#------------------------------------------------------------------------------
#$Date: 2016-03-26 17:53:29 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180403 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/72/7207230.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_7207230
loop_
_publ_author_name
'Li, Xiao-Zeng'
'Hao, Peng-Peng'
'Wang, Dan'
'Zhang, Wen-Qin'
'Zhu, Li-Na'
_publ_section_title
;
 New metalloligands suitable for the construction of polynuclear complexes
 and coordination polymers with exposed metal sites
;
_journal_issue                   2
_journal_name_full               CrystEngComm
_journal_page_first              366
_journal_paper_doi               10.1039/c1ce06273e
_journal_volume                  14
_journal_year                    2012
_chemical_formula_sum            'C26 H28 N4 Ni2 O12'
_chemical_formula_weight         705.91
_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                90.00
_cell_angle_beta                 126.332(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.3667(10)
_cell_length_b                   9.0896(6)
_cell_length_c                   24.9074(12)
_cell_measurement_reflns_used    9255
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.85
_cell_measurement_theta_min      2.46
_cell_volume                     2802.7(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.0180
_diffrn_reflns_av_sigmaI/netI    0.0197
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            13921
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.64
_exptl_absorpt_coefficient_mu    1.416
_exptl_absorpt_correction_T_max  0.8156
_exptl_absorpt_correction_T_min  0.7947
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            RED
_exptl_crystal_density_diffrn    1.673
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             1456
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.649
_refine_diff_density_min         -0.533
_refine_diff_density_rms         0.052
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     403
_refine_ls_number_reflns         4935
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0349
_refine_ls_R_factor_gt           0.0276
_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)+(0.0349P)²+2.0951P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0688
_refine_ls_wR_factor_ref         0.0726
_reflns_number_gt                4282
_reflns_number_total             4935
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1ce06273e.txt
_cod_data_source_block           compound_3
_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 2.4.1 from
2010-06-29.

'_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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7207230
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ni1 Ni 0.08465(2) 0.55365(3) 0.891858(14) 0.02509(9) Uani 1 1 d . . .
Ni2 Ni -0.32533(2) 0.47250(3) 0.723514(14) 0.02618(9) Uani 1 1 d . . .
N1 N -0.01609(15) 0.4482(2) 0.89546(9) 0.0275(4) Uani 1 1 d . . .
N2 N -0.02926(14) 0.6761(2) 0.82985(9) 0.0264(4) Uani 1 1 d . . .
N3 N 0.18548(14) 0.6531(2) 0.88555(9) 0.0275(4) Uani 1 1 d . . .
N4 N 0.19890(15) 0.4311(2) 0.95293(9) 0.0287(4) Uani 1 1 d . . .
O1 O -0.19972(12) 0.39744(18) 0.81641(8) 0.0303(4) Uani 1 1 d . . .
O2 O -0.21490(12) 0.64192(18) 0.75208(8) 0.0316(4) Uani 1 1 d . . .
O3 O 0.24774(12) 0.86991(18) 0.81030(8) 0.0317(4) Uani 1 1 d . . .
O4 O 0.34395(14) 0.9191(2) 0.91976(9) 0.0445(5) Uani 1 1 d . . .
O5 O 0.35787(17) 0.4341(2) 1.10557(10) 0.0572(6) Uani 1 1 d . . .
O6 O 0.35726(14) 0.2006(2) 1.07847(9) 0.0492(5) Uani 1 1 d . . .
O7 O -0.43642(14) 0.5630(2) 0.63324(9) 0.0463(5) Uani 1 1 d . . .
H7A H -0.4223 0.5258 0.6079 0.069 Uiso 1 1 d R . .
H7B H -0.4812 0.6339 0.6176 0.069 Uiso 1 1 d R . .
O8 O -0.38780(15) 0.5684(2) 0.76828(10) 0.0478(5) Uani 1 1 d . . .
H8A H -0.4532 0.5966 0.7428 0.072 Uiso 1 1 d R . .
H8B H -0.3650 0.5377 0.8068 0.072 Uiso 1 1 d R . .
O9 O -0.42280(13) 0.2933(2) 0.69560(9) 0.0409(4) Uani 1 1 d . . .
H9A H -0.4118 0.2408 0.7273 0.061 Uiso 1 1 d R . .
H9B H -0.4877 0.3013 0.6611 0.061 Uiso 1 1 d R . .
C1 C -0.11497(17) 0.4689(2) 0.83936(11) 0.0257(5) Uani 1 1 d . . .
C2 C -0.12372(17) 0.6065(2) 0.80142(11) 0.0255(5) Uani 1 1 d . . .
C3 C -0.02050(18) 0.8229(3) 0.81603(11) 0.0281(5) Uani 1 1 d . . .
C4 C 0.08188(18) 0.8796(3) 0.83938(12) 0.0289(5) Uani 1 1 d . . .
C5 C 0.0917(2) 1.0321(3) 0.83316(14) 0.0387(6) Uani 1 1 d . . .
H5 H 0.1588 1.0701 0.8482 0.046 Uiso 1 1 calc R . .
C6 C 0.0057(2) 1.1253(3) 0.80580(14) 0.0419(6) Uani 1 1 d . . .
H6 H 0.0149 1.2260 0.8042 0.050 Uiso 1 1 calc R . .
C7 C -0.0953(2) 1.0680(3) 0.78038(14) 0.0413(6) Uani 1 1 d . . .
H7 H -0.1547 1.1304 0.7605 0.050 Uiso 1 1 calc R . .
C8 C -0.1087(2) 0.9193(3) 0.78425(13) 0.0379(6) Uani 1 1 d . . .
H8 H -0.1776 0.8824 0.7654 0.045 Uiso 1 1 calc R . .
C9 C 0.17752(18) 0.7882(3) 0.86610(11) 0.0284(5) Uani 1 1 d . . .
C10 C 0.26674(18) 0.8650(3) 0.86649(12) 0.0308(5) Uani 1 1 d . . .
C11 C 0.27573(18) 0.5588(3) 0.90688(11) 0.0300(5) Uani 1 1 d . . .
C12 C 0.28391(18) 0.4394(3) 0.94535(11) 0.0294(5) Uani 1 1 d . . .
C13 C 0.36213(19) 0.3328(3) 0.96557(13) 0.0375(6) Uani 1 1 d . . .
H13 H 0.3671 0.2525 0.9904 0.045 Uiso 1 1 calc R . .
C14 C 0.4323(2) 0.3464(3) 0.94871(13) 0.0406(6) Uani 1 1 d . . .
H14 H 0.4861 0.2763 0.9633 0.049 Uiso 1 1 calc R . .
C15 C 0.4238(2) 0.4623(3) 0.91055(13) 0.0399(6) Uani 1 1 d . . .
H15 H 0.4713 0.4695 0.8991 0.048 Uiso 1 1 calc R . .
C16 C 0.34539(19) 0.5684(3) 0.88896(13) 0.0359(6) Uani 1 1 d . . .
H16 H 0.3393 0.6458 0.8625 0.043 Uiso 1 1 calc R . .
C17 C 0.20737(18) 0.3606(3) 1.00149(11) 0.0304(5) Uani 1 1 d . . .
C18 C 0.3190(2) 0.3264(3) 1.06714(13) 0.0386(6) Uani 1 1 d . . .
C19 C 0.11439(19) 0.3213(3) 1.00002(12) 0.0314(5) Uani 1 1 d . . .
C20 C 0.00570(19) 0.3531(3) 0.94662(11) 0.0294(5) Uani 1 1 d . . .
C21 C -0.0764(2) 0.2973(3) 0.94921(13) 0.0414(6) Uani 1 1 d . . .
H21 H -0.1479 0.3187 0.9148 0.050 Uiso 1 1 calc R . .
C22 C -0.0537(2) 0.2109(3) 1.00178(14) 0.0464(7) Uani 1 1 d . . .
H22 H -0.1099 0.1737 1.0020 0.056 Uiso 1 1 calc R . .
C23 C 0.0515(2) 0.1797(3) 1.05378(14) 0.0458(7) Uani 1 1 d . . .
H23 H 0.0667 0.1211 1.0890 0.055 Uiso 1 1 calc R . .
C24 C 0.1332(2) 0.2353(3) 1.05322(13) 0.0425(6) Uani 1 1 d . . .
H24 H 0.2042 0.2159 1.0892 0.051 Uiso 1 1 calc R . .
C25 C 0.3268(3) 0.5408(4) 0.68186(18) 0.0703(10) Uani 1 1 d . . .
H25A H 0.3111 0.4940 0.6420 0.084 Uiso 1 1 calc R . .
H25B H 0.2603 0.5826 0.6713 0.084 Uiso 1 1 calc R . .
C26 C 0.3683(3) 0.4314(4) 0.7349(2) 0.0845(13) Uani 1 1 d . . .
H26A H 0.4376 0.3972 0.7481 0.127 Uiso 1 1 calc R . .
H26B H 0.3191 0.3500 0.7188 0.127 Uiso 1 1 calc R . .
H26C H 0.3756 0.4753 0.7724 0.127 Uiso 1 1 calc R . .
O10 O 0.6109(3) 0.2677(4) 0.90009(18) 0.0613(8) Uani 0.636(4) 1 d P A 1
O10' O 0.6852(5) 0.2938(7) 0.9114(3) 0.0613(8) Uani 0.364(4) 1 d P A 2
O11 O 0.6944(3) 0.4373(3) 0.48515(16) 0.1242(14) Uani 1 1 d . . .
H11A H 0.6498 0.4427 0.4947 0.186 Uiso 1 1 d R . .
H11B H 0.7263 0.3555 0.4922 0.186 Uiso 1 1 d R . .
O12 O 0.40426(15) 0.6540(2) 0.70256(9) 0.0458(5) Uani 1 1 d . . .
H12 H 0.3888 0.7015 0.6700 0.069 Uiso 1 1 calc R . .
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
N4 Ni1 N2 179.19(8) . .
N4 Ni1 N1 93.49(8) . .
N2 Ni1 N1 87.02(8) . .
N4 Ni1 N3 86.05(8) . .
N2 Ni1 N3 93.41(8) . .
N1 Ni1 N3 177.36(9) . .
O7 Ni2 O9 88.85(8) . .
O7 Ni2 O3 92.38(7) . 2_546
O9 Ni2 O3 89.14(7) . 2_546
O7 Ni2 O8 94.19(8) . .
O9 Ni2 O8 92.24(8) . .
O3 Ni2 O8 173.31(7) 2_546 .
O7 Ni2 O1 173.43(7) . .
O9 Ni2 O1 97.39(7) . .
O3 Ni2 O1 85.68(6) 2_546 .
O8 Ni2 O1 87.65(7) . .
O7 Ni2 O2 93.41(7) . .
O9 Ni2 O2 174.29(7) . .
O3 Ni2 O2 85.53(7) 2_546 .
O8 Ni2 O2 92.83(8) . .
O1 Ni2 O2 80.19(6) . .
C1 N1 C20 123.19(19) . .
C1 N1 Ni1 109.85(15) . .
C20 N1 Ni1 126.86(15) . .
C2 N2 C3 123.44(19) . .
C2 N2 Ni1 110.33(14) . .
C3 N2 Ni1 126.17(15) . .
C9 N3 C11 124.0(2) . .
C9 N3 Ni1 125.87(16) . .
C11 N3 Ni1 110.16(15) . .
C17 N4 C12 123.47(19) . .
C17 N4 Ni1 125.33(16) . .
C12 N4 Ni1 110.72(15) . .
C1 O1 Ni2 111.73(14) . .
C2 O2 Ni2 111.13(14) . .
C10 O3 Ni2 132.10(15) . 2_556
Ni2 O7 H7A 104.2 . .
Ni2 O7 H7B 137.5 . .
H7A O7 H7B 117.1 . .
Ni2 O8 H8A 116.8 . .
Ni2 O8 H8B 117.6 . .
H8A O8 H8B 117.1 . .
Ni2 O9 H9A 115.6 . .
Ni2 O9 H9B 117.5 . .
H9A O9 H9B 117.1 . .
O1 C1 N1 129.6(2) . .
O1 C1 C2 117.21(19) . .
N1 C1 C2 113.08(19) . .
O2 C2 N2 129.5(2) . .
O2 C2 C1 117.42(19) . .
N2 C2 C1 112.97(18) . .
C8 C3 N2 122.2(2) . .
C8 C3 C4 118.2(2) . .
N2 C3 C4 119.4(2) . .
C3 C4 C5 118.5(2) . .
C3 C4 C9 123.7(2) . .
C5 C4 C9 117.7(2) . .
C6 C5 C4 122.0(2) . .
C6 C5 H5 119.0 . .
C4 C5 H5 119.0 . .
C5 C6 C7 119.1(2) . .
C5 C6 H6 120.4 . .
C7 C6 H6 120.4 . .
C8 C7 C6 120.7(2) . .
C8 C7 H7 119.7 . .
C6 C7 H7 119.7 . .
C7 C8 C3 121.2(2) . .
C7 C8 H8 119.4 . .
C3 C8 H8 119.4 . .
N3 C9 C4 123.7(2) . .
N3 C9 C10 122.8(2) . .
C4 C9 C10 113.5(2) . .
O4 C10 O3 128.5(2) . .
O4 C10 C9 118.1(2) . .
O3 C10 C9 113.2(2) . .
C16 C11 C12 119.7(2) . .
C16 C11 N3 127.1(2) . .
C12 C11 N3 113.0(2) . .
C13 C12 C11 119.8(2) . .
C13 C12 N4 125.4(2) . .
C11 C12 N4 114.3(2) . .
C14 C13 C12 119.6(2) . .
C14 C13 H13 120.2 . .
C12 C13 H13 120.2 . .
C15 C14 C13 120.7(2) . .
C15 C14 H14 119.7 . .
C13 C14 H14 119.7 . .
C14 C15 C16 120.6(2) . .
C14 C15 H15 119.7 . .
C16 C15 H15 119.7 . .
C15 C16 C11 119.6(2) . .
C15 C16 H16 120.2 . .
C11 C16 H16 120.2 . .
N4 C17 C19 122.8(2) . .
N4 C17 C18 121.2(2) . .
C19 C17 C18 115.8(2) . .
O6 C18 O5 127.1(2) . .
O6 C18 C17 120.4(2) . .
O5 C18 C17 112.4(2) . .
C24 C19 C20 117.8(2) . .
C24 C19 C17 117.4(2) . .
C20 C19 C17 124.6(2) . .
C21 C20 N1 121.9(2) . .
C21 C20 C19 118.5(2) . .
N1 C20 C19 119.4(2) . .
C22 C21 C20 121.5(2) . .
C22 C21 H21 119.3 . .
C20 C21 H21 119.3 . .
C23 C22 C21 120.4(3) . .
C23 C22 H22 119.8 . .
C21 C22 H22 119.8 . .
C24 C23 C22 119.3(2) . .
C24 C23 H23 120.3 . .
C22 C23 H23 120.3 . .
C23 C24 C19 122.5(2) . .
C23 C24 H24 118.7 . .
C19 C24 H24 118.7 . .
O12 C25 C26 110.0(3) . .
O12 C25 H25A 109.7 . .
C26 C25 H25A 109.7 . .
O12 C25 H25B 109.7 . .
C26 C25 H25B 109.7 . .
H25A C25 H25B 108.2 . .
C25 C26 H26A 109.5 . .
C25 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
C25 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
H11A O11 H11B 117.1 . .
C25 O12 H12 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ni1 N4 1.8632(19) .
Ni1 N2 1.8667(18) .
Ni1 N1 1.8675(19) .
Ni1 N3 1.8791(19) .
Ni2 O7 2.0243(17) .
Ni2 O9 2.0362(17) .
Ni2 O3 2.0469(16) 2_546
Ni2 O8 2.0475(18) .
Ni2 O1 2.0622(15) .
Ni2 O2 2.0801(16) .
N1 C1 1.334(3) .
N1 C20 1.406(3) .
N2 C2 1.338(3) .
N2 C3 1.404(3) .
N3 C9 1.299(3) .
N3 C11 1.438(3) .
N4 C17 1.305(3) .
N4 C12 1.428(3) .
O1 C1 1.250(3) .
O2 C2 1.240(3) .
O3 C10 1.250(3) .
O3 Ni2 2.0469(16) 2_556
O4 C10 1.243(3) .
O5 C18 1.247(3) .
O6 C18 1.240(3) .
O7 H7A 0.8500 .
O7 H7B 0.8505 .
O8 H8A 0.8500 .
O8 H8B 0.8501 .
O9 H9A 0.8497 .
O9 H9B 0.8502 .
C1 C2 1.525(3) .
C3 C8 1.400(3) .
C3 C4 1.412(3) .
C4 C5 1.413(3) .
C4 C9 1.461(3) .
C5 C6 1.363(4) .
C5 H5 0.9300 .
C6 C7 1.385(4) .
C6 H6 0.9300 .
C7 C8 1.379(4) .
C7 H7 0.9300 .
C8 H8 0.9300 .
C9 C10 1.533(3) .
C11 C16 1.385(3) .
C11 C12 1.403(3) .
C12 C13 1.386(3) .
C13 C14 1.375(4) .
C13 H13 0.9300 .
C14 C15 1.373(4) .
C14 H14 0.9300 .
C15 C16 1.379(3) .
C15 H15 0.9300 .
C16 H16 0.9300 .
C17 C19 1.452(3) .
C17 C18 1.546(3) .
C19 C24 1.413(3) .
C19 C20 1.418(3) .
C20 C21 1.395(3) .
C21 C22 1.383(4) .
C21 H21 0.9300 .
C22 C23 1.375(4) .
C22 H22 0.9300 .
C23 C24 1.362(4) .
C23 H23 0.9300 .
C24 H24 0.9300 .
C25 O12 1.420(4) .
C25 C26 1.463(5) .
C25 H25A 0.9700 .
C25 H25B 0.9700 .
C26 H26A 0.9600 .
C26 H26B 0.9600 .
C26 H26C 0.9600 .
O11 H11A 0.8502 .
O11 H11B 0.8500 .
O12 H12 0.8200 .
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
N4 Ni1 N1 C1 -155.72(16) .
N2 Ni1 N1 C1 23.65(16) .
N3 Ni1 N1 C1 -75.8(18) .
N4 Ni1 N1 C20 20.7(2) .
N2 Ni1 N1 C20 -159.9(2) .
N3 Ni1 N1 C20 100.6(18) .
N4 Ni1 N2 C2 107(6) .
N1 Ni1 N2 C2 -21.82(16) .
N3 Ni1 N2 C2 155.57(15) .
N4 Ni1 N2 C3 -76(6) .
N1 Ni1 N2 C3 155.35(19) .
N3 Ni1 N2 C3 -27.26(19) .
N4 Ni1 N3 C9 -157.1(2) .
N2 Ni1 N3 C9 23.5(2) .
N1 Ni1 N3 C9 122.7(17) .
N4 Ni1 N3 C11 21.68(15) .
N2 Ni1 N3 C11 -157.71(15) .
N1 Ni1 N3 C11 -58.4(18) .
N2 Ni1 N4 C17 -160(6) .
N1 Ni1 N4 C17 -30.6(2) .
N3 Ni1 N4 C17 152.1(2) .
N2 Ni1 N4 C12 28(6) .
N1 Ni1 N4 C12 157.24(16) .
N3 Ni1 N4 C12 -20.15(16) .
O7 Ni2 O1 C1 1.2(7) .
O9 Ni2 O1 C1 162.88(15) .
O3 Ni2 O1 C1 74.31(15) 2_546
O8 Ni2 O1 C1 -105.17(16) .
O2 Ni2 O1 C1 -11.89(15) .
O7 Ni2 O2 C2 -164.99(16) .
O9 Ni2 O2 C2 -51.8(8) .
O3 Ni2 O2 C2 -72.86(15) 2_546
O8 Ni2 O2 C2 100.64(16) .
O1 Ni2 O2 C2 13.52(15) .
Ni2 O1 C1 N1 -175.5(2) .
Ni2 O1 C1 C2 8.9(2) .
C20 N1 C1 O1 -12.5(4) .
Ni1 N1 C1 O1 164.1(2) .
C20 N1 C1 C2 163.3(2) .
Ni1 N1 C1 C2 -20.1(2) .
Ni2 O2 C2 N2 171.1(2) .
Ni2 O2 C2 C1 -13.0(2) .
C3 N2 C2 O2 14.2(4) .
Ni1 N2 C2 O2 -168.6(2) .
C3 N2 C2 C1 -161.9(2) .
Ni1 N2 C2 C1 15.4(2) .
O1 C1 C2 O2 3.0(3) .
N1 C1 C2 O2 -173.3(2) .
O1 C1 C2 N2 179.6(2) .
N1 C1 C2 N2 3.3(3) .
C2 N2 C3 C8 15.9(3) .
Ni1 N2 C3 C8 -160.95(19) .
C2 N2 C3 C4 -169.3(2) .
Ni1 N2 C3 C4 13.9(3) .
C8 C3 C4 C5 3.7(3) .
N2 C3 C4 C5 -171.3(2) .
C8 C3 C4 C9 -172.4(2) .
N2 C3 C4 C9 12.5(3) .
C3 C4 C5 C6 0.4(4) .
C9 C4 C5 C6 176.8(2) .
C4 C5 C6 C7 -3.2(4) .
C5 C6 C7 C8 1.8(4) .
C6 C7 C8 C3 2.4(4) .
N2 C3 C8 C7 169.7(2) .
C4 C3 C8 C7 -5.2(4) .
C11 N3 C9 C4 174.8(2) .
Ni1 N3 C9 C4 -6.5(3) .
C11 N3 C9 C10 -2.6(3) .
Ni1 N3 C9 C10 176.00(16) .
C3 C4 C9 N3 -16.7(4) .
C5 C4 C9 N3 167.1(2) .
C3 C4 C9 C10 160.9(2) .
C5 C4 C9 C10 -15.3(3) .
Ni2 O3 C10 O4 -3.2(4) 2_556
Ni2 O3 C10 C9 173.11(15) 2_556
N3 C9 C10 O4 -82.4(3) .
C4 C9 C10 O4 99.9(3) .
N3 C9 C10 O3 100.9(3) .
C4 C9 C10 O3 -76.8(3) .
C9 N3 C11 C16 -25.5(4) .
Ni1 N3 C11 C16 155.7(2) .
C9 N3 C11 C12 160.2(2) .
Ni1 N3 C11 C12 -18.7(2) .
C16 C11 C12 C13 0.6(3) .
N3 C11 C12 C13 175.4(2) .
C16 C11 C12 N4 -171.9(2) .
N3 C11 C12 N4 2.9(3) .
C17 N4 C12 C13 30.1(4) .
Ni1 N4 C12 C13 -157.6(2) .
C17 N4 C12 C11 -158.0(2) .
Ni1 N4 C12 C11 14.4(2) .
C11 C12 C13 C14 1.1(4) .
N4 C12 C13 C14 172.7(2) .
C12 C13 C14 C15 -1.8(4) .
C13 C14 C15 C16 0.7(4) .
C14 C15 C16 C11 1.0(4) .
C12 C11 C16 C15 -1.6(4) .
N3 C11 C16 C15 -175.6(2) .
C12 N4 C17 C19 -164.0(2) .
Ni1 N4 C17 C19 24.7(3) .
C12 N4 C17 C18 21.5(3) .
Ni1 N4 C17 C18 -149.73(19) .
N4 C17 C18 O6 -103.8(3) .
C19 C17 C18 O6 81.4(3) .
N4 C17 C18 O5 80.4(3) .
C19 C17 C18 O5 -94.4(3) .
N4 C17 C19 C24 175.3(2) .
C18 C17 C19 C24 -10.0(3) .
N4 C17 C19 C20 0.5(4) .
C18 C17 C19 C20 175.2(2) .
C1 N1 C20 C21 -14.0(4) .
Ni1 N1 C20 C21 170.05(19) .
C1 N1 C20 C19 170.9(2) .
Ni1 N1 C20 C19 -5.0(3) .
C24 C19 C20 C21 -0.4(4) .
C17 C19 C20 C21 174.4(2) .
C24 C19 C20 N1 174.8(2) .
C17 C19 C20 N1 -10.4(4) .
N1 C20 C21 C22 -176.1(3) .
C19 C20 C21 C22 -1.0(4) .
C20 C21 C22 C23 1.1(5) .
C21 C22 C23 C24 0.4(5) .
C22 C23 C24 C19 -1.8(5) .
C20 C19 C24 C23 1.9(4) .
C17 C19 C24 C23 -173.3(3) .
