#------------------------------------------------------------------------------
#$Date: 2016-03-24 01:50:36 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179542 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/11/4501168.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_4501168
loop_
_publ_author_name
'Liu, Qing-Xiang'
'Zhao, Zhi-Xiang'
'Zhao, Xiao-Jun'
'Yao, Zhao-Quan'
'Li, Shu-Juan'
'Wang, Xiu-Guang'
_publ_section_title
;
 Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl
 Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak
 Interactions
;
_journal_issue                   11
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              4933
_journal_paper_doi               10.1021/cg2008182
_journal_volume                  11
_journal_year                    2011
_chemical_formula_sum            'C24 H28 Co N4 O7'
_chemical_formula_weight         543.43
_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                 93.121(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.948(2)
_cell_length_b                   9.1229(16)
_cell_length_c                   21.960(4)
_cell_measurement_reflns_used    5821
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.46
_cell_measurement_theta_min      2.42
_cell_volume                     2390.1(7)
_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 1.000
_diffrn_measured_fraction_theta_max 1.000
_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  0.0273
_diffrn_reflns_av_sigmaI/netI    0.0275
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            11707
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.86
_exptl_absorpt_coefficient_mu    0.771
_exptl_absorpt_correction_T_max  0.857
_exptl_absorpt_correction_T_min  0.825
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            RED
_exptl_crystal_density_diffrn    1.510
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             1132
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.457
_refine_diff_density_min         -0.205
_refine_diff_density_rms         0.050
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     325
_refine_ls_number_reflns         4200
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.037
_refine_ls_R_factor_all          0.0450
_refine_ls_R_factor_gt           0.0329
_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)+(0.0384P)²+1.2039P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0758
_refine_ls_wR_factor_ref         0.0815
_reflns_number_gt                3452
_reflns_number_total             4202
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg2008182_si_003.cif
_cod_data_source_block           91207b
_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 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'NONE' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      P21/C
_cod_database_code               4501168
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
Co1 Co 0.16354(2) 0.52382(3) 0.085228(13) 0.02552(10) Uani 1 1 d .
O1 O 0.52025(14) 0.1578(2) 0.16348(8) 0.0480(5) Uani 1 1 d .
O2 O 0.36190(17) 0.1337(2) 0.25864(10) 0.0575(5) Uani 1 1 d .
O3 O 0.15591(13) 0.75573(17) 0.08976(7) 0.0343(4) Uani 1 1 d .
O4 O 0.16217(13) 0.66002(17) -0.00163(7) 0.0351(4) Uani 1 1 d .
O5 O 0.10745(15) 1.21977(18) -0.02761(8) 0.0443(4) Uani 1 1 d .
O6 O 0.15723(14) 1.30337(17) 0.06539(8) 0.0409(4) Uani 1 1 d .
O7 O -0.01767(13) 0.52931(17) 0.07763(7) 0.0352(4) Uani 1 1 d .
H7A H -0.0377 0.6119 0.0628 0.053 Uiso 1 1 d R
H7B H -0.0412 0.4533 0.0586 0.053 Uiso 1 1 d R
N1 N 0.34553(16) 0.5088(2) 0.08698(9) 0.0327(4) Uani 1 1 d .
N2 N 0.51063(16) 0.3942(2) 0.07847(9) 0.0337(5) Uani 1 1 d .
N3 N 0.16675(16) 0.4769(2) 0.17941(8) 0.0324(4) Uani 1 1 d .
N4 N 0.17313(17) 0.3313(2) 0.26157(8) 0.0342(5) Uani 1 1 d .
C1 C 0.4308(2) 0.6138(3) 0.08340(10) 0.0320(5) Uani 1 1 d .
C2 C 0.5341(2) 0.5440(3) 0.07649(10) 0.0324(5) Uani 1 1 d .
C3 C 0.6325(2) 0.6210(3) 0.06748(11) 0.0415(6) Uani 1 1 d .
H3 H 0.6998 0.5733 0.0615 0.050 Uiso 1 1 calc R
C4 C 0.6246(2) 0.7714(3) 0.06795(13) 0.0516(7) Uani 1 1 d .
H4 H 0.6881 0.8269 0.0615 0.062 Uiso 1 1 calc R
C5 C 0.5239(2) 0.8432(3) 0.07786(14) 0.0520(7) Uani 1 1 d .
H5 H 0.5228 0.9451 0.0791 0.062 Uiso 1 1 calc R
C6 C 0.4254(2) 0.7665(3) 0.08593(12) 0.0423(6) Uani 1 1 d .
H6 H 0.3587 0.8149 0.0927 0.051 Uiso 1 1 calc R
C7 C 0.39887(19) 0.3824(3) 0.08455(11) 0.0350(6) Uani 1 1 d .
H7 H 0.3626 0.2925 0.0868 0.042 Uiso 1 1 calc R
C8 C 0.5896(2) 0.2725(3) 0.07588(11) 0.0394(6) Uani 1 1 d .
H8A H 0.6574 0.3069 0.0581 0.047 Uiso 1 1 calc R
H8B H 0.5571 0.1969 0.0494 0.047 Uiso 1 1 calc R
C9 C 0.6200(2) 0.2068(3) 0.13781(12) 0.0418(6) Uani 1 1 d .
H9A H 0.6711 0.1252 0.1337 0.050 Uiso 1 1 calc R
H9B H 0.6568 0.2797 0.1641 0.050 Uiso 1 1 calc R
C10 C 0.5410(3) 0.0828(4) 0.22028(15) 0.0612(9) Uani 1 1 d .
H10A H 0.5719 0.1505 0.2508 0.073 Uiso 1 1 calc R
H10B H 0.5950 0.0048 0.2154 0.073 Uiso 1 1 calc R
C11 C 0.4347(3) 0.0205(3) 0.24038(17) 0.0686(10) Uani 1 1 d .
H11A H 0.3983 -0.0350 0.2073 0.082 Uiso 1 1 calc R
H11B H 0.4506 -0.0459 0.2743 0.082 Uiso 1 1 calc R
C12 C 0.2542(2) 0.0816(3) 0.27174(14) 0.0518(7) Uani 1 1 d .
H12A H 0.2616 -0.0012 0.2994 0.062 Uiso 1 1 calc R
H12B H 0.2149 0.0487 0.2344 0.062 Uiso 1 1 calc R
C13 C 0.1888(2) 0.2000(3) 0.30000(12) 0.0455(7) Uani 1 1 d .
H13A H 0.1158 0.1617 0.3090 0.055 Uiso 1 1 calc R
H13B H 0.2269 0.2281 0.3384 0.055 Uiso 1 1 calc R
C14 C 0.1885(2) 0.3443(3) 0.20096(10) 0.0350(6) Uani 1 1 d .
H14 H 0.2121 0.2674 0.1770 0.042 Uiso 1 1 calc R
C15 C 0.13561(18) 0.5590(3) 0.22975(10) 0.0293(5) Uani 1 1 d .
C16 C 0.13737(19) 0.4668(3) 0.28113(10) 0.0318(5) Uani 1 1 d .
C17 C 0.1063(2) 0.5160(3) 0.33824(11) 0.0399(6) Uani 1 1 d .
H17 H 0.1050 0.4536 0.3717 0.048 Uiso 1 1 calc R
C18 C 0.0779(2) 0.6619(3) 0.34214(11) 0.0427(6) Uani 1 1 d .
H18 H 0.0572 0.6993 0.3793 0.051 Uiso 1 1 calc R
C19 C 0.0795(2) 0.7557(3) 0.29140(12) 0.0417(6) Uani 1 1 d .
H19 H 0.0612 0.8540 0.2962 0.050 Uiso 1 1 calc R
C20 C 0.1075(2) 0.7065(3) 0.23466(11) 0.0361(6) Uani 1 1 d .
H20 H 0.1075 0.7691 0.2012 0.043 Uiso 1 1 calc R
C21 C 0.15769(17) 0.7717(2) 0.03279(10) 0.0279(5) Uani 1 1 d .
C22 C 0.1558(2) 0.9239(2) 0.00522(10) 0.0323(5) Uani 1 1 d .
H22A H 0.0865 0.9357 -0.0193 0.039 Uiso 1 1 calc R
H22B H 0.2171 0.9317 -0.0219 0.039 Uiso 1 1 calc R
C23 C 0.1656(2) 1.0484(2) 0.05098(11) 0.0377(6) Uani 1 1 d .
H23A H 0.2410 1.0475 0.0697 0.045 Uiso 1 1 calc R
H23B H 0.1147 1.0285 0.0829 0.045 Uiso 1 1 calc R
C24 C 0.14123(18) 1.2032(2) 0.02656(11) 0.0297(5) 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'
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
O6 Co1 N3 90.45(7) 1_545 .
O6 Co1 O3 169.67(7) 1_545 .
N3 Co1 O3 98.90(7) . .
O6 Co1 O7 88.93(6) 1_545 .
N3 Co1 O7 92.58(7) . .
O3 Co1 O7 86.28(6) . .
O6 Co1 N1 88.12(7) 1_545 .
N3 Co1 N1 90.29(7) . .
O3 Co1 N1 96.17(7) . .
O7 Co1 N1 175.90(7) . .
O6 Co1 O4 110.95(6) 1_545 .
N3 Co1 O4 158.60(7) . .
O3 Co1 O4 59.75(6) . .
O7 Co1 O4 87.78(6) . .
N1 Co1 O4 90.62(7) . .
C9 O1 C10 112.8(2) . .
C12 O2 C11 113.0(2) . .
C21 O3 Co1 93.76(13) . .
C21 O4 Co1 86.43(13) . .
C24 O6 Co1 148.87(16) . 1_565
Co1 O7 H7A 108.1 . .
Co1 O7 H7B 108.8 . .
H7A O7 H7B 117.1 . .
C7 N1 C1 103.93(19) . .
C7 N1 Co1 122.57(16) . .
C1 N1 Co1 133.08(15) . .
C7 N2 C2 106.38(19) . .
C7 N2 C8 125.9(2) . .
C2 N2 C8 127.7(2) . .
C14 N3 C15 105.20(18) . .
C14 N3 Co1 122.00(16) . .
C15 N3 Co1 132.31(15) . .
C14 N4 C16 106.66(19) . .
C14 N4 C13 127.8(2) . .
C16 N4 C13 125.5(2) . .
C6 C1 N1 130.1(2) . .
C6 C1 C2 120.0(2) . .
N1 C1 C2 109.9(2) . .
C3 C2 N2 132.1(2) . .
C3 C2 C1 122.7(2) . .
N2 C2 C1 105.18(19) . .
C4 C3 C2 116.3(2) . .
C4 C3 H3 121.8 . .
C2 C3 H3 121.8 . .
C3 C4 C5 121.9(2) . .
C3 C4 H4 119.0 . .
C5 C4 H4 119.0 . .
C6 C5 C4 121.8(3) . .
C6 C5 H5 119.1 . .
C4 C5 H5 119.1 . .
C5 C6 C1 117.2(2) . .
C5 C6 H6 121.4 . .
C1 C6 H6 121.4 . .
N1 C7 N2 114.5(2) . .
N1 C7 H7 122.7 . .
N2 C7 H7 122.7 . .
N2 C8 C9 113.0(2) . .
N2 C8 H8A 109.0 . .
C9 C8 H8A 109.0 . .
N2 C8 H8B 109.0 . .
C9 C8 H8B 109.0 . .
H8A C8 H8B 107.8 . .
O1 C9 C8 108.4(2) . .
O1 C9 H9A 110.0 . .
C8 C9 H9A 110.0 . .
O1 C9 H9B 110.0 . .
C8 C9 H9B 110.0 . .
H9A C9 H9B 108.4 . .
O1 C10 C11 109.4(3) . .
O1 C10 H10A 109.8 . .
C11 C10 H10A 109.8 . .
O1 C10 H10B 109.8 . .
C11 C10 H10B 109.8 . .
H10A C10 H10B 108.2 . .
O2 C11 C10 110.7(3) . .
O2 C11 H11A 109.5 . .
C10 C11 H11A 109.5 . .
O2 C11 H11B 109.5 . .
C10 C11 H11B 109.5 . .
H11A C11 H11B 108.1 . .
O2 C12 C13 110.2(2) . .
O2 C12 H12A 109.6 . .
C13 C12 H12A 109.6 . .
O2 C12 H12B 109.6 . .
C13 C12 H12B 109.6 . .
H12A C12 H12B 108.1 . .
N4 C13 C12 113.9(2) . .
N4 C13 H13A 108.8 . .
C12 C13 H13A 108.8 . .
N4 C13 H13B 108.8 . .
C12 C13 H13B 108.8 . .
H13A C13 H13B 107.7 . .
N3 C14 N4 113.4(2) . .
N3 C14 H14 123.3 . .
N4 C14 H14 123.3 . .
C20 C15 N3 130.7(2) . .
C20 C15 C16 120.6(2) . .
N3 C15 C16 108.7(2) . .
N4 C16 C17 131.7(2) . .
N4 C16 C15 106.0(2) . .
C17 C16 C15 122.2(2) . .
C18 C17 C16 116.3(2) . .
C18 C17 H17 121.8 . .
C16 C17 H17 121.8 . .
C17 C18 C19 121.7(2) . .
C17 C18 H18 119.2 . .
C19 C18 H18 119.2 . .
C20 C19 C18 122.1(2) . .
C20 C19 H19 119.0 . .
C18 C19 H19 119.0 . .
C19 C20 C15 117.1(2) . .
C19 C20 H20 121.5 . .
C15 C20 H20 121.5 . .
O3 C21 O4 120.1(2) . .
O3 C21 C22 120.13(19) . .
O4 C21 C22 119.81(19) . .
C21 C22 C23 115.00(19) . .
C21 C22 H22A 108.5 . .
C23 C22 H22A 108.5 . .
C21 C22 H22B 108.5 . .
C23 C22 H22B 108.5 . .
H22A C22 H22B 107.5 . .
C22 C23 C24 116.9(2) . .
C22 C23 H23A 108.1 . .
C24 C23 H23A 108.1 . .
C22 C23 H23B 108.1 . .
C24 C23 H23B 108.1 . .
H23A C23 H23B 107.3 . .
O5 C24 O6 126.1(2) . .
O5 C24 C23 119.4(2) . .
O6 C24 C23 114.4(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O6 2.0583(16) 1_545
Co1 N3 2.1104(19) .
Co1 O3 2.1202(16) .
Co1 O7 2.1630(16) .
Co1 N1 2.1770(19) .
Co1 O4 2.2757(16) .
O1 C9 1.419(3) .
O1 C10 1.433(3) .
O2 C12 1.416(3) .
O2 C11 1.422(3) .
O3 C21 1.261(3) .
O4 C21 1.271(3) .
O5 C24 1.244(3) .
O6 C24 1.257(3) .
O6 Co1 2.0584(16) 1_565
O7 H7A 0.8501 .
O7 H7B 0.8498 .
N1 C7 1.320(3) .
N1 C1 1.404(3) .
N2 C7 1.354(3) .
N2 C2 1.396(3) .
N2 C8 1.460(3) .
N3 C14 1.320(3) .
N3 C15 1.402(3) .
N4 C14 1.359(3) .
N4 C16 1.383(3) .
N4 C13 1.472(3) .
C1 C6 1.396(3) .
C1 C2 1.404(3) .
C2 C3 1.393(3) .
C3 C4 1.376(4) .
C3 H3 0.9300 .
C4 C5 1.397(4) .
C4 H4 0.9300 .
C5 C6 1.388(4) .
C5 H5 0.9300 .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 C9 1.512(4) .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 C11 1.480(4) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 C13 1.488(4) .
C12 H12A 0.9700 .
C12 H12B 0.9700 .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 H14 0.9300 .
C15 C20 1.393(3) .
C15 C16 1.406(3) .
C16 C17 1.401(3) .
C17 C18 1.377(4) .
C17 H17 0.9300 .
C18 C19 1.406(4) .
C18 H18 0.9300 .
C19 C20 1.382(3) .
C19 H19 0.9300 .
C20 H20 0.9300 .
C21 C22 1.514(3) .
C22 C23 1.517(3) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 C24 1.533(3) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
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
O6 Co1 O3 C21 -27.2(4) 1_545
N3 Co1 O3 C21 178.20(13) .
O7 Co1 O3 C21 -89.77(13) .
N1 Co1 O3 C21 86.94(13) .
O4 Co1 O3 C21 -0.17(12) .
O6 Co1 O4 C21 175.16(12) 1_545
N3 Co1 O4 C21 -4.2(2) .
O3 Co1 O4 C21 0.17(12) .
O7 Co1 O4 C21 87.16(12) .
N1 Co1 O4 C21 -96.61(13) .
O6 Co1 N1 C7 -8.84(19) 1_545
N3 Co1 N1 C7 81.60(19) .
O3 Co1 N1 C7 -179.41(18) .
O7 Co1 N1 C7 -52.8(10) .
O4 Co1 N1 C7 -119.78(19) .
O6 Co1 N1 C1 162.4(2) 1_545
N3 Co1 N1 C1 -107.1(2) .
O3 Co1 N1 C1 -8.2(2) .
O7 Co1 N1 C1 118.4(9) .
O4 Co1 N1 C1 51.5(2) .
O6 Co1 N3 C14 14.86(19) 1_545
O3 Co1 N3 C14 -169.56(18) .
O7 Co1 N3 C14 103.80(19) .
N1 Co1 N3 C14 -73.27(19) .
O4 Co1 N3 C14 -165.71(17) .
O6 Co1 N3 C15 -155.9(2) 1_545
O3 Co1 N3 C15 19.7(2) .
O7 Co1 N3 C15 -66.9(2) .
N1 Co1 N3 C15 116.0(2) .
O4 Co1 N3 C15 23.5(3) .
C7 N1 C1 C6 -177.5(3) .
Co1 N1 C1 C6 10.1(4) .
C7 N1 C1 C2 2.2(3) .
Co1 N1 C1 C2 -170.18(16) .
C7 N2 C2 C3 -176.0(3) .
C8 N2 C2 C3 5.2(4) .
C7 N2 C2 C1 1.5(2) .
C8 N2 C2 C1 -177.3(2) .
C6 C1 C2 C3 -4.8(4) .
N1 C1 C2 C3 175.4(2) .
C6 C1 C2 N2 177.4(2) .
N1 C1 C2 N2 -2.4(3) .
N2 C2 C3 C4 179.5(2) .
C1 C2 C3 C4 2.4(4) .
C2 C3 C4 C5 0.9(4) .
C3 C4 C5 C6 -2.0(5) .
C4 C5 C6 C1 -0.4(4) .
N1 C1 C6 C5 -176.7(2) .
C2 C1 C6 C5 3.6(4) .
C1 N1 C7 N2 -1.3(3) .
Co1 N1 C7 N2 172.16(15) .
C2 N2 C7 N1 -0.2(3) .
C8 N2 C7 N1 178.7(2) .
C7 N2 C8 C9 -77.7(3) .
C2 N2 C8 C9 100.9(3) .
C10 O1 C9 C8 175.2(2) .
N2 C8 C9 O1 58.3(3) .
C9 O1 C10 C11 -173.5(2) .
C12 O2 C11 C10 173.3(3) .
O1 C10 C11 O2 -70.2(4) .
C11 O2 C12 C13 170.8(2) .
C14 N4 C13 C12 15.6(4) .
C16 N4 C13 C12 -165.5(2) .
O2 C12 C13 N4 59.1(3) .
C15 N3 C14 N4 0.7(3) .
Co1 N3 C14 N4 -172.23(15) .
C16 N4 C14 N3 0.5(3) .
C13 N4 C14 N3 179.6(2) .
C14 N3 C15 C20 177.5(2) .
Co1 N3 C15 C20 -10.6(4) .
C14 N3 C15 C16 -1.6(3) .
Co1 N3 C15 C16 170.27(16) .
C14 N4 C16 C17 178.2(3) .
C13 N4 C16 C17 -0.9(4) .
C14 N4 C16 C15 -1.5(2) .
C13 N4 C16 C15 179.4(2) .
C20 C15 C16 N4 -177.3(2) .
N3 C15 C16 N4 1.9(2) .
C20 C15 C16 C17 3.0(3) .
N3 C15 C16 C17 -177.8(2) .
N4 C16 C17 C18 178.0(2) .
C15 C16 C17 C18 -2.4(4) .
C16 C17 C18 C19 0.3(4) .
C17 C18 C19 C20 1.3(4) .
C18 C19 C20 C15 -0.7(4) .
N3 C15 C20 C19 179.7(2) .
C16 C15 C20 C19 -1.3(3) .
Co1 O3 C21 O4 0.3(2) .
Co1 O3 C21 C22 -179.00(18) .
Co1 O4 C21 O3 -0.3(2) .
Co1 O4 C21 C22 179.02(19) .
O3 C21 C22 C23 6.8(3) .
O4 C21 C22 C23 -172.5(2) .
C21 C22 C23 C24 -168.4(2) .
Co1 O6 C24 O5 -6.5(5) 1_565
Co1 O6 C24 C23 174.3(2) 1_565
C22 C23 C24 O5 5.0(3) .
C22 C23 C24 O6 -175.8(2) .
