#------------------------------------------------------------------------------
#$Date: 2016-03-26 22:56:04 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180523 $
#$URL: svn://www.crystallography.net/cod/cif/7/21/92/7219264.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_7219264
loop_
_publ_author_name
'Kang, Meng'
'Yang, Guo-Ping'
'Hou, Lei'
'Wu, Wei-Ping'
'Wu, Yun-Long'
'Wang, Yao-Yu'
_publ_section_title
;
 Peculiar phenomena of structural transformations triggered from a nickel
 coordination polymer
;
_journal_issue                   8
_journal_name_full               CrystEngComm
_journal_page_first              1839
_journal_paper_doi               10.1039/C4CE02333A
_journal_volume                  17
_journal_year                    2015
_chemical_formula_sum            'C25 H16 N2 Ni O5'
_chemical_formula_weight         483.11
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2014-04-23 deposited with the CCDC.
2015-01-12 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 102.748(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.883(7)
_cell_length_b                   18.292(13)
_cell_length_c                   13.048(9)
_cell_measurement_temperature    296(2)
_cell_volume                     2301(3)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.974
_diffrn_measured_fraction_theta_max 0.974
_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  0.0331
_diffrn_reflns_av_sigmaI/netI    0.0749
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            4975
_diffrn_reflns_theta_full        25.09
_diffrn_reflns_theta_max         25.09
_diffrn_reflns_theta_min         2.23
_exptl_absorpt_coefficient_mu    0.881
_exptl_absorpt_correction_T_max  0.8163
_exptl_absorpt_correction_T_min  0.7779
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_density_diffrn    1.395
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             992
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.24
_refine_diff_density_max         1.090
_refine_diff_density_min         -0.545
_refine_diff_density_rms         0.126
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.85(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.007
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     298
_refine_ls_number_reflns         3321
_refine_ls_number_restraints     200
_refine_ls_restrained_S_all      0.987
_refine_ls_R_factor_all          0.0766
_refine_ls_R_factor_gt           0.0657
_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)+(0.0900P)²+13.4240P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1676
_refine_ls_wR_factor_ref         0.1768
_reflns_number_gt                2867
_reflns_number_total             3321
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4ce02333a2.cif
_cod_data_source_block           1
_cod_depositor_comments
'Adding full bibliography for 7219261--7219264.cif.'
_cod_original_sg_symbol_H-M      Cc
_cod_database_code               7219264
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'x, -y, z+1/2'
'x+1/2, y+1/2, z'
'x+1/2, -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
C1 C 0.2114(8) 0.9816(5) 0.6158(7) 0.0388(18) Uani 1 1 d U
C2 C 0.0850(8) 0.9538(5) 0.6559(7) 0.0393(19) Uani 1 1 d U
C3 C -0.0009(9) 0.9020(5) 0.5959(8) 0.051(2) Uani 1 1 d U
H3 H 0.0134 0.8882 0.5305 0.061 Uiso 1 1 calc R
C4 C -0.1065(9) 0.8714(6) 0.6336(8) 0.051(2) Uani 1 1 d U
H4 H -0.1628 0.8367 0.5928 0.061 Uiso 1 1 calc R
C5 C -0.1334(8) 0.8906(5) 0.7320(7) 0.044(2) Uani 1 1 d U
C6 C -0.0518(10) 0.9457(5) 0.7903(7) 0.051(2) Uani 1 1 d U
H6 H -0.0712 0.9625 0.8528 0.061 Uiso 1 1 calc R
C7 C 0.0601(10) 0.9751(5) 0.7526(7) 0.047(2) Uani 1 1 d U
H7 H 0.1181 1.0093 0.7930 0.056 Uiso 1 1 calc R
C8 C -0.2386(9) 0.8522(5) 0.7781(8) 0.050(2) Uani 1 1 d U
C9 C -0.3381(9) 0.8015(5) 0.7103(8) 0.048(2) Uani 1 1 d U
C10 C -0.3442(13) 0.7272(6) 0.7384(10) 0.069(3) Uani 1 1 d U
H10 H -0.2840 0.7099 0.7986 0.083 Uiso 1 1 calc R
C11 C -0.4350(14) 0.6811(6) 0.6799(13) 0.078(4) Uani 1 1 d U
H11 H -0.4377 0.6329 0.7022 0.094 Uiso 1 1 calc R
C12 C -0.5218(12) 0.7016(6) 0.5910(11) 0.068(3) Uani 1 1 d U
H12 H -0.5813 0.6677 0.5511 0.082 Uiso 1 1 calc R
C13 C -0.5224(10) 0.7738(6) 0.5587(9) 0.057(3) Uani 1 1 d U
H13 H -0.5826 0.7887 0.4970 0.068 Uiso 1 1 calc R
C14 C -0.4331(8) 0.8239(5) 0.6185(7) 0.0374(18) Uani 1 1 d U
C15 C -0.4552(8) 0.9052(4) 0.5944(6) 0.0328(17) Uani 1 1 d U
C16 C 0.5828(11) 1.1013(5) 0.7457(7) 0.052(2) Uani 1 1 d U
H16 H 0.5540 1.0611 0.7789 0.062 Uiso 1 1 calc R
C17 C 0.6441(12) 1.1599(5) 0.8069(7) 0.055(3) Uani 1 1 d U
H17 H 0.6566 1.1584 0.8797 0.067 Uiso 1 1 calc R
C18 C 0.6863(8) 1.2204(5) 0.7588(7) 0.039(2) Uani 1 1 d U
C19 C 0.6651(8) 1.2194(5) 0.6507(7) 0.0416(19) Uani 1 1 d U
H19 H 0.6901 1.2593 0.6147 0.050 Uiso 1 1 calc R
C20 C 0.6056(9) 1.1577(5) 0.5964(7) 0.0411(19) Uani 1 1 d U
H20 H 0.5952 1.1572 0.5238 0.049 Uiso 1 1 calc R
C21 C 0.3779(9) 1.1040(4) 0.3607(6) 0.0390(19) Uani 1 1 d U
H21 H 0.4360 1.0701 0.3392 0.047 Uiso 1 1 calc R
C22 C 0.3326(9) 1.1643(5) 0.2958(6) 0.0410(19) Uani 1 1 d U
H22 H 0.3647 1.1713 0.2347 0.049 Uiso 1 1 calc R
C23 C 0.2402(8) 1.2132(4) 0.3231(6) 0.0348(18) Uani 1 1 d U
C24 C 0.2014(12) 1.1989(6) 0.4156(8) 0.062(3) Uani 1 1 d U
H24 H 0.1413 1.2311 0.4384 0.075 Uiso 1 1 calc R
C25 C 0.2477(12) 1.1394(6) 0.4752(8) 0.061(3) Uani 1 1 d U
H25 H 0.2132 1.1302 0.5348 0.074 Uiso 1 1 calc R
N1 N 0.5636(8) 1.1007(4) 0.6400(5) 0.0394(16) Uani 1 1 d U
N2 N 0.3414(7) 1.0933(4) 0.4512(5) 0.0337(15) Uani 1 1 d U
Ni1 Ni 0.42392(8) 1.02030(5) 0.56700(7) 0.0321(3) Uani 1 1 d U
O1 O 0.2761(6) 1.0352(3) 0.6630(5) 0.0395(14) Uani 1 1 d U
O2 O 0.2405(7) 0.9521(4) 0.5396(5) 0.0527(16) Uani 1 1 d U
O3 O -0.2396(10) 0.8580(6) 0.8710(6) 0.087(3) Uani 1 1 d U
O4 O -0.4708(6) 0.9304(3) 0.5039(5) 0.0471(15) Uani 1 1 d U
O5 O -0.4722(6) 0.9420(3) 0.6706(4) 0.0415(14) Uani 1 1 d U
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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O2 C1 O1 124.0(8) . .
O2 C1 C2 119.0(8) . .
O1 C1 C2 117.0(7) . .
C3 C2 C7 119.5(8) . .
C3 C2 C1 118.2(8) . .
C7 C2 C1 122.2(8) . .
C4 C3 C2 119.7(9) . .
C4 C3 H3 120.2 . .
C2 C3 H3 120.2 . .
C3 C4 C5 122.5(9) . .
C3 C4 H4 118.7 . .
C5 C4 H4 118.7 . .
C6 C5 C4 118.1(8) . .
C6 C5 C8 119.2(8) . .
C4 C5 C8 122.7(9) . .
C5 C6 C7 119.0(9) . .
C5 C6 H6 120.5 . .
C7 C6 H6 120.5 . .
C2 C7 C6 121.1(9) . .
C2 C7 H7 119.4 . .
C6 C7 H7 119.4 . .
O3 C8 C5 121.4(9) . .
O3 C8 C9 119.6(9) . .
C5 C8 C9 118.8(8) . .
C14 C9 C10 116.3(10) . .
C14 C9 C8 123.4(8) . .
C10 C9 C8 120.3(9) . .
C11 C10 C9 121.3(12) . .
C11 C10 H10 119.4 . .
C9 C10 H10 119.4 . .
C12 C11 C10 122.6(11) . .
C12 C11 H11 118.7 . .
C10 C11 H11 118.7 . .
C11 C12 C13 119.4(10) . .
C11 C12 H12 120.3 . .
C13 C12 H12 120.3 . .
C12 C13 C14 120.0(11) . .
C12 C13 H13 120.0 . .
C14 C13 H13 120.0 . .
C13 C14 C9 120.5(9) . .
C13 C14 C15 118.9(8) . .
C9 C14 C15 119.8(8) . .
O5 C15 O4 123.2(8) . .
O5 C15 C14 113.8(7) . .
O4 C15 C14 122.6(7) . .
O5 C15 Ni1 59.6(4) . 1_455
O4 C15 Ni1 65.3(4) . 1_455
C14 C15 Ni1 157.9(5) . 1_455
N1 C16 C17 122.5(8) . .
N1 C16 H16 118.8 . .
C17 C16 H16 118.8 . .
C18 C17 C16 119.5(8) . .
C18 C17 H17 120.3 . .
C16 C17 H17 120.3 . .
C19 C18 C17 117.6(8) . .
C19 C18 C23 122.3(7) . 4_575
C17 C18 C23 119.8(8) . 4_575
C18 C19 C20 118.8(8) . .
C18 C19 H19 120.6 . .
C20 C19 H19 120.6 . .
N1 C20 C19 124.7(8) . .
N1 C20 H20 117.7 . .
C19 C20 H20 117.7 . .
N2 C21 C22 122.8(7) . .
N2 C21 H21 118.6 . .
C22 C21 H21 118.6 . .
C23 C22 C21 119.6(7) . .
C23 C22 H22 120.2 . .
C21 C22 H22 120.2 . .
C24 C23 C22 115.7(8) . .
C24 C23 C18 120.7(8) . 4_474
C22 C23 C18 123.5(7) . 4_474
C25 C24 C23 122.2(8) . .
C25 C24 H24 118.9 . .
C23 C24 H24 118.9 . .
N2 C25 C24 122.2(8) . .
N2 C25 H25 118.9 . .
C24 C25 H25 118.9 . .
C20 N1 C16 117.0(8) . .
C20 N1 Ni1 127.3(6) . .
C16 N1 Ni1 113.6(6) . .
C21 N2 C25 117.1(7) . .
C21 N2 Ni1 127.8(6) . .
C25 N2 Ni1 114.9(6) . .
N2 Ni1 O5 171.5(3) . 1_655
N2 Ni1 N1 89.6(3) . .
O5 Ni1 N1 90.4(3) 1_655 .
N2 Ni1 O1 97.8(3) . .
O5 Ni1 O1 90.6(2) 1_655 .
N1 Ni1 O1 96.3(3) . .
N2 Ni1 O2 94.1(3) . .
O5 Ni1 O2 89.2(2) 1_655 .
N1 Ni1 O2 157.4(3) . .
O1 Ni1 O2 61.0(2) . .
N2 Ni1 O4 110.8(3) . 1_655
O5 Ni1 O4 61.4(2) 1_655 1_655
N1 Ni1 O4 112.1(3) . 1_655
O1 Ni1 O4 139.0(2) . 1_655
O2 Ni1 O4 87.4(3) . 1_655
N2 Ni1 C15 141.6(3) . 1_655
O5 Ni1 C15 31.1(2) 1_655 1_655
N1 Ni1 C15 106.9(3) . 1_655
O1 Ni1 C15 113.9(2) . 1_655
O2 Ni1 C15 83.7(3) . 1_655
O4 Ni1 C15 30.9(2) 1_655 1_655
C1 O1 Ni1 87.3(5) . .
C1 O2 Ni1 87.1(5) . .
C15 O4 Ni1 83.8(5) . 1_455
C15 O5 Ni1 89.3(5) . 1_455
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O2 1.220(11) .
C1 O1 1.257(10) .
C1 C2 1.543(12) .
C2 C3 1.393(13) .
C2 C7 1.394(13) .
C3 C4 1.367(13) .
C3 H3 0.9300 .
C4 C5 1.411(13) .
C4 H4 0.9300 .
C5 C6 1.405(13) .
C5 C8 1.487(12) .
C6 C7 1.413(13) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 O3 1.219(13) .
C8 C9 1.493(14) .
C9 C14 1.410(13) .
C9 C10 1.412(14) .
C10 C11 1.341(18) .
C10 H10 0.9300 .
C11 C12 1.335(18) .
C11 H11 0.9300 .
C12 C13 1.387(16) .
C12 H12 0.9300 .
C13 C14 1.386(13) .
C13 H13 0.9300 .
C14 C15 1.525(12) .
C15 O5 1.243(10) .
C15 O4 1.246(10) .
C15 Ni1 2.409(8) 1_455
C16 N1 1.350(11) .
C16 C17 1.394(13) .
C16 H16 0.9300 .
C17 C18 1.380(13) .
C17 H17 0.9300 .
C18 C19 1.380(12) .
C18 C23 1.506(11) 4_575
C19 C20 1.392(12) .
C19 H19 0.9300 .
C20 N1 1.299(12) .
C20 H20 0.9300 .
C21 N2 1.323(11) .
C21 C22 1.402(12) .
C21 H21 0.9300 .
C22 C23 1.380(12) .
C22 H22 0.9300 .
C23 C24 1.370(12) .
C23 C18 1.506(11) 4_474
C24 C25 1.358(15) .
C24 H24 0.9300 .
C25 N2 1.339(12) .
C25 H25 0.9300 .
N1 Ni1 2.096(7) .
N2 Ni1 2.047(7) .
Ni1 O5 2.078(6) 1_655
Ni1 O1 2.141(5) .
Ni1 O2 2.165(7) .
Ni1 O4 2.201(6) 1_655
Ni1 C15 2.409(8) 1_655
O4 Ni1 2.201(6) 1_455
O5 Ni1 2.078(6) 1_455
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
O2 C1 C2 C3 -7.7(12) . .
O1 C1 C2 C3 170.4(8) . .
O2 C1 C2 C7 168.0(8) . .
O1 C1 C2 C7 -13.9(12) . .
C7 C2 C3 C4 -1.5(13) . .
C1 C2 C3 C4 174.3(8) . .
C2 C3 C4 C5 0.3(15) . .
C3 C4 C5 C6 3.1(14) . .
C3 C4 C5 C8 -173.6(9) . .
C4 C5 C6 C7 -5.2(13) . .
C8 C5 C6 C7 171.6(8) . .
C3 C2 C7 C6 -0.7(13) . .
C1 C2 C7 C6 -176.3(8) . .
C5 C6 C7 C2 4.1(13) . .
C6 C5 C8 O3 -13.0(15) . .
C4 C5 C8 O3 163.6(10) . .
C6 C5 C8 C9 171.5(8) . .
C4 C5 C8 C9 -11.9(13) . .
O3 C8 C9 C14 123.2(11) . .
C5 C8 C9 C14 -61.2(12) . .
O3 C8 C9 C10 -54.6(14) . .
C5 C8 C9 C10 121.0(10) . .
C14 C9 C10 C11 0.5(15) . .
C8 C9 C10 C11 178.4(10) . .
C9 C10 C11 C12 1.9(19) . .
C10 C11 C12 C13 -2.2(18) . .
C11 C12 C13 C14 0.2(15) . .
C12 C13 C14 C9 2.1(13) . .
C12 C13 C14 C15 -167.6(8) . .
C10 C9 C14 C13 -2.4(12) . .
C8 C9 C14 C13 179.7(8) . .
C10 C9 C14 C15 167.3(8) . .
C8 C9 C14 C15 -10.6(12) . .
C13 C14 C15 O5 122.6(8) . .
C9 C14 C15 O5 -47.2(10) . .
C13 C14 C15 O4 -49.4(11) . .
C9 C14 C15 O4 140.7(8) . .
C13 C14 C15 Ni1 55.3(18) . 1_455
C9 C14 C15 Ni1 -114.6(14) . 1_455
N1 C16 C17 C18 0.6(16) . .
C16 C17 C18 C19 0.0(15) . .
C16 C17 C18 C23 174.3(9) . 4_575
C17 C18 C19 C20 -1.3(13) . .
C23 C18 C19 C20 -175.4(8) 4_575 .
C18 C19 C20 N1 2.3(14) . .
N2 C21 C22 C23 -3.6(13) . .
C21 C22 C23 C24 1.3(13) . .
C21 C22 C23 C18 179.7(8) . 4_474
C22 C23 C24 C25 -1.8(17) . .
C18 C23 C24 C25 179.7(10) 4_474 .
C23 C24 C25 N2 4.5(19) . .
C19 C20 N1 C16 -1.8(14) . .
C19 C20 N1 Ni1 160.6(7) . .
C17 C16 N1 C20 0.3(15) . .
C17 C16 N1 Ni1 -164.5(8) . .
C22 C21 N2 C25 6.0(13) . .
C22 C21 N2 Ni1 -167.8(6) . .
C24 C25 N2 C21 -6.4(16) . .
C24 C25 N2 Ni1 168.2(10) . .
C21 N2 Ni1 O5 2(2) . 1_655
C25 N2 Ni1 O5 -171.9(16) . 1_655
C21 N2 Ni1 N1 91.8(7) . .
C25 N2 Ni1 N1 -82.1(8) . .
C21 N2 Ni1 O1 -171.9(7) . .
C25 N2 Ni1 O1 14.2(8) . .
C21 N2 Ni1 O2 -110.6(7) . .
C25 N2 Ni1 O2 75.5(7) . .
C21 N2 Ni1 O4 -21.8(8) . 1_655
C25 N2 Ni1 O4 164.3(7) . 1_655
C21 N2 Ni1 C15 -25.5(9) . 1_655
C25 N2 Ni1 C15 160.6(7) . 1_655
C20 N1 Ni1 N2 -23.6(8) . .
C16 N1 Ni1 N2 139.3(7) . .
C20 N1 Ni1 O5 147.9(8) . 1_655
C16 N1 Ni1 O5 -49.2(7) . 1_655
C20 N1 Ni1 O1 -121.4(8) . .
C16 N1 Ni1 O1 41.5(7) . .
C20 N1 Ni1 O2 -123.2(8) . .
C16 N1 Ni1 O2 39.6(11) . .
C20 N1 Ni1 O4 88.8(8) . 1_655
C16 N1 Ni1 O4 -108.3(7) . 1_655
C20 N1 Ni1 C15 121.2(8) . 1_655
C16 N1 Ni1 C15 -75.9(7) . 1_655
O2 C1 O1 Ni1 -7.8(9) . .
C2 C1 O1 Ni1 174.2(6) . .
N2 Ni1 O1 C1 94.5(5) . .
O5 Ni1 O1 C1 -84.6(5) 1_655 .
N1 Ni1 O1 C1 -175.1(5) . .
O2 Ni1 O1 C1 4.1(5) . .
O4 Ni1 O1 C1 -40.3(6) 1_655 .
C15 Ni1 O1 C1 -63.4(6) 1_655 .
O1 C1 O2 Ni1 7.7(9) . .
C2 C1 O2 Ni1 -174.3(7) . .
N2 Ni1 O2 C1 -101.0(5) . .
O5 Ni1 O2 C1 86.9(5) 1_655 .
N1 Ni1 O2 C1 -2.2(10) . .
O1 Ni1 O2 C1 -4.3(5) . .
O4 Ni1 O2 C1 148.3(5) 1_655 .
C15 Ni1 O2 C1 117.5(5) 1_655 .
O5 C15 O4 Ni1 -14.9(8) . 1_455
C14 C15 O4 Ni1 156.4(7) . 1_455
O4 C15 O5 Ni1 15.7(8) . 1_455
C14 C15 O5 Ni1 -156.3(6) . 1_455
