#------------------------------------------------------------------------------
#$Date: 2019-11-17 11:54:45 +0200 (Sun, 17 Nov 2019) $
#$Revision: 229718 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/81/7048116.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_7048116
loop_
_publ_author_name
'Wang, Yichen'
'Li, Jing'
'Zhang, Li'
'Chen, Chao'
'Feng, Rui'
'Zhao, Yue'
'Zhang, Yi-Quan'
'Tan, Gengwen'
'Song, You'
'Wang, Xinping'
_publ_section_title
;
 Magnetic on-off switching in redox non-innocent ligand bridged binuclear
 cobalt complexes.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              17211
_journal_page_last               17215
_journal_paper_doi               10.1039/c8dt04157a
_journal_volume                  47
_journal_year                    2018
_chemical_formula_sum            'C66 H88 Co2 N8'
_chemical_formula_weight         1111.30
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2018-08-17 deposited with the CCDC.
2018-11-13 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 105.293(4)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.577(2)
_cell_length_b                   16.039(3)
_cell_length_c                   15.838(2)
_cell_measurement_reflns_used    4984
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      27.24
_cell_measurement_theta_min      2.67
_cell_volume                     3081.7(9)
_computing_cell_refinement       'Saint+ ver. V8.37A (Bruker AXS)'
_computing_data_collection       'APEX2 ver. 2014.9 (Bruker AXS)'
_computing_data_reduction        'Saint+ ver. V8.37A (Bruker AXS)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXT (Sheldrick, 2014)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker D8 Quest'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0674
_diffrn_reflns_av_unetI/netI     0.0679
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            19966
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.000
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_min         2.242
_diffrn_source                   'microfocus sealed tube (Incoatec ImS)'
_exptl_absorpt_coefficient_mu    0.583
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.5951
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SadAbs 2016/2 (Bruker AXS)'
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.198
_exptl_crystal_description       block
_exptl_crystal_F_000             1188
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.551
_refine_diff_density_min         -0.336
_refine_diff_density_rms         0.058
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.011
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     353
_refine_ls_number_reflns         5405
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.011
_refine_ls_R_factor_all          0.0786
_refine_ls_R_factor_gt           0.0441
_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)+(0.0279P)²+3.1558P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0875
_refine_ls_wR_factor_ref         0.1019
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3817
_reflns_number_total             5405
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8dt04157a2.cif
_cod_data_source_block           P2_a
_cod_depositor_comments
'Adding full bibliography for 7048116--7048117.cif.'
_cod_original_cell_volume        3081.9(8)
_cod_database_code               7048116
_shelx_shelxl_version_number     2014/7
_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.
;
_shelx_estimated_absorpt_t_min   0.892
_shelx_estimated_absorpt_t_max   0.944
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
C1 C 0.4501(2) 0.49796(17) 0.47042(18) 0.0225(7) Uani 1 1 d . .
C2 C 0.2829(3) 0.43121(18) 0.4164(2) 0.0308(8) Uani 1 1 d . .
H2 H 0.2335 0.3866 0.4171 0.037 Uiso 1 1 calc R U
C3 C 0.2492(3) 0.49396(19) 0.3545(2) 0.0342(8) Uani 1 1 d . .
H3 H 0.1778 0.4933 0.3149 0.041 Uiso 1 1 calc R U
C4 C 0.3235(3) 0.55774(18) 0.35253(19) 0.0293(7) Uani 1 1 d . .
H4 H 0.3022 0.6005 0.3099 0.035 Uiso 1 1 calc R U
C5 C 0.6160(3) 0.70166(19) 0.18062(19) 0.0315(8) Uani 1 1 d . .
H5A H 0.6863 0.6720 0.1901 0.047 Uiso 1 1 calc R U
H5B H 0.6246 0.7588 0.1615 0.047 Uiso 1 1 calc R U
H5C H 0.5595 0.6729 0.1355 0.047 Uiso 1 1 calc R U
C6 C 0.5815(2) 0.70369(17) 0.26501(18) 0.0217(6) Uani 1 1 d . .
C7 C 0.5147(2) 0.77146(17) 0.27571(19) 0.0235(7) Uani 1 1 d . .
H7 H 0.4831 0.8023 0.2240 0.028 Uiso 1 1 calc R U
C8 C 0.4880(2) 0.80021(16) 0.35117(19) 0.0228(7) Uani 1 1 d . .
C9 C 0.4325(3) 0.88455(18) 0.3450(2) 0.0344(8) Uani 1 1 d . .
H9A H 0.3543 0.8788 0.3144 0.052 Uiso 1 1 calc R U
H9B H 0.4677 0.9230 0.3126 0.052 Uiso 1 1 calc R U
H9C H 0.4397 0.9064 0.4040 0.052 Uiso 1 1 calc R U
C10 C 0.5031(3) 0.79887(17) 0.50582(19) 0.0240(7) Uani 1 1 d . .
C11 C 0.4098(3) 0.78747(18) 0.5370(2) 0.0310(8) Uani 1 1 d . .
C12 C 0.4081(3) 0.8246(2) 0.6164(2) 0.0430(9) Uani 1 1 d . .
H12 H 0.3456 0.8173 0.6387 0.052 Uiso 1 1 calc R U
C13 C 0.4957(3) 0.8717(2) 0.6630(2) 0.0460(10) Uani 1 1 d . .
H13 H 0.4936 0.8962 0.7171 0.055 Uiso 1 1 calc R U
C14 C 0.5858(3) 0.88300(19) 0.6311(2) 0.0392(9) Uani 1 1 d . .
H14 H 0.6456 0.9160 0.6634 0.047 Uiso 1 1 calc R U
C15 C 0.5917(3) 0.84713(18) 0.5524(2) 0.0300(7) Uani 1 1 d . .
C16 C 0.6924(3) 0.8627(2) 0.5188(2) 0.0409(9) Uani 1 1 d . .
H16 H 0.6834 0.8294 0.4640 0.049 Uiso 1 1 calc R U
C17 C 0.7023(3) 0.9547(2) 0.4957(3) 0.0632(12) Uani 1 1 d . .
H17A H 0.7181 0.9884 0.5492 0.095 Uiso 1 1 calc R U
H17B H 0.6329 0.9734 0.4557 0.095 Uiso 1 1 calc R U
H17C H 0.7623 0.9613 0.4673 0.095 Uiso 1 1 calc R U
C18 C 0.7975(3) 0.8336(2) 0.5838(3) 0.0577(11) Uani 1 1 d . .
H18A H 0.8113 0.8681 0.6367 0.087 Uiso 1 1 calc R U
H18B H 0.8594 0.8388 0.5575 0.087 Uiso 1 1 calc R U
H18C H 0.7894 0.7752 0.5992 0.087 Uiso 1 1 calc R U
C19 C 0.3102(3) 0.7384(2) 0.4860(2) 0.0340(8) Uani 1 1 d . .
H19 H 0.3270 0.7171 0.4316 0.041 Uiso 1 1 calc R U
C20 C 0.2881(3) 0.6625(2) 0.5383(2) 0.0452(9) Uani 1 1 d . .
H20A H 0.3537 0.6268 0.5534 0.068 Uiso 1 1 calc R U
H20B H 0.2257 0.6307 0.5027 0.068 Uiso 1 1 calc R U
H20C H 0.2709 0.6815 0.5920 0.068 Uiso 1 1 calc R U
C21 C 0.2076(3) 0.7933(2) 0.4583(3) 0.0490(10) Uani 1 1 d . .
H21A H 0.1888 0.8148 0.5104 0.074 Uiso 1 1 calc R U
H21B H 0.1459 0.7603 0.4234 0.074 Uiso 1 1 calc R U
H21C H 0.2223 0.8401 0.4231 0.074 Uiso 1 1 calc R U
C22 C 0.6894(2) 0.58084(17) 0.31366(18) 0.0224(7) Uani 1 1 d . .
C23 C 0.6505(3) 0.51102(18) 0.26029(19) 0.0289(7) Uani 1 1 d . .
C24 C 0.7270(3) 0.45143(19) 0.2517(2) 0.0383(9) Uani 1 1 d . .
H24 H 0.7025 0.4039 0.2161 0.046 Uiso 1 1 calc R U
C25 C 0.8367(3) 0.4591(2) 0.2932(2) 0.0416(9) Uani 1 1 d . .
H25 H 0.8876 0.4184 0.2844 0.050 Uiso 1 1 calc R U
C26 C 0.8732(3) 0.52611(19) 0.3478(2) 0.0355(8) Uani 1 1 d . .
H26 H 0.9490 0.5301 0.3782 0.043 Uiso 1 1 calc R U
C27 C 0.8006(3) 0.58783(17) 0.3589(2) 0.0273(7) Uani 1 1 d . .
C28 C 0.8421(3) 0.66158(18) 0.4184(2) 0.0303(7) Uani 1 1 d . .
H28 H 0.7811 0.6790 0.4442 0.036 Uiso 1 1 calc R U
C29 C 0.8681(3) 0.7362(2) 0.3662(2) 0.0483(10) Uani 1 1 d . .
H29A H 0.8930 0.7834 0.4059 0.072 Uiso 1 1 calc R U
H29B H 0.8017 0.7521 0.3210 0.072 Uiso 1 1 calc R U
H29C H 0.9263 0.7207 0.3385 0.072 Uiso 1 1 calc R U
C30 C 0.9423(3) 0.6418(2) 0.4943(2) 0.0465(9) Uani 1 1 d . .
H30A H 1.0070 0.6334 0.4718 0.070 Uiso 1 1 calc R U
H30B H 0.9281 0.5910 0.5240 0.070 Uiso 1 1 calc R U
H30C H 0.9560 0.6884 0.5359 0.070 Uiso 1 1 calc R U
C31 C 0.5300(3) 0.49766(19) 0.2150(2) 0.0330(8) Uani 1 1 d . .
H31 H 0.4887 0.5487 0.2241 0.040 Uiso 1 1 calc R U
C32 C 0.4838(3) 0.4235(2) 0.2544(2) 0.0432(9) Uani 1 1 d . .
H32A H 0.5193 0.3721 0.2423 0.065 Uiso 1 1 calc R U
H32B H 0.4041 0.4197 0.2283 0.065 Uiso 1 1 calc R U
H32C H 0.4984 0.4311 0.3178 0.065 Uiso 1 1 calc R U
C33 C 0.5113(3) 0.4850(2) 0.1156(2) 0.0454(9) Uani 1 1 d . .
H33A H 0.5416 0.5326 0.0909 0.068 Uiso 1 1 calc R U
H33B H 0.4321 0.4804 0.0876 0.068 Uiso 1 1 calc R U
H33C H 0.5484 0.4338 0.1050 0.068 Uiso 1 1 calc R U
Co1 Co 0.54737(3) 0.63996(2) 0.42308(3) 0.02134(12) Uani 1 1 d . .
N3 N 0.51097(19) 0.75823(13) 0.42660(15) 0.0195(5) Uani 1 1 d . .
N4 N 0.61451(19) 0.64495(14) 0.32530(14) 0.0207(5) Uani 1 1 d . .
N1 N 0.4225(2) 0.56103(14) 0.40778(15) 0.0230(6) Uani 1 1 d . .
N2 N 0.3804(2) 0.43039(14) 0.47458(15) 0.0241(6) Uani 1 1 d . .
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'
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
C1 C1 N1 117.9(3) 3_666 .
C1 C1 N2 118.7(3) 3_666 .
N1 C1 N2 123.4(3) . .
N2 C2 C3 123.5(3) . .
N2 C2 H2 118.3 . .
C3 C2 H2 118.3 . .
C4 C3 C2 117.7(3) . .
C4 C3 H3 121.1 . .
C2 C3 H3 121.1 . .
N1 C4 C3 122.4(3) . .
N1 C4 H4 118.8 . .
C3 C4 H4 118.8 . .
C6 C5 H5A 109.5 . .
C6 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
C6 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
N4 C6 C7 122.9(3) . .
N4 C6 C5 120.8(3) . .
C7 C6 C5 116.2(2) . .
C8 C7 C6 129.8(3) . .
C8 C7 H7 115.1 . .
C6 C7 H7 115.1 . .
N3 C8 C7 123.6(2) . .
N3 C8 C9 119.8(3) . .
C7 C8 C9 116.7(2) . .
C8 C9 H9A 109.5 . .
C8 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C8 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C15 C10 C11 120.8(3) . .
C15 C10 N3 118.8(3) . .
C11 C10 N3 120.3(3) . .
C12 C11 C10 118.4(3) . .
C12 C11 C19 119.6(3) . .
C10 C11 C19 122.0(3) . .
C13 C12 C11 121.1(3) . .
C13 C12 H12 119.5 . .
C11 C12 H12 119.5 . .
C14 C13 C12 119.9(3) . .
C14 C13 H13 120.1 . .
C12 C13 H13 120.1 . .
C13 C14 C15 121.3(3) . .
C13 C14 H14 119.3 . .
C15 C14 H14 119.3 . .
C14 C15 C10 118.5(3) . .
C14 C15 C16 119.5(3) . .
C10 C15 C16 122.0(3) . .
C15 C16 C18 111.7(3) . .
C15 C16 C17 111.7(3) . .
C18 C16 C17 110.2(3) . .
C15 C16 H16 107.7 . .
C18 C16 H16 107.7 . .
C17 C16 H16 107.7 . .
C16 C17 H17A 109.5 . .
C16 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C16 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C16 C18 H18A 109.5 . .
C16 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C16 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C11 C19 C21 111.7(3) . .
C11 C19 C20 111.4(3) . .
C21 C19 C20 110.6(3) . .
C11 C19 H19 107.7 . .
C21 C19 H19 107.7 . .
C20 C19 H19 107.7 . .
C19 C20 H20A 109.5 . .
C19 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
C19 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
C19 C21 H21A 109.5 . .
C19 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
C19 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
C27 C22 C23 120.8(3) . .
C27 C22 N4 118.5(2) . .
C23 C22 N4 120.6(3) . .
C24 C23 C22 117.8(3) . .
C24 C23 C31 119.3(3) . .
C22 C23 C31 122.8(3) . .
C25 C24 C23 121.9(3) . .
C25 C24 H24 119.1 . .
C23 C24 H24 119.1 . .
C24 C25 C26 119.8(3) . .
C24 C25 H25 120.1 . .
C26 C25 H25 120.1 . .
C25 C26 C27 120.9(3) . .
C25 C26 H26 119.5 . .
C27 C26 H26 119.5 . .
C26 C27 C22 118.7(3) . .
C26 C27 C28 120.3(3) . .
C22 C27 C28 121.0(3) . .
C27 C28 C30 113.9(3) . .
C27 C28 C29 111.1(3) . .
C30 C28 C29 109.6(3) . .
C27 C28 H28 107.3 . .
C30 C28 H28 107.3 . .
C29 C28 H28 107.3 . .
C28 C29 H29A 109.5 . .
C28 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
C28 C29 H29C 109.5 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
C28 C30 H30A 109.5 . .
C28 C30 H30B 109.5 . .
H30A C30 H30B 109.5 . .
C28 C30 H30C 109.5 . .
H30A C30 H30C 109.5 . .
H30B C30 H30C 109.5 . .
C23 C31 C32 111.0(3) . .
C23 C31 C33 111.5(3) . .
C32 C31 C33 110.0(3) . .
C23 C31 H31 108.1 . .
C32 C31 H31 108.1 . .
C33 C31 H31 108.1 . .
C31 C32 H32A 109.5 . .
C31 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
C31 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
C31 C33 H33A 109.5 . .
C31 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
C31 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
N4 Co1 N3 97.84(9) . .
N4 Co1 N1 115.09(10) . .
N3 Co1 N1 116.06(10) . .
N4 Co1 N2 118.06(10) . 3_666
N3 Co1 N2 125.99(10) . 3_666
N1 Co1 N2 85.05(10) . 3_666
C8 N3 C10 120.2(2) . .
C8 N3 Co1 117.45(18) . .
C10 N3 Co1 122.29(17) . .
C6 N4 C22 120.4(2) . .
C6 N4 Co1 118.75(19) . .
C22 N4 Co1 120.48(17) . .
C4 N1 C1 117.1(2) . .
C4 N1 Co1 133.2(2) . .
C1 N1 Co1 109.63(18) . .
C2 N2 C1 115.7(2) . .
C2 N2 Co1 135.4(2) . 3_666
C1 N2 Co1 108.64(18) . 3_666
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C1 1.355(6) 3_666
C1 N1 1.395(3) .
C1 N2 1.406(3) .
C2 N2 1.325(4) .
C2 C3 1.391(4) .
C2 H2 0.9500 .
C3 C4 1.391(4) .
C3 H3 0.9500 .
C4 N1 1.321(4) .
C4 H4 0.9500 .
C5 C6 1.511(4) .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C6 N4 1.328(3) .
C6 C7 1.411(4) .
C7 C8 1.402(4) .
C7 H7 0.9500 .
C8 N3 1.335(3) .
C8 C9 1.513(4) .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C10 C15 1.398(4) .
C10 C11 1.399(4) .
C10 N3 1.440(4) .
C11 C12 1.396(4) .
C11 C19 1.520(4) .
C12 C13 1.378(5) .
C12 H12 0.9500 .
C13 C14 1.369(5) .
C13 H13 0.9500 .
C14 C15 1.393(4) .
C14 H14 0.9500 .
C15 C16 1.517(5) .
C16 C18 1.519(5) .
C16 C17 1.535(5) .
C16 H16 1.0000 .
C17 H17A 0.9800 .
C17 H17B 0.9800 .
C17 H17C 0.9800 .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C19 C21 1.528(4) .
C19 C20 1.538(4) .
C19 H19 1.0000 .
C20 H20A 0.9800 .
C20 H20B 0.9800 .
C20 H20C 0.9800 .
C21 H21A 0.9800 .
C21 H21B 0.9800 .
C21 H21C 0.9800 .
C22 C27 1.398(4) .
C22 C23 1.410(4) .
C22 N4 1.438(3) .
C23 C24 1.388(4) .
C23 C31 1.512(4) .
C24 C25 1.368(5) .
C24 H24 0.9500 .
C25 C26 1.380(5) .
C25 H25 0.9500 .
C26 C27 1.388(4) .
C26 H26 0.9500 .
C27 C28 1.517(4) .
C28 C30 1.528(4) .
C28 C29 1.538(4) .
C28 H28 1.0000 .
C29 H29A 0.9800 .
C29 H29B 0.9800 .
C29 H29C 0.9800 .
C30 H30A 0.9800 .
C30 H30B 0.9800 .
C30 H30C 0.9800 .
C31 C32 1.528(4) .
C31 C33 1.543(4) .
C31 H31 1.0000 .
C32 H32A 0.9800 .
C32 H32B 0.9800 .
C32 H32C 0.9800 .
C33 H33A 0.9800 .
C33 H33B 0.9800 .
C33 H33C 0.9800 .
Co1 N4 1.951(2) .
Co1 N3 1.956(2) .
Co1 N1 1.982(2) .
Co1 N2 1.987(2) 3_666
N2 Co1 1.987(2) 3_666
