#------------------------------------------------------------------------------
#$Date: 2021-04-23 12:31:25 +0300 (Fri, 23 Apr 2021) $
#$Revision: 264467 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/20/1562042.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_1562042
loop_
_publ_author_name
'Yin, Fei'
'Chen, Jing'
'Liang, Yongfeng'
'Zou, Yang'
'Yinzhi, Jiang'
'Xie, Jingli'
_publ_section_title
;
 Syntheses, structures, and properties of Co(II)/Zn(II) mixed-ligand
 coordination polymers based on 4-[(3,5-dinitrobenzoyl)amino]benzoic acid
 and 1,4-bis(1-imidazolyl) benzene
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              310
_journal_page_last               314
_journal_paper_doi               10.1016/j.jssc.2014.12.022
_journal_volume                  225
_journal_year                    2015
_chemical_formula_moiety         'C40 H26 Co N10 O14'
_chemical_formula_sum            'C40 H26 Co N10 O14'
_chemical_formula_weight         929.64
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 93.840(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.319(4)
_cell_length_b                   18.261(8)
_cell_length_c                   30.925(15)
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      28.83
_cell_measurement_theta_min      1.30
_cell_volume                     4687(4)
_computing_cell_refinement       'SAINT (Bruker, 2003)'
_computing_data_collection       'Bruker SMART (Bruker, 2003)'
_computing_data_reduction        'SAINT (Bruker, 2003)'
_computing_molecular_graphics    'XP in SHELXTL and DIAMOND(Brandenburg,2000)'
_computing_publication_material  'SHELXTL (Bruker, 2003)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.965
_diffrn_measured_fraction_theta_max 0.965
_diffrn_measurement_device_type  'Bruker SMART CCD'
_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  0.0526
_diffrn_reflns_av_sigmaI/netI    0.0743
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       39
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_number            30382
_diffrn_reflns_theta_full        28.83
_diffrn_reflns_theta_max         28.83
_diffrn_reflns_theta_min         1.30
_exptl_absorpt_coefficient_mu    0.438
_exptl_absorpt_correction_T_max  0.9292
_exptl_absorpt_correction_T_min  0.8945
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.317
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1900
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.17
_refine_diff_density_max         0.306
_refine_diff_density_min         -0.510
_refine_diff_density_rms         0.070
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.935
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     586
_refine_ls_number_reflns         11843
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.935
_refine_ls_R_factor_all          0.0863
_refine_ls_R_factor_gt           0.0504
_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)+(0.0330P)²+1.9500P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1031
_refine_ls_wR_factor_ref         0.1133
_reflns_number_gt                7040
_reflns_number_total             11843
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            JSSC-2015-2225-310.cif
_cod_data_source_block           yz1312imono
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Monoclinic' was changed to
'monoclinic' in accordance with the built-in table derived from the
CIF Core dictionary named 'cif_core.dic' version 2.4.5 last updated
on 2014-11-21.

Automatic conversion script
Id: cif_fix_values 8369 2020-08-20 11:38:08Z andrius 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               1562042
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
_atom_site_disorder_assembly
_atom_site_disorder_group
C36 C 1.2538(3) -0.15630(14) 0.25333(11) 0.0622(8) Uani 1 1 d . . .
N7 N 1.2608(2) -0.27640(10) 0.25998(6) 0.0368(4) Uani 1 1 d . . .
C35 C 1.1230(3) -0.25213(12) 0.27246(8) 0.0390(5) Uani 1 1 d . . .
N8 N 1.1120(2) -0.17940(10) 0.26888(7) 0.0428(5) Uani 1 1 d . . .
Co1 Co 0.18124(3) 0.117700(16) 0.247585(10) 0.03167(9) Uani 1 1 d . . .
N1 N -1.0817(3) 0.39443(17) 0.34830(9) 0.0815(9) Uani 1 1 d . . .
N2 N -1.0944(3) 0.33569(14) 0.50058(8) 0.0575(6) Uani 1 1 d . . .
N3 N -0.5907(2) 0.22767(11) 0.38646(6) 0.0399(5) Uani 1 1 d . . .
H3N H -0.6814 0.2159 0.3690 0.048 Uiso 1 1 d R . .
N4 N -0.1183(4) -0.27982(19) -0.09297(12) 0.1020(11) Uani 1 1 d . . .
N5 N 0.2353(4) -0.1341(2) -0.17667(9) 0.0901(12) Uani 1 1 d . . .
N6 N 0.1171(2) -0.07876(10) 0.01080(6) 0.0376(4) Uani 1 1 d . . .
H6N H 0.0358 -0.1189 0.0153 0.045 Uiso 1 1 d R . .
N9 N 0.3481(2) 0.05307(10) 0.27869(6) 0.0398(5) Uani 1 1 d . . .
N10 N 0.5571(2) -0.01740(11) 0.29399(7) 0.0459(5) Uani 1 1 d . . .
O1 O -1.0049(3) 0.39815(15) 0.31665(8) 0.0978(9) Uani 1 1 d . . .
O2 O -1.2172(4) 0.4161(2) 0.34984(9) 0.1596(16) Uani 1 1 d . . .
O3 O -1.2343(2) 0.35467(12) 0.49874(7) 0.0747(6) Uani 1 1 d . . .
O4 O -1.0174(3) 0.31935(15) 0.53380(7) 0.0879(8) Uani 1 1 d . . .
O5 O -0.52865(19) 0.27308(10) 0.45369(5) 0.0485(4) Uani 1 1 d . . .
O6 O -0.00222(18) 0.12535(9) 0.28309(5) 0.0414(4) Uani 1 1 d . . .
O7 O 0.13561(19) 0.17037(10) 0.34036(6) 0.0546(5) Uani 1 1 d . . .
O8 O -0.1786(4) -0.29000(17) -0.05913(11) 0.1240(11) Uani 1 1 d . . .
O9 O -0.1473(5) -0.3166(2) -0.12526(12) 0.1675(16) Uani 1 1 d . . .
O10 O 0.2161(4) -0.17901(19) -0.20547(8) 0.1287(12) Uani 1 1 d . . .
O11 O 0.3096(3) -0.0782(2) -0.17975(8) 0.1126(12) Uani 1 1 d . . .
O12 O 0.2997(3) -0.02704(12) -0.03013(6) 0.0751(7) Uani 1 1 d . . .
O13 O 0.09057(18) 0.05969(9) 0.19745(5) 0.0412(4) Uani 1 1 d . . .
O14 O 0.3285(2) 0.10017(9) 0.18294(5) 0.0454(4) Uani 1 1 d . . .
C1 C -0.7894(3) 0.29447(12) 0.42209(8) 0.0364(5) Uani 1 1 d . . .
C2 C -0.8612(3) 0.32636(13) 0.38520(8) 0.0418(6) Uani 1 1 d . . .
H2 H -0.8118 0.3244 0.3591 0.050 Uiso 1 1 calc R . .
C3 C -1.0065(3) 0.36099(15) 0.38757(9) 0.0499(7) Uani 1 1 d . . .
C4 C -1.0852(3) 0.36504(15) 0.42480(9) 0.0520(7) Uani 1 1 d . . .
H4 H -1.1840 0.3887 0.4257 0.062 Uiso 1 1 calc R . .
C5 C -1.0118(3) 0.33271(14) 0.46046(8) 0.0437(6) Uani 1 1 d . . .
C6 C -0.8657(3) 0.29797(13) 0.46017(8) 0.0414(6) Uani 1 1 d . . .
H6 H -0.8188 0.2771 0.4854 0.050 Uiso 1 1 calc R . .
C7 C -0.6233(3) 0.26318(12) 0.42259(7) 0.0353(5) Uani 1 1 d . . .
C8 C -0.4390(2) 0.20737(12) 0.37285(7) 0.0337(5) Uani 1 1 d . . .
C9 C -0.4340(3) 0.18892(14) 0.33005(8) 0.0454(6) Uani 1 1 d . . .
H9 H -0.5284 0.1888 0.3122 0.054 Uiso 1 1 calc R . .
C10 C -0.2912(3) 0.17060(14) 0.31337(8) 0.0437(6) Uani 1 1 d . . .
H10 H -0.2899 0.1576 0.2843 0.052 Uiso 1 1 calc R . .
C11 C -0.1489(2) 0.17108(12) 0.33911(7) 0.0327(5) Uani 1 1 d . . .
C12 C -0.1560(3) 0.18859(14) 0.38193(8) 0.0418(6) Uani 1 1 d . . .
H12 H -0.0615 0.1887 0.3998 0.050 Uiso 1 1 calc R . .
C13 C -0.2998(3) 0.20611(14) 0.39942(8) 0.0428(6) Uani 1 1 d . . .
H13 H -0.3023 0.2169 0.4288 0.051 Uiso 1 1 calc R . .
C14 C 0.0072(3) 0.15485(12) 0.32026(8) 0.0358(5) Uani 1 1 d . . .
C15 C 0.1392(3) -0.12079(14) -0.06223(7) 0.0401(5) Uani 1 1 d . . .
C16 C 0.0332(3) -0.17756(14) -0.05968(8) 0.0476(6) Uani 1 1 d . . .
H16 H -0.0114 -0.1882 -0.0336 0.057 Uiso 1 1 calc R . .
C17 C -0.0072(4) -0.21905(17) -0.09617(9) 0.0601(8) Uani 1 1 d . . .
C18 C 0.0565(4) -0.20586(19) -0.13475(9) 0.0670(9) Uani 1 1 d . . .
H18 H 0.0286 -0.2342 -0.1591 0.080 Uiso 1 1 calc R . .
C19 C 0.1621(4) -0.14979(19) -0.13631(8) 0.0571(8) Uani 1 1 d . . .
C20 C 0.2054(3) -0.10683(16) -0.10148(8) 0.0495(7) Uani 1 1 d . . .
H20 H 0.2783 -0.0687 -0.1039 0.059 Uiso 1 1 calc R . .
C21 C 0.1940(3) -0.07120(14) -0.02583(7) 0.0415(6) Uani 1 1 d . . .
C22 C 0.1478(3) -0.04226(12) 0.05041(7) 0.0337(5) Uani 1 1 d . . .
C23 C 0.0406(3) -0.05466(13) 0.08170(7) 0.0383(5) Uani 1 1 d . . .
H23 H -0.0456 -0.0863 0.0759 0.046 Uiso 1 1 calc R . .
C24 C 0.0594(3) -0.02110(13) 0.12112(7) 0.0379(5) Uani 1 1 d . . .
H24 H -0.0148 -0.0294 0.1418 0.046 Uiso 1 1 calc R . .
C25 C 0.1882(3) 0.02522(12) 0.13049(7) 0.0332(5) Uani 1 1 d . . .
C26 C 0.2982(3) 0.03534(13) 0.09955(8) 0.0401(6) Uani 1 1 d . . .
H26 H 0.3875 0.0650 0.1060 0.048 Uiso 1 1 calc R . .
C27 C 0.2793(3) 0.00281(13) 0.05965(8) 0.0400(6) Uani 1 1 d . . .
H27 H 0.3539 0.0109 0.0390 0.048 Uiso 1 1 calc R . .
C28 C 0.2056(3) 0.06382(12) 0.17250(7) 0.0357(5) Uani 1 1 d . . .
C29 C 0.9751(3) -0.13623(13) 0.27681(9) 0.0442(6) Uani 1 1 d . . .
C30 C 0.9470(3) -0.07228(13) 0.25518(9) 0.0491(7) Uani 1 1 d . . .
H30 H 1.0198 -0.0557 0.2358 0.059 Uiso 1 1 calc R . .
C31 C 0.8115(3) -0.03198(14) 0.26179(9) 0.0488(7) Uani 1 1 d . . .
H31 H 0.7950 0.0127 0.2477 0.059 Uiso 1 1 calc R . .
C32 C 0.7017(3) -0.05678(13) 0.28868(8) 0.0449(6) Uani 1 1 d . . .
C33 C 0.7324(4) -0.11887(17) 0.31190(12) 0.0861(12) Uani 1 1 d . . .
H33 H 0.6598 -0.1349 0.3315 0.103 Uiso 1 1 calc R . .
C34 C 0.8709(4) -0.15807(17) 0.30647(12) 0.0853(12) Uani 1 1 d . . .
H34 H 0.8936 -0.1997 0.3231 0.102 Uiso 1 1 calc R . .
H35 H 1.0405 -0.2817 0.2822 0.102 Uiso 1 1 d R . .
H36 H 1.2810 -0.1079 0.2475 0.102 Uiso 1 1 d R . .
C37 C 1.3427(3) -0.21589(14) 0.24804(10) 0.0546(7) Uani 1 1 d . . .
H37 H 1.4452 -0.2162 0.2377 0.066 Uiso 1 1 calc R . .
C38 C 0.4794(3) 0.02549(12) 0.26418(8) 0.0378(5) Uani 1 1 d . . .
H38 H 0.5143 0.0345 0.2367 0.045 Uiso 1 1 calc R . .
C39 C 0.3405(4) 0.02639(16) 0.31963(9) 0.0637(8) Uani 1 1 d . . .
H39 H 0.2593 0.0366 0.3380 0.076 Uiso 1 1 calc R . .
C40 C 0.4674(4) -0.01669(18) 0.32934(10) 0.0732(10) Uani 1 1 d . . .
H40 H 0.4904 -0.0415 0.3553 0.088 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'
Co Co 0.3494 0.9721 '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
C37 C36 N8 106.8(2) . .
C37 C36 H36 127.4 . .
N8 C36 H36 125.8 . .
C35 N7 C37 105.6(2) . .
C35 N7 Co1 125.49(16) . 2_645
C37 N7 Co1 128.36(16) . 2_645
N7 C35 N8 111.6(2) . .
N7 C35 H35 125.0 . .
N8 C35 H35 123.4 . .
C35 N8 C36 106.2(2) . .
C35 N8 C29 126.1(2) . .
C36 N8 C29 127.5(2) . .
O6 Co1 O13 102.00(7) . .
O6 Co1 N7 101.54(7) . 2_655
O13 Co1 N7 120.27(7) . 2_655
O6 Co1 N9 108.31(8) . .
O13 Co1 N9 105.89(8) . .
N7 Co1 N9 117.11(8) 2_655 .
O2 N1 O1 124.4(3) . .
O2 N1 C3 117.1(3) . .
O1 N1 C3 118.5(2) . .
O4 N2 O3 124.2(2) . .
O4 N2 C5 117.4(2) . .
O3 N2 C5 118.4(3) . .
C7 N3 C8 127.98(19) . .
C7 N3 H3N 113.5 . .
C8 N3 H3N 118.5 . .
O8 N4 O9 123.9(4) . .
O8 N4 C17 118.7(3) . .
O9 N4 C17 117.3(4) . .
O11 N5 O10 124.0(3) . .
O11 N5 C19 118.9(3) . .
O10 N5 C19 117.1(4) . .
C21 N6 C22 128.1(2) . .
C21 N6 H6N 123.3 . .
C22 N6 H6N 108.0 . .
C38 N9 C39 105.9(2) . .
C38 N9 Co1 128.68(17) . .
C39 N9 Co1 125.40(17) . .
C38 N10 C40 106.3(2) . .
C38 N10 C32 126.1(2) . .
C40 N10 C32 127.6(2) . .
C14 O6 Co1 122.65(14) . .
C28 O13 Co1 100.40(14) . .
C6 C1 C2 119.2(2) . .
C6 C1 C7 119.2(2) . .
C2 C1 C7 121.2(2) . .
C3 C2 C1 119.0(2) . .
C3 C2 H2 120.5 . .
C1 C2 H2 120.5 . .
C4 C3 C2 123.0(2) . .
C4 C3 N1 118.4(2) . .
C2 C3 N1 118.6(2) . .
C5 C4 C3 116.5(2) . .
C5 C4 H4 121.8 . .
C3 C4 H4 121.8 . .
C4 C5 C6 123.1(2) . .
C4 C5 N2 117.5(2) . .
C6 C5 N2 119.4(2) . .
C5 C6 C1 119.1(2) . .
C5 C6 H6 120.4 . .
C1 C6 H6 120.4 . .
O5 C7 N3 125.3(2) . .
O5 C7 C1 120.1(2) . .
N3 C7 C1 114.63(19) . .
C9 C8 C13 119.6(2) . .
C9 C8 N3 116.15(19) . .
C13 C8 N3 124.2(2) . .
C10 C9 C8 120.6(2) . .
C10 C9 H9 119.7 . .
C8 C9 H9 119.7 . .
C9 C10 C11 120.9(2) . .
C9 C10 H10 119.6 . .
C11 C10 H10 119.6 . .
C12 C11 C10 117.9(2) . .
C12 C11 C14 121.41(19) . .
C10 C11 C14 120.6(2) . .
C11 C12 C13 121.8(2) . .
C11 C12 H12 119.1 . .
C13 C12 H12 119.1 . .
C8 C13 C12 119.1(2) . .
C8 C13 H13 120.4 . .
C12 C13 H13 120.4 . .
O7 C14 O6 123.7(2) . .
O7 C14 C11 120.4(2) . .
O6 C14 C11 115.91(19) . .
C16 C15 C20 119.0(2) . .
C16 C15 C21 125.6(2) . .
C20 C15 C21 115.4(2) . .
C15 C16 C17 119.4(3) . .
C15 C16 H16 120.3 . .
C17 C16 H16 120.3 . .
C18 C17 C16 122.1(3) . .
C18 C17 N4 118.9(3) . .
C16 C17 N4 119.0(3) . .
C19 C18 C17 117.3(3) . .
C19 C18 H18 121.4 . .
C17 C18 H18 121.4 . .
C18 C19 C20 123.1(3) . .
C18 C19 N5 119.4(3) . .
C20 C19 N5 117.5(3) . .
C19 C20 C15 119.1(3) . .
C19 C20 H20 120.5 . .
C15 C20 H20 120.5 . .
O12 C21 N6 123.6(2) . .
O12 C21 C15 120.7(2) . .
N6 C21 C15 115.8(2) . .
C23 C22 C27 119.5(2) . .
C23 C22 N6 116.5(2) . .
C27 C22 N6 123.9(2) . .
C24 C23 C22 120.9(2) . .
C24 C23 H23 119.6 . .
C22 C23 H23 119.6 . .
C23 C24 C25 120.2(2) . .
C23 C24 H24 119.9 . .
C25 C24 H24 119.9 . .
C26 C25 C24 118.6(2) . .
C26 C25 C28 121.0(2) . .
C24 C25 C28 120.4(2) . .
C27 C26 C25 121.7(2) . .
C27 C26 H26 119.2 . .
C25 C26 H26 119.2 . .
C26 C27 C22 119.1(2) . .
C26 C27 H27 120.5 . .
C22 C27 H27 120.5 . .
O14 C28 O13 120.9(2) . .
O14 C28 C25 120.9(2) . .
O13 C28 C25 118.2(2) . .
C30 C29 C34 119.1(2) . .
C30 C29 N8 120.4(2) . .
C34 C29 N8 120.5(2) . .
C29 C30 C31 120.2(2) . .
C29 C30 H30 119.9 . .
C31 C30 H30 119.9 . .
C32 C31 C30 120.4(2) . .
C32 C31 H31 119.8 . .
C30 C31 H31 119.8 . .
C31 C32 C33 119.6(2) . .
C31 C32 N10 120.9(2) . .
C33 C32 N10 119.5(2) . .
C32 C33 C34 119.9(3) . .
C32 C33 H33 120.0 . .
C34 C33 H33 120.0 . .
C29 C34 C33 120.4(3) . .
C29 C34 H34 119.8 . .
C33 C34 H34 119.8 . .
C36 C37 N7 109.7(2) . .
C36 C37 H37 125.1 . .
N7 C37 H37 125.1 . .
N9 C38 N10 111.3(2) . .
N9 C38 H38 124.3 . .
N10 C38 H38 124.3 . .
C40 C39 N9 109.5(2) . .
C40 C39 H39 125.2 . .
N9 C39 H39 125.2 . .
C39 C40 N10 107.0(2) . .
C39 C40 H40 126.5 . .
N10 C40 H40 126.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C36 C37 1.332(4) .
C36 N8 1.370(3) .
C36 H36 0.9330 .
N7 C35 1.311(3) .
N7 C37 1.362(3) .
N7 Co1 2.011(2) 2_645
C35 N8 1.335(3) .
C35 H35 0.9382 .
N8 C29 1.420(3) .
Co1 O6 1.9439(17) .
Co1 O13 1.9845(16) .
Co1 N7 2.011(2) 2_655
Co1 N9 2.017(2) .
N1 O2 1.199(3) .
N1 O1 1.206(3) .
N1 C3 1.462(4) .
N2 O4 1.211(3) .
N2 O3 1.212(3) .
N2 C5 1.459(3) .
N3 C7 1.335(3) .
N3 C8 1.406(3) .
N3 H3N 0.9238 .
N4 O8 1.205(4) .
N4 O9 1.214(4) .
N4 C17 1.452(4) .
N5 O11 1.202(4) .
N5 O10 1.213(4) .
N5 C19 1.453(4) .
N6 C21 1.345(3) .
N6 C22 1.403(3) .
N6 H6N 1.0130 .
N9 C38 1.309(3) .
N9 C39 1.362(3) .
N10 C38 1.342(3) .
N10 C40 1.364(3) .
N10 C32 1.420(3) .
O5 C7 1.215(3) .
O6 C14 1.267(3) .
O7 C14 1.232(3) .
O12 C21 1.207(3) .
O13 C28 1.271(3) .
O14 C28 1.243(3) .
C1 C6 1.376(3) .
C1 C2 1.381(3) .
C1 C7 1.494(3) .
C2 C3 1.370(3) .
C2 H2 0.9300 .
C3 C4 1.364(4) .
C4 C5 1.359(4) .
C4 H4 0.9300 .
C5 C6 1.372(3) .
C6 H6 0.9300 .
C8 C9 1.369(3) .
C8 C13 1.375(3) .
C9 C10 1.368(3) .
C9 H9 0.9300 .
C10 C11 1.382(3) .
C10 H10 0.9300 .
C11 C12 1.367(3) .
C11 C14 1.489(3) .
C12 C13 1.383(3) .
C12 H12 0.9300 .
C13 H13 0.9300 .
C15 C16 1.367(3) .
C15 C20 1.390(3) .
C15 C21 1.492(3) .
C16 C17 1.382(4) .
C16 H16 0.9300 .
C17 C18 1.359(4) .
C18 C19 1.352(4) .
C18 H18 0.9300 .
C19 C20 1.361(4) .
C20 H20 0.9300 .
C22 C23 1.378(3) .
C22 C27 1.384(3) .
C23 C24 1.364(3) .
C23 H23 0.9300 .
C24 C25 1.380(3) .
C24 H24 0.9300 .
C25 C26 1.380(3) .
C25 C28 1.477(3) .
C26 C27 1.369(3) .
C26 H26 0.9300 .
C27 H27 0.9300 .
C29 C30 1.358(3) .
C29 C34 1.363(4) .
C30 C31 1.373(3) .
C30 H30 0.9300 .
C31 C32 1.354(3) .
C31 H31 0.9300 .
C32 C33 1.357(4) .
C33 C34 1.377(4) .
C33 H33 0.9300 .
C34 H34 0.9300 .
C37 H37 0.9300 .
C38 H38 0.9300 .
C39 C40 1.335(4) .
C39 H39 0.9300 .
C40 H40 0.9300 .
