#------------------------------------------------------------------------------
#$Date: 2019-11-27 07:05:22 +0200 (Wed, 27 Nov 2019) $
#$Revision: 243773 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/80/7238053.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_7238053
loop_
_publ_author_name
'Tang, Long'
'Wang, Huan-Huan'
'Fu, Yu-Hao'
'Wang, Yi-Tong'
'Wang, JiJiang'
'Hou, XiangYang'
_publ_section_title
;
 Three cobalt-based coordination polymers with tripodal carboxylate and
 imidazole-containing ligands: syntheses, structures, properties and DFT
 studies
;
_journal_issue                   66
_journal_name_full               'RSC Advances'
_journal_page_first              38902
_journal_paper_doi               10.1039/C9RA07737E
_journal_volume                  9
_journal_year                    2019
_chemical_formula_sum            'C38 H27 Co N7 O6'
_chemical_formula_weight         736.59
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2018/1
_audit_update_record
;
2019-09-20 deposited with the CCDC.	2019-11-20 downloaded from the CCDC.
;
_cell_angle_alpha                94.820(3)
_cell_angle_beta                 100.924(3)
_cell_angle_gamma                92.663(3)
_cell_formula_units_Z            2
_cell_length_a                   9.0115(15)
_cell_length_b                   10.9375(17)
_cell_length_c                   17.301(3)
_cell_measurement_reflns_used    3461
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.3134
_cell_measurement_theta_min      2.3202
_cell_volume                     1665.0(5)
_computing_cell_refinement       'SAINT (Bruker,1997)'
_computing_data_collection       'SMART (Bruker, 1997)'
_computing_data_reduction        'SAINT (Bruker,1997)'
_computing_molecular_graphics    'DIAMOND (Brandenburg, 1999)'
_computing_publication_material  SHELXTL(Bruker,2000)
_computing_structure_refinement  'SHELXL-2018/1 (Sheldrick, 2018)'
_computing_structure_solution    'SHElXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker SMART diffractometer'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0139
_diffrn_reflns_av_unetI/netI     0.0285
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            8424
_diffrn_reflns_point_group_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        24.989
_diffrn_reflns_theta_max         24.989
_diffrn_reflns_theta_min         2.306
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    0.576
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.6638
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.469
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             758
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.372
_refine_diff_density_min         -0.373
_refine_diff_density_rms         0.057
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.062
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     472
_refine_ls_number_reflns         5817
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.062
_refine_ls_R_factor_all          0.0510
_refine_ls_R_factor_gt           0.0397
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0697P)²+0.4053P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1113
_refine_ls_wR_factor_ref         0.1167
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4809
_reflns_number_total             5817
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9ra07737e2.cif
_cod_data_source_block           yd1009_0m
_cod_database_code               7238053
_shelx_shelxl_version_number     2018/1
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
loop_
_space_group_symop_operation_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
Co1 Co 0.36829(4) 0.56374(3) 0.08024(2) 0.03230(13) Uani 1 1 d . .
O1 O 0.3724(2) 0.55838(19) 0.20594(10) 0.0469(5) Uani 1 1 d . .
O2 O 0.1683(2) 0.61454(17) 0.13152(10) 0.0424(4) Uani 1 1 d . .
O3 O -0.8727(2) 0.9558(2) 0.44182(12) 0.0519(5) Uani 1 1 d D .
O4 O -0.8562(2) 0.95534(19) 0.57110(12) 0.0529(5) Uani 1 1 d . .
O5 O 0.2745(2) 0.60840(17) 0.97001(9) 0.0426(4) Uani 1 1 d . .
O6 O 0.4224(2) 0.4972(2) 0.90887(11) 0.0524(5) Uani 1 1 d . .
N1 N -0.1684(2) 0.71073(18) 0.46397(11) 0.0306(4) Uani 1 1 d . .
N2 N -0.1427(2) 0.72254(17) 0.60314(11) 0.0290(4) Uani 1 1 d . .
N3 N 0.0562(2) 0.65109(17) 0.54304(10) 0.0275(4) Uani 1 1 d . .
N4 N 0.2638(2) 0.38572(19) 0.05537(12) 0.0399(5) Uani 1 1 d . .
N5 N 0.0868(3) 0.2379(2) 0.01285(13) 0.0414(5) Uani 1 1 d . .
N6 N 0.4031(3) 0.0850(2) -0.16679(15) 0.0511(6) Uani 1 1 d . .
N7 N 0.5332(3) 0.2509(2) -0.10410(13) 0.0453(5) Uani 1 1 d . .
C1 C 0.2393(3) 0.5930(2) 0.19773(14) 0.0342(6) Uani 1 1 d . .
C2 C 0.1684(3) 0.6107(2) 0.26941(13) 0.0296(5) Uani 1 1 d . .
C3 C 0.0275(3) 0.6585(2) 0.26328(14) 0.0350(6) Uani 1 1 d . .
H3 H -0.023740 0.678523 0.214535 0.042 Uiso 1 1 calc R U
C4 C -0.0372(3) 0.6767(2) 0.32916(14) 0.0341(6) Uani 1 1 d . .
H4 H -0.131843 0.708888 0.324607 0.041 Uiso 1 1 calc R U
C5 C 0.0382(2) 0.6472(2) 0.40215(13) 0.0255(5) Uani 1 1 d . .
C6 C 0.1794(3) 0.5979(2) 0.40796(13) 0.0306(5) Uani 1 1 d . .
H6 H 0.230638 0.577147 0.456508 0.037 Uiso 1 1 calc R U
C7 C 0.2430(3) 0.5798(2) 0.34182(14) 0.0330(5) Uani 1 1 d . .
H7 H 0.337034 0.546516 0.345970 0.040 Uiso 1 1 calc R U
C8 C -0.0287(2) 0.6702(2) 0.47362(13) 0.0249(5) Uani 1 1 d . .
C9 C -0.2196(2) 0.7351(2) 0.53073(13) 0.0263(5) Uani 1 1 d . .
C10 C -0.0061(2) 0.6789(2) 0.60612(13) 0.0255(5) Uani 1 1 d . .
C11 C -0.3734(2) 0.7812(2) 0.52415(13) 0.0284(5) Uani 1 1 d . .
C12 C -0.4537(3) 0.8108(2) 0.45233(14) 0.0340(5) Uani 1 1 d . .
H12 H -0.412451 0.798294 0.407128 0.041 Uiso 1 1 calc R U
C13 C -0.5935(3) 0.8582(2) 0.44700(14) 0.0358(6) Uani 1 1 d . .
H13 H -0.646213 0.877400 0.398378 0.043 Uiso 1 1 calc R U
C14 C -0.6561(2) 0.8776(2) 0.51404(14) 0.0307(5) Uani 1 1 d . .
C15 C -0.5784(3) 0.8452(2) 0.58568(15) 0.0397(6) Uani 1 1 d . .
H15 H -0.621330 0.855497 0.630449 0.048 Uiso 1 1 calc R U
C16 C -0.4386(3) 0.7979(3) 0.59114(14) 0.0386(6) Uani 1 1 d . .
H16 H -0.387120 0.776857 0.639570 0.046 Uiso 1 1 calc R U
C17 C -0.8048(3) 0.9326(2) 0.50914(15) 0.0345(6) Uani 1 1 d . .
C18 C 0.0820(3) 0.6578(2) 0.68425(13) 0.0275(5) Uani 1 1 d . .
C19 C 0.0204(3) 0.6792(2) 0.75192(14) 0.0340(6) Uani 1 1 d . .
H19 H -0.074381 0.710939 0.748100 0.041 Uiso 1 1 calc R U
C20 C 0.0991(3) 0.6536(2) 0.82405(14) 0.0360(6) Uani 1 1 d . .
H20 H 0.057458 0.669254 0.868848 0.043 Uiso 1 1 calc R U
C21 C 0.2394(3) 0.6050(2) 0.83125(13) 0.0302(5) Uani 1 1 d . .
C22 C 0.3021(3) 0.5846(2) 0.76399(14) 0.0359(6) Uani 1 1 d . .
H22 H 0.396563 0.552104 0.767958 0.043 Uiso 1 1 calc R U
C23 C 0.2248(3) 0.6124(2) 0.69168(13) 0.0343(6) Uani 1 1 d . .
H23 H 0.268765 0.600571 0.647343 0.041 Uiso 1 1 calc R U
C24 C 0.3199(3) 0.5680(2) 0.90923(13) 0.0319(5) Uani 1 1 d . .
C25 C 0.2956(4) 0.2851(3) 0.09675(18) 0.0563(8) Uani 1 1 d . .
H25 H 0.379562 0.280879 0.136840 0.068 Uiso 1 1 calc R U
C26 C 0.1897(4) 0.1949(3) 0.07136(19) 0.0578(8) Uani 1 1 d . .
H26 H 0.186012 0.117483 0.089726 0.069 Uiso 1 1 calc R U
C27 C 0.1359(3) 0.3527(2) 0.00566(15) 0.0394(6) Uani 1 1 d . .
H27 H 0.085803 0.403101 -0.030093 0.047 Uiso 1 1 calc R U
C28 C -0.0498(3) 0.1719(3) -0.03390(16) 0.0446(6) Uani 1 1 d . .
H28A H -0.128915 0.229141 -0.043373 0.054 Uiso 1 1 calc R U
H28B H -0.083757 0.109487 -0.003384 0.054 Uiso 1 1 calc R U
C29 C -0.0291(3) 0.1113(2) -0.11216(16) 0.0421(6) Uani 1 1 d . .
C30 C -0.1564(4) 0.0755(3) -0.17023(18) 0.0531(7) Uani 1 1 d . .
H30 H -0.252254 0.091657 -0.160935 0.064 Uiso 1 1 calc R U
C31 C -0.1410(4) 0.0166(3) -0.24119(19) 0.0600(8) Uani 1 1 d . .
H31 H -0.226847 -0.008675 -0.279287 0.072 Uiso 1 1 calc R U
C32 C 0.0005(4) -0.0057(3) -0.25657(18) 0.0557(8) Uani 1 1 d . .
H32 H 0.009652 -0.046784 -0.304566 0.067 Uiso 1 1 calc R U
C33 C 0.1275(4) 0.0326(3) -0.20120(18) 0.0506(7) Uani 1 1 d . .
C34 C 0.1117(3) 0.0901(3) -0.12815(17) 0.0482(7) Uani 1 1 d . .
H34 H 0.197549 0.114349 -0.089878 0.058 Uiso 1 1 calc R U
C35 C 0.2819(4) 0.0114(3) -0.2202(2) 0.0687(10) Uani 1 1 d . .
H35A H 0.300838 -0.074845 -0.217665 0.082 Uiso 1 1 calc R U
H35B H 0.282098 0.030860 -0.273908 0.082 Uiso 1 1 calc R U
C36 C 0.4396(3) 0.2054(3) -0.16742(17) 0.0512(7) Uani 1 1 d . .
H36 H 0.401774 0.251205 -0.208876 0.061 Uiso 1 1 calc R U
C37 C 0.5553(4) 0.1556(3) -0.05742(19) 0.0554(8) Uani 1 1 d . .
H37 H 0.615247 0.160958 -0.007035 0.066 Uiso 1 1 calc R U
C38 C 0.4772(4) 0.0529(3) -0.0954(2) 0.0619(8) Uani 1 1 d . .
H38 H 0.474318 -0.024439 -0.076904 0.074 Uiso 1 1 calc R U
H3A H -0.963(3) 0.982(3) 0.437(2) 0.093 Uiso 1 1 d 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'
Co Co 0.3494 0.9721 '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'
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
O6 Co1 O5 115.23(7) 2_666 1_554
O6 Co1 N4 93.07(9) 2_666 .
O5 Co1 N4 91.25(8) 1_554 .
O6 Co1 N7 89.16(9) 2_666 2_665
O5 Co1 N7 87.29(8) 1_554 2_665
N4 Co1 N7 177.70(8) . 2_665
O6 Co1 O1 91.72(7) 2_666 .
O5 Co1 O1 152.73(7) 1_554 .
N4 Co1 O1 91.39(8) . .
N7 Co1 O1 89.09(8) 2_665 .
O6 Co1 O2 151.09(7) 2_666 .
O5 Co1 O2 93.67(7) 1_554 .
N4 Co1 O2 86.66(8) . .
N7 Co1 O2 91.65(8) 2_665 .
O1 Co1 O2 59.41(6) . .
C1 O1 Co1 90.95(14) . .
C1 O2 Co1 88.86(14) . .
C17 O3 H3A 119(3) . .
C24 O5 Co1 122.34(15) . 1_556
C24 O6 Co1 160.3(2) . 2_666
C9 N1 C8 114.92(18) . .
C9 N2 C10 115.21(18) . .
C8 N3 C10 115.16(18) . .
C27 N4 C25 104.7(2) . .
C27 N4 Co1 126.40(17) . .
C25 N4 Co1 127.88(19) . .
C27 N5 C26 106.8(2) . .
C27 N5 C28 126.0(2) . .
C26 N5 C28 127.2(2) . .
C36 N6 C38 105.9(3) . .
C36 N6 C35 127.0(3) . .
C38 N6 C35 125.5(3) . .
C36 N7 C37 105.1(3) . .
C36 N7 Co1 126.5(2) . 2_665
C37 N7 Co1 128.4(2) . 2_665
O2 C1 O1 120.8(2) . .
O2 C1 C2 120.4(2) . .
O1 C1 C2 118.8(2) . .
C7 C2 C3 119.5(2) . .
C7 C2 C1 120.5(2) . .
C3 C2 C1 120.0(2) . .
C4 C3 C2 120.3(2) . .
C4 C3 H3 119.9 . .
C2 C3 H3 119.9 . .
C3 C4 C5 120.4(2) . .
C3 C4 H4 119.8 . .
C5 C4 H4 119.8 . .
C4 C5 C6 119.2(2) . .
C4 C5 C8 120.57(19) . .
C6 C5 C8 120.22(19) . .
C7 C6 C5 120.1(2) . .
C7 C6 H6 120.0 . .
C5 C6 H6 120.0 . .
C6 C7 C2 120.6(2) . .
C6 C7 H7 119.7 . .
C2 C7 H7 119.7 . .
N3 C8 N1 124.85(19) . .
N3 C8 C5 117.41(19) . .
N1 C8 C5 117.73(19) . .
N2 C9 N1 125.1(2) . .
N2 C9 C11 117.29(19) . .
N1 C9 C11 117.60(19) . .
N2 C10 N3 124.71(19) . .
N2 C10 C18 117.88(19) . .
N3 C10 C18 117.41(19) . .
C12 C11 C16 118.8(2) . .
C12 C11 C9 121.0(2) . .
C16 C11 C9 120.2(2) . .
C13 C12 C11 120.9(2) . .
C13 C12 H12 119.6 . .
C11 C12 H12 119.6 . .
C12 C13 C14 120.1(2) . .
C12 C13 H13 119.9 . .
C14 C13 H13 119.9 . .
C15 C14 C13 119.4(2) . .
C15 C14 C17 120.3(2) . .
C13 C14 C17 120.4(2) . .
C16 C15 C14 120.6(2) . .
C16 C15 H15 119.7 . .
C14 C15 H15 119.7 . .
C15 C16 C11 120.2(2) . .
C15 C16 H16 119.9 . .
C11 C16 H16 119.9 . .
O4 C17 O3 123.1(2) . .
O4 C17 C14 119.5(2) . .
O3 C17 C14 117.4(2) . .
C23 C18 C19 118.8(2) . .
C23 C18 C10 120.93(19) . .
C19 C18 C10 120.3(2) . .
C20 C19 C18 120.3(2) . .
C20 C19 H19 119.9 . .
C18 C19 H19 119.9 . .
C19 C20 C21 121.1(2) . .
C19 C20 H20 119.5 . .
C21 C20 H20 119.5 . .
C20 C21 C22 118.9(2) . .
C20 C21 C24 120.9(2) . .
C22 C21 C24 120.1(2) . .
C23 C22 C21 120.2(2) . .
C23 C22 H22 119.9 . .
C21 C22 H22 119.9 . .
C22 C23 C18 120.7(2) . .
C22 C23 H23 119.6 . .
C18 C23 H23 119.6 . .
O6 C24 O5 124.5(2) . .
O6 C24 C21 118.0(2) . .
O5 C24 C21 117.4(2) . .
C26 C25 N4 110.3(3) . .
C26 C25 H25 124.8 . .
N4 C25 H25 124.8 . .
C25 C26 N5 106.5(3) . .
C25 C26 H26 126.7 . .
N5 C26 H26 126.7 . .
N4 C27 N5 111.7(2) . .
N4 C27 H27 124.1 . .
N5 C27 H27 124.1 . .
N5 C28 C29 114.1(2) . .
N5 C28 H28A 108.7 . .
C29 C28 H28A 108.7 . .
N5 C28 H28B 108.7 . .
C29 C28 H28B 108.7 . .
H28A C28 H28B 107.6 . .
C34 C29 C30 118.9(3) . .
C34 C29 C28 122.2(2) . .
C30 C29 C28 119.0(3) . .
C31 C30 C29 120.2(3) . .
C31 C30 H30 119.9 . .
C29 C30 H30 119.9 . .
C30 C31 C32 120.6(3) . .
C30 C31 H31 119.7 . .
C32 C31 H31 119.7 . .
C33 C32 C31 120.1(3) . .
C33 C32 H32 120.0 . .
C31 C32 H32 120.0 . .
C32 C33 C34 119.3(3) . .
C32 C33 C35 119.3(3) . .
C34 C33 C35 121.4(3) . .
C29 C34 C33 120.9(3) . .
C29 C34 H34 119.5 . .
C33 C34 H34 119.5 . .
N6 C35 C33 112.8(2) . .
N6 C35 H35A 109.0 . .
C33 C35 H35A 109.0 . .
N6 C35 H35B 109.0 . .
C33 C35 H35B 109.0 . .
H35A C35 H35B 107.8 . .
N7 C36 N6 112.8(3) . .
N7 C36 H36 123.6 . .
N6 C36 H36 123.6 . .
C38 C37 N7 109.9(3) . .
C38 C37 H37 125.1 . .
N7 C37 H37 125.1 . .
C37 C38 N6 106.3(3) . .
C37 C38 H38 126.8 . .
N6 C38 H38 126.8 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O6 2.0104(18) 2_666
Co1 O5 2.0430(17) 1_554
Co1 N4 2.097(2) .
Co1 N7 2.150(2) 2_665
Co1 O1 2.1739(18) .
Co1 O2 2.2269(17) .
O1 C1 1.261(3) .
O2 C1 1.248(3) .
O3 C17 1.261(3) .
O3 H3A 0.863(19) .
O4 C17 1.257(3) .
O5 C24 1.253(3) .
O6 C24 1.234(3) .
N1 C9 1.334(3) .
N1 C8 1.340(3) .
N2 C9 1.333(3) .
N2 C10 1.335(3) .
N3 C8 1.334(3) .
N3 C10 1.339(3) .
N4 C27 1.316(3) .
N4 C25 1.375(4) .
N5 C27 1.335(3) .
N5 C26 1.368(3) .
N5 C28 1.461(3) .
N6 C36 1.345(4) .
N6 C38 1.370(4) .
N6 C35 1.451(4) .
N7 C36 1.295(4) .
N7 C37 1.371(4) .
C1 C2 1.502(3) .
C2 C7 1.382(3) .
C2 C3 1.385(3) .
C3 C4 1.379(3) .
C3 H3 0.9300 .
C4 C5 1.387(3) .
C4 H4 0.9300 .
C5 C6 1.395(3) .
C5 C8 1.483(3) .
C6 C7 1.378(3) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C9 C11 1.484(3) .
C10 C18 1.474(3) .
C11 C12 1.386(3) .
C11 C16 1.398(3) .
C12 C13 1.375(3) .
C12 H12 0.9300 .
C13 C14 1.388(3) .
C13 H13 0.9300 .
C14 C15 1.386(3) .
C14 C17 1.485(3) .
C15 C16 1.374(3) .
C15 H15 0.9300 .
C16 H16 0.9300 .
C18 C23 1.389(3) .
C18 C19 1.395(3) .
C19 C20 1.371(3) .
C19 H19 0.9300 .
C20 C21 1.382(3) .
C20 H20 0.9300 .
C21 C22 1.393(3) .
C21 C24 1.503(3) .
C22 C23 1.377(3) .
C22 H22 0.9300 .
C23 H23 0.9300 .
C25 C26 1.327(4) .
C25 H25 0.9300 .
C26 H26 0.9300 .
C27 H27 0.9300 .
C28 C29 1.505(4) .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C29 C34 1.374(4) .
C29 C30 1.391(4) .
C30 C31 1.372(4) .
C30 H30 0.9300 .
C31 C32 1.380(5) .
C31 H31 0.9300 .
C32 C33 1.370(4) .
C32 H32 0.9300 .
C33 C34 1.399(4) .
C33 C35 1.513(4) .
C34 H34 0.9300 .
C35 H35A 0.9700 .
C35 H35B 0.9700 .
C36 H36 0.9300 .
C37 C38 1.348(5) .
C37 H37 0.9300 .
C38 H38 0.9300 .
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
Co1 O2 C1 O1 0.5(2) .
Co1 O2 C1 C2 179.1(2) .
Co1 O1 C1 O2 -0.5(3) .
Co1 O1 C1 C2 -179.2(2) .
O2 C1 C2 C7 176.1(2) .
O1 C1 C2 C7 -5.3(4) .
O2 C1 C2 C3 -4.1(4) .
O1 C1 C2 C3 174.5(2) .
C7 C2 C3 C4 0.8(4) .
C1 C2 C3 C4 -179.0(2) .
C2 C3 C4 C5 0.0(4) .
C3 C4 C5 C6 -0.6(4) .
C3 C4 C5 C8 178.1(2) .
C4 C5 C6 C7 0.5(4) .
C8 C5 C6 C7 -178.2(2) .
C5 C6 C7 C2 0.3(4) .
C3 C2 C7 C6 -0.9(4) .
C1 C2 C7 C6 178.9(2) .
C10 N3 C8 N1 -1.8(3) .
C10 N3 C8 C5 176.81(19) .
C9 N1 C8 N3 1.6(3) .
C9 N1 C8 C5 -177.0(2) .
C4 C5 C8 N3 -173.5(2) .
C6 C5 C8 N3 5.2(3) .
C4 C5 C8 N1 5.2(3) .
C6 C5 C8 N1 -176.1(2) .
C10 N2 C9 N1 -1.8(3) .
C10 N2 C9 C11 178.95(19) .
C8 N1 C9 N2 0.4(3) .
C8 N1 C9 C11 179.59(19) .
C9 N2 C10 N3 1.6(3) .
C9 N2 C10 C18 -177.4(2) .
C8 N3 C10 N2 0.1(3) .
C8 N3 C10 C18 179.1(2) .
N2 C9 C11 C12 172.3(2) .
N1 C9 C11 C12 -7.0(3) .
N2 C9 C11 C16 -6.5(3) .
N1 C9 C11 C16 174.2(2) .
C16 C11 C12 C13 1.5(4) .
C9 C11 C12 C13 -177.3(2) .
C11 C12 C13 C14 0.2(4) .
C12 C13 C14 C15 -1.9(4) .
C12 C13 C14 C17 178.0(2) .
C13 C14 C15 C16 2.0(4) .
C17 C14 C15 C16 -177.9(2) .
C14 C15 C16 C11 -0.4(4) .
C12 C11 C16 C15 -1.4(4) .
C9 C11 C16 C15 177.4(2) .
C15 C14 C17 O4 3.6(4) .
C13 C14 C17 O4 -176.4(2) .
C15 C14 C17 O3 -177.3(2) .
C13 C14 C17 O3 2.7(3) .
N2 C10 C18 C23 179.9(2) .
N3 C10 C18 C23 0.8(3) .
N2 C10 C18 C19 2.2(3) .
N3 C10 C18 C19 -176.8(2) .
C23 C18 C19 C20 -1.1(4) .
C10 C18 C19 C20 176.6(2) .
C18 C19 C20 C21 -0.8(4) .
C19 C20 C21 C22 1.4(4) .
C19 C20 C21 C24 -175.3(2) .
C20 C21 C22 C23 -0.2(4) .
C24 C21 C22 C23 176.6(2) .
C21 C22 C23 C18 -1.7(4) .
C19 C18 C23 C22 2.4(4) .
C10 C18 C23 C22 -175.4(2) .
Co1 O6 C24 O5 -80.5(6) 2_666
Co1 O6 C24 C21 102.0(5) 2_666
Co1 O5 C24 O6 1.1(4) 1_556
Co1 O5 C24 C21 178.53(16) 1_556
C20 C21 C24 O6 161.3(3) .
C22 C21 C24 O6 -15.4(4) .
C20 C21 C24 O5 -16.3(4) .
C22 C21 C24 O5 167.0(2) .
C27 N4 C25 C26 0.6(4) .
Co1 N4 C25 C26 169.3(2) .
N4 C25 C26 N5 -0.4(4) .
C27 N5 C26 C25 0.0(4) .
C28 N5 C26 C25 179.4(3) .
C25 N4 C27 N5 -0.6(3) .
Co1 N4 C27 N5 -169.50(16) .
C26 N5 C27 N4 0.4(3) .
C28 N5 C27 N4 -179.0(2) .
C27 N5 C28 C29 83.9(3) .
C26 N5 C28 C29 -95.3(3) .
N5 C28 C29 C34 17.5(4) .
N5 C28 C29 C30 -162.5(2) .
C34 C29 C30 C31 2.1(4) .
C28 C29 C30 C31 -177.9(3) .
C29 C30 C31 C32 -1.4(5) .
C30 C31 C32 C33 -0.9(5) .
C31 C32 C33 C34 2.4(5) .
C31 C32 C33 C35 -177.8(3) .
C30 C29 C34 C33 -0.5(4) .
C28 C29 C34 C33 179.4(3) .
C32 C33 C34 C29 -1.7(5) .
C35 C33 C34 C29 178.6(3) .
C36 N6 C35 C33 -76.9(4) .
C38 N6 C35 C33 86.3(4) .
C32 C33 C35 N6 164.0(3) .
C34 C33 C35 N6 -16.2(5) .
C37 N7 C36 N6 -2.4(3) .
Co1 N7 C36 N6 177.10(17) 2_665
C38 N6 C36 N7 1.9(3) .
C35 N6 C36 N7 167.6(3) .
C36 N7 C37 C38 2.0(4) .
Co1 N7 C37 C38 -177.5(2) 2_665
N7 C37 C38 N6 -0.9(4) .
C36 N6 C38 C37 -0.5(3) .
C35 N6 C38 C37 -166.6(3) .
