 Ni1 O1 C23 3_766 . 22.9(2)
O4 Ni1 O1 C23 . . -157.1(2)
C15 C14 O3 C17 . . -26.7(5)
C13 C14 O3 C17 . . 155.7(3)
C22 C17 O3 C14 . . 117.8(3)
C18 C17 O3 C14 . . -65.4(4)
