#------------------------------------------------------------------------------
#$Date: 2015-12-09 16:13:01 +0200 (Wed, 09 Dec 2015) $
#$Revision: 171180 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/65/7036567.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_7036567
loop_
_publ_author_name
'Feng, Jian-Shen'
'Cai, Zhong-Sheng'
'Ren, Min'
'Bao, Song-Song'
'Zheng, Li-Min'
_publ_section_title
;
 Racemic cobalt phosphonates incorporating flexible bis(imidazole)
 co-ligands.
;
_journal_issue                   41
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              18122
_journal_page_last               18129
_journal_paper_doi               10.1039/c5dt03046c
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         'C48 H58 Co3 N10 O14 P2, 5(H2 O)'
_chemical_formula_sum            'C48 H68 Co3 N10 O19 P2'
_chemical_formula_weight         1327.85
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2015-07-23 deposited with the CCDC.
2015-09-16 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 91.7880(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.6927(6)
_cell_length_b                   38.9262(15)
_cell_length_c                   10.7667(4)
_cell_measurement_reflns_used    3610
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      22.948
_cell_measurement_theta_min      2.428
_cell_volume                     5735.9(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  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXTL (Bruker, 2000)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker APEX II'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0800
_diffrn_reflns_av_unetI/netI     0.1046
_diffrn_reflns_laue_measured_fraction_full 1.000
_diffrn_reflns_laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       51
_diffrn_reflns_limit_k_min       -51
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            41588
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.342
_diffrn_reflns_theta_min         1.488
_exptl_absorpt_coefficient_mu    0.994
_exptl_absorpt_correction_T_max  0.951
_exptl_absorpt_correction_T_min  0.888
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS(Bruker, 2000)'
_exptl_crystal_colour            'purple red'
_exptl_crystal_density_diffrn    1.538
_exptl_crystal_description       block
_exptl_crystal_F_000             2756
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.050
_refine_diff_density_max         0.447
_refine_diff_density_min         -0.514
_refine_diff_density_rms         0.086
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.001
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     739
_refine_ls_number_reflns         14291
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.001
_refine_ls_R_factor_all          0.1251
_refine_ls_R_factor_gt           0.0525
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0378P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0935
_refine_ls_wR_factor_ref         0.1150
_reflns_Friedel_coverage         0.000
_reflns_number_gt                7673
_reflns_number_total             14291
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c5dt03046c2.cif
_cod_data_source_block           1
_cod_depositor_comments
'Adding full bibliography for 7036565--7036568.cif.'
_cod_database_code               7036567
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.692
_shelx_estimated_absorpt_t_max   0.952
_shelxl_version_number           2013-4
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Co1 Co 0.47207(4) 0.68626(2) 0.34996(4) 0.02363(12) Uani 1 1 d . .
Co2 Co 0.36598(4) 0.57108(2) 0.42379(4) 0.02400(12) Uani 1 1 d . .
Co3 Co 0.41655(4) 0.63006(2) 0.88552(4) 0.02482(12) Uani 1 1 d . .
P1 P 0.42249(7) 0.64344(2) 0.58187(8) 0.0233(2) Uani 1 1 d . .
P2 P 0.40821(7) 0.61459(2) 0.18808(8) 0.0224(2) Uani 1 1 d . .
C1 C 0.3262(3) 0.67340(9) 0.5381(3) 0.0306(9) Uani 1 1 d . .
H1A H 0.2637 0.6645 0.5632 0.037 Uiso 1 1 calc R U
H1B H 0.3374 0.6952 0.5799 0.037 Uiso 1 1 calc R U
C2 C 0.2527(3) 0.70445(9) 0.3567(3) 0.0308(9) Uani 1 1 d . .
H2A H 0.2731 0.7266 0.3924 0.037 Uiso 1 1 calc R U
C3 C 0.2560(3) 0.70811(10) 0.2178(3) 0.0406(10) Uani 1 1 d . .
H3A H 0.1997 0.7215 0.1899 0.049 Uiso 1 1 calc R U
H3B H 0.2491 0.6854 0.1814 0.049 Uiso 1 1 calc R U
C4 C 0.3468(3) 0.72468(9) 0.1668(3) 0.0306(9) Uani 1 1 d . .
C5 C 0.1508(3) 0.69733(9) 0.4018(3) 0.0315(9) Uani 1 1 d . .
C6 C 0.1105(4) 0.71884(12) 0.4887(4) 0.0549(13) Uani 1 1 d . .
H6A H 0.1441 0.7384 0.5149 0.066 Uiso 1 1 calc R U
C7 C 0.0212(4) 0.71134(18) 0.5364(5) 0.085(2) Uani 1 1 d . .
H7A H -0.0054 0.7259 0.5949 0.102 Uiso 1 1 calc R U
C8 C -0.0290(4) 0.6825(2) 0.4987(6) 0.092(2) Uani 1 1 d . .
H8A H -0.0898 0.6776 0.5306 0.111 Uiso 1 1 calc R U
C9 C 0.0113(4) 0.66093(16) 0.4129(5) 0.0776(18) Uani 1 1 d . .
H9A H -0.0220 0.6412 0.3871 0.093 Uiso 1 1 calc R U
C10 C 0.1006(3) 0.66847(12) 0.3658(4) 0.0513(12) Uani 1 1 d . .
H10A H 0.1276 0.6537 0.3082 0.062 Uiso 1 1 calc R U
C11 C 0.5065(3) 0.58516(9) 0.2270(3) 0.0275(8) Uani 1 1 d . .
H11A H 0.4941 0.5632 0.1872 0.033 Uiso 1 1 calc R U
H11B H 0.5675 0.5941 0.1972 0.033 Uiso 1 1 calc R U
C12 C 0.5871(3) 0.55465(9) 0.4030(3) 0.0285(9) Uani 1 1 d . .
H12A H 0.5656 0.5325 0.3684 0.034 Uiso 1 1 calc R U
C13 C 0.5893(3) 0.55119(9) 0.5450(3) 0.0318(9) Uani 1 1 d . .
H13A H 0.6470 0.5381 0.5699 0.038 Uiso 1 1 calc R U
H13B H 0.5966 0.5740 0.5806 0.038 Uiso 1 1 calc R U
C14 C 0.5011(3) 0.53422(9) 0.6017(3) 0.0288(9) Uani 1 1 d . .
C15 C 0.6894(3) 0.56132(10) 0.3580(3) 0.0338(9) Uani 1 1 d . .
C16 C 0.7249(3) 0.59425(11) 0.3385(4) 0.0453(11) Uani 1 1 d . .
H16A H 0.6856 0.6131 0.3545 0.054 Uiso 1 1 calc R U
C17 C 0.8179(3) 0.59930(14) 0.2956(4) 0.0592(14) Uani 1 1 d . .
H17A H 0.8404 0.6215 0.2822 0.071 Uiso 1 1 calc R U
C18 C 0.8770(4) 0.57187(17) 0.2726(4) 0.0681(16) Uani 1 1 d . .
H18A H 0.9396 0.5753 0.2439 0.082 Uiso 1 1 calc R U
C19 C 0.8433(4) 0.53919(15) 0.2924(5) 0.0698(16) Uani 1 1 d . .
H19A H 0.8834 0.5205 0.2772 0.084 Uiso 1 1 calc R U
C20 C 0.7500(3) 0.53385(11) 0.3346(4) 0.0480(12) Uani 1 1 d . .
H20A H 0.7280 0.5116 0.3474 0.058 Uiso 1 1 calc R U
C21 C -0.3612(3) 0.71037(9) 1.1957(3) 0.0355(10) Uani 1 1 d . .
H21A H -0.4060 0.7158 1.1320 0.043 Uiso 1 1 calc R U
C22 C -0.2981(3) 0.69061(10) 1.3641(4) 0.0406(10) Uani 1 1 d . .
H22A H -0.2910 0.6798 1.4408 0.049 Uiso 1 1 calc R U
C23 C -0.2251(3) 0.70554(10) 1.3019(4) 0.0458(11) Uani 1 1 d . .
H23A H -0.1595 0.7068 1.3269 0.055 Uiso 1 1 calc R U
C24 C -0.2179(3) 0.73663(10) 1.0953(4) 0.0525(13) Uani 1 1 d . .
H24A H -0.1659 0.7508 1.1312 0.063 Uiso 1 1 calc R U
H24B H -0.2645 0.7517 1.0531 0.063 Uiso 1 1 calc R U
C25 C -0.1756(3) 0.71245(10) 1.0022(4) 0.0397(10) Uani 1 1 d . .
C26 C -0.2192(3) 0.70828(12) 0.8868(4) 0.0519(12) Uani 1 1 d . .
H26A H -0.2746 0.7210 0.8648 0.062 Uiso 1 1 calc R U
C27 C -0.1820(4) 0.68556(13) 0.8038(5) 0.0647(15) Uani 1 1 d . .
H27A H -0.2114 0.6832 0.7252 0.078 Uiso 1 1 calc R U
C28 C -0.1016(4) 0.66619(12) 0.8357(5) 0.0617(14) Uani 1 1 d . .
H28A H -0.0771 0.6507 0.7788 0.074 Uiso 1 1 calc R U
C29 C -0.0569(3) 0.66948(12) 0.9506(4) 0.0501(12) Uani 1 1 d . .
C30 C -0.0938(3) 0.69305(11) 1.0335(4) 0.0450(11) Uani 1 1 d . .
H30A H -0.0631 0.6959 1.1112 0.054 Uiso 1 1 calc R U
C31 C 0.0275(4) 0.64656(14) 0.9885(5) 0.0778(18) Uani 1 1 d . .
H31A H 0.0394 0.6484 1.0776 0.093 Uiso 1 1 calc R U
H31B H 0.0102 0.6229 0.9701 0.093 Uiso 1 1 calc R U
C32 C 0.1971(3) 0.63521(11) 0.9251(4) 0.0491(12) Uani 1 1 d . .
H32A H 0.2000 0.6133 0.9597 0.059 Uiso 1 1 calc R U
C33 C 0.2367(3) 0.68172(11) 0.8373(4) 0.0473(12) Uani 1 1 d . .
H33A H 0.2732 0.6984 0.7977 0.057 Uiso 1 1 calc R U
C34 C 0.1436(4) 0.68553(11) 0.8694(4) 0.0582(14) Uani 1 1 d . .
H34A H 0.1045 0.7048 0.8567 0.070 Uiso 1 1 calc R U
C35 C 0.5984(3) 0.58134(10) 0.8901(3) 0.0364(10) Uani 1 1 d . .
H35A H 0.5619 0.5636 0.8542 0.044 Uiso 1 1 calc R U
C36 C 0.6407(3) 0.62931(11) 0.9660(4) 0.0467(11) Uani 1 1 d . .
H36A H 0.6388 0.6519 0.9938 0.056 Uiso 1 1 calc R U
C37 C 0.7204(3) 0.60926(11) 0.9720(4) 0.0509(12) Uani 1 1 d . .
H37A H 0.7822 0.6152 1.0030 0.061 Uiso 1 1 calc R U
C38 C 0.7503(3) 0.54697(11) 0.9162(5) 0.0595(14) Uani 1 1 d . .
H38A H 0.7183 0.5316 0.8570 0.071 Uiso 1 1 calc R U
H38B H 0.7513 0.5358 0.9968 0.071 Uiso 1 1 calc R U
C39 C 0.8542(3) 0.55253(10) 0.8782(4) 0.0441(11) Uani 1 1 d . .
C40 C 0.9293(4) 0.54141(12) 0.9545(4) 0.0568(13) Uani 1 1 d . .
H40A H 0.9157 0.5312 1.0302 0.068 Uiso 1 1 calc R U
C41 C 1.0255(4) 0.54519(13) 0.9203(4) 0.0671(15) Uani 1 1 d . .
H41A H 1.0762 0.5376 0.9727 0.080 Uiso 1 1 calc R U
C42 C 1.0458(3) 0.56035(12) 0.8080(5) 0.0555(13) Uani 1 1 d . .
H42A H 1.1102 0.5628 0.7845 0.067 Uiso 1 1 calc R U
C43 C 0.9708(3) 0.57191(11) 0.7306(4) 0.0462(11) Uani 1 1 d . .
C44 C 0.8752(3) 0.56790(10) 0.7661(4) 0.0452(11) Uani 1 1 d . .
H44A H 0.8243 0.5756 0.7140 0.054 Uiso 1 1 calc R U
C45 C 0.9932(3) 0.59034(12) 0.6102(4) 0.0619(15) Uani 1 1 d . .
H45A H 0.9348 0.5908 0.5570 0.074 Uiso 1 1 calc R U
H45B H 1.0116 0.6139 0.6288 0.074 Uiso 1 1 calc R U
C46 C 1.1644(3) 0.58489(10) 0.5354(4) 0.0431(11) Uani 1 1 d . .
H46A H 1.1871 0.6055 0.5690 0.052 Uiso 1 1 calc R U
C47 C 1.1577(3) 0.53668(10) 0.4438(4) 0.0459(11) Uani 1 1 d . .
H47A H 1.1757 0.5172 0.4002 0.055 Uiso 1 1 calc R U
C48 C 1.0673(3) 0.54283(12) 0.4862(4) 0.0558(13) Uani 1 1 d . .
H48A H 1.0128 0.5287 0.4774 0.067 Uiso 1 1 calc R U
N1 N 0.3243(2) 0.67861(7) 0.4027(2) 0.0254(7) Uani 1 1 d . .
H1C H 0.3037 0.6567 0.3658 0.031 Uiso 1 1 calc R U
N2 N 0.5142(2) 0.58052(7) 0.3634(2) 0.0249(7) Uani 1 1 d . .
H2B H 0.5353 0.6025 0.3992 0.030 Uiso 1 1 calc R U
N3 N -0.3833(2) 0.69385(7) 1.2974(3) 0.0289(7) Uani 1 1 d . .
N4 N 0.2703(2) 0.65003(8) 0.8708(3) 0.0369(8) Uani 1 1 d . .
N5 N 0.5627(2) 0.61217(8) 0.9138(3) 0.0301(7) Uani 1 1 d . .
N6 N 1.2189(2) 0.56343(8) 0.4743(3) 0.0332(8) Uani 1 1 d . .
N7 N -0.2667(3) 0.71839(8) 1.1953(3) 0.0375(8) Uani 1 1 d . .
N8 N 0.1176(3) 0.65529(9) 0.9248(3) 0.0484(10) Uani 1 1 d . .
N9 N 0.6926(2) 0.57863(8) 0.9236(3) 0.0375(8) Uani 1 1 d . .
N10 N 1.0720(2) 0.57372(9) 0.5441(3) 0.0461(9) Uani 1 1 d . .
O1 O 0.38190(18) 0.60722(5) 0.56503(19) 0.0282(6) Uani 1 1 d . .
O2 O 0.45137(18) 0.65084(6) 0.71644(19) 0.0293(6) Uani 1 1 d . .
O3 O 0.50535(17) 0.65107(6) 0.49344(19) 0.0254(6) Uani 1 1 d . .
O4 O 0.4240(2) 0.72618(6) 0.2334(2) 0.0347(6) Uani 1 1 d . .
O5 O 0.3399(2) 0.73524(7) 0.0569(2) 0.0445(7) Uani 1 1 d . .
O6 O 0.44681(18) 0.65106(6) 0.2057(2) 0.0290(6) Uani 1 1 d . .
O7 O 0.32814(17) 0.60573(6) 0.27891(19) 0.0255(6) Uani 1 1 d . .
O8 O 0.37703(18) 0.60779(6) 0.05365(19) 0.0265(6) Uani 1 1 d . .
O9 O 0.4194(2) 0.53406(6) 0.5473(2) 0.0340(6) Uani 1 1 d . .
O10 O 0.5171(2) 0.52050(6) 0.7070(2) 0.0378(7) Uani 1 1 d . .
O1W O 0.5015(2) 0.72791(6) 0.4828(2) 0.0391(7) Uani 1 1 d . .
H1WA H 0.4620 0.7443 0.4674 0.047 Uiso 1 1 d R U
H1WB H 0.4935 0.7206 0.5562 0.047 Uiso 1 1 d R U
O2W O 0.34231(19) 0.52916(6) 0.2921(2) 0.0367(7) Uani 1 1 d . .
H2WA H 0.3592 0.5088 0.3114 0.044 Uiso 1 1 d R U
H2WB H 0.2887 0.5280 0.2504 0.044 Uiso 1 1 d R U
O3W O 0.46305(19) 0.67702(6) 0.9779(2) 0.0342(7) Uani 1 1 d . .
H3WA H 0.4939 0.6684 1.0402 0.041 Uiso 1 1 d R U
H3WB H 0.4290 0.6936 1.0040 0.041 Uiso 1 1 d R U
O4W O 0.3629(2) 0.58321(6) 0.7958(2) 0.0400(7) Uani 1 1 d . .
H4WA H 0.4101 0.5728 0.7629 0.060 Uiso 1 1 d R U
H4WB H 0.3203 0.5884 0.7398 0.060 Uiso 1 1 d R U
O5W O 0.5604(2) 0.71286(7) 0.7268(3) 0.0532(8) Uani 1 1 d . .
H5WA H 0.5319 0.6949 0.7519 0.064 Uiso 1 1 d R U
H5WB H 0.5530 0.7285 0.7810 0.064 Uiso 1 1 d R U
O6W O 0.6831(3) 0.63498(9) 0.6291(3) 0.0797(11) Uani 1 1 d . .
H6WA H 0.6295 0.6416 0.5950 0.096 Uiso 1 1 d R U
H6WB H 0.6715 0.6236 0.6945 0.096 Uiso 1 1 d R U
O7W O 0.2869(2) 0.54395(7) 0.0466(3) 0.0584(9) Uani 1 1 d . .
H7WA H 0.2928 0.5657 0.0479 0.070 Uiso 1 1 d R U
H7WB H 0.2786 0.5372 -0.0281 0.070 Uiso 1 1 d R U
O8W O 0.5834(3) 0.49649(10) 0.0916(4) 0.1159(17) Uani 1 1 d . .
H8WA H 0.5680 0.5031 0.1637 0.139 Uiso 1 1 d R U
H8WB H 0.5660 0.5116 0.0385 0.139 Uiso 1 1 d R U
O9W O 0.1363(2) 0.59145(9) 0.1892(3) 0.0814(11) Uani 1 1 d . .
H9WA H 0.1521 0.5882 0.2653 0.098 Uiso 1 1 d R U
H9WB H 0.1713 0.6074 0.1600 0.098 Uiso 1 1 d R U
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'
P P 0.1023 0.0942 '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
O4 Co1 O6 89.96(10) . .
O4 Co1 N3 90.89(11) . 1_654
O6 Co1 N3 91.57(10) . 1_654
O4 Co1 O3 168.98(9) . .
O6 Co1 O3 98.37(9) . .
N3 Co1 O3 96.04(11) 1_654 .
O4 Co1 N1 88.86(10) . .
O6 Co1 N1 88.29(10) . .
N3 Co1 N1 179.72(13) 1_654 .
O3 Co1 N1 84.22(10) . .
O4 Co1 O1W 83.68(10) . .
O6 Co1 O1W 172.81(9) . .
N3 Co1 O1W 85.19(10) 1_654 .
O3 Co1 O1W 88.36(9) . .
N1 Co1 O1W 94.92(10) . .
O1 Co2 O9 88.54(10) . .
O1 Co2 O7 97.22(9) . .
O9 Co2 O7 170.96(9) . .
O1 Co2 N6 89.21(11) . 1_455
O9 Co2 N6 93.25(11) . 1_455
O7 Co2 N6 93.78(10) . 1_455
O1 Co2 O2W 173.24(9) . .
O9 Co2 O2W 86.51(10) . .
O7 Co2 O2W 88.27(9) . .
N6 Co2 O2W 86.48(11) 1_455 .
O1 Co2 N2 91.54(10) . .
O9 Co2 N2 89.74(10) . .
O7 Co2 N2 83.18(9) . .
N6 Co2 N2 176.94(11) 1_455 .
O2W Co2 N2 93.04(10) . .
O2 Co3 O8 177.77(10) . 1_556
O2 Co3 N5 90.71(10) . .
O8 Co3 N5 90.46(10) 1_556 .
O2 Co3 N4 91.92(11) . .
O8 Co3 N4 87.03(11) 1_556 .
N5 Co3 N4 175.54(12) . .
O2 Co3 O3W 90.09(9) . .
O8 Co3 O3W 91.86(8) 1_556 .
N5 Co3 O3W 87.06(11) . .
N4 Co3 O3W 89.34(11) . .
O2 Co3 O4W 91.19(9) . .
O8 Co3 O4W 86.81(9) 1_556 .
N5 Co3 O4W 95.28(11) . .
N4 Co3 O4W 88.26(12) . .
O3W Co3 O4W 177.31(10) . .
O2 P1 O1 111.86(13) . .
O2 P1 O3 112.36(14) . .
O1 P1 O3 112.31(12) . .
O2 P1 C1 106.99(15) . .
O1 P1 C1 107.74(17) . .
O3 P1 C1 105.10(14) . .
O8 P2 O6 111.52(13) . .
O8 P2 O7 112.56(14) . .
O6 P2 O7 112.50(13) . .
O8 P2 C11 107.20(14) . .
O6 P2 C11 107.98(16) . .
O7 P2 C11 104.59(14) . .
N1 C1 P1 109.7(2) . .
N1 C1 H1A 109.7 . .
P1 C1 H1A 109.7 . .
N1 C1 H1B 109.7 . .
P1 C1 H1B 109.7 . .
H1A C1 H1B 108.2 . .
N1 C2 C3 110.9(3) . .
N1 C2 C5 112.1(3) . .
C3 C2 C5 113.1(3) . .
N1 C2 H2A 106.8 . .
C3 C2 H2A 106.8 . .
C5 C2 H2A 106.8 . .
C2 C3 C4 116.8(3) . .
C2 C3 H3A 108.1 . .
C4 C3 H3A 108.1 . .
C2 C3 H3B 108.1 . .
C4 C3 H3B 108.1 . .
H3A C3 H3B 107.3 . .
O5 C4 O4 124.0(4) . .
O5 C4 C3 116.3(4) . .
O4 C4 C3 119.7(3) . .
C10 C5 C6 118.9(4) . .
C10 C5 C2 121.2(4) . .
C6 C5 C2 119.7(4) . .
C7 C6 C5 120.2(5) . .
C7 C6 H6A 119.9 . .
C5 C6 H6A 119.9 . .
C8 C7 C6 120.5(5) . .
C8 C7 H7A 119.7 . .
C6 C7 H7A 119.7 . .
C7 C8 C9 119.3(5) . .
C7 C8 H8A 120.3 . .
C9 C8 H8A 120.3 . .
C10 C9 C8 119.9(6) . .
C10 C9 H9A 120.0 . .
C8 C9 H9A 120.0 . .
C5 C10 C9 121.1(5) . .
C5 C10 H10A 119.4 . .
C9 C10 H10A 119.4 . .
N2 C11 P2 109.7(2) . .
N2 C11 H11A 109.7 . .
P2 C11 H11A 109.7 . .
N2 C11 H11B 109.7 . .
P2 C11 H11B 109.7 . .
H11A C11 H11B 108.2 . .
N2 C12 C15 114.5(3) . .
N2 C12 C13 110.0(3) . .
C15 C12 C13 110.0(3) . .
N2 C12 H12A 107.3 . .
C15 C12 H12A 107.3 . .
C13 C12 H12A 107.3 . .
C14 C13 C12 116.5(3) . .
C14 C13 H13A 108.2 . .
C12 C13 H13A 108.2 . .
C14 C13 H13B 108.2 . .
C12 C13 H13B 108.2 . .
H13A C13 H13B 107.3 . .
O9 C14 O10 123.2(3) . .
O9 C14 C13 121.7(3) . .
O10 C14 C13 115.1(4) . .
C20 C15 C16 118.1(4) . .
C20 C15 C12 119.4(4) . .
C16 C15 C12 122.5(3) . .
C17 C16 C15 120.8(4) . .
C17 C16 H16A 119.6 . .
C15 C16 H16A 119.6 . .
C18 C17 C16 120.4(5) . .
C18 C17 H17A 119.8 . .
C16 C17 H17A 119.8 . .
C17 C18 C19 119.5(5) . .
C17 C18 H18A 120.2 . .
C19 C18 H18A 120.2 . .
C18 C19 C20 120.5(5) . .
C18 C19 H19A 119.7 . .
C20 C19 H19A 119.7 . .
C15 C20 C19 120.6(4) . .
C15 C20 H20A 119.7 . .
C19 C20 H20A 119.7 . .
N3 C21 N7 111.5(4) . .
N3 C21 H21A 124.3 . .
N7 C21 H21A 124.3 . .
C23 C22 N3 109.6(4) . .
C23 C22 H22A 125.2 . .
N3 C22 H22A 125.2 . .
C22 C23 N7 106.2(4) . .
C22 C23 H23A 126.9 . .
N7 C23 H23A 126.9 . .
N7 C24 C25 112.3(3) . .
N7 C24 H24A 109.1 . .
C25 C24 H24A 109.1 . .
N7 C24 H24B 109.1 . .
C25 C24 H24B 109.1 . .
H24A C24 H24B 107.9 . .
C26 C25 C30 118.9(4) . .
C26 C25 C24 120.8(4) . .
C30 C25 C24 120.3(4) . .
C27 C26 C25 120.5(5) . .
C27 C26 H26A 119.8 . .
C25 C26 H26A 119.8 . .
C26 C27 C28 120.4(5) . .
C26 C27 H27A 119.8 . .
C28 C27 H27A 119.8 . .
C29 C28 C27 120.6(4) . .
C29 C28 H28A 119.7 . .
C27 C28 H28A 119.7 . .
C28 C29 C30 118.8(4) . .
C28 C29 C31 120.5(4) . .
C30 C29 C31 120.6(5) . .
C25 C30 C29 120.8(4) . .
C25 C30 H30A 119.6 . .
C29 C30 H30A 119.6 . .
N8 C31 C29 112.6(4) . .
N8 C31 H31A 109.1 . .
C29 C31 H31A 109.1 . .
N8 C31 H31B 109.1 . .
C29 C31 H31B 109.1 . .
H31A C31 H31B 107.8 . .
N4 C32 N8 112.0(4) . .
N4 C32 H32A 124.0 . .
N8 C32 H32A 124.0 . .
C34 C33 N4 110.4(4) . .
C34 C33 H33A 124.8 . .
N4 C33 H33A 124.8 . .
C33 C34 N8 106.2(4) . .
C33 C34 H34A 126.9 . .
N8 C34 H34A 126.9 . .
N5 C35 N9 112.3(4) . .
N5 C35 H35A 123.9 . .
N9 C35 H35A 123.9 . .
C37 C36 N5 111.1(4) . .
C37 C36 H36A 124.5 . .
N5 C36 H36A 124.5 . .
C36 C37 N9 106.0(4) . .
C36 C37 H37A 127.0 . .
N9 C37 H37A 127.0 . .
N9 C38 C39 114.1(3) . .
N9 C38 H38A 108.7 . .
C39 C38 H38A 108.7 . .
N9 C38 H38B 108.7 . .
C39 C38 H38B 108.7 . .
H38A C38 H38B 107.6 . .
C40 C39 C44 119.3(4) . .
C40 C39 C38 119.3(4) . .
C44 C39 C38 121.4(4) . .
C39 C40 C41 120.6(4) . .
C39 C40 H40A 119.7 . .
C41 C40 H40A 119.7 . .
C42 C41 C40 119.8(5) . .
C42 C41 H41A 120.1 . .
C40 C41 H41A 120.1 . .
C43 C42 C41 120.2(4) . .
C43 C42 H42A 119.9 . .
C41 C42 H42A 119.9 . .
C42 C43 C44 119.4(4) . .
C42 C43 C45 120.2(4) . .
C44 C43 C45 120.4(4) . .
C43 C44 C39 120.8(4) . .
C43 C44 H44A 119.6 . .
C39 C44 H44A 119.6 . .
N10 C45 C43 112.2(3) . .
N10 C45 H45A 109.2 . .
C43 C45 H45A 109.2 . .
N10 C45 H45B 109.2 . .
C43 C45 H45B 109.2 . .
H45A C45 H45B 107.9 . .
N6 C46 N10 112.4(4) . .
N6 C46 H46A 123.8 . .
N10 C46 H46A 123.8 . .
C48 C47 N6 110.1(4) . .
C48 C47 H47A 125.0 . .
N6 C47 H47A 125.0 . .
C47 C48 N10 106.3(4) . .
C47 C48 H48A 126.8 . .
N10 C48 H48A 126.8 . .
C1 N1 C2 114.6(3) . .
C1 N1 Co1 107.2(2) . .
C2 N1 Co1 116.0(2) . .
C1 N1 H1C 106.1 . .
C2 N1 H1C 106.1 . .
Co1 N1 H1C 106.1 . .
C12 N2 C11 113.4(2) . .
C12 N2 Co2 115.3(2) . .
C11 N2 Co2 106.2(2) . .
C12 N2 H2B 107.2 . .
C11 N2 H2B 107.2 . .
Co2 N2 H2B 107.2 . .
C21 N3 C22 105.7(3) . .
C21 N3 Co1 122.5(3) . 1_456
C22 N3 Co1 130.4(2) . 1_456
C32 N4 C33 105.1(3) . .
C32 N4 Co3 122.1(3) . .
C33 N4 Co3 130.9(3) . .
C35 N5 C36 103.6(3) . .
C35 N5 Co3 128.2(3) . .
C36 N5 Co3 128.1(3) . .
C46 N6 C47 104.6(3) . .
C46 N6 Co2 126.8(3) . 1_655
C47 N6 Co2 128.5(3) . 1_655
C21 N7 C23 107.1(3) . .
C21 N7 C24 125.5(4) . .
C23 N7 C24 127.4(4) . .
C32 N8 C34 106.2(4) . .
C32 N8 C31 123.9(4) . .
C34 N8 C31 129.4(4) . .
C35 N9 C37 107.1(3) . .
C35 N9 C38 124.8(4) . .
C37 N9 C38 128.0(4) . .
C46 N10 C48 106.6(3) . .
C46 N10 C45 127.0(4) . .
C48 N10 C45 126.3(4) . .
P1 O1 Co2 137.97(12) . .
P1 O2 Co3 135.07(14) . .
P1 O3 Co1 115.76(13) . .
C4 O4 Co1 123.4(2) . .
P2 O6 Co1 138.67(13) . .
P2 O7 Co2 116.81(13) . .
P2 O8 Co3 132.76(14) . 1_554
C14 O9 Co2 126.2(2) . .
Co1 O1W H1WA 109.0 . .
Co1 O1W H1WB 109.4 . .
H1WA O1W H1WB 109.5 . .
Co2 O2W H2WA 120.4 . .
Co2 O2W H2WB 119.4 . .
H2WA O2W H2WB 107.7 . .
Co3 O3W H3WA 99.2 . .
Co3 O3W H3WB 129.5 . .
H3WA O3W H3WB 107.7 . .
Co3 O4W H4WA 109.5 . .
Co3 O4W H4WB 109.1 . .
H4WA O4W H4WB 109.5 . .
H5WA O5W H5WB 107.7 . .
H6WA O6W H6WB 109.5 . .
H7WA O7W H7WB 109.5 . .
H8WA O8W H8WB 109.5 . .
H9WA O9W H9WB 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O4 2.091(3) .
Co1 O6 2.092(2) .
Co1 N3 2.098(3) 1_654
Co1 O3 2.104(2) .
Co1 N1 2.139(3) .
Co1 O1W 2.191(2) .
Co2 O1 2.078(2) .
Co2 O9 2.078(3) .
Co2 O7 2.114(2) .
Co2 N6 2.124(3) 1_455
Co2 O2W 2.179(2) .
Co2 N2 2.181(3) .
Co3 O2 2.062(2) .
Co3 O8 2.093(2) 1_556
Co3 N5 2.132(3) .
Co3 N4 2.149(3) .
Co3 O3W 2.167(2) .
Co3 O4W 2.181(3) .
P1 O2 1.518(2) .
P1 O1 1.524(2) .
P1 O3 1.533(2) .
P1 C1 1.812(4) .
P2 O8 1.519(2) .
P2 O6 1.525(2) .
P2 O7 1.531(2) .
P2 C11 1.807(4) .
C1 N1 1.471(4) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
C2 N1 1.479(4) .
C2 C3 1.504(5) .
C2 C5 1.517(5) .
C2 H2A 0.9800 .
C3 C4 1.519(5) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 O5 1.253(4) .
C4 O4 1.260(5) .
C5 C10 1.367(5) .
C5 C6 1.382(5) .
C6 C7 1.372(7) .
C6 H6A 0.9300 .
C7 C8 1.371(8) .
C7 H7A 0.9300 .
C8 C9 1.377(8) .
C8 H8A 0.9300 .
C9 C10 1.370(6) .
C9 H9A 0.9300 .
C10 H10A 0.9300 .
C11 N2 1.479(4) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 N2 1.472(4) .
C12 C15 1.519(5) .
C12 C13 1.535(5) .
C12 H12A 0.9800 .
C13 C14 1.521(5) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 O9 1.246(5) .
C14 O10 1.266(4) .
C15 C20 1.381(5) .
C15 C16 1.389(5) .
C16 C17 1.382(5) .
C16 H16A 0.9300 .
C17 C18 1.367(7) .
C17 H17A 0.9300 .
C18 C19 1.372(7) .
C18 H18A 0.9300 .
C19 C20 1.385(6) .
C19 H19A 0.9300 .
C20 H20A 0.9300 .
C21 N3 1.313(4) .
C21 N7 1.331(5) .
C21 H21A 0.9300 .
C22 C23 1.352(5) .
C22 N3 1.357(5) .
C22 H22A 0.9300 .
C23 N7 1.361(5) .
C23 H23A 0.9300 .
C24 N7 1.469(4) .
C24 C25 1.505(5) .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 C26 1.372(6) .
C25 C30 1.384(6) .
C26 C27 1.367(6) .
C26 H26A 0.9300 .
C27 C28 1.369(7) .
C27 H27A 0.9300 .
C28 C29 1.369(6) .
C28 H28A 0.9300 .
C29 C30 1.387(5) .
C29 C31 1.506(6) .
C30 H30A 0.9300 .
C31 N8 1.470(5) .
C31 H31A 0.9700 .
C31 H31B 0.9700 .
C32 N4 1.310(5) .
C32 N8 1.340(5) .
C32 H32A 0.9300 .
C33 C34 1.339(6) .
C33 N4 1.361(5) .
C33 H33A 0.9300 .
C34 N8 1.372(5) .
C34 H34A 0.9300 .
C35 N5 1.323(4) .
C35 N9 1.332(5) .
C35 H35A 0.9300 .
C36 C37 1.342(5) .
C36 N5 1.365(5) .
C36 H36A 0.9300 .
C37 N9 1.351(5) .
C37 H37A 0.9300 .
C38 N9 1.468(5) .
C38 C39 1.508(5) .
C38 H38A 0.9700 .
C38 H38B 0.9700 .
C39 C40 1.366(6) .
C39 C44 1.386(5) .
C40 C41 1.388(6) .
C40 H40A 0.9300 .
C41 C42 1.381(6) .
C41 H41A 0.9300 .
C42 C43 1.377(6) .
C42 H42A 0.9300 .
C43 C44 1.384(5) .
C43 C45 1.521(5) .
C44 H44A 0.9300 .
C45 N10 1.461(5) .
C45 H45A 0.9700 .
C45 H45B 0.9700 .
C46 N6 1.311(4) .
C46 N10 1.344(5) .
C46 H46A 0.9300 .
C47 C48 1.354(6) .
C47 N6 1.370(5) .
C47 H47A 0.9300 .
C48 N10 1.355(5) .
C48 H48A 0.9300 .
N1 H1C 0.9800 .
N2 H2B 0.9800 .
N3 Co1 2.098(3) 1_456
N6 Co2 2.124(3) 1_655
O8 Co3 2.093(2) 1_554
O1W H1WA 0.8503 .
O1W H1WB 0.8500 .
O2W H2WA 0.8498 .
O2W H2WB 0.8501 .
O3W H3WA 0.8501 .
O3W H3WB 0.8499 .
O4W H4WA 0.8497 .
O4W H4WB 0.8500 .
O5W H5WA 0.8499 .
O5W H5WB 0.8502 .
O6W H6WA 0.8500 .
O6W H6WB 0.8500 .
O7W H7WA 0.8498 .
O7W H7WB 0.8501 .
O8W H8WA 0.8499 .
O8W H8WB 0.8502 .
O9W H9WA 0.8501 .
O9W H9WB 0.8499 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O9W H9WA N6 0.85 2.59 3.417(4) 164.9 1_455
O8W H8WA O10 0.85 2.06 2.687(4) 130.1 3_666
O7W H7WB O8W 0.85 2.42 2.831(5) 110.7 3_665
O7W H7WA O8 0.85 2.00 2.775(4) 150.4 .
O6W H6WA O3 0.85 2.03 2.868(4) 170.7 .
O5W H5WB O4 0.85 2.54 3.023(4) 117.1 4_576
O5W H5WA O2 0.85 2.07 2.839(3) 150.7 .
O4W H4WB O1 0.85 2.21 2.675(3) 114.3 .
O4W H4WA O10 0.85 2.59 3.385(4) 156.3 .
O3W H3WB O5 0.85 2.12 2.965(4) 176.1 1_556
O3W H3WA O6 0.85 2.03 2.668(3) 131.3 1_556
O2W H2WB O7W 0.85 2.28 2.788(4) 118.5 .
O2W H2WA O10 0.85 2.06 2.727(4) 135.4 3_666
O1W H1WB O5W 0.85 2.05 2.787(4) 144.6 .
O1W H1WA O5 0.85 2.11 2.775(4) 134.6 4_576
N2 H2B O3 0.98 2.19 3.087(3) 151.7 .
N1 H1C O7 0.98 2.22 3.136(4) 154.5 .
C36 H36A O3W 0.93 2.60 3.066(5) 111.7 .
C35 H35A O10 0.93 2.38 3.255(5) 157.9 .
C12 H12A O10 0.98 2.48 3.448(4) 170.1 3_666
C2 H2A O5 0.98 2.47 3.379(5) 154.9 4_576
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_4
O2 P1 C1 N1 155.2(2) .
O1 P1 C1 N1 -84.4(3) .
O3 P1 C1 N1 35.6(3) .
N1 C2 C3 C4 -69.5(4) .
C5 C2 C3 C4 163.7(3) .
C2 C3 C4 O5 -163.2(3) .
C2 C3 C4 O4 18.9(5) .
N1 C2 C5 C10 -64.9(5) .
C3 C2 C5 C10 61.4(5) .
N1 C2 C5 C6 109.8(4) .
C3 C2 C5 C6 -123.9(4) .
C10 C5 C6 C7 -0.7(7) .
C2 C5 C6 C7 -175.5(4) .
C5 C6 C7 C8 0.0(8) .
C6 C7 C8 C9 0.6(9) .
C7 C8 C9 C10 -0.4(8) .
C6 C5 C10 C9 0.9(6) .
C2 C5 C10 C9 175.6(4) .
C8 C9 C10 C5 -0.3(7) .
O8 P2 C11 N2 -157.9(2) .
O6 P2 C11 N2 81.8(2) .
O7 P2 C11 N2 -38.2(3) .
N2 C12 C13 C14 70.6(4) .
C15 C12 C13 C14 -162.3(3) .
C12 C13 C14 O9 -24.5(5) .
C12 C13 C14 O10 155.5(3) .
N2 C12 C15 C20 -148.9(4) .
C13 C12 C15 C20 86.6(4) .
N2 C12 C15 C16 30.7(5) .
C13 C12 C15 C16 -93.8(4) .
C20 C15 C16 C17 0.7(6) .
C12 C15 C16 C17 -178.9(4) .
C15 C16 C17 C18 -0.6(7) .
C16 C17 C18 C19 0.1(8) .
C17 C18 C19 C20 0.3(8) .
C16 C15 C20 C19 -0.3(6) .
C12 C15 C20 C19 179.3(4) .
C18 C19 C20 C15 -0.2(7) .
N3 C22 C23 N7 0.4(5) .
N7 C24 C25 C26 105.8(5) .
N7 C24 C25 C30 -71.7(5) .
C30 C25 C26 C27 -0.6(6) .
C24 C25 C26 C27 -178.2(4) .
C25 C26 C27 C28 1.2(7) .
C26 C27 C28 C29 -0.5(7) .
C27 C28 C29 C30 -0.8(7) .
C27 C28 C29 C31 176.0(4) .
C26 C25 C30 C29 -0.7(6) .
C24 C25 C30 C29 176.9(4) .
C28 C29 C30 C25 1.4(6) .
C31 C29 C30 C25 -175.4(4) .
C28 C29 C31 N8 72.7(6) .
C30 C29 C31 N8 -110.6(5) .
N4 C33 C34 N8 -0.1(5) .
N5 C36 C37 N9 -0.5(5) .
N9 C38 C39 C40 122.7(5) .
N9 C38 C39 C44 -58.9(6) .
C44 C39 C40 C41 -0.4(7) .
C38 C39 C40 C41 178.0(4) .
C39 C40 C41 C42 0.0(7) .
C40 C41 C42 C43 0.5(7) .
C41 C42 C43 C44 -0.6(7) .
C41 C42 C43 C45 176.7(4) .
C42 C43 C44 C39 0.2(6) .
C45 C43 C44 C39 -177.1(4) .
C40 C39 C44 C43 0.3(6) .
C38 C39 C44 C43 -178.0(4) .
C42 C43 C45 N10 42.8(6) .
C44 C43 C45 N10 -140.0(4) .
N6 C47 C48 N10 -0.1(5) .
P1 C1 N1 C2 -176.1(2) .
P1 C1 N1 Co1 -45.8(3) .
C3 C2 N1 C1 179.9(3) .
C5 C2 N1 C1 -52.7(4) .
C3 C2 N1 Co1 54.1(4) .
C5 C2 N1 Co1 -178.5(2) .
C15 C12 N2 C11 56.2(4) .
C13 C12 N2 C11 -179.3(3) .
C15 C12 N2 Co2 178.9(2) .
C13 C12 N2 Co2 -56.6(3) .
P2 C11 N2 C12 175.1(2) .
P2 C11 N2 Co2 47.5(2) .
N7 C21 N3 C22 -1.2(4) .
N7 C21 N3 Co1 166.5(2) 1_456
C23 C22 N3 C21 0.4(4) .
C23 C22 N3 Co1 -165.9(3) 1_456
N8 C32 N4 C33 1.9(5) .
N8 C32 N4 Co3 167.6(3) .
C34 C33 N4 C32 -1.1(5) .
C34 C33 N4 Co3 -165.0(3) .
N9 C35 N5 C36 -0.4(4) .
N9 C35 N5 Co3 -177.7(2) .
C37 C36 N5 C35 0.5(5) .
C37 C36 N5 Co3 177.8(3) .
N10 C46 N6 C47 -0.9(5) .
N10 C46 N6 Co2 174.9(3) 1_655
C48 C47 N6 C46 0.6(5) .
C48 C47 N6 Co2 -175.1(3) 1_655
N3 C21 N7 C23 1.5(4) .
N3 C21 N7 C24 179.5(3) .
C22 C23 N7 C21 -1.1(4) .
C22 C23 N7 C24 -179.1(3) .
C25 C24 N7 C21 -92.2(5) .
C25 C24 N7 C23 85.4(5) .
N4 C32 N8 C34 -2.0(5) .
N4 C32 N8 C31 -174.5(4) .
C33 C34 N8 C32 1.2(5) .
C33 C34 N8 C31 173.2(5) .
C29 C31 N8 C32 -167.5(4) .
C29 C31 N8 C34 21.8(8) .
N5 C35 N9 C37 0.1(4) .
N5 C35 N9 C38 175.9(3) .
C36 C37 N9 C35 0.3(5) .
C36 C37 N9 C38 -175.4(4) .
C39 C38 N9 C35 142.6(4) .
C39 C38 N9 C37 -42.5(6) .
N6 C46 N10 C48 0.9(5) .
N6 C46 N10 C45 177.1(4) .
C47 C48 N10 C46 -0.4(5) .
C47 C48 N10 C45 -176.7(4) .
C43 C45 N10 C46 -105.7(5) .
C43 C45 N10 C48 69.8(6) .
O2 P1 O1 Co2 -156.3(2) .
O3 P1 O1 Co2 -28.9(3) .
C1 P1 O1 Co2 86.4(2) .
O1 P1 O2 Co3 -20.2(3) .
O3 P1 O2 Co3 -147.58(18) .
C1 P1 O2 Co3 97.6(2) .
O2 P1 O3 Co1 -123.20(14) .
O1 P1 O3 Co1 109.64(15) .
C1 P1 O3 Co1 -7.22(19) .
O5 C4 O4 Co1 -138.2(3) .
C3 C4 O4 Co1 39.5(5) .
O8 P2 O6 Co1 161.0(2) .
O7 P2 O6 Co1 33.5(3) .
C11 P2 O6 Co1 -81.4(2) .
O8 P2 O7 Co2 125.08(14) .
O6 P2 O7 Co2 -107.91(15) .
C11 P2 O7 Co2 9.03(19) .
O6 P2 O8 Co3 23.8(2) 1_554
O7 P2 O8 Co3 151.30(17) 1_554
C11 P2 O8 Co3 -94.2(2) 1_554
O10 C14 O9 Co2 150.9(3) .
C13 C14 O9 Co2 -29.1(5) .
