#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/14/4511409.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_4511409
loop_
_publ_author_name
'Wang, Xiu-li'
'Sui, Fang-fang'
'Lin, Hong-yan'
'Zhang, Ju-wen'
'Liu, Guo-cheng'
_publ_section_title
;
 Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible
 Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
;
_journal_issue                   7
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              3438
_journal_paper_doi               10.1021/cg500371n
_journal_volume                  14
_journal_year                    2014
_chemical_formula_moiety         'C44 H44 Co2 N8 O16'
_chemical_formula_sum            'C44 H44 Co2 N8 O16'
_chemical_formula_weight         1058.73
_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                111.325(3)
_cell_angle_beta                 103.680(4)
_cell_angle_gamma                102.598(3)
_cell_formula_units_Z            2
_cell_length_a                   10.1112(19)
_cell_length_b                   15.943(3)
_cell_length_c                   16.764(3)
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      2.3
_cell_volume                     2303.8(7)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω 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  0.0324
_diffrn_reflns_av_sigmaI/netI    0.0762
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            11836
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.39
_exptl_absorpt_coefficient_mu    0.801
_exptl_absorpt_correction_T_max  0.8892
_exptl_absorpt_correction_T_min  0.8187
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ' SADABS, Sheldrick, 1996'
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.526
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1092
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.379
_refine_diff_density_min         -0.444
_refine_diff_density_rms         0.107
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.054
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     631
_refine_ls_number_reflns         8045
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.054
_refine_ls_R_factor_all          0.1018
_refine_ls_R_factor_gt           0.0602
_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)+(0.0807P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1434
_refine_ls_wR_factor_ref         0.1615
_reflns_number_gt                5270
_reflns_number_total             8093
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg500371n_si_002.cif
_cod_data_source_block           compound-9
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 4511401--4511410.cif.
;
_cod_original_cell_volume        2303.7(8)
_cod_original_sg_symbol_Hall     '-P 1 '
_cod_database_code               4511409
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 0.42436(6) 0.37657(4) -0.40765(4) 0.02130(18) Uani 1 1 d .
N1 N 0.5104(4) 0.4356(3) -0.2598(3) 0.0301(9) Uani 1 1 d .
O1 O 0.7664(4) 0.7050(3) 0.0673(3) 0.0650(13) Uani 1 1 d .
C1 C 0.6267(5) 0.5139(3) -0.2082(3) 0.0327(12) Uani 1 1 d .
H1A H 0.6736 0.5435 -0.2374 0.039 Uiso 1 1 calc R
O1W O 0.3579(6) 0.1599(4) -0.1627(4) 0.137(3) Uani 1 1 d .
H1WA H 0.3155 0.1690 -0.2066 0.165 Uiso 1 1 d R
H1WB H 0.3319 0.0968 -0.1834 0.165 Uiso 1 1 d R
Co2 Co 0.67789(6) 0.20604(4) -0.40719(4) 0.02197(18) Uani 1 1 d .
N2 N 0.8035(5) 0.6381(3) -0.0672(3) 0.0484(12) Uani 1 1 d .
H2A H 0.8635 0.6449 -0.0950 0.058 Uiso 1 1 calc R
O2 O 1.2145(5) 0.9539(3) 0.1138(3) 0.0932(18) Uani 1 1 d .
C2 C 0.6815(6) 0.5538(4) -0.1137(4) 0.0414(13) Uani 1 1 d .
O2W O 0.9884(6) 0.6741(4) -0.1643(4) 0.122(2) Uani 1 1 d .
H2WA H 0.9907 0.6472 -0.2192 0.147 Uiso 1 1 d R
H2WB H 1.0618 0.6704 -0.1295 0.147 Uiso 1 1 d R
N3 N 1.2736(4) 0.9656(3) 0.2569(3) 0.0337(10) Uani 1 1 d .
H3B H 1.2437 0.9418 0.2905 0.040 Uiso 1 1 calc R
O3 O 0.7880(6) 0.3922(4) 0.0817(3) 0.0963(19) Uani 1 1 d .
C3 C 0.6159(7) 0.5066(4) -0.0704(4) 0.0526(16) Uani 1 1 d .
H3A H 0.6528 0.5286 -0.0074 0.063 Uiso 1 1 calc R
O3W O 1.1605(18) 0.8816(11) -0.0833(10) 0.62(2) Uani 1 1 d .
H3WA H 1.0958 0.8671 -0.1127 0.739 Uiso 1 1 d R
H3WB H 1.1942 0.8706 -0.0385 0.739 Uiso 1 1 d R
N4 N 1.5959(4) 1.1449(2) 0.4454(3) 0.0244(9) Uani 1 1 d .
O4 O 0.3656(5) 0.1921(3) 0.1136(3) 0.0732(15) Uani 1 1 d .
C4 C 0.4945(7) 0.4263(4) -0.1236(4) 0.0514(16) Uani 1 1 d .
H4A H 0.4477 0.3940 -0.0963 0.062 Uiso 1 1 calc R
O4W O 0.2987(19) 0.0374(7) -0.0659(10) 0.474(15) Uani 1 1 d .
H4WA H 0.3057 0.0773 -0.0130 0.568 Uiso 1 1 d R
H4WB H 0.3709 0.0187 -0.0588 0.568 Uiso 1 1 d R
O5 O 0.6199(3) 0.4503(2) -0.4036(2) 0.0299(8) Uani 1 1 d .
N5 N 0.7620(4) 0.2808(3) -0.2588(3) 0.0320(10) Uani 1 1 d .
C5 C 0.4432(6) 0.3940(4) -0.2165(4) 0.0409(13) Uani 1 1 d .
H5A H 0.3588 0.3416 -0.2508 0.049 Uiso 1 1 calc R
N6 N 0.6618(5) 0.2819(3) -0.0636(3) 0.0505(13) Uani 1 1 d .
H6A H 0.5855 0.2323 -0.0964 0.061 Uiso 1 1 calc R
O6 O 0.7071(4) 0.3346(2) -0.4076(3) 0.0416(10) Uani 1 1 d .
C6 C 0.8360(6) 0.7097(4) 0.0174(4) 0.0491(15) Uani 1 1 d .
O7 O 1.2064(3) 0.3669(2) -0.4099(2) 0.0308(8) Uani 1 1 d .
N7 N 0.4619(4) 0.3120(3) 0.2580(3) 0.0339(10) Uani 1 1 d .
H7C H 0.5283 0.3668 0.2919 0.041 Uiso 1 1 calc R
C7 C 0.9653(6) 0.7955(4) 0.0443(4) 0.0546(16) Uani 1 1 d .
H7A H 1.0342 0.7737 0.0180 0.066 Uiso 1 1 calc R
H7B H 0.9341 0.8360 0.0181 0.066 Uiso 1 1 calc R
O8 O 1.3499(3) 0.5017(2) -0.3888(2) 0.0282(8) Uani 1 1 d .
N8 N 0.3424(4) 0.3054(2) 0.4448(3) 0.0238(9) Uani 1 1 d .
C8 C 1.0406(6) 0.8545(4) 0.1458(4) 0.0422(13) Uani 1 1 d .
H8A H 1.0569 0.8124 0.1740 0.051 Uiso 1 1 calc R
H8B H 0.9783 0.8864 0.1709 0.051 Uiso 1 1 calc R
O9 O 0.4882(3) 0.1365(2) -0.4013(2) 0.0302(8) Uani 1 1 d .
C9 C 1.1839(6) 0.9288(4) 0.1697(4) 0.0424(14) Uani 1 1 d .
C10 C 1.4098(5) 1.0379(3) 0.2999(3) 0.0296(11) Uani 1 1 d .
O10 O 0.3918(3) 0.2442(2) -0.4136(3) 0.0365(9) Uani 1 1 d .
O11 O -0.1082(3) 0.2111(2) -0.4130(2) 0.0298(8) Uani 1 1 d .
C11 C 1.4910(6) 1.0739(4) 0.2555(4) 0.0395(13) Uani 1 1 d .
H11A H 1.4571 1.0510 0.1923 0.047 Uiso 1 1 calc R
O12 O -0.2277(3) 0.0970(2) -0.3895(2) 0.0298(8) Uani 1 1 d .
C12 C 1.6242(6) 1.1451(4) 0.3091(4) 0.0397(13) Uani 1 1 d .
H12A H 1.6812 1.1700 0.2814 0.048 Uiso 1 1 calc R
C13 C 1.6720(5) 1.1789(3) 0.4012(4) 0.0318(12) Uani 1 1 d .
H13A H 1.7609 1.2275 0.4352 0.038 Uiso 1 1 calc R
C14 C 1.4678(5) 1.0755(3) 0.3940(3) 0.0274(11) Uani 1 1 d .
H14A H 1.4144 1.0510 0.4236 0.033 Uiso 1 1 calc R
C15 C 0.6920(6) 0.2613(4) -0.2058(4) 0.0382(13) Uani 1 1 d .
H15A H 0.6017 0.2138 -0.2335 0.046 Uiso 1 1 calc R
C16 C 0.7484(6) 0.3088(4) -0.1115(4) 0.0394(13) Uani 1 1 d .
C17 C 0.8856(6) 0.3766(4) -0.0687(4) 0.0485(15) Uani 1 1 d .
H17A H 0.9272 0.4082 -0.0054 0.058 Uiso 1 1 calc R
C18 C 0.9586(6) 0.3955(4) -0.1242(4) 0.0492(15) Uani 1 1 d .
H18A H 1.0505 0.4411 -0.0982 0.059 Uiso 1 1 calc R
C19 C 0.8944(6) 0.3467(4) -0.2179(4) 0.0467(15) Uani 1 1 d .
H19A H 0.9449 0.3601 -0.2540 0.056 Uiso 1 1 calc R
C20 C 0.6829(7) 0.3235(5) 0.0263(4) 0.0580(17) Uani 1 1 d .
C21 C 0.5640(8) 0.2762(5) 0.0523(4) 0.075(2) Uani 1 1 d .
H21A H 0.4731 0.2770 0.0174 0.090 Uiso 1 1 calc R
H21B H 0.5571 0.2098 0.0339 0.090 Uiso 1 1 calc R
C22 C 0.5810(6) 0.3195(4) 0.1497(4) 0.0480(15) Uani 1 1 d .
H22A H 0.5867 0.3857 0.1686 0.058 Uiso 1 1 calc R
H22B H 0.6713 0.3187 0.1852 0.058 Uiso 1 1 calc R
C23 C 0.4584(6) 0.2684(4) 0.1709(4) 0.0396(13) Uani 1 1 d .
C24 C 0.3712(5) 0.2792(3) 0.2997(3) 0.0276(11) Uani 1 1 d .
C25 C 0.2407(5) 0.2039(3) 0.2542(3) 0.0378(13) Uani 1 1 d .
H25A H 0.2052 0.1702 0.1909 0.045 Uiso 1 1 calc R
C26 C 0.1645(5) 0.1808(3) 0.3077(4) 0.0374(13) Uani 1 1 d .
H26A H 0.0772 0.1305 0.2797 0.045 Uiso 1 1 calc R
C27 C 0.2173(5) 0.2315(3) 0.3997(3) 0.0302(11) Uani 1 1 d .
H27A H 0.1647 0.2143 0.4333 0.036 Uiso 1 1 calc R
C28 C 0.4168(5) 0.3280(3) 0.3941(3) 0.0253(11) Uani 1 1 d .
H28A H 0.5032 0.3791 0.4241 0.030 Uiso 1 1 calc R
C29 C 0.8657(5) 0.4770(3) -0.3920(3) 0.0213(10) Uani 1 1 d .
C30 C 0.9776(4) 0.4398(3) -0.3944(3) 0.0225(10) Uani 1 1 d .
H30A H 0.9644 0.3784 -0.3992 0.027 Uiso 1 1 calc R
C31 C 1.1098(5) 0.4947(3) -0.3896(3) 0.0222(10) Uani 1 1 d .
C32 C 1.1297(5) 0.5867(3) -0.3809(3) 0.0276(11) Uani 1 1 d .
H32A H 1.2182 0.6234 -0.3772 0.033 Uiso 1 1 calc R
C33 C 1.0191(5) 0.6250(3) -0.3778(4) 0.0319(12) Uani 1 1 d .
H33A H 1.0333 0.6870 -0.3716 0.038 Uiso 1 1 calc R
C34 C 0.8866(5) 0.5694(3) -0.3841(3) 0.0293(11) Uani 1 1 d .
H34A H 0.8114 0.5941 -0.3831 0.035 Uiso 1 1 calc R
C35 C 1.2279(4) 0.4517(3) -0.3956(3) 0.0205(10) Uani 1 1 d .
C36 C 0.7201(5) 0.4160(3) -0.4014(3) 0.0216(10) Uani 1 1 d .
C37 C 0.2417(5) 0.0352(3) -0.3821(3) 0.0269(11) Uani 1 1 d .
H37A H 0.3190 0.0124 -0.3791 0.032 Uiso 1 1 calc R
C38 C 0.2525(4) 0.1187(3) -0.3939(3) 0.0189(10) Uani 1 1 d .
C39 C 0.1376(4) 0.1527(3) -0.3969(3) 0.0228(10) Uani 1 1 d .
H39A H 0.1438 0.2086 -0.4039 0.027 Uiso 1 1 calc R
C40 C 0.0112(5) 0.1029(3) -0.3895(3) 0.0237(10) Uani 1 1 d .
C41 C 0.0029(5) 0.0209(3) -0.3791(3) 0.0278(11) Uani 1 1 d .
H41A H -0.0809 -0.0122 -0.3747 0.033 Uiso 1 1 calc R
C42 C 0.1184(5) -0.0136(3) -0.3750(4) 0.0322(12) Uani 1 1 d .
H42A H 0.1121 -0.0692 -0.3675 0.039 Uiso 1 1 calc R
C43 C 0.3867(5) 0.1712(3) -0.4039(3) 0.0204(10) Uani 1 1 d .
C44 C -0.1143(5) 0.1392(3) -0.3976(3) 0.0223(10) 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
O10 Co1 O5 118.92(12) . .
O10 Co1 N8 86.07(14) . 1_554
O5 Co1 N8 92.39(13) . 1_554
O10 Co1 O7 90.82(12) . 1_455
O5 Co1 O7 150.26(12) . 1_455
N8 Co1 O7 89.12(13) 1_554 1_455
O10 Co1 N1 88.73(15) . .
O5 Co1 N1 88.56(14) . .
N8 Co1 N1 174.49(14) 1_554 .
O7 Co1 N1 92.75(13) 1_455 .
O10 Co1 O8 149.28(11) . 1_455
O5 Co1 O8 91.38(11) . 1_455
N8 Co1 O8 98.39(12) 1_554 1_455
O7 Co1 O8 59.06(11) 1_455 1_455
N1 Co1 O8 87.01(13) . 1_455
C1 N1 C5 117.3(4) . .
C1 N1 Co1 122.9(3) . .
C5 N1 Co1 119.7(3) . .
N1 C1 C2 123.8(4) . .
O6 Co2 O9 119.17(12) . .
O6 Co2 N4 87.11(15) . 1_444
O9 Co2 N4 93.17(13) . 1_444
O6 Co2 O11 91.08(12) . 1_655
O9 Co2 O11 149.74(12) . 1_655
N4 Co2 O11 88.46(13) 1_444 1_655
O6 Co2 N5 87.44(15) . .
O9 Co2 N5 89.16(13) . .
N4 Co2 N5 174.54(14) 1_444 .
O11 Co2 N5 92.01(13) 1_655 .
O6 Co2 O12 148.94(12) . 1_655
O9 Co2 O12 90.96(11) . 1_655
N4 Co2 O12 99.33(12) 1_444 1_655
O11 Co2 O12 59.03(11) 1_655 1_655
N5 Co2 O12 85.56(13) . 1_655
C6 N2 C2 126.7(5) . .
C1 C2 C3 118.0(5) . .
C1 C2 N2 118.1(5) . .
C3 C2 N2 123.9(5) . .
C9 N3 C10 128.4(4) . .
C4 C3 C2 118.2(5) . .
C14 N4 C13 116.9(4) . .
C14 N4 Co2 123.0(3) . 1_666
C13 N4 Co2 120.0(3) . 1_666
C5 C4 C3 120.0(5) . .
C36 O5 Co1 120.7(3) . .
C15 N5 C19 117.9(4) . .
C15 N5 Co2 123.7(3) . .
C19 N5 Co2 118.3(3) . .
N1 C5 C4 122.4(5) . .
C20 N6 C16 128.8(5) . .
C36 O6 Co2 174.1(3) . .
O1 C6 N2 123.1(5) . .
O1 C6 C7 122.8(5) . .
N2 C6 C7 114.2(5) . .
C35 O7 Co1 92.6(2) . 1_655
C23 N7 C24 128.3(4) . .
C8 C7 C6 114.6(5) . .
C35 O8 Co1 89.1(2) . 1_655
C27 N8 C28 117.0(4) . .
C27 N8 Co1 120.3(3) . 1_556
C28 N8 Co1 122.5(3) . 1_556
C7 C8 C9 112.7(4) . .
C43 O9 Co2 120.3(3) . .
O2 C9 N3 122.8(5) . .
O2 C9 C8 121.9(5) . .
N3 C9 C8 115.3(4) . .
C14 C10 C11 117.7(4) . .
C14 C10 N3 116.8(4) . .
C11 C10 N3 125.5(5) . .
C43 O10 Co1 170.3(3) . .
C44 O11 Co2 92.3(2) . 1_455
C12 C11 C10 117.6(5) . .
C44 O12 Co2 89.4(3) . 1_455
C13 C12 C11 120.8(5) . .
N4 C13 C12 122.6(5) . .
N4 C14 C10 124.3(4) . .
N5 C15 C16 122.7(5) . .
C15 C16 C17 119.7(5) . .
C15 C16 N6 116.9(5) . .
C17 C16 N6 123.4(5) . .
C16 C17 C18 117.3(5) . .
C19 C18 C17 119.9(5) . .
N5 C19 C18 122.5(5) . .
O3 C20 N6 123.2(5) . .
O3 C20 C21 123.0(6) . .
N6 C20 C21 113.8(5) . .
C22 C21 C20 116.0(6) . .
C21 C22 C23 113.2(5) . .
O4 C23 N7 123.0(5) . .
O4 C23 C22 122.0(5) . .
N7 C23 C22 114.9(5) . .
C28 C24 C25 118.5(4) . .
C28 C24 N7 116.1(4) . .
C25 C24 N7 125.3(4) . .
C24 C25 C26 117.3(5) . .
C27 C26 C25 120.4(5) . .
N8 C27 C26 123.0(4) . .
N8 C28 C24 123.6(4) . .
C30 C29 C34 119.7(4) . .
C30 C29 C36 120.0(4) . .
C34 C29 C36 120.2(4) . .
C29 C30 C31 120.0(4) . .
C32 C31 C30 119.8(4) . .
C32 C31 C35 121.1(4) . .
C30 C31 C35 119.1(4) . .
C31 C32 C33 120.8(4) . .
C32 C33 C34 119.2(4) . .
C33 C34 C29 120.5(4) . .
O7 C35 O8 119.2(4) . .
O7 C35 C31 121.0(4) . .
O8 C35 C31 119.8(4) . .
O6 C36 O5 124.0(4) . .
O6 C36 C29 117.8(4) . .
O5 C36 C29 118.1(4) . .
C42 C37 C38 121.0(4) . .
C39 C38 C37 119.0(4) . .
C39 C38 C43 119.9(4) . .
C37 C38 C43 121.1(4) . .
C38 C39 C40 120.1(4) . .
C41 C40 C39 119.6(4) . .
C41 C40 C44 121.6(4) . .
C39 C40 C44 118.7(4) . .
C40 C41 C42 120.9(4) . .
C37 C42 C41 119.4(4) . .
O10 C43 O9 123.8(4) . .
O10 C43 C38 118.9(4) . .
O9 C43 C38 117.3(4) . .
O11 C44 O12 119.3(4) . .
O11 C44 C40 120.8(4) . .
O12 C44 C40 120.0(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O10 2.025(3) .
Co1 O5 2.040(3) .
Co1 N8 2.161(4) 1_554
Co1 O7 2.166(3) 1_455
Co1 N1 2.170(4) .
Co1 O8 2.225(3) 1_455
N1 C1 1.336(6) .
N1 C5 1.348(6) .
O1 C6 1.226(6) .
C1 C2 1.386(7) .
Co2 O6 2.009(3) .
Co2 O9 2.039(3) .
Co2 N4 2.161(4) 1_444
Co2 O11 2.173(3) 1_655
Co2 N5 2.175(4) .
Co2 O12 2.234(3) 1_655
N2 C6 1.364(7) .
N2 C2 1.412(6) .
O2 C9 1.222(6) .
C2 C3 1.393(7) .
N3 C9 1.349(6) .
N3 C10 1.407(6) .
O3 C20 1.215(7) .
C3 C4 1.381(8) .
N4 C14 1.341(6) .
N4 C13 1.348(5) .
N4 Co2 2.161(4) 1_666
O4 C23 1.228(6) .
C4 C5 1.370(7) .
O5 C36 1.252(5) .
N5 C15 1.338(6) .
N5 C19 1.340(6) .
N6 C20 1.347(7) .
N6 C16 1.420(6) .
O6 C36 1.238(5) .
C6 C7 1.508(7) .
O7 C35 1.243(5) .
O7 Co1 2.166(3) 1_655
N7 C23 1.358(6) .
N7 C24 1.402(5) .
C7 C8 1.507(7) .
O8 C35 1.268(5) .
O8 Co1 2.226(3) 1_655
N8 C27 1.346(6) .
N8 C28 1.351(5) .
N8 Co1 2.161(4) 1_556
C8 C9 1.515(7) .
O9 C43 1.267(5) .
C10 C14 1.383(7) .
C10 C11 1.396(6) .
O10 C43 1.224(5) .
O11 C44 1.256(5) .
O11 Co2 2.173(3) 1_455
C11 C12 1.389(7) .
O12 C44 1.261(5) .
O12 Co2 2.234(3) 1_455
C12 C13 1.354(7) .
C15 C16 1.382(7) .
C16 C17 1.385(7) .
C17 C18 1.391(7) .
C18 C19 1.379(8) .
C20 C21 1.514(8) .
C21 C22 1.473(8) .
C22 C23 1.517(7) .
C24 C28 1.387(6) .
C24 C25 1.390(7) .
C25 C26 1.406(6) .
C26 C27 1.354(7) .
C29 C30 1.389(6) .
C29 C34 1.394(6) .
C29 C36 1.514(6) .
C30 C31 1.395(6) .
C31 C32 1.384(6) .
C31 C35 1.507(6) .
C32 C33 1.388(6) .
C33 C34 1.392(6) .
C37 C42 1.374(6) .
C37 C38 1.401(6) .
C38 C39 1.384(6) .
C38 C43 1.511(5) .
C39 C40 1.408(6) .
C40 C41 1.368(6) .
C40 C44 1.503(6) .
C41 C42 1.393(6) .
