#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/68/7206839.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_7206839
loop_
_publ_author_name
'Wu, Hua'
'Ma, Jian-Fang'
'Liu, Ying-Ying'
'Yang, Jin'
'Liu, Hai-Yan'
_publ_section_title
;
 Diverse topologies of six coordination polymers constructed from a
 tris(4-imidazolylphenyl)amine ligand and different carboxylates
;
_journal_issue                   23
_journal_name_full               CrystEngComm
_journal_page_first              7121
_journal_paper_doi               10.1039/c1ce05889d
_journal_volume                  13
_journal_year                    2011
_chemical_formula_moiety         'C78 H42 Co3 N14 O12'
_chemical_formula_sum            'C78 H42 Co3 N14 O12'
_chemical_formula_weight         1544.05
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                92.596(4)
_cell_angle_beta                 103.076(4)
_cell_angle_gamma                96.167(4)
_cell_formula_units_Z            1
_cell_length_a                   10.6440(5)
_cell_length_b                   10.7230(5)
_cell_length_c                   16.1450(9)
_cell_measurement_reflns_used    6402
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.4
_cell_measurement_theta_min      4.2
_cell_volume                     1779.94(16)
_computing_cell_refinement       CrysAlis
_computing_data_collection       'CrysAlis (Oxford Diffraction, 2006)'
_computing_data_reduction        CrysAlis
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 10.0
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'Oxford Diffraction Gemini R Ultra'
_diffrn_measurement_method       'ω scan'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0631
_diffrn_reflns_av_sigmaI/netI    0.2036
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            11608
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         4.19
_exptl_absorpt_coefficient_mu    0.765
_exptl_absorpt_correction_T_max  0.842
_exptl_absorpt_correction_T_min  0.810
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis (Oxford Diffraction, 2006)
;
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.440
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             785
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.23
_refine_diff_density_max         0.969
_refine_diff_density_min         -0.619
_refine_diff_density_rms         0.086
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.836
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     523
_refine_ls_number_reflns         6402
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      0.835
_refine_ls_R_factor_all          0.1500
_refine_ls_R_factor_gt           0.0663
_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)+(0.0736P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1415
_refine_ls_wR_factor_ref         0.1603
_reflns_number_gt                2830
_reflns_number_total             6402
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            c1ce05889d.txt
_cod_data_source_block           6
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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_cell_volume        1779.94(15)
_cod_original_sg_symbol_Hall     '-P 1 '
_cod_original_sg_symbol_H-M      'P -1 '
_cod_database_code               7206839
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Co1 Co 0.0000 0.5000 1.0000 0.0252(3) Uani 1 2 d S
Co2 Co -0.15686(7) 0.18397(7) 1.21762(5) 0.0352(3) Uani 1 1 d .
C1 C -0.2900(5) 0.1691(5) 0.9772(3) 0.0297(14) Uani 1 1 d .
C2 C -0.2977(5) 0.0443(5) 0.9910(4) 0.0319(14) Uani 1 1 d .
H2 H -0.2368 0.0160 1.0347 0.038 Uiso 1 1 calc R
C3 C -0.3963(5) -0.0417(5) 0.9401(4) 0.0367(15) Uani 1 1 d .
H3 H -0.3983 -0.1273 0.9475 0.044 Uiso 1 1 calc R
C4 C -0.4896(5) 0.0021(5) 0.8793(4) 0.0349(15) Uani 1 1 d .
C5 C -0.4837(5) 0.1272(6) 0.8653(4) 0.0431(17) Uani 1 1 d .
H5 H -0.5481 0.1559 0.8241 0.052 Uiso 1 1 calc R
C6 C -0.3814(5) 0.2114(6) 0.9124(4) 0.0416(17) Uani 1 1 d .
H6 H -0.3743 0.2956 0.9006 0.050 Uiso 1 1 calc R
C7 C -0.1837(5) 0.2642(5) 1.0309(4) 0.0327(14) Uani 1 1 d .
C8 C -0.6076(6) -0.0872(6) 0.8327(4) 0.0390(16) Uani 1 1 d .
C9 C -0.0467(6) 0.3798(6) 1.5125(5) 0.0501(18) Uani 1 1 d .
H9 H -0.0774 0.2981 1.5212 0.060 Uiso 1 1 calc R
C10 C -0.0488(5) 0.4129(5) 1.4314(4) 0.0403(16) Uani 1 1 d .
C11 C -0.0003(6) 0.5337(5) 1.4185(4) 0.0468(17) Uani 1 1 d .
H11 H 0.0006 0.5564 1.3637 0.056 Uiso 1 1 calc R
C12 C -0.0974(6) 0.3171(6) 1.3565(5) 0.0478(18) Uani 1 1 d .
C13 C 0.5013(6) 0.1501(8) 0.5784(5) 0.060(4) Uani 0.50 1 d PG
C14 C 0.6249(7) 0.1807(6) 0.5647(5) 0.087(3) Uani 1 1 d G
C15 C 0.7270(5) 0.1183(7) 0.6052(6) 0.104(4) Uani 1 1 d G
C16 C 0.7056(6) 0.0254(7) 0.6595(6) 0.066(4) Uani 0.50 1 d PG
C17 C 0.5820(7) -0.0051(7) 0.6732(5) 0.049(4) Uani 0.50 1 d PG
C18 C 0.4799(5) 0.0572(8) 0.6327(6) 0.057(4) Uani 0.50 1 d PG
C13' C 0.5838(12) 0.2758(12) 0.5986(8) 0.041(3) Uani 0.50 1 d P
C16' C 0.7617(11) 0.1296(14) 0.6793(8) 0.038(3) Uani 0.50 1 d P
C17' C 0.7458(11) 0.2400(13) 0.7211(9) 0.048(4) Uani 0.50 1 d P
C18' C 0.6556(11) 0.3149(11) 0.6803(8) 0.040(3) Uani 0.50 1 d P
C19 C 0.9287(6) -0.0397(8) 0.7014(5) 0.065(2) Uani 1 1 d .
H19 H 0.9508 -0.0353 0.6490 0.079 Uiso 1 1 calc R
C20 C 0.9232(6) -0.0845(7) 0.8293(5) 0.0566(19) Uani 1 1 d .
H20 H 0.9424 -0.1188 0.8819 0.068 Uiso 1 1 calc R
C21 C 0.8279(7) -0.0124(10) 0.8040(5) 0.089(3) Uani 1 1 d .
H21 H 0.7713 0.0135 0.8357 0.107 Uiso 1 1 calc R
C22 C 0.3367(8) 0.2555(9) 0.6136(4) 0.083(3) Uani 1 1 d G
C23 C 0.3983(7) 0.3442(10) 0.6797(6) 0.090(7) Uiso 0.50 1 d PG
C24 C 0.3363(8) 0.3738(8) 0.7438(5) 0.083(5) Uiso 0.50 1 d PG
C25 C 0.2128(8) 0.3146(7) 0.7418(4) 0.082(3) Uani 1 1 d G
C26 C 0.1512(7) 0.2259(8) 0.6757(5) 0.063(4) Uiso 0.50 1 d PG
C27 C 0.2132(8) 0.1963(8) 0.6116(5) 0.075(5) Uani 0.50 1 d PG
C23' C 0.3832(11) 0.4615(12) 0.6669(8) 0.041(3) Uani 0.50 1 d P
C24' C 0.3048(12) 0.4587(13) 0.7277(9) 0.054(4) Uani 0.50 1 d P
C26' C 0.2551(12) 0.2353(12) 0.6971(9) 0.049(4) Uani 0.50 1 d P
C27' C 0.3897(12) 0.3520(12) 0.6226(12) 0.055(5) Uani 0.50 1 d P
C28 C 0.1246(6) 0.4229(6) 0.8468(4) 0.0380(15) Uani 1 1 d .
H28 H 0.1464 0.5056 0.8354 0.046 Uiso 1 1 calc R
C29 C 0.0503(9) 0.2619(6) 0.9001(5) 0.080(3) Uani 1 1 d .
H29 H 0.0080 0.2113 0.9332 0.096 Uiso 1 1 calc R
C30 C 0.1122(2) 0.2187(2) 0.84273(17) 0.098(3) Uani 1 1 d .
H30 H 0.1222 0.1355 0.8297 0.118 Uiso 1 1 calc R
C32 C 0.3147(2) 0.3470(2) 0.29889(17) 0.060(2) Uani 1 1 d R
C33 C 0.2515(2) 0.3776(2) 0.35826(17) 0.0397(15) Uani 1 1 d R
C34 C 0.2916(2) 0.3579(2) 0.44312(17) 0.0451(16) Uani 1 1 d R
C35 C 0.3804(2) 0.2624(2) 0.46386(17) 0.037(3) Uani 0.50 1 d PR
C36 C 0.4314(2) 0.2088(2) 0.40230(17) 0.048(3) Uani 0.50 1 d PR
C37 C 0.3929(2) 0.2413(2) 0.31719(17) 0.045(3) Uani 0.50 1 d PR
C35' C 0.4263(2) 0.3520(2) 0.47590(17) 0.033(3) Uani 0.50 1 d PR
C36' C 0.5073(2) 0.3529(2) 0.41966(17) 0.041(3) Uani 0.50 1 d PR
C37' C 0.4607(2) 0.3599(2) 0.33168(17) 0.035(3) Uani 0.50 1 d PR
C38 C 0.1570(2) 0.4063(2) 0.17216(17) 0.0404(15) Uani 1 1 d R
H38 H 0.0915 0.4186 0.2001 0.048 Uiso 1 1 d R
C39 C 0.3423(6) 0.3632(6) 0.1503(4) 0.0490(17) Uani 1 1 d .
H39 H 0.4258 0.3409 0.1571 0.059 Uiso 1 1 calc R
C40 C 0.2646(6) 0.3952(7) 0.0776(5) 0.061(2) Uani 1 1 d .
H40 H 0.2873 0.3986 0.0254 0.073 Uiso 1 1 calc R
N1' N 0.4743(8) 0.3421(10) 0.5637(6) 0.040(3) Uani 0.50 1 d P
N1 N 0.4109(11) 0.2336(11) 0.5493(8) 0.057(3) Uani 0.50 1 d PU
N2 N 0.1569(6) 0.3225(5) 0.8078(4) 0.0598(16) Uani 1 1 d .
N3 N 0.0581(4) 0.3898(4) 0.9033(3) 0.0376(12) Uani 1 1 d .
N4 N 0.2734(4) 0.3703(4) 0.2115(3) 0.0360(12) Uani 1 1 d .
N5 N 0.1473(4) 0.4221(4) 0.0920(3) 0.0327(12) Uani 1 1 d .
N6 N 0.8305(6) 0.0149(9) 0.7238(4) 0.112(3) Uani 1 1 d .
N7 N 0.9880(4) -0.1000(5) 0.7658(3) 0.0447(13) Uani 1 1 d .
O1 O -0.6076(4) -0.2016(4) 0.8298(3) 0.0549(13) Uani 1 1 d .
O2 O -0.7094(4) -0.0359(4) 0.7999(3) 0.0444(11) Uani 1 1 d .
O3 O -0.1514(4) 0.3587(3) 0.9964(3) 0.0465(12) Uani 1 1 d .
O4 O -0.1328(4) 0.2429(4) 1.1063(3) 0.0526(13) Uani 1 1 d .
O5 O -0.1278(5) 0.2062(4) 1.3681(3) 0.0671(15) Uani 1 1 d .
O6 O -0.0998(5) 0.3529(4) 1.2828(3) 0.0633(15) 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
O3 Co1 O3 180.0(2) 2_567 .
O3 Co1 N3 88.59(18) 2_567 2_567
O3 Co1 N3 91.41(18) . 2_567
O3 Co1 N3 91.41(18) 2_567 .
O3 Co1 N3 88.59(18) . .
N3 Co1 N3 180.000(1) 2_567 .
O3 Co1 N5 82.65(16) 2_567 1_556
O3 Co1 N5 97.35(16) . 1_556
N3 Co1 N5 93.18(18) 2_567 1_556
N3 Co1 N5 86.82(18) . 1_556
O3 Co1 N5 97.35(16) 2_567 2_566
O3 Co1 N5 82.65(16) . 2_566
N3 Co1 N5 86.82(18) 2_567 2_566
N3 Co1 N5 93.18(18) . 2_566
N5 Co1 N5 180.000(1) 1_556 2_566
O2 Co2 O4 110.83(17) 2_457 .
O2 Co2 O6 142.9(2) 2_457 .
O4 Co2 O6 95.4(2) . .
O2 Co2 N7 101.67(19) 2_457 2_657
O4 Co2 N7 90.7(2) . 2_657
O6 Co2 N7 103.80(19) . 2_657
O2 Co2 O5 95.35(16) 2_457 .
O4 Co2 O5 153.24(15) . .
O6 Co2 O5 58.78(19) . .
N7 Co2 O5 89.2(2) 2_657 .
O2 Co2 C12 120.6(2) 2_457 .
O4 Co2 C12 124.9(2) . .
O6 Co2 C12 29.8(2) . .
N7 Co2 C12 97.0(2) 2_657 .
O5 Co2 C12 28.97(19) . .
C2 C1 C6 119.6(5) . .
C2 C1 C7 121.8(5) . .
C6 C1 C7 118.5(5) . .
C1 C2 C3 120.7(5) . .
C1 C2 H2 119.7 . .
C3 C2 H2 119.7 . .
C4 C3 C2 119.0(5) . .
C4 C3 H3 120.5 . .
C2 C3 H3 120.5 . .
C5 C4 C3 120.8(5) . .
C5 C4 C8 119.5(5) . .
C3 C4 C8 119.5(5) . .
C4 C5 C6 120.1(6) . .
C4 C5 H5 120.0 . .
C6 C5 H5 120.0 . .
C1 C6 C5 119.6(5) . .
C1 C6 H6 120.2 . .
C5 C6 H6 120.2 . .
O3 C7 O4 123.8(5) . .
O3 C7 C1 116.6(5) . .
O4 C7 C1 119.6(5) . .
O1 C8 O2 121.9(5) . .
O1 C8 C4 122.0(6) . .
O2 C8 C4 116.0(6) . .
C10 C9 C11 120.8(6) . 2_568
C10 C9 H9 119.6 . .
C11 C9 H9 119.6 2_568 .
C9 C10 C11 119.7(6) . .
C9 C10 C12 120.4(6) . .
C11 C10 C12 119.8(7) . .
C9 C11 C10 119.5(6) 2_568 .
C9 C11 H11 120.3 2_568 .
C10 C11 H11 120.3 . .
O5 C12 O6 121.6(6) . .
O5 C12 C10 120.3(7) . .
O6 C12 C10 118.0(6) . .
O5 C12 Co2 69.1(4) . .
O6 C12 Co2 52.5(3) . .
C10 C12 Co2 169.8(6) . .
C14 C13 C18 120.0 . .
C14 C13 N1 116.0(7) . .
C18 C13 N1 122.8(7) . .
C14 C13 C13' 53.0(6) . .
C18 C13 C13' 129.3(6) . .
N1 C13 C13' 77.9(7) . .
C13' C14 C15 125.0(7) . .
C13' C14 C13 68.1(7) . .
C15 C14 C13 120.0 . .
C16' C15 C16 55.3(8) . .
C16' C15 C14 119.5(8) . .
C16 C15 C14 120.0 . .
C16' C16 C15 52.9(6) . .
C16' C16 C17 120.2(7) . .
C15 C16 C17 120.0 . .
C16' C16 N6 72.0(8) . .
C15 C16 N6 109.5(6) . .
C17 C16 N6 124.6(6) . .
C18 C17 C16 120.0 . .
C17 C18 C13 120.0 . .
C14 C13' C18' 113.5(11) . .
C14 C13' N1' 129.0(11) . .
C18' C13' N1' 117.5(11) . .
C14 C13' C13 58.9(6) . .
C18' C13' C13 122.0(10) . .
N1' C13' C13 91.9(8) . .
C14 C13' N1 96.9(9) . .
C18' C13' N1 134.9(11) . .
N1' C13' N1 43.4(6) . .
C13 C13' N1 48.5(5) . .
C15 C16' C16 71.8(8) . .
C15 C16' C17' 118.4(13) . .
C16 C16' C17' 139.0(12) . .
C15 C16' N6 116.0(10) . .
C16 C16' N6 62.8(8) . .
C17' C16' N6 125.6(11) . .
C16' C17' C18' 119.3(12) . .
C13' C18' C17' 118.7(11) . .
N7 C19 N6 109.4(6) . .
N7 C19 H19 125.3 . .
N6 C19 H19 125.3 . .
C21 C20 N7 109.8(7) . .
C21 C20 H20 125.1 . .
N7 C20 H20 125.1 . .
C20 C21 N6 106.5(7) . .
C20 C21 H21 126.8 . .
N6 C21 H21 126.8 . .
C27' C22 C23 41.0(10) . .
C27' C22 C27 139.0(9) . .
C23 C22 C27 120.0 . .
C27' C22 N1 85.3(12) . .
C23 C22 N1 115.0(8) . .
C27 C22 N1 125.0(8) . .
C27' C22 C26' 108.1(11) . .
C23 C22 C26' 72.7(4) . .
C27 C22 C26' 50.1(4) . .
N1 C22 C26' 162.9(9) . .
C27' C23 C23' 73.5(12) . .
C27' C23 C22 52.9(8) . .
C23' C23 C22 116.7(9) . .
C27' C23 C24 139.5(11) . .
C23' C23 C24 79.4(8) . .
C22 C23 C24 120.0 . .
C27' C23 C26' 109.4(10) . .
C23' C23 C26' 118.6(8) . .
C22 C23 C26' 62.9(5) . .
C24 C23 C26' 59.4(5) . .
C27' C23 C24' 111.7(12) . .
C23' C23 C24' 48.5(7) . .
C22 C23 C24' 121.7(5) . .
C24 C23 C24' 31.8(5) . .
C26' C23 C24' 78.3(7) . .
C24' C24 C25 94.3(10) . .
C24' C24 C23 102.8(11) . .
C25 C24 C23 120.0 . .
C24' C24 C26' 122.4(11) . .
C25 C24 C26' 47.7(5) . .
C23 C24 C26' 75.5(6) . .
C24' C24 C23' 55.8(10) . .
C25 C24 C23' 127.2(6) . .
C23 C24 C23' 48.1(6) . .
C26' C24 C23' 108.7(8) . .
C26' C25 N2 141.4(9) . .
C26' C25 C24 78.5(6) . .
N2 C25 C24 122.9(7) . .
C26' C25 C26 47.3(6) . .
N2 C25 C26 116.2(7) . .
C24 C25 C26 120.0 . .
C26' C25 C24' 101.9(9) . .
N2 C25 C24' 113.2(7) . .
C24 C25 C24' 34.9(5) . .
C26 C25 C24' 124.0(6) . .
C26' C26 C25 60.7(8) . .
C26' C26 C27 66.8(8) . .
C25 C26 C27 120.0 . .
C26' C27 C26 45.5(6) . .
C26' C27 C22 79.4(6) . .
C26 C27 C22 120.0 . .
C23 C23' C27' 40.0(9) . .
C23 C23' C24' 88.3(10) . .
C27' C23' C24' 118.6(13) . .
C23 C23' C24 52.5(5) . .
C27' C23' C24 88.5(10) . .
C24' C23' C24 36.6(7) . .
C24 C24' C23' 87.5(12) . .
C24 C24' C25 50.7(7) . .
C23' C24' C25 120.0(11) . .
C24 C24' C23 45.4(7) . .
C23' C24' C23 43.2(7) . .
C25 C24' C23 81.3(6) . .
C26 C26' C25 72.1(9) . .
C26 C26' C27 67.6(7) . .
C25 C26' C27 130.1(10) . .
C26 C26' C24 119.7(11) . .
C25 C26' C24 53.8(5) . .
C27 C26' C24 129.5(10) . .
C26 C26' C22 113.4(10) . .
C25 C26' C22 131.2(10) . .
C27 C26' C22 50.5(5) . .
C24 C26' C22 88.2(7) . .
C26 C26' C23 136.8(11) . .
C25 C26' C23 96.7(7) . .
C27 C26' C23 93.0(8) . .
C24 C26' C23 45.1(3) . .
C22 C26' C23 44.3(4) . .
C23 C27' C22 86.2(14) . .
C23 C27' C23' 66.5(12) . .
C22 C27' C23' 135.9(16) . .
C23 C27' N1' 135.1(13) . .
C22 C27' N1' 100.7(11) . .
C23' C27' N1' 123.2(13) . .
C23 C27' N1 125.0(13) . .
C22 C27' N1 55.8(8) . .
C23' C27' N1 166.9(15) . .
N1' C27' N1 45.0(7) . .
N3 C28 N2 111.5(6) . .
N3 C28 H28 124.3 . .
N2 C28 H28 124.3 . .
C30 C29 N3 110.9(6) . .
C30 C29 H29 124.5 . .
N3 C29 H29 124.5 . .
C29 C30 N2 105.3(4) . .
C29 C30 H30 127.3 . .
N2 C30 H30 127.3 . .
C33 C32 N4 123.5(2) . .
C33 C32 C37 115.5 . .
N4 C32 C37 116.0(2) . .
C33 C32 C37' 113.5 . .
N4 C32 C37' 114.1(2) . .
C37 C32 C37' 54.8 . .
C32 C33 C34 124.1 . .
C33 C34 C35' 117.5 . .
C33 C34 C35 116.2 . .
C35' C34 C35 41.3 . .
C35' C35 C36 105.5 . .
C35' C35 N1 94.5(5) . .
C36 C35 N1 123.4(5) . .
C35' C35 C34 67.0 . .
C36 C35 C34 120.6 . .
N1 C35 C34 116.0(5) . .
C35' C35 N1' 50.5(4) . .
C36 C35 N1' 125.2(3) . .
N1 C35 N1' 44.1(5) . .
C34 C35 N1' 95.9(3) . .
C35' C35 C36' 46.8 . .
C36 C35 C36' 58.7 . .
N1 C35 C36' 119.2(5) . .
C34 C35 C36' 92.0 . .
N1' C35 C36' 82.8(4) . .
C35 C36 C37 119.5 . .
C35 C36 C36' 76.0 . .
C37 C36 C36' 84.3 . .
C35 C36 C35' 30.9 . .
C37 C36 C35' 108.0 . .
C36' C36 C35' 45.1 . .
C37' C37 C36 95.2 . .
C37' C37 C32 63.9 . .
C36 C37 C32 119.0 . .
C35 C35' C36' 100.9 . .
C35 C35' N1' 95.5(5) . .
C36' C35' N1' 121.3(4) . .
C35 C35' C34 71.7 . .
C36' C35' C34 118.8 . .
N1' C35' C34 119.9(4) . .
C35 C35' N1 51.1(4) . .
C36' C35' N1 125.1(4) . .
N1' C35' N1 44.5(5) . .
C34 C35' N1 97.6(4) . .
C35 C35' C36 43.6 . .
C36' C35' C36 57.3 . .
N1' C35' C36 116.4(4) . .
C34 C35' C36 94.1 . .
N1 C35' C36 82.2(4) . .
C35' C36' C37' 122.2 . .
C35' C36' C36 77.6 . .
C37' C36' C36 84.6 . .
C35' C36' C35 32.4 . .
C37' C36' C35 109.6 . .
C36 C36' C35 45.3 . .
C37 C37' C36' 95.7 . .
C37 C37' C32 61.3 . .
C36' C37' C32 116.6 . .
N5 C38 N4 113.1(4) . .
N5 C38 H38 123.5 . .
N4 C38 H38 123.4 . .
C40 C39 N4 106.2(6) . .
C40 C39 H39 126.9 . .
N4 C39 H39 126.9 . .
C39 C40 N5 110.5(6) . .
C39 C40 H40 124.7 . .
N5 C40 H40 124.7 . .
N1 N1' C35' 84.3(8) . .
N1 N1' C13' 84.6(9) . .
C35' N1' C13' 123.8(9) . .
N1 N1' C27' 80.3(9) . .
C35' N1' C27' 120.4(8) . .
C13' N1' C27' 111.6(10) . .
N1 N1' C35 50.4(7) . .
C35' N1' C35 34.0(2) . .
C13' N1' C35 110.3(8) . .
C27' N1' C35 109.1(7) . .
N1' N1 C35 85.6(8) . .
N1' N1 C13 105.5(9) . .
C35 N1 C13 121.5(10) . .
N1' N1 C22 93.5(10) . .
C35 N1 C22 127.2(9) . .
C13 N1 C22 109.6(10) . .
N1' N1 C27' 54.7(8) . .
C35 N1 C27' 114.8(9) . .
C13 N1 C27' 118.1(10) . .
C22 N1 C27' 38.9(7) . .
N1' N1 C35' 51.2(6) . .
C35 N1 C35' 34.4(3) . .
C13 N1 C35' 126.1(9) . .
C22 N1 C35' 118.5(8) . .
C27' N1 C35' 88.6(8) . .
N1' N1 C13' 52.0(7) . .
C35 N1 C13' 111.7(8) . .
C13 N1 C13' 53.6(6) . .
C22 N1 C13' 108.5(9) . .
C27' N1 C13' 84.0(8) . .
C35' N1 C13' 87.9(6) . .
C25 N2 C28 130.2(6) . .
C25 N2 C30 122.1(5) . .
C28 N2 C30 107.6(5) . .
C28 N3 C29 104.7(6) . .
C28 N3 Co1 131.1(4) . .
C29 N3 Co1 123.3(5) . .
C39 N4 C38 105.9(4) . .
C39 N4 C32 127.2(4) . .
C38 N4 C32 126.9(4) . .
C38 N5 C40 104.3(4) . .
C38 N5 Co1 130.7(3) . 1_554
C40 N5 Co1 124.4(4) . 1_554
C21 N6 C19 108.3(7) . .
C21 N6 C16 120.2(7) . .
C19 N6 C16 121.2(7) . .
C21 N6 C16' 122.3(8) . .
C19 N6 C16' 126.3(8) . .
C16 N6 C16' 45.2(5) . .
C19 N7 C20 106.0(6) . .
C19 N7 Co2 130.4(5) . 2_657
C20 N7 Co2 123.2(5) . 2_657
C8 O2 Co2 100.1(3) . 2_457
C7 O3 Co1 143.5(4) . .
C7 O4 Co2 148.1(4) . .
C12 O5 Co2 81.9(4) . .
C12 O6 Co2 97.7(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O3 2.079(3) 2_567
Co1 O3 2.079(3) .
Co1 N3 2.154(5) 2_567
Co1 N3 2.154(5) .
Co1 N5 2.168(5) 1_556
Co1 N5 2.168(5) 2_566
Co2 O2 1.980(3) 2_457
Co2 O4 1.992(5) .
Co2 O6 2.015(4) .
Co2 N7 2.065(5) 2_657
Co2 O5 2.377(5) .
Co2 C12 2.518(7) .
C1 C2 1.364(7) .
C1 C6 1.387(7) .
C1 C7 1.517(7) .
C2 C3 1.400(7) .
C2 H2 0.9300 .
C3 C4 1.368(8) .
C3 H3 0.9300 .
C4 C5 1.367(8) .
C4 C8 1.520(7) .
C5 C6 1.390(7) .
C5 H5 0.9300 .
C6 H6 0.9300 .
C7 O3 1.234(6) .
C7 O4 1.257(6) .
C8 O1 1.225(7) .
C8 O2 1.286(7) .
C9 C10 1.368(9) .
C9 C11 1.381(8) 2_568
C9 H9 0.9300 .
C10 C11 1.384(8) .
C10 C12 1.509(9) .
C11 C9 1.381(8) 2_568
C11 H11 0.9300 .
C12 O5 1.232(7) .
C12 O6 1.263(8) .
C13 C14 1.3900 .
C13 C18 1.3900 .
C13 N1 1.402(13) .
C13 C13' 1.507(15) .
C14 C13' 1.298(14) .
C14 C15 1.3900 .
C15 C16' 1.166(13) .
C15 C16 1.3900 .
C16 C16' 1.203(16) .
C16 C17 1.3900 .
C16 N6 1.509(9) .
C17 C18 1.3900 .
C13' C18' 1.388(16) .
C13' N1' 1.449(15) .
C13' N1 1.831(17) .
C16' C17' 1.381(18) .
C16' N6 1.613(15) .
C17' C18' 1.388(16) .
C19 N7 1.322(8) .
C19 N6 1.361(9) .
C19 H19 0.9300 .
C20 C21 1.342(10) .
C20 N7 1.372(8) .
C20 H20 0.9300 .
C21 N6 1.346(10) .
C21 H21 0.9300 .
C22 C27' 1.111(13) .
C22 C23 1.3900 .
C22 C27 1.3900 .
C22 N1 1.463(14) .
C22 C26' 1.771(16) .
C23 C27' 0.913(19) .
C23 C23' 1.304(15) .
C23 C24 1.3900 .
C23 C26' 1.899(14) .
C23 C24' 1.904(17) .
C24 C24' 1.028(15) .
C24 C25 1.3900 .
C24 C26' 1.688(13) .
C24 C23' 1.721(16) .
C25 C26' 1.273(15) .
C25 N2 1.336(8) .
C25 C26 1.3900 .
C25 C24' 1.791(16) .
C26 C26' 1.073(13) .
C26 C27 1.3900 .
C27 C26' 1.382(14) .
C23' C27' 1.362(18) .
C23' C24' 1.425(18) .
C27' N1' 1.46(2) .
C27' N1 1.763(19) .
C28 N3 1.314(7) .
C28 N2 1.338(8) .
C28 H28 0.9300 .
C29 C30 1.345(9) .
C29 N3 1.362(8) .
C29 H29 0.9300 .
C30 N2 1.359(7) .
C30 H30 0.9300 .
C32 C33 1.3382 .
C32 N4 1.422(5) .
C32 C37 1.4781 .
C32 C37' 1.5133 .
C33 C34 1.3730 .
C34 C35' 1.4206 .
C34 C35 1.4659 .
C35 C35' 1.0187 .
C35 C36 1.3683 .
C35 N1 1.401(13) .
C35 N1' 1.813(10) .
C35 C36' 1.8685 .
C36 C37 1.4132 .
C36 C36' 1.6460 .
C36 C35' 1.9116 .
C37 C37' 1.3762 .
C35' C36' 1.3860 .
C35' N1' 1.406(10) .
C35' N1 1.796(13) .
C36' C37' 1.4028 .
C38 N5 1.295(5) .
C38 N4 1.362(5) .
C38 H38 0.9300 .
C39 C40 1.356(9) .
C39 N4 1.361(8) .
C39 H39 0.9300 .
C40 N5 1.378(8) .
C40 H40 0.9300 .
N1' N1 1.265(13) .
N5 Co1 2.168(4) 1_554
N7 Co2 2.065(5) 2_657
O2 Co2 1.980(3) 2_457
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
_geom_torsion_site_symmetry_4
C6 C1 C2 C3 0.5(8) . .
C7 C1 C2 C3 -179.6(5) . .
C1 C2 C3 C4 -3.8(8) . .
C2 C3 C4 C5 3.3(9) . .
C2 C3 C4 C8 -171.1(5) . .
C3 C4 C5 C6 0.5(9) . .
C8 C4 C5 C6 174.9(6) . .
C2 C1 C6 C5 3.3(9) . .
C7 C1 C6 C5 -176.6(6) . .
C4 C5 C6 C1 -3.9(9) . .
C2 C1 C7 O3 151.8(6) . .
C6 C1 C7 O3 -28.3(8) . .
C2 C1 C7 O4 -27.3(8) . .
C6 C1 C7 O4 152.6(6) . .
C5 C4 C8 O1 165.7(6) . .
C3 C4 C8 O1 -19.9(9) . .
C5 C4 C8 O2 -17.7(9) . .
C3 C4 C8 O2 156.8(6) . .
C11 C9 C10 C11 1.6(10) 2_568 .
C11 C9 C10 C12 178.5(6) 2_568 .
C9 C10 C11 C9 -1.6(10) . 2_568
C12 C10 C11 C9 -178.5(6) . 2_568
C9 C10 C12 O5 -4.7(9) . .
C11 C10 C12 O5 172.3(6) . .
C9 C10 C12 O6 178.6(6) . .
C11 C10 C12 O6 -4.4(9) . .
C9 C10 C12 Co2 -161(2) . .
C11 C10 C12 Co2 16(3) . .
O2 Co2 C12 O5 32.6(4) 2_457 .
O4 Co2 C12 O5 -171.3(3) . .
O6 Co2 C12 O5 179.0(6) . .
N7 Co2 C12 O5 -75.5(4) 2_657 .
O2 Co2 C12 O6 -146.4(4) 2_457 .
O4 Co2 C12 O6 9.7(5) . .
N7 Co2 C12 O6 105.5(4) 2_657 .
O5 Co2 C12 O6 -179.0(6) . .
O2 Co2 C12 C10 -169(2) 2_457 .
O4 Co2 C12 C10 -13(3) . .
O6 Co2 C12 C10 -23(2) . .
N7 Co2 C12 C10 83(2) 2_657 .
O5 Co2 C12 C10 158(3) . .
C18 C13 C14 C13' -118.7(8) . .
N1 C13 C14 C13' 48.8(9) . .
C18 C13 C14 C15 0.0 . .
N1 C13 C14 C15 167.6(9) . .
C13' C13 C14 C15 118.7(8) . .
C13' C14 C15 C16' 18.4(12) . .
C13 C14 C15 C16' -64.6(9) . .
C13' C14 C15 C16 83.0(8) . .
C13 C14 C15 C16 0.0 . .
C14 C15 C16 C16' -107.0(9) . .
C16' C15 C16 C17 107.0(9) . .
C14 C15 C16 C17 0.0 . .
C16' C15 C16 N6 -47.2(8) . .
C14 C15 C16 N6 -154.2(8) . .
C16' C16 C17 C18 61.9(7) . .
C15 C16 C17 C18 0.0 . .
N6 C16 C17 C18 150.1(9) . .
C16 C17 C18 C13 0.0 . .
C14 C13 C18 C17 0.0 . .
N1 C13 C18 C17 -166.7(10) . .
C13' C13 C18 C17 -64.9(7) . .
C15 C14 C13' C18' 2.3(14) . .
C13 C14 C13' C18' 114.4(11) . .
C15 C14 C13' N1' -176.1(9) . .
C13 C14 C13' N1' -63.9(12) . .
C15 C14 C13' C13 -112.1(5) . .
C15 C14 C13' N1 -143.6(6) . .
C13 C14 C13' N1 -31.5(5) . .
C18 C13 C13' C14 101.1(6) . .
N1 C13 C13' C14 -136.2(8) . .
C14 C13 C13' C18' -99.8(12) . .
C18 C13 C13' C18' 1.3(15) . .
N1 C13 C13' C18' 124.0(13) . .
C14 C13 C13' N1' 135.7(10) . .
C18 C13 C13' N1' -123.2(7) . .
N1 C13 C13' N1' -0.5(9) . .
C14 C13 C13' N1 136.2(8) . .
C18 C13 C13' N1 -122.7(9) . .
C14 C15 C16' C16 107.9(6) . .
C16 C15 C16' C17' -136.5(14) . .
C14 C15 C16' C17' -28.6(15) . .
C16 C15 C16' N6 46.0(8) . .
C14 C15 C16' N6 153.9(7) . .
C17 C16 C16' C15 -106.5(6) . .
N6 C16 C16' C15 133.3(7) . .
C15 C16 C16' C17' 112.7(19) . .
C17 C16 C16' C17' 6(2) . .
N6 C16 C16' C17' -114.0(18) . .
C15 C16 C16' N6 -133.3(7) . .
C17 C16 C16' N6 120.1(7) . .
C15 C16' C17' C18' 20.3(19) . .
C16 C16' C17' C18' -74(2) . .
N6 C16' C17' C18' -162.4(11) . .
C14 C13' C18' C17' -9.9(17) . .
N1' C13' C18' C17' 168.7(11) . .
C13 C13' C18' C17' 56.9(17) . .
N1 C13' C18' C17' 118.3(15) . .
C16' C17' C18' C13' 0.1(19) . .
N7 C20 C21 N6 1.5(10) . .
C27 C22 C23 C27' -131.6(13) . .
N1 C22 C23 C27' 47.7(13) . .
C26' C22 C23 C27' -148.7(14) . .
C27' C22 C23 C23' 38.6(13) . .
C27 C22 C23 C23' -93.0(8) . .
N1 C22 C23 C23' 86.3(10) . .
C26' C22 C23 C23' -110.1(9) . .
C27' C22 C23 C24 131.6(13) . .
C27 C22 C23 C24 0.0 . .
N1 C22 C23 C24 179.3(8) . .
C26' C22 C23 C24 -17.1(4) . .
C27' C22 C23 C26' 148.7(14) . .
C27 C22 C23 C26' 17.1(4) . .
N1 C22 C23 C26' -163.6(9) . .
C27' C22 C23 C24' 94.4(14) . .
C27 C22 C23 C24' -37.1(6) . .
N1 C22 C23 C24' 142.1(10) . .
C26' C22 C23 C24' -54.3(8) . .
C27' C23 C24 C24' -36.2(16) . .
C23' C23 C24 C24' 12.1(10) . .
C22 C23 C24 C24' -102.8(10) . .
C26' C23 C24 C24' -120.5(11) . .
C27' C23 C24 C25 66.6(13) . .
C23' C23 C24 C25 114.8(8) . .
C22 C23 C24 C25 0.0 . .
C26' C23 C24 C25 -17.8(5) . .
C24' C23 C24 C25 102.8(10) . .
C27' C23 C24 C26' 84.3(13) . .
C23' C23 C24 C26' 132.6(9) . .
C22 C23 C24 C26' 17.8(5) . .
C24' C23 C24 C26' 120.5(11) . .
C27' C23 C24 C23' -48.3(14) . .
C22 C23 C24 C23' -114.8(8) . .
C26' C23 C24 C23' -132.6(9) . .
C24' C23 C24 C23' -12.1(10) . .
C24' C24 C25 C26' 131.1(12) . .
C23 C24 C25 C26' 23.5(6) . .
C23' C24 C25 C26' 81.6(9) . .
C24' C24 C25 N2 -84.0(11) . .
C23 C24 C25 N2 168.5(6) . .
C26' C24 C25 N2 145.0(9) . .
C23' C24 C25 N2 -133.5(8) . .
C24' C24 C25 C26 107.5(10) . .
C23 C24 C25 C26 0.0 . .
C26' C24 C25 C26 -23.5(6) . .
C23' C24 C25 C26 58.0(7) . .
C23 C24 C25 C24' -107.5(10) . .
C26' C24 C25 C24' -131.1(12) . .
C23' C24 C25 C24' -49.5(11) . .
N2 C25 C26 C26' -137.0(11) . .
C24 C25 C26 C26' 32.2(9) . .
C24' C25 C26 C26' 73.4(11) . .
C26' C25 C26 C27 -32.2(9) . .
N2 C25 C26 C27 -169.3(5) . .
C24 C25 C26 C27 0.0 . .
C24' C25 C26 C27 41.2(6) . .
C25 C26 C27 C26' 30.4(8) . .
C26' C26 C27 C22 -30.4(8) . .
C25 C26 C27 C22 0.0 . .
C27' C22 C27 C26' -69.9(16) . .
C23 C22 C27 C26' -21.5(6) . .
N1 C22 C27 C26' 159.3(10) . .
C27' C22 C27 C26 -48.3(15) . .
C23 C22 C27 C26 0.0 . .
N1 C22 C27 C26 -179.2(9) . .
C26' C22 C27 C26 21.5(6) . .
C22 C23 C23' C27' -31.3(10) . .
C24 C23 C23' C27' -149.6(9) . .
C26' C23 C23' C27' -103.5(12) . .
C24' C23 C23' C27' -141.2(12) . .
C27' C23 C23' C24' 141.2(12) . .
C22 C23 C23' C24' 109.9(8) . .
C24 C23 C23' C24' -8.5(7) . .
C26' C23 C23' C24' 37.7(12) . .
C27' C23 C23' C24 149.6(9) . .
C22 C23 C23' C24 118.4(3) . .
C26' C23 C23' C24 46.2(8) . .
C24' C23 C23' C24 8.5(7) . .
C24' C24 C23' C23 -165.7(11) . .
C25 C24 C23' C23 -99.3(7) . .
C26' C24 C23' C23 -48.8(8) . .
C24' C24 C23' C27' -146.8(13) . .
C25 C24 C23' C27' -80.4(9) . .
C23 C24 C23' C27' 19.0(6) . .
C26' C24 C23' C27' -29.8(10) . .
C25 C24 C23' C24' 66.4(12) . .
C23 C24 C23' C24' 165.7(12) . .
C26' C24 C23' C24' 116.9(12) . .
C25 C24 C24' C23' -133.0(7) . .
C23 C24 C24' C23' -10.8(9) . .
C26' C24 C24' C23' -91.7(13) . .
C23 C24 C24' C25 122.1(3) . .
C26' C24 C24' C25 41.3(9) . .
C23' C24 C24' C25 133.0(7) . .
C25 C24 C24' C23 -122.1(3) . .
C26' C24 C24' C23 -80.8(10) . .
C23' C24 C24' C23 10.8(9) . .
C23 C23' C24' C24 11.3(9) . .
C27' C23' C24' C24 38.6(15) . .
C23 C23' C24' C25 -29.6(12) . .
C27' C23' C24' C25 -2.3(17) . .
C24 C23' C24' C25 -40.8(7) . .
C27' C23' C24' C23 27.3(9) . .
C24 C23' C24' C23 -11.3(9) . .
C26' C25 C24' C24 -49.0(11) . .
N2 C25 C24' C24 114.7(10) . .
C26 C25 C24' C24 -95.0(9) . .
C26' C25 C24' C23' 8.5(13) . .
N2 C25 C24' C23' 172.2(10) . .
C24 C25 C24' C23' 57.6(11) . .
C26 C25 C24' C23' -37.4(13) . .
C26' C25 C24' C23 -11.4(8) . .
N2 C25 C24' C23 152.2(6) . .
C24 C25 C24' C23 37.6(5) . .
C26 C25 C24' C23 -57.4(7) . .
C27' C23 C24' C24 155.6(10) . .
C23' C23 C24' C24 -164.1(13) . .
C22 C23 C24' C24 96.8(9) . .
C26' C23 C24' C24 49.2(9) . .
C27' C23 C24' C23' -40.3(13) . .
C22 C23 C24' C23' -99.1(11) . .
C24 C23 C24' C23' 164.1(13) . .
C26' C23 C24' C23' -146.7(10) . .
C27' C23 C24' C25 114.1(10) . .
C23' C23 C24' C25 154.4(11) . .
C22 C23 C24' C25 55.2(7) . .
C24 C23 C24' C25 -41.6(6) . .
C26' C23 C24' C25 7.6(6) . .
C27 C26 C26' C25 149.9(7) . .
C25 C26 C26' C27 -149.9(7) . .
C25 C26 C26' C24 -26.0(7) . .
C27 C26 C26' C24 123.9(13) . .
C25 C26 C26' C22 -127.9(11) . .
C27 C26 C26' C22 22.0(5) . .
C25 C26 C26' C23 -80.6(15) . .
C27 C26 C26' C23 69.3(15) . .
N2 C25 C26' C26 78.7(15) . .
C24 C25 C26' C26 -151.9(7) . .
C24' C25 C26' C26 -125.7(8) . .
N2 C25 C26' C27 116.1(15) . .
C24 C25 C26' C27 -114.5(14) . .
C26 C25 C26' C27 37.4(8) . .
C24' C25 C26' C27 -88.3(14) . .
N2 C25 C26' C24 -129.4(13) . .
C26 C25 C26' C24 151.9(7) . .
C24' C25 C26' C24 26.2(6) . .
N2 C25 C26' C22 -175.5(10) . .
C24 C25 C26' C22 -46.2(9) . .
C26 C25 C26' C22 105.7(13) . .
C24' C25 C26' C22 -20.0(12) . .
N2 C25 C26' C23 -144.1(12) . .
C24 C25 C26' C23 -14.8(3) . .
C26 C25 C26' C23 137.1(10) . .
C24' C25 C26' C23 11.4(8) . .
C22 C27 C26' C26 153.6(6) . .
C26 C27 C26' C25 -38.7(10) . .
C22 C27 C26' C25 114.9(14) . .
C26 C27 C26' C24 -110.8(14) . .
C22 C27 C26' C24 42.7(10) . .
C26 C27 C26' C22 -153.6(6) . .
C26 C27 C26' C23 -140.1(9) . .
C22 C27 C26' C23 13.5(3) . .
C24' C24 C26' C26 -32(2) . .
C25 C24 C26' C26 31.1(9) . .
C23 C24 C26' C26 -128.0(13) . .
C23' C24 C26' C26 -92.6(15) . .
C24' C24 C26' C25 -62.9(15) . .
C23 C24 C26' C25 -159.1(5) . .
C23' C24 C26' C25 -123.7(8) . .
C24' C24 C26' C27 53(2) . .
C25 C24 C26' C27 115.5(13) . .
C23 C24 C26' C27 -43.6(11) . .
C23' C24 C26' C27 -8.2(14) . .
C24' C24 C26' C22 84.2(14) . .
C25 C24 C26' C22 147.1(8) . .
C23 C24 C26' C22 -12.0(3) . .
C23' C24 C26' C22 23.4(8) . .
C24' C24 C26' C23 96.2(13) . .
C25 C24 C26' C23 159.1(5) . .
C23' C24 C26' C23 35.4(7) . .
C27' C22 C26' C26 112.9(12) . .
C23 C22 C26' C26 133.9(11) . .
C27 C22 C26' C26 -26.7(7) . .
N1 C22 C26' C26 -107(3) . .
C27' C22 C26' C25 26.8(14) . .
C23 C22 C26' C25 47.8(10) . .
C27 C22 C26' C25 -112.8(13) . .
N1 C22 C26' C25 167(3) . .
C27' C22 C26' C27 139.6(9) . .
C23 C22 C26' C27 160.6(5) . .
N1 C22 C26' C27 -80(3) . .
C27' C22 C26' C24 -8.8(10) . .
C23 C22 C26' C24 12.1(3) . .
C27 C22 C26' C24 -148.4(8) . .
N1 C22 C26' C24 132(3) . .
C27' C22 C26' C23 -21.0(9) . .
C27 C22 C26' C23 -160.6(5) . .
N1 C22 C26' C23 120(3) . .
C27' C23 C26' C26 -49(2) . .
C23' C23 C26' C26 32(2) . .
C22 C23 C26' C26 -74.9(16) . .
C24 C23 C26' C26 87.8(17) . .
C24' C23 C26' C26 60.2(18) . .
C27' C23 C26' C25 -119.9(13) . .
C23' C23 C26' C25 -38.6(13) . .
C22 C23 C26' C25 -145.9(8) . .
C24 C23 C26' C25 16.9(4) . .
C24' C23 C26' C25 -10.7(8) . .
C27' C23 C26' C27 11.1(13) . .
C23' C23 C26' C27 92.4(12) . .
C22 C23 C26' C27 -14.9(4) . .
C24 C23 C26' C27 147.8(8) . .
C24' C23 C26' C27 120.2(9) . .
C27' C23 C26' C24 -136.7(11) . .
C23' C23 C26' C24 -55.5(10) . .
C22 C23 C26' C24 -162.7(4) . .
C24' C23 C26' C24 -27.6(6) . .
C27' C23 C26' C22 26.0(11) . .
C23' C23 C26' C22 107.3(10) . .
C24 C23 C26' C22 162.7(4) . .
C24' C23 C26' C22 135.1(6) . .
C23' C23 C27' C22 -144.5(10) . .
C24 C23 C27' C22 -94.5(12) . .
C26' C23 C27' C22 -29.3(12) . .
C24' C23 C27' C22 -114.1(8) . .
C22 C23 C27' C23' 144.5(10) . .
C24 C23 C27' C23' 49.9(13) . .
C26' C23 C27' C23' 115.1(10) . .
C24' C23 C27' C23' 30.3(9) . .
C23' C23 C27' N1' 114.2(18) . .
C22 C23 C27' N1' -101.4(18) . .
C24 C23 C27' N1' 164.1(11) . .
C26' C23 C27' N1' -130.7(15) . .
C24' C23 C27' N1' 144.5(15) . .
C23' C23 C27' N1 172.8(15) . .
C22 C23 C27' N1 -42.7(9) . .
C24 C23 C27' N1 -137.3(12) . .
C26' C23 C27' N1 -72.1(16) . .
C24' C23 C27' N1 -156.8(11) . .
C27 C22 C27' C23 80.7(15) . .
N1 C22 C27' C23 -137.8(11) . .
C26' C22 C27' C23 31.4(13) . .
C23 C22 C27' C23' -50.0(18) . .
C27 C22 C27' C23' 31(3) . .
N1 C22 C27' C23' 172.2(19) . .
C26' C22 C27' C23' -19(2) . .
C23 C22 C27' N1' 135.2(14) . .
C27 C22 C27' N1' -144.1(9) . .
N1 C22 C27' N1' -2.5(9) . .
C26' C22 C27' N1' 166.7(8) . .
C23 C22 C27' N1 137.8(11) . .
C27 C22 C27' N1 -141.6(14) . .
C26' C22 C27' N1 169.2(9) . .
C24' C23' C27' C23 -45.5(13) . .
C24 C23' C27' C23 -23.7(7) . .
C23 C23' C27' C22 56.5(19) . .
C24' C23' C27' C22 11(3) . .
C24 C23' C27' C22 32.8(19) . .
C23 C23' C27' N1' -129.7(15) . .
C24' C23' C27' N1' -175.3(11) . .
C24 C23' C27' N1' -153.4(12) . .
C23 C23' C27' N1 -153(5) . .
C24' C23' C27' N1 161(4) . .
C24 C23' C27' N1 -177(5) . .
N3 C29 C30 N2 -1.5(8) . .
N4 C32 C33 C34 -178.7(2) . .
C37 C32 C33 C34 27.4 . .
C37' C32 C33 C34 -33.3 . .
C32 C33 C34 C35' 25.4 . .
C32 C33 C34 C35 -21.2 . .
C33 C34 C35 C35' 102.6 . .
C33 C34 C35 C36 7.7 . .
C35' C34 C35 C36 -94.9 . .
C33 C34 C35 N1 -173.8(5) . .
C35' C34 C35 N1 83.5(5) . .
C33 C34 C35 N1' 145.0(4) . .
C35' C34 C35 N1' 42.4(4) . .
C33 C34 C35 C36' 62.1 . .
C35' C34 C35 C36' -40.5 . .
C35' C35 C36 C37 -75.2 . .
N1 C35 C36 C37 178.5(6) . .
C34 C35 C36 C37 -3.2 . .
N1' C35 C36 C37 -127.5(4) . .
C36' C35 C36 C37 -75.0 . .
C35' C35 C36 C36' -0.2 . .
N1 C35 C36 C36' -106.4(6) . .
C34 C35 C36 C36' 71.9 . .
N1' C35 C36 C36' -52.5(4) . .
N1 C35 C36 C35' -106.2(6) . .
C34 C35 C36 C35' 72.1 . .
N1' C35 C36 C35' -52.3(4) . .
C36' C35 C36 C35' 0.2 . .
C35 C36 C37 C37' 72.6 . .
C36' C36 C37 C37' 2.2 . .
C35' C36 C37 C37' 41.1 . .
C35 C36 C37 C32 9.6 . .
C36' C36 C37 C32 -60.8 . .
C35' C36 C37 C32 -21.9 . .
C33 C32 C37 C37' -101.9 . .
N4 C32 C37 C37' 102.3(2) . .
C33 C32 C37 C36 -20.8 . .
N4 C32 C37 C36 -176.7(2) . .
C37' C32 C37 C36 81.0 . .
C36 C35 C35' C36' 0.2 . .
N1 C35 C35' C36' 126.7(5) . .
C34 C35 C35' C36' -116.9 . .
N1' C35 C35' C36' 123.4(4) . .
C36 C35 C35' N1' -123.2(4) . .
N1 C35 C35' N1' 3.3(6) . .
C34 C35 C35' N1' 119.7(4) . .
C36' C35 C35' N1' -123.4(4) . .
C36 C35 C35' C34 117.1 . .
N1 C35 C35' C34 -116.4(5) . .
N1' C35 C35' C34 -119.7(4) . .
C36' C35 C35' C34 116.9 . .
C36 C35 C35' N1 -126.5(5) . .
C34 C35 C35' N1 116.4(5) . .
N1' C35 C35' N1 -3.3(6) . .
C36' C35 C35' N1 -126.7(5) . .
N1 C35 C35' C36 126.5(5) . .
C34 C35 C35' C36 -117.1 . .
N1' C35 C35' C36 123.2(4) . .
C36' C35 C35' C36 -0.2 . .
C33 C34 C35' C35 -99.3 . .
C33 C34 C35' C36' -6.7 . .
C35 C34 C35' C36' 92.6 . .
C33 C34 C35' N1' 174.9(5) . .
C35 C34 C35' N1' -85.8(5) . .
C33 C34 C35' N1 -144.0(4) . .
C35 C34 C35' N1 -44.7(4) . .
C33 C34 C35' C36 -61.3 . .
C35 C34 C35' C36 38.0 . .
C37 C36 C35' C35 117.8 . .
C36' C36 C35' C35 179.7 . .
C35 C36 C35' C36' -179.7 . .
C37 C36 C35' C36' -61.9 . .
C35 C36 C35' N1' 68.5(5) . .
C37 C36 C35' N1' -173.7(5) . .
C36' C36 C35' N1' -111.8(5) . .
C35 C36 C35' C34 -57.9 . .
C37 C36 C35' C34 59.9 . .
C36' C36 C35' C34 121.8 . .
C35 C36 C35' N1 39.2(4) . .
C37 C36 C35' N1 156.9(4) . .
C36' C36 C35' N1 -141.1(4) . .
C35 C35' C36' C37' 75.3 . .
N1' C35' C36' C37' 178.6(5) . .
C34 C35' C36' C37' 0.2 . .
N1 C35' C36' C37' 124.9(5) . .
C36 C35' C36' C37' 75.4 . .
C35 C35' C36' C36 -0.2 . .
N1' C35' C36' C36 103.1(5) . .
C34 C35' C36' C36 -75.2 . .
N1 C35' C36' C36 49.5(5) . .
N1' C35' C36' C35 103.3(5) . .
C34 C35' C36' C35 -75.0 . .
N1 C35' C36' C35 49.7(5) . .
C36 C35' C36' C35 0.2 . .
C35 C36 C36' C35' 0.1 . .
C37 C36 C36' C35' 122.5 . .
C35 C36 C36' C37' -124.5 . .
C37 C36 C36' C37' -2.2 . .
C35' C36 C36' C37' -124.7 . .
C37 C36 C36' C35 122.4 . .
C35' C36 C36' C35 -0.1 . .
C36 C35 C36' C35' -179.7 . .
N1 C35 C36' C35' -66.3(6) . .
C34 C35 C36' C35' 55.2 . .
N1' C35 C36' C35' -40.5(3) . .
C35' C35 C36' C37' -119.7 . .
C36 C35 C36' C37' 60.5 . .
N1 C35 C36' C37' 174.0(6) . .
C34 C35 C36' C37' -64.5 . .
N1' C35 C36' C37' -160.2(3) . .
C35' C35 C36' C36 179.7 . .
N1 C35 C36' C36 113.5(6) . .
C34 C35 C36' C36 -125.1 . .
N1' C35 C36' C36 139.2(3) . .
C36 C37 C37' C36' -2.6 . .
C32 C37 C37' C36' 117.3 . .
C36 C37 C37' C32 -119.8 . .
C35' C36' C37' C37 -69.5 . .
C36 C36' C37' C37 2.2 . .
C35 C36' C37' C37 -36.2 . .
C35' C36' C37' C32 -8.8 . .
C36 C36' C37' C32 62.9 . .
C35 C36' C37' C32 24.5 . .
C33 C32 C37' C37 105.4 . .
N4 C32 C37' C37 -105.8(2) . .
C33 C32 C37' C36' 23.9 . .
N4 C32 C37' C36' 172.6(2) . .
C37 C32 C37' C36' -81.6 . .
N4 C39 C40 N5 -0.2(8) . .
C35 C35' N1' N1 -3.7(7) . .
C36' C35' N1' N1 -109.9(7) . .
C34 C35' N1' N1 68.4(8) . .
C36 C35' N1' N1 -43.8(7) . .
C35 C35' N1' C13' 75.9(10) . .
C36' C35' N1' C13' -30.3(12) . .
C34 C35' N1' C13' 148.0(8) . .
N1 C35' N1' C13' 79.6(12) . .
C36 C35' N1' C13' 35.8(12) . .
C35 C35' N1' C27' -78.9(10) . .
C36' C35' N1' C27' 174.8(8) . .
C34 C35' N1' C27' -6.9(12) . .
N1 C35' N1' C27' -75.3(11) . .
C36 C35' N1' C27' -119.1(9) . .
C36' C35' N1' C35 -106.3(3) . .
C34 C35' N1' C35 72.1(3) . .
N1 C35' N1' C35 3.7(7) . .
C36 C35' N1' C35 -40.14(18) . .
C14 C13' N1' N1 50.8(15) . .
C18' C13' N1' N1 -127.5(13) . .
C13 C13' N1' N1 0.6(9) . .
C14 C13' N1' C35' -28.6(19) . .
C18' C13' N1' C35' 153.1(10) . .
C13 C13' N1' C35' -78.9(11) . .
N1 C13' N1' C35' -79.5(11) . .
C14 C13' N1' C27' 128.2(13) . .
C18' C13' N1' C27' -50.1(15) . .
C13 C13' N1' C27' 77.9(10) . .
N1 C13' N1' C27' 77.4(10) . .
C14 C13' N1' C35 6.7(16) . .
C18' C13' N1' C35 -171.6(10) . .
C13 C13' N1' C35 -43.5(9) . .
N1 C13' N1' C35 -44.1(7) . .
C23 C27' N1' N1 98.3(18) . .
C22 C27' N1' N1 2.9(11) . .
C23' C27' N1' N1 -172.7(14) . .
C23 C27' N1' C35' 175.8(14) . .
C22 C27' N1' C35' 80.4(13) . .
C23' C27' N1' C35' -95.2(14) . .
N1 C27' N1' C35' 77.5(10) . .
C23 C27' N1' C13' 18(2) . .
C22 C27' N1' C13' -77.3(12) . .
C23' C27' N1' C13' 107.1(14) . .
N1 C27' N1' C13' -80.2(11) . .
C23 C27' N1' C35 140.3(15) . .
C22 C27' N1' C35 44.9(11) . .
C23' C27' N1' C35 -130.7(12) . .
N1 C27' N1' C35 42.0(7) . .
C35' C35 N1' N1 175.3(9) . .
C36 C35 N1' N1 -103.8(8) . .
C34 C35 N1' N1 121.8(8) . .
C36' C35 N1' N1 -146.9(8) . .
C36 C35 N1' C35' 80.9(3) . .
N1 C35 N1' C35' -175.3(9) . .
C34 C35 N1' C35' -53.5(3) . .
C36' C35 N1' C35' 37.8(2) . .
C35' C35 N1' C13' -120.7(9) . .
C36 C35 N1' C13' -39.7(10) . .
N1 C35 N1' C13' 64.1(11) . .
C34 C35 N1' C13' -174.1(8) . .
C36' C35 N1' C13' -82.9(8) . .
C35' C35 N1' C27' 116.4(9) . .
C36 C35 N1' C27' -162.7(6) . .
N1 C35 N1' C27' -58.9(10) . .
C34 C35 N1' C27' 62.9(8) . .
C36' C35 N1' C27' 154.2(8) . .
C35' N1' N1 C35 2.7(5) . .
C13' N1' N1 C35 -122.1(8) . .
C27' N1' N1 C35 124.8(8) . .
C35' N1' N1 C13 124.2(9) . .
C13' N1' N1 C13 -0.6(10) . .
C27' N1' N1 C13 -113.7(10) . .
C35 N1' N1 C13 121.5(11) . .
C35' N1' N1 C22 -124.4(7) . .
C13' N1' N1 C22 110.9(9) . .
C27' N1' N1 C22 -2.2(8) . .
C35 N1' N1 C22 -127.0(9) . .
C35' N1' N1 C27' -122.2(7) . .
C13' N1' N1 C27' 113.1(10) . .
C35 N1' N1 C27' -124.8(8) . .
C13' N1' N1 C35' -124.8(8) . .
C27' N1' N1 C35' 122.2(7) . .
C35 N1' N1 C35' -2.7(5) . .
C35' N1' N1 C13' 124.8(8) . .
C27' N1' N1 C13' -113.1(10) . .
C35 N1' N1 C13' 122.1(8) . .
C35' C35 N1 N1' -3.7(7) . .
C36 C35 N1 N1' 108.2(6) . .
C34 C35 N1 N1' -70.2(7) . .
C36' C35 N1 N1' 38.3(8) . .
C35' C35 N1 C13 -109.2(9) . .
C36 C35 N1 C13 2.7(12) . .
C34 C35 N1 C13 -175.7(7) . .
N1' C35 N1 C13 -105.5(12) . .
C36' C35 N1 C13 -67.2(10) . .
C35' C35 N1 C22 87.4(11) . .
C36 C35 N1 C22 -160.8(8) . .
C34 C35 N1 C22 20.8(13) . .
N1' C35 N1 C22 91.0(13) . .
C36' C35 N1 C22 129.3(9) . .
C35' C35 N1 C27' 43.9(9) . .
C36 C35 N1 C27' 155.7(6) . .
C34 C35 N1 C27' -22.6(10) . .
N1' C35 N1 C27' 47.5(8) . .
C36' C35 N1 C27' 85.9(9) . .
C36 C35 N1 C35' 111.9(3) . .
C34 C35 N1 C35' -66.5(2) . .
N1' C35 N1 C35' 3.7(7) . .
C36' C35 N1 C35' 42.0(3) . .
C35' C35 N1 C13' -49.5(8) . .
C36 C35 N1 C13' 62.3(9) . .
C34 C35 N1 C13' -116.1(7) . .
N1' C35 N1 C13' -45.9(7) . .
C36' C35 N1 C13' -7.6(10) . .
C14 C13 N1 N1' -37.4(12) . .
C18 C13 N1 N1' 129.8(9) . .
C13' C13 N1 N1' 0.6(10) . .
C14 C13 N1 C35 57.0(11) . .
C18 C13 N1 C35 -135.8(8) . .
C13' C13 N1 C35 95.0(10) . .
C14 C13 N1 C22 -136.9(8) . .
C18 C13 N1 C22 30.3(12) . .
C13' C13 N1 C22 -99.0(10) . .
C14 C13 N1 C27' -95.2(11) . .
C18 C13 N1 C27' 72.0(12) . .
C13' C13 N1 C27' -57.3(11) . .
C14 C13 N1 C35' 15.6(13) . .
C18 C13 N1 C35' -177.2(6) . .
C13' C13 N1 C35' 53.6(10) . .
C14 C13 N1 C13' -38.0(7) . .
C18 C13 N1 C13' 129.2(8) . .
C27' C22 N1 N1' 2.9(10) . .
C23 C22 N1 N1' -26.2(10) . .
C27 C22 N1 N1' 153.0(8) . .
C26' C22 N1 N1' -140(3) . .
C27' C22 N1 C35 -84.2(12) . .
C23 C22 N1 C35 -113.3(10) . .
C27 C22 N1 C35 65.9(13) . .
C26' C22 N1 C35 133(2) . .
C27' C22 N1 C13 110.7(11) . .
C23 C22 N1 C13 81.6(9) . .
C27 C22 N1 C13 -99.2(10) . .
C26' C22 N1 C13 -32(3) . .
C23 C22 N1 C27' -29.1(8) . .
C27 C22 N1 C27' 150.1(11) . .
C26' C22 N1 C27' -143(3) . .
C27' C22 N1 C35' -44.2(10) . .
C23 C22 N1 C35' -73.3(9) . .
C27 C22 N1 C35' 105.9(9) . .
C26' C22 N1 C35' 173(2) . .
C27' C22 N1 C13' 53.8(11) . .
C23 C22 N1 C13' 24.7(10) . .
C27 C22 N1 C13' -156.1(7) . .
C26' C22 N1 C13' -89(3) . .
C23 C27' N1 N1' -121.5(16) . .
C22 C27' N1 N1' -176.5(13) . .
C23' C27' N1 N1' 28(5) . .
C23 C27' N1 C35 174.1(12) . .
C22 C27' N1 C35 119.1(11) . .
C23' C27' N1 C35 -36(5) . .
N1' C27' N1 C35 -64.4(9) . .
C23 C27' N1 C13 -32(2) . .
C22 C27' N1 C13 -86.8(12) . .
C23' C27' N1 C13 118(5) . .
N1' C27' N1 C13 89.7(11) . .
C23 C27' N1 C22 55.0(14) . .
C23' C27' N1 C22 -155(5) . .
N1' C27' N1 C22 176.5(13) . .
C23 C27' N1 C35' -162.8(14) . .
C22 C27' N1 C35' 142.2(9) . .
C23' C27' N1 C35' -13(5) . .
N1' C27' N1 C35' -41.3(6) . .
C23 C27' N1 C13' -74.8(15) . .
C22 C27' N1 C13' -129.7(10) . .
C23' C27' N1 C13' 75(5) . .
N1' C27' N1 C13' 46.8(7) . .
C35 C35' N1 N1' 175.3(9) . .
C36' C35' N1 N1' 101.1(7) . .
C34 C35' N1 N1' -125.6(6) . .
C36 C35' N1 N1' 141.3(7) . .
C36' C35' N1 C35 -74.3(5) . .
N1' C35' N1 C35 -175.3(9) . .
C34 C35' N1 C35 59.1(4) . .
C36 C35' N1 C35 -34.1(3) . .
C35 C35' N1 C13 94.6(11) . .
C36' C35' N1 C13 20.3(12) . .
N1' C35' N1 C13 -80.7(11) . .
C34 C35' N1 C13 153.7(10) . .
C36 C35' N1 C13 60.5(10) . .
C35 C35' N1 C22 -115.0(10) . .
C36' C35' N1 C22 170.7(6) . .
N1' C35' N1 C22 69.6(10) . .
C34 C35' N1 C22 -55.9(9) . .
C36 C35' N1 C22 -149.1(9) . .
C35 C35' N1 C27' -141.0(8) . .
C36' C35' N1 C27' 144.7(5) . .
N1' C35' N1 C27' 43.7(7) . .
C34 C35' N1 C27' -81.9(6) . .
C36 C35' N1 C27' -175.1(6) . .
C35 C35' N1 C13' 135.0(8) . .
C36' C35' N1 C13' 60.7(7) . .
N1' C35' N1 C13' -40.3(7) . .
C34 C35' N1 C13' -165.9(5) . .
C36 C35' N1 C13' 100.9(6) . .
C14 C13' N1 N1' -142.6(12) . .
C18' C13' N1 N1' 84.0(16) . .
C13 C13' N1 N1' -179.3(12) . .
C14 C13' N1 C35 -77.3(10) . .
C18' C13' N1 C35 149.3(13) . .
N1' C13' N1 C35 65.3(10) . .
C13 C13' N1 C35 -113.9(11) . .
C14 C13' N1 C13 36.6(7) . .
C18' C13' N1 C13 -96.8(15) . .
N1' C13' N1 C13 179.3(12) . .
C14 C13' N1 C22 137.8(9) . .
C18' C13' N1 C22 4.4(18) . .
N1' C13' N1 C22 -79.6(10) . .
C13 C13' N1 C22 101.1(10) . .
C14 C13' N1 C27' 168.4(9) . .
C18' C13' N1 C27' 35.0(16) . .
N1' C13' N1 C27' -49.0(9) . .
C13 C13' N1 C27' 131.7(10) . .
C14 C13' N1 C35' -102.8(8) . .
C18' C13' N1 C35' 123.8(14) . .
N1' C13' N1 C35' 39.8(7) . .
C13 C13' N1 C35' -139.4(9) . .
C26' C25 N2 C28 177.1(11) . .
C24 C25 N2 C28 61.5(9) . .
C26 C25 N2 C28 -129.5(8) . .
C24' C25 N2 C28 23.2(10) . .
C26' C25 N2 C30 -8.8(16) . .
C24 C25 N2 C30 -124.3(7) . .
C26 C25 N2 C30 44.6(8) . .
C24' C25 N2 C30 -162.7(6) . .
N3 C28 N2 C25 172.9(7) . .
N3 C28 N2 C30 -1.9(7) . .
C29 C30 N2 C25 -173.3(7) . .
C29 C30 N2 C28 2.0(7) . .
N2 C28 N3 C29 0.9(7) . .
N2 C28 N3 Co1 170.0(4) . .
C30 C29 N3 C28 0.4(8) . .
C30 C29 N3 Co1 -169.8(4) . .
O3 Co1 N3 C28 -24.1(5) 2_567 .
O3 Co1 N3 C28 155.9(5) . .
N3 Co1 N3 C28 172(100) 2_567 .
N5 Co1 N3 C28 -106.6(5) 1_556 .
N5 Co1 N3 C28 73.4(5) 2_566 .
O3 Co1 N3 C29 143.2(6) 2_567 .
O3 Co1 N3 C29 -36.8(6) . .
N3 Co1 N3 C29 -21(100) 2_567 .
N5 Co1 N3 C29 60.7(6) 1_556 .
N5 Co1 N3 C29 -119.3(6) 2_566 .
C40 C39 N4 C38 0.0(7) . .
C40 C39 N4 C32 -179.0(5) . .
N5 C38 N4 C39 0.1(5) . .
N5 C38 N4 C32 179.1(3) . .
C33 C32 N4 C39 167.4(4) . .
C37 C32 N4 C39 -38.8(6) . .
C37' C32 N4 C39 22.2(6) . .
C33 C32 N4 C38 -11.4(6) . .
C37 C32 N4 C38 142.4(4) . .
C37' C32 N4 C38 -156.6(3) . .
N4 C38 N5 C40 -0.2(5) . .
N4 C38 N5 Co1 -171.3(3) . 1_554
C39 C40 N5 C38 0.2(7) . .
C39 C40 N5 Co1 172.1(4) . 1_554
C20 C21 N6 C19 -0.8(11) . .
C20 C21 N6 C16 144.7(8) . .
C20 C21 N6 C16' -162.0(8) . .
N7 C19 N6 C21 -0.3(10) . .
N7 C19 N6 C16 -145.3(7) . .
N7 C19 N6 C16' 160.0(9) . .
C16' C16 N6 C21 107.1(11) . .
C15 C16 N6 C21 145.1(9) . .
C17 C16 N6 C21 -7.6(13) . .
C16' C16 N6 C19 -111.9(11) . .
C15 C16 N6 C19 -74.0(10) . .
C17 C16 N6 C19 133.3(8) . .
C15 C16 N6 C16' 38.0(7) . .
C17 C16 N6 C16' -114.8(9) . .
C15 C16' N6 C21 -152.3(10) . .
C16 C16' N6 C21 -102.1(10) . .
C17' C16' N6 C21 30.4(18) . .
C15 C16' N6 C19 50.0(15) . .
C16 C16' N6 C19 100.2(11) . .
C17' C16' N6 C19 -127.3(12) . .
C15 C16' N6 C16 -50.2(9) . .
C17' C16' N6 C16 132.5(16) . .
N6 C19 N7 C20 1.2(8) . .
N6 C19 N7 Co2 -171.4(5) . 2_657
C21 C20 N7 C19 -1.7(8) . .
C21 C20 N7 Co2 171.6(5) . 2_657
O1 C8 O2 Co2 14.2(7) . 2_457
C4 C8 O2 Co2 -162.5(4) . 2_457
O4 C7 O3 Co1 23.4(11) . .
C1 C7 O3 Co1 -155.7(5) . .
O3 Co1 O3 C7 161(100) 2_567 .
N3 Co1 O3 C7 -84.4(7) 2_567 .
N3 Co1 O3 C7 95.6(7) . .
N5 Co1 O3 C7 9.0(7) 1_556 .
N5 Co1 O3 C7 -171.0(7) 2_566 .
O3 C7 O4 Co2 137.1(6) . .
C1 C7 O4 Co2 -43.8(11) . .
O2 Co2 O4 C7 40.3(8) 2_457 .
O6 Co2 O4 C7 -112.9(8) . .
N7 Co2 O4 C7 143.1(8) 2_657 .
O5 Co2 O4 C7 -127.1(7) . .
C12 Co2 O4 C7 -117.8(8) . .
O6 C12 O5 Co2 1.0(6) . .
C10 C12 O5 Co2 -175.6(5) . .
O2 Co2 O5 C12 -152.3(4) 2_457 .
O4 Co2 O5 C12 16.0(6) . .
O6 Co2 O5 C12 -0.6(4) . .
N7 Co2 O5 C12 106.1(4) 2_657 .
O5 C12 O6 Co2 -1.1(7) . .
C10 C12 O6 Co2 175.5(4) . .
O2 Co2 O6 C12 52.2(5) 2_457 .
O4 Co2 O6 C12 -172.0(4) . .
N7 Co2 O6 C12 -79.9(4) 2_657 .
O5 Co2 O6 C12 0.6(4) . .
