#------------------------------------------------------------------------------
#$Date: 2017-02-04 15:49:48 +0200 (Sat, 04 Feb 2017) $
#$Revision: 191595 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/12/7041291.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_7041291
loop_
_publ_author_name
'Zhou, Xinhui'
'Chen, Qianqian'
'Liu, Baolin'
'Li, Liang'
'Yang, Tao'
'Huang, Wei'
_publ_section_title
;
 Syntheses, structures and magnetic properties of nine coordination
 polymers based on terphenyl-tetracarboxylic acid ligands.
;
_journal_issue                   2
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              430
_journal_page_last               444
_journal_paper_doi               10.1039/c6dt04270h
_journal_volume                  46
_journal_year                    2017
_chemical_formula_sum            'C30 H30 Co2 N2 O11'
_chemical_formula_weight         712.42
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2016-04-19 deposited with the CCDC.
2016-11-30 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 98.1080(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.5448(11)
_cell_length_b                   14.5678(11)
_cell_length_c                   15.7871(11)
_cell_measurement_reflns_used    2101
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      20.6
_cell_measurement_theta_min      2.1
_cell_volume                     2856.3(4)
_computing_cell_refinement       SMART
_computing_data_collection       'SMART (Bruker, 2000)'
_computing_data_reduction        'SAINT (Bruker, 2000)'
_computing_molecular_graphics    SHELXTL
_computing_publication_material  SHELXTL
_computing_structure_refinement  SHELXTL
_computing_structure_solution    'SHELXTL (Bruker, 2000)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker Smart Aepex CCD'
_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  0.0346
_diffrn_reflns_av_sigmaI/netI    0.0324
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            17987
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.15
_exptl_absorpt_coefficient_mu    1.230
_exptl_absorpt_correction_T_max  0.8869
_exptl_absorpt_correction_T_min  0.8665
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS; Bruker, 2000'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.657
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1464
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.706
_refine_diff_density_min         -0.905
_refine_diff_density_rms         0.107
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.093
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     428
_refine_ls_number_reflns         5014
_refine_ls_number_restraints     186
_refine_ls_restrained_S_all      1.086
_refine_ls_R_factor_all          0.0714
_refine_ls_R_factor_gt           0.0508
_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)+(0.0570P)²+9.7827P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1276
_refine_ls_wR_factor_ref         0.1445
_reflns_number_gt                3593
_reflns_number_total             5014
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6dt04270h2.cif
_cod_data_source_block           7
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/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 4268 2015-11-12 08:31:59Z antanas 

 Adding full bibliography for 7041290--7041299.cif.
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7041291
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.2945(3) 0.1498(3) 0.1082(3) 0.0219(9) Uani 1 1 d U . .
C2 C 0.3290(3) 0.0912(3) 0.1743(3) 0.0250(10) Uani 1 1 d U . .
H2 H 0.2798 0.0523 0.1948 0.030 Uiso 1 1 calc R . .
C3 C 0.4365(3) 0.0891(3) 0.2113(3) 0.0251(10) Uani 1 1 d U . .
H3 H 0.4577 0.0499 0.2571 0.030 Uiso 1 1 calc R . .
C4 C 0.5122(3) 0.1447(3) 0.1805(3) 0.0200(9) Uani 1 1 d U . .
C5 C 0.4756(3) 0.2058(3) 0.1144(3) 0.0255(10) Uani 1 1 d U . .
H5 H 0.5246 0.2448 0.0935 0.031 Uiso 1 1 calc R . .
C6 C 0.3683(3) 0.2096(3) 0.0793(3) 0.0248(10) Uani 1 1 d U . .
H6 H 0.3454 0.2519 0.0364 0.030 Uiso 1 1 calc R . .
C7 C 0.6281(3) 0.1367(3) 0.2150(3) 0.0177(9) Uani 1 1 d U . .
C8 C 0.6652(3) 0.1269(3) 0.3024(3) 0.0155(8) Uani 1 1 d U . .
C9 C 0.7745(3) 0.1184(3) 0.3303(3) 0.0172(8) Uani 1 1 d U . .
H9 H 0.7975 0.1125 0.3887 0.021 Uiso 1 1 calc R . .
C10 C 0.8516(3) 0.1182(3) 0.2746(3) 0.0157(8) Uani 1 1 d U . .
C11 C 0.8147(3) 0.1267(3) 0.1862(3) 0.0155(8) Uani 1 1 d U . .
C12 C 0.7055(3) 0.1359(3) 0.1593(3) 0.0186(9) Uani 1 1 d U . .
H12 H 0.6822 0.1419 0.1009 0.022 Uiso 1 1 calc R . .
C13 C 0.9683(3) 0.1123(3) 0.3098(3) 0.0182(9) Uani 1 1 d U . .
C14 C 1.0037(3) 0.0535(3) 0.3778(3) 0.0282(10) Uani 1 1 d U . .
H14 H 0.9541 0.0163 0.4000 0.034 Uiso 1 1 calc R . .
C15 C 1.1117(4) 0.0493(3) 0.4131(3) 0.0288(11) Uani 1 1 d U . .
H15 H 1.1343 0.0083 0.4572 0.035 Uiso 1 1 calc R . .
C16 C 1.1855(3) 0.1072(3) 0.3819(3) 0.0221(9) Uani 1 1 d U . .
C17 C 1.1511(3) 0.1637(3) 0.3144(3) 0.0251(10) Uani 1 1 d U . .
H17 H 1.2007 0.2011 0.2925 0.030 Uiso 1 1 calc R . .
C18 C 1.0444(3) 0.1665(3) 0.2780(3) 0.0237(10) Uani 1 1 d U . .
H18 H 1.0234 0.2051 0.2317 0.028 Uiso 1 1 calc R . .
C19 C 0.1795(3) 0.1451(3) 0.0657(3) 0.0194(9) Uani 1 1 d U . .
C20 C 0.5921(3) 0.1297(3) 0.3712(2) 0.0154(8) Uani 1 1 d U . .
C21 C 1.3020(3) 0.1100(3) 0.4222(3) 0.0198(9) Uani 1 1 d U . .
C22 C 0.8882(3) 0.1235(3) 0.1179(2) 0.0152(8) Uani 1 1 d U . .
C23 C -0.0520(5) 0.1169(4) -0.2318(4) 0.0546(16) Uani 1 1 d U . .
H23A H -0.0014 0.1157 -0.1801 0.082 Uiso 1 1 d R A .
H23B H -0.0428 0.0630 -0.2650 0.082 Uiso 1 1 d R . .
H23C H -0.0398 0.1706 -0.2643 0.082 Uiso 1 1 d R . .
C25 C -0.2703(5) 0.1209(4) -0.0887(4) 0.0469(14) Uani 1 1 d U . .
H25A H -0.2167 0.1193 -0.0389 0.070 Uiso 1 1 d R A .
H25B H -0.3166 0.0684 -0.0886 0.070 Uiso 1 1 d R . .
H25C H -0.3123 0.1760 -0.0879 0.070 Uiso 1 1 d R . .
C26 C -0.2690(5) 0.1215(4) -0.2618(4) 0.0565(18) Uani 1 1 d U . .
H26A H -0.2147 0.1200 -0.2990 0.085 Uiso 1 1 d R A .
H26B H -0.3107 0.1767 -0.2720 0.085 Uiso 1 1 d R . .
H26C H -0.3152 0.0691 -0.2729 0.085 Uiso 1 1 d R . .
C27 C 0.7727(5) 0.3779(4) 0.1570(5) 0.0532(16) Uani 1 1 d U . .
H27A H 0.8032 0.3766 0.1046 0.080 Uiso 1 1 d R . .
H27B H 0.7287 0.3244 0.1604 0.080 Uiso 1 1 d R . .
H27C H 0.7293 0.4320 0.1584 0.080 Uiso 1 1 d R . .
C28 C 0.8613(5) 0.3789(4) 0.2313(4) 0.0425(13) Uani 1 1 d U . .
C29 C 0.7309(6) 0.3749(5) 0.3349(6) 0.079(2) Uani 1 1 d U . .
H29A H 0.6789 0.3726 0.2841 0.119 Uiso 1 1 d R . .
H29B H 0.7252 0.3204 0.3681 0.119 Uiso 1 1 d R . .
H29C H 0.7176 0.4278 0.3681 0.119 Uiso 1 1 d R . .
C30 C 0.9269(7) 0.3847(6) 0.3812(5) 0.084(2) Uani 1 1 d U . .
H30A H 0.9086 0.4263 0.4241 0.125 Uiso 1 1 calc R . .
H30B H 0.9910 0.4057 0.3605 0.125 Uiso 1 1 calc R . .
H30C H 0.9391 0.3246 0.4056 0.125 Uiso 1 1 calc R . .
N2 N 0.8394(5) 0.3808(3) 0.3110(4) 0.0573(14) Uani 1 1 d . . .
Co1 Co 0.0000 0.0000 0.0000 0.0149(2) Uani 1 2 d S . .
Co2 Co -0.01894(4) 0.25057(3) -0.01201(3) 0.01375(17) Uani 1 1 d . . .
Co3 Co 0.0000 0.5000 0.0000 0.0144(2) Uani 1 2 d S . .
O1 O 0.1341(2) 0.2191(2) 0.0421(2) 0.0346(8) Uani 1 1 d . . .
O2 O 0.1384(2) 0.0671(2) 0.0566(2) 0.0311(8) Uani 1 1 d . . .
O3 O 0.5509(3) 0.2050(2) 0.3848(2) 0.0297(7) Uani 1 1 d . . .
O4 O 0.5823(3) 0.0560(2) 0.4095(2) 0.0329(8) Uani 1 1 d . . .
O5 O 1.3487(2) 0.0356(2) 0.4395(2) 0.0304(8) Uani 1 1 d . . .
O6 O 1.3411(2) 0.1893(2) 0.4337(2) 0.0302(8) Uani 1 1 d . . .
O7 O 0.9209(2) 0.0462(2) 0.09815(19) 0.0255(7) Uani 1 1 d . . .
O8 O 0.9077(2) 0.2000(2) 0.08653(18) 0.0232(7) Uani 1 1 d . . .
O9 O -0.0618(2) 0.12033(19) -0.07646(18) 0.0232(7) Uani 1 1 d . . .
O10 O 0.0213(2) 0.37398(18) 0.07027(18) 0.0204(6) Uani 1 1 d . . .
H10X H -0.0280 0.3746 0.1139 0.024 Uiso 1 1 d R A .
H10Y H 0.0957 0.3567 0.0939 0.024 Uiso 1 1 d R . .
O11 O 0.9581(3) 0.3798(2) 0.2183(2) 0.0421(9) Uani 1 1 d . . .
C24 C -0.1093(8) 0.1186(6) -0.1524(7) 0.034(2) Uani 0.60 1 d PU A 1
N1 N -0.2153(8) 0.1195(5) -0.1692(6) 0.042(2) Uani 0.60 1 d P A 1
C24' C -0.1598(13) 0.1187(8) -0.1236(9) 0.024(3) Uani 0.40 1 d PU A 2
N1' N -0.1595(11) 0.1193(8) -0.2102(7) 0.036(3) Uani 0.40 1 d P A 2
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
C2 C1 C6 119.1(4) . .
C2 C1 C19 119.4(4) . .
C6 C1 C19 121.4(4) . .
C1 C2 C3 121.1(4) . .
C1 C2 H2 119.4 . .
C3 C2 H2 119.4 . .
C4 C3 C2 120.7(4) . .
C4 C3 H3 119.7 . .
C2 C3 H3 119.7 . .
C3 C4 C5 117.7(4) . .
C3 C4 C7 120.6(4) . .
C5 C4 C7 121.7(4) . .
C6 C5 C4 121.5(4) . .
C6 C5 H5 119.3 . .
C4 C5 H5 119.3 . .
C5 C6 C1 119.9(4) . .
C5 C6 H6 120.1 . .
C1 C6 H6 120.1 . .
C12 C7 C8 117.1(4) . .
C12 C7 C4 120.0(4) . .
C8 C7 C4 122.9(4) . .
C9 C8 C7 120.0(4) . .
C9 C8 C20 116.5(3) . .
C7 C8 C20 123.5(3) . .
C8 C9 C10 122.8(4) . .
C8 C9 H9 118.6 . .
C10 C9 H9 118.6 . .
C9 C10 C11 117.6(4) . .
C9 C10 C13 119.7(4) . .
C11 C10 C13 122.7(4) . .
C12 C11 C10 118.9(4) . .
C12 C11 C22 117.4(3) . .
C10 C11 C22 123.6(3) . .
C11 C12 C7 123.6(4) . .
C11 C12 H12 118.2 . .
C7 C12 H12 118.2 . .
C18 C13 C14 117.9(4) . .
C18 C13 C10 121.4(4) . .
C14 C13 C10 120.7(4) . .
C15 C14 C13 121.3(4) . .
C15 C14 H14 119.3 . .
C13 C14 H14 119.3 . .
C14 C15 C16 119.4(4) . .
C14 C15 H15 120.3 . .
C16 C15 H15 120.3 . .
C17 C16 C15 119.2(4) . .
C17 C16 C21 119.5(4) . .
C15 C16 C21 121.3(4) . .
C16 C17 C18 121.6(4) . .
C16 C17 H17 119.2 . .
C18 C17 H17 119.2 . .
C17 C18 C13 120.5(4) . .
C17 C18 H18 119.7 . .
C13 C18 H18 119.7 . .
O2 C19 O1 125.9(4) . .
O2 C19 C1 116.6(4) . .
O1 C19 C1 117.4(4) . .
O3 C20 O4 127.2(4) . .
O3 C20 C8 117.0(3) . .
O4 C20 C8 115.7(3) . .
O5 C21 O6 127.3(4) . .
O5 C21 C16 117.8(4) . .
O6 C21 C16 114.9(4) . .
O7 C22 O8 127.6(4) . .
O7 C22 C11 117.2(3) . .
O8 C22 C11 115.2(3) . .
N1' C23 H23A 109.2 . .
C24 C23 H23A 68.6 . .
N1' C23 H23B 109.8 . .
C24 C23 H23B 124.5 . .
H23A C23 H23B 109.5 . .
N1' C23 H23C 109.4 . .
C24 C23 H23C 123.6 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
N1 C25 H25A 109.4 . .
C24' C25 H25A 74.5 . .
N1 C25 H25B 109.5 . .
C24' C25 H25B 123.3 . .
H25A C25 H25B 109.5 . .
N1 C25 H25C 109.5 . .
C24' C25 H25C 122.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
N1' C26 H26A 69.9 . .
N1 C26 H26A 109.4 . .
N1' C26 H26B 123.1 . .
N1 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
N1' C26 H26C 124.6 . .
N1 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
C28 C27 H27A 109.4 . .
C28 C27 H27B 109.5 . .
H27A C27 H27B 109.5 . .
C28 C27 H27C 109.6 . .
H27A C27 H27C 109.5 . .
H27B C27 H27C 109.5 . .
O11 C28 N2 119.2(6) . .
O11 C28 C27 120.0(5) . .
N2 C28 C27 120.8(6) . .
N2 C29 H29A 109.6 . .
N2 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
N2 C29 H29C 109.4 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
N2 C30 H30A 109.5 . .
N2 C30 H30B 109.5 . .
H30A C30 H30B 109.5 . .
N2 C30 H30C 109.5 . .
H30A C30 H30C 109.5 . .
H30B C30 H30C 109.5 . .
C28 N2 C30 119.4(6) . .
C28 N2 C29 124.6(7) . .
C30 N2 C29 116.0(6) . .
O7 Co1 O7 180.00(15) 1_455 3_655
O7 Co1 O2 90.88(13) 1_455 3
O7 Co1 O2 89.12(13) 3_655 3
O7 Co1 O2 89.12(13) 1_455 .
O7 Co1 O2 90.88(13) 3_655 .
O2 Co1 O2 180.0(3) 3 .
O7 Co1 O9 91.00(11) 1_455 3
O7 Co1 O9 89.00(11) 3_655 3
O2 Co1 O9 93.97(12) 3 3
O2 Co1 O9 86.03(12) . 3
O7 Co1 O9 89.00(11) 1_455 .
O7 Co1 O9 91.00(11) 3_655 .
O2 Co1 O9 86.03(12) 3 .
O2 Co1 O9 93.97(12) . .
O9 Co1 O9 180.00(15) 3 .
O6 Co2 O1 167.37(13) 4_465 .
O6 Co2 O8 91.22(13) 4_465 1_455
O1 Co2 O8 95.65(13) . 1_455
O6 Co2 O3 88.27(13) 4_465 4_565
O1 Co2 O3 85.48(14) . 4_565
O8 Co2 O3 176.65(12) 1_455 4_565
O6 Co2 O9 92.09(12) 4_465 .
O1 Co2 O9 98.92(12) . .
O8 Co2 O9 86.23(11) 1_455 .
O3 Co2 O9 90.48(12) 4_565 .
O6 Co2 O10 90.54(11) 4_465 .
O1 Co2 O10 79.35(12) . .
O8 Co2 O10 86.37(11) 1_455 .
O3 Co2 O10 96.94(12) 4_565 .
O9 Co2 O10 172.20(10) . .
O4 Co3 O4 180.00(12) 2 4_565
O4 Co3 O5 84.39(13) 2 4_465
O4 Co3 O5 95.61(13) 4_565 4_465
O4 Co3 O5 95.61(13) 2 2_655
O4 Co3 O5 84.39(13) 4_565 2_655
O5 Co3 O5 180.0 4_465 2_655
O4 Co3 O10 91.05(12) 2 .
O4 Co3 O10 88.95(12) 4_565 .
O5 Co3 O10 93.66(11) 4_465 .
O5 Co3 O10 86.34(11) 2_655 .
O4 Co3 O10 88.95(12) 2 3_565
O4 Co3 O10 91.05(12) 4_565 3_565
O5 Co3 O10 86.34(11) 4_465 3_565
O5 Co3 O10 93.66(11) 2_655 3_565
O10 Co3 O10 180.00(7) . 3_565
C19 O1 Co2 132.8(3) . .
C19 O2 Co1 141.6(3) . .
C20 O3 Co2 130.3(3) . 4_666
C20 O4 Co3 140.8(3) . 2_545
C21 O5 Co3 133.9(3) . 2_645
C21 O6 Co2 138.6(3) . 4_766
C22 O7 Co1 133.5(3) . 1_655
C22 O8 Co2 138.5(3) . 1_655
C24 O9 Co2 120.8(4) . .
C24' O9 Co2 114.8(6) . .
C24 O9 Co1 125.9(4) . .
C24' O9 Co1 120.8(6) . .
Co2 O9 Co1 113.02(12) . .
Co3 O10 Co2 112.78(12) . .
Co3 O10 H10X 108.0 . .
Co2 O10 H10X 107.5 . .
Co3 O10 H10Y 117.2 . .
Co2 O10 H10Y 98.0 . .
H10X O10 H10Y 112.9 . .
O9 C24 N1 121.2(12) . .
O9 C24 C23 124.4(8) . .
N1 C24 C23 114.4(10) . .
C24 N1 C26 119.3(11) . .
C24 N1 C25 113.2(10) . .
C26 N1 C25 127.5(7) . .
O9 C24' N1' 115.0(14) . .
O9 C24' C25 126.3(10) . .
N1' C24' C25 118.7(14) . .
C24' N1' C23 111.8(13) . .
C24' N1' C26 114.4(14) . .
C23 N1' C26 133.8(9) . .
C24' N1' H26A 152.1 . .
C23 N1' H26A 96.1 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C2 1.370(6) .
C1 C6 1.394(6) .
C1 C19 1.504(6) .
C2 C3 1.392(6) .
C2 H2 0.9300 .
C3 C4 1.388(6) .
C3 H3 0.9300 .
C4 C5 1.400(6) .
C4 C7 1.483(6) .
C5 C6 1.383(6) .
C5 H5 0.9300 .
C6 H6 0.9300 .
C7 C12 1.400(6) .
C7 C8 1.400(6) .
C8 C9 1.385(6) .
C8 C20 1.518(5) .
C9 C10 1.397(6) .
C9 H9 0.9300 .
C10 C11 1.413(6) .
C10 C13 1.494(6) .
C11 C12 1.383(6) .
C11 C22 1.514(5) .
C12 H12 0.9300 .
C13 C18 1.387(6) .
C13 C14 1.397(6) .
C14 C15 1.391(6) .
C14 H14 0.9300 .
C15 C16 1.393(6) .
C15 H15 0.9300 .
C16 C17 1.368(6) .
C16 C21 1.509(6) .
C17 C18 1.380(6) .
C17 H17 0.9300 .
C18 H18 0.9300 .
C19 O2 1.248(5) .
C19 O1 1.252(5) .
C20 O3 1.244(5) .
C20 O4 1.246(5) .
C21 O5 1.245(5) .
C21 O6 1.258(5) .
C22 O7 1.253(5) .
C22 O8 1.257(5) .
C23 N1' 1.438(15) .
C23 C24 1.530(13) .
C23 H23A 0.9601 .
C23 H23B 0.9599 .
C23 H23C 0.9600 .
C25 N1 1.530(12) .
C25 C24' 1.564(17) .
C25 H25A 0.9600 .
C25 H25B 0.9600 .
C25 H25C 0.9600 .
C26 N1' 1.495(14) .
C26 N1 1.521(11) .
C26 H26A 0.9600 .
C26 H26B 0.9600 .
C26 H26C 0.9600 .
C27 C28 1.497(9) .
C27 H27A 0.9601 .
C27 H27B 0.9600 .
C27 H27C 0.9599 .
C28 O11 1.259(7) .
C28 N2 1.327(8) .
C29 N2 1.464(8) .
C29 H29A 0.9600 .
C29 H29B 0.9600 .
C29 H29C 0.9601 .
C30 N2 1.447(10) .
C30 H30A 0.9600 .
C30 H30B 0.9600 .
C30 H30C 0.9600 .
Co1 O7 2.067(3) 1_455
Co1 O7 2.067(3) 3_655
Co1 O2 2.081(3) 3
Co1 O2 2.081(3) .
Co1 O9 2.206(3) 3
Co1 O9 2.206(3) .
Co2 O6 2.039(3) 4_465
Co2 O1 2.040(3) .
Co2 O8 2.053(3) 1_455
Co2 O3 2.060(3) 4_565
Co2 O9 2.184(3) .
Co2 O10 2.234(3) .
Co3 O4 2.048(3) 2
Co3 O4 2.048(3) 4_565
Co3 O5 2.067(3) 4_465
Co3 O5 2.067(3) 2_655
Co3 O10 2.142(3) .
Co3 O10 2.142(3) 3_565
O3 Co2 2.060(3) 4_666
O4 Co3 2.048(3) 2_545
O5 Co3 2.067(3) 2_645
O6 Co2 2.039(3) 4_766
O7 Co1 2.067(3) 1_655
O8 Co2 2.053(3) 1_655
O9 C24 1.261(11) .
O9 C24' 1.345(16) .
O10 H10X 0.9891 .
O10 H10Y 0.9880 .
C24 N1 1.319(14) .
C24' N1' 1.367(18) .
