# Electronic Supplementary Material (ESI) for CrystEngComm.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_p21c
_database_code_depnum_ccdc_archive 'CCDC 1570978'
_audit_update_record             
;
2017-08-26 deposited with the CCDC.
2018-10-01 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C30 H30 Co8 N10 O10'
_chemical_formula_weight         1162.08

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'

_symmetry_cell_setting           ?
_symmetry_space_group_name_H-M   ?

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   9.711(4)
_cell_length_b                   16.824(7)
_cell_length_c                   26.957(11)
_cell_angle_alpha                90.00
_cell_angle_beta                 96.816(7)
_cell_angle_gamma                90.00
_cell_volume                     4373(3)
_cell_formula_units_Z            5
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       ?
_exptl_crystal_colour            ?
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.206
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2880
_exptl_absorpt_coefficient_mu    3.769
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            30011
_diffrn_reflns_av_R_equivalents  0.2139
_diffrn_reflns_av_sigmaI/netI    0.1564
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_theta_min         1.43
_diffrn_reflns_theta_max         27.59
_reflns_number_total             9813
_reflns_number_gt                5049
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.2000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         9813
_refine_ls_number_parameters     443
_refine_ls_number_restraints     5
_refine_ls_R_factor_all          0.1735
_refine_ls_R_factor_gt           0.1248
_refine_ls_wR_factor_ref         0.3633
_refine_ls_wR_factor_gt          0.3220
_refine_ls_goodness_of_fit_ref   1.065
_refine_ls_restrained_S_all      1.074
_refine_ls_shift/su_max          0.957
_refine_ls_shift/su_mean         0.060

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
Co1 Co 0.04207(7) 0.10021(4) 0.74127(3) 0.0438(3) Uani 1 1 d . . .
C1 C 1.4852(8) -0.1588(5) 0.8923(3) 0.090(2) Uani 1 1 d . . .
C2 C 1.3702(7) -0.1066(4) 0.9020(2) 0.0600(15) Uani 1 1 d . . .
C3 C 1.3827(6) -0.0583(4) 0.9453(2) 0.0636(17) Uani 1 1 d . . .
H3 H 1.4641 -0.0593 0.9673 0.076 Uiso 1 1 calc R . .
C4 C 1.2769(6) -0.0106(4) 0.9548(2) 0.0555(14) Uani 1 1 d . . .
H4 H 1.2866 0.0213 0.9832 0.067 Uiso 1 1 calc R . .
C5 C 1.1531(5) -0.0084(3) 0.92258(19) 0.0474(12) Uani 1 1 d . . .
C6 C 1.1413(6) -0.0569(4) 0.8802(2) 0.0563(15) Uani 1 1 d . . .
H6 H 1.0599 -0.0565 0.8582 0.068 Uiso 1 1 calc R . .
C7 C 1.2482(7) -0.1046(4) 0.8709(2) 0.0626(16) Uani 1 1 d . . .
H7 H 1.2382 -0.1367 0.8427 0.075 Uiso 1 1 calc R . .
C8 C 1.0349(5) 0.0402(3) 0.93352(18) 0.0453(12) Uani 1 1 d . . .
C9 C 0.9431(5) 0.1313(3) 0.98147(18) 0.0469(12) Uani 1 1 d . . .
C10 C 0.9574(6) 0.1847(4) 1.02530(19) 0.0505(13) Uani 1 1 d . . .
C11 C 0.8497(7) 0.2352(4) 1.0337(2) 0.0645(17) Uani 1 1 d . . .
H11 H 0.7696 0.2368 1.0110 0.077 Uiso 1 1 calc R . .
C12 C 0.8609(8) 0.2835(4) 1.0758(2) 0.0680(18) Uani 1 1 d . . .
H12 H 0.7884 0.3173 1.0812 0.082 Uiso 1 1 calc R . .
C13 C 0.9810(6) 0.2815(3) 1.1100(2) 0.0537(14) Uani 1 1 d . . .
C14 C 1.0875(6) 0.2312(4) 1.1015(2) 0.0655(17) Uani 1 1 d . . .
H14 H 1.1676 0.2299 1.1241 0.079 Uiso 1 1 calc R . .
C15 C 1.0775(6) 0.1819(4) 1.0594(2) 0.0608(16) Uani 1 1 d . . .
H15 H 1.1497 0.1477 1.0543 0.073 Uiso 1 1 calc R . .
C16 C 0.9921(7) 0.3313(3) 1.1558(2) 0.0554(14) Uani 1 1 d . . .
C17 C 0.8111(5) 0.0779(3) 0.91538(18) 0.0449(12) Uani 1 1 d . . .
C18 C 0.6772(5) 0.0731(3) 0.88257(18) 0.0458(12) Uani 1 1 d . . .
C19 C 0.5595(6) 0.1088(4) 0.8960(2) 0.0570(15) Uani 1 1 d . . .
H19 H 0.5635 0.1354 0.9264 0.068 Uiso 1 1 calc R . .
C20 C 0.4376(6) 0.1058(4) 0.8656(2) 0.0577(15) Uani 1 1 d . . .
H20 H 0.3592 0.1293 0.8760 0.069 Uiso 1 1 calc R . .
C21 C 0.4276(5) 0.0686(3) 0.81952(19) 0.0494(13) Uani 1 1 d . . .
C22 C 0.5463(7) 0.0330(5) 0.8062(2) 0.076(2) Uani 1 1 d . . .
H22 H 0.5432 0.0072 0.7756 0.091 Uiso 1 1 calc R . .
C23 C 0.6681(7) 0.0351(5) 0.8374(2) 0.073(2) Uani 1 1 d . . .
H23 H 0.7462 0.0104 0.8277 0.087 Uiso 1 1 calc R . .
C24 C 0.2951(6) 0.0715(4) 0.7845(2) 0.0554(15) Uani 1 1 d . . .
C25 C 0.0382(7) -0.0802(4) 0.7513(3) 0.0680(18) Uani 1 1 d . . .
H25 H 0.1330 -0.0839 0.7613 0.082 Uiso 1 1 calc R . .
C26 C -0.1609(8) -0.0318(4) 0.7251(4) 0.091(3) Uani 1 1 d . . .
H26 H -0.2321 0.0029 0.7135 0.110 Uiso 1 1 calc R . .
C27 C -0.0516(8) -0.1426(4) 0.7477(3) 0.079(2) Uani 1 1 d . . .
H27 H -0.0305 -0.1955 0.7551 0.095 Uiso 1 1 calc R . .
C28 C -0.310(3) -0.1595(11) 0.7043(7) 0.268(15) Uani 1 1 d D . .
C29 C -0.2071(8) 0.2060(5) 0.7565(3) 0.085(2) Uani 1 1 d . . .
H29 H -0.2493 0.1981 0.7240 0.102 Uiso 1 1 calc R . .
C30 C -0.0694(8) 0.1966(4) 0.8224(3) 0.0725(18) Uani 1 1 d . . .
H30 H 0.0065 0.1831 0.8452 0.087 Uiso 1 1 calc R . .
C31 C -0.1733(11) 0.2459(6) 0.8314(4) 0.101(3) Uani 1 1 d . . .
H31 H -0.1854 0.2695 0.8618 0.122 Uiso 1 1 calc R . .
C32 C -0.3826(14) 0.3112(7) 0.7756(6) 0.144(4) Uani 1 1 d . . .
C33 C -0.3510(18) -0.1759(13) 0.7475(8) 0.217(9) Uani 1 1 d D . .
C34 C -0.5109(18) 0.2779(11) 0.7893(8) 0.217(9) Uani 1 1 d . . .
N1 N 0.8201(5) 0.1280(3) 0.95302(16) 0.0513(11) Uani 1 1 d . . .
N2 N 1.0530(5) 0.0888(3) 0.97322(16) 0.0506(11) Uani 1 1 d . . .
N3 N 0.9146(4) 0.0313(3) 0.90387(15) 0.0495(11) Uani 1 1 d . . .
N4 N -0.0309(5) -0.0119(3) 0.73806(17) 0.0495(11) Uani 1 1 d . . .
N5 N -0.0933(5) 0.1700(3) 0.7749(2) 0.0605(13) Uani 1 1 d . . .
N6 N -0.2557(8) 0.2543(5) 0.7881(3) 0.108(3) Uani 1 1 d . . .
N7 N -0.1747(8) -0.1131(4) 0.7316(4) 0.114(3) Uani 1 1 d . . .
O1 O 0.1945(4) 0.1092(2) 0.79789(16) 0.0580(11) Uani 1 1 d . . .
O2 O 0.2893(4) 0.0343(3) 0.74308(15) 0.0698(12) Uani 1 1 d . . .
O3 O 1.4566(7) -0.2059(4) 0.8532(3) 0.127(3) Uani 1 1 d . . .
O4 O 1.5917(7) -0.1660(6) 0.9202(4) 0.180(4) Uani 1 1 d . . .
O5 O 1.1006(4) 0.3306(3) 1.18607(15) 0.0627(11) Uani 1 1 d . . .
O6 O 0.8909(5) 0.3742(3) 1.16518(17) 0.0774(14) Uani 1 1 d . . .
O1W O 1.6126(11) -0.3225(7) 0.8308(4) 0.166(3) Uiso 1 1 d D . .
H1WB H 1.682(10) -0.320(11) 0.812(5) 0.249 Uiso 1 1 d D . .
H1WA H 1.545(11) -0.307(10) 0.807(5) 0.249 Uiso 1 1 d D . .


_geom_special_details            
;
 All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell s.u.'s are taken
 into account individually in the estimation of s.u.'s in distances, angles
 and torsion angles; correlations between s.u.'s in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell s.u.'s is used for estimating s.u.'s involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Co1 O1 2.002(4) . ?
Co1 N4 2.013(5) . ?
Co1 O5 2.023(4) 4_465 ?
Co1 N5 2.052(6) . ?
C1 O4 1.211(10) . ?
C1 O3 1.322(10) . ?
C1 C2 1.468(10) . ?
C2 C7 1.369(9) . ?
C2 C3 1.415(9) . ?
C3 C4 1.352(8) . ?
C3 H3 0.9300 . ?
C4 C5 1.397(7) . ?
C4 H4 0.9300 . ?
C5 C6 1.397(7) . ?
C5 C8 1.467(8) . ?
C6 C7 1.358(8) . ?
C6 H6 0.9300 . ?
C7 H7 0.9300 . ?
C8 N2 1.342(6) . ?
C8 N3 1.343(6) . ?
C9 N2 1.326(7) . ?
C9 N1 1.342(6) . ?
C9 C10 1.477(7) . ?
C10 C11 1.387(8) . ?
C10 C15 1.398(7) . ?
C11 C12 1.390(8) . ?
C11 H11 0.9300 . ?
C12 C13 1.398(8) . ?
C12 H12 0.9300 . ?
C13 C14 1.377(8) . ?
C13 C16 1.485(8) . ?
C14 C15 1.398(8) . ?
C14 H14 0.9300 . ?
C15 H15 0.9300 . ?
C16 O5 1.255(7) . ?
C16 O6 1.269(7) . ?
C17 N1 1.314(7) . ?
C17 N3 1.340(7) . ?
C17 C18 1.485(6) . ?
C18 C23 1.369(8) . ?
C18 C19 1.377(8) . ?
C19 C20 1.358(7) . ?
C19 H19 0.9300 . ?
C20 C21 1.384(8) . ?
C20 H20 0.9300 . ?
C21 C22 1.383(9) . ?
C21 C24 1.504(7) . ?
C22 C23 1.367(7) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 O1 1.253(7) . ?
C24 O2 1.276(7) . ?
C25 N4 1.358(8) . ?
C25 C27 1.361(10) . ?
C25 H25 0.9300 . ?
C26 N4 1.313(8) . ?
C26 N7 1.388(9) . ?
C26 H26 0.9300 . ?
C27 N7 1.319(10) . ?
C27 H27 0.9300 . ?
C28 C33 1.303(16) . ?
C28 N7 1.63(2) . ?
C29 N6 1.306(10) . ?
C29 N5 1.307(8) . ?
C29 H29 0.9300 . ?
C30 N5 1.348(8) . ?
C30 C31 1.351(10) . ?
C30 H30 0.9300 . ?
C31 N6 1.341(12) . ?
C31 H31 0.9300 . ?
C32 C34 1.452(19) . ?
C32 N6 1.565(13) . ?
O5 Co1 2.023(4) 4_666 ?
O1W H1WB 0.89(2) . ?
O1W H1WA 0.90(3) . ?

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
_geom_angle_publ_flag
O1 Co1 N4 109.16(17) . . ?
O1 Co1 O5 105.70(18) . 4_465 ?
N4 Co1 O5 129.48(19) . 4_465 ?
O1 Co1 N5 94.2(2) . . ?
N4 Co1 N5 108.3(2) . . ?
O5 Co1 N5 104.27(19) 4_465 . ?
O4 C1 O3 121.3(8) . . ?
O4 C1 C2 124.0(8) . . ?
O3 C1 C2 114.1(6) . . ?
C7 C2 C3 118.3(6) . . ?
C7 C2 C1 121.8(6) . . ?
C3 C2 C1 119.9(6) . . ?
C4 C3 C2 120.3(5) . . ?
C4 C3 H3 119.9 . . ?
C2 C3 H3 119.8 . . ?
C3 C4 C5 121.0(5) . . ?
C3 C4 H4 119.5 . . ?
C5 C4 H4 119.5 . . ?
C6 C5 C4 118.3(5) . . ?
C6 C5 C8 120.0(4) . . ?
C4 C5 C8 121.7(5) . . ?
C7 C6 C5 120.3(5) . . ?
C7 C6 H6 119.9 . . ?
C5 C6 H6 119.8 . . ?
C6 C7 C2 121.8(6) . . ?
C6 C7 H7 119.1 . . ?
C2 C7 H7 119.1 . . ?
N2 C8 N3 124.4(5) . . ?
N2 C8 C5 117.9(4) . . ?
N3 C8 C5 117.6(4) . . ?
N2 C9 N1 124.2(5) . . ?
N2 C9 C10 117.5(4) . . ?
N1 C9 C10 118.4(5) . . ?
C11 C10 C15 120.0(5) . . ?
C11 C10 C9 120.1(5) . . ?
C15 C10 C9 119.8(5) . . ?
C10 C11 C12 120.2(5) . . ?
C10 C11 H11 119.9 . . ?
C12 C11 H11 119.9 . . ?
C11 C12 C13 120.2(6) . . ?
C11 C12 H12 119.9 . . ?
C13 C12 H12 119.9 . . ?
C14 C13 C12 119.3(5) . . ?
C14 C13 C16 120.2(5) . . ?
C12 C13 C16 120.4(6) . . ?
C13 C14 C15 121.2(5) . . ?
C13 C14 H14 119.4 . . ?
C15 C14 H14 119.4 . . ?
C10 C15 C14 119.1(6) . . ?
C10 C15 H15 120.5 . . ?
C14 C15 H15 120.5 . . ?
O5 C16 O6 119.1(5) . . ?
O5 C16 C13 120.6(6) . . ?
O6 C16 C13 120.4(5) . . ?
N1 C17 N3 124.8(5) . . ?
N1 C17 C18 117.9(5) . . ?
N3 C17 C18 117.3(4) . . ?
C23 C18 C19 118.0(5) . . ?
C23 C18 C17 121.0(5) . . ?
C19 C18 C17 121.0(5) . . ?
C20 C19 C18 121.1(5) . . ?
C20 C19 H19 119.5 . . ?
C18 C19 H19 119.4 . . ?
C19 C20 C21 121.4(6) . . ?
C19 C20 H20 119.3 . . ?
C21 C20 H20 119.3 . . ?
C22 C21 C20 117.2(5) . . ?
C22 C21 C24 121.9(5) . . ?
C20 C21 C24 120.8(5) . . ?
C23 C22 C21 121.1(6) . . ?
C23 C22 H22 119.5 . . ?
C21 C22 H22 119.5 . . ?
C18 C23 C22 121.2(6) . . ?
C18 C23 H23 119.4 . . ?
C22 C23 H23 119.4 . . ?
O1 C24 O2 123.0(5) . . ?
O1 C24 C21 118.3(5) . . ?
O2 C24 C21 118.6(6) . . ?
N4 C25 C27 110.0(6) . . ?
N4 C25 H25 125.0 . . ?
C27 C25 H25 125.0 . . ?
N4 C26 N7 108.8(7) . . ?
N4 C26 H26 125.6 . . ?
N7 C26 H26 125.6 . . ?
N7 C27 C25 106.4(6) . . ?
N7 C27 H27 126.8 . . ?
C25 C27 H27 126.8 . . ?
C33 C28 N7 90.8(14) . . ?
N6 C29 N5 113.2(7) . . ?
N6 C29 H29 123.4 . . ?
N5 C29 H29 123.4 . . ?
N5 C30 C31 109.1(7) . . ?
N5 C30 H30 125.5 . . ?
C31 C30 H30 125.4 . . ?
N6 C31 C30 106.8(8) . . ?
N6 C31 H31 126.6 . . ?
C30 C31 H31 126.6 . . ?
C34 C32 N6 112.8(11) . . ?
C17 N1 C9 116.2(5) . . ?
C9 N2 C8 115.5(4) . . ?
C17 N3 C8 114.8(4) . . ?
C26 N4 C25 106.5(5) . . ?
C26 N4 Co1 125.0(4) . . ?
C25 N4 Co1 128.4(4) . . ?
C29 N5 C30 104.5(6) . . ?
C29 N5 Co1 130.9(5) . . ?
C30 N5 Co1 124.2(4) . . ?
C29 N6 C31 106.2(7) . . ?
C29 N6 C32 125.1(9) . . ?
C31 N6 C32 128.7(9) . . ?
C27 N7 C26 108.3(6) . . ?
C27 N7 C28 128.3(11) . . ?
C26 N7 C28 120.0(10) . . ?
C24 O1 Co1 105.9(3) . . ?
C16 O5 Co1 100.7(4) . 4_666 ?
H1WB O1W H1WA 97(4) . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O4 C1 C2 C7 -175.6(10) . . . . ?
O3 C1 C2 C7 -3.8(12) . . . . ?
O4 C1 C2 C3 2.7(14) . . . . ?
O3 C1 C2 C3 174.5(8) . . . . ?
C7 C2 C3 C4 -1.0(10) . . . . ?
C1 C2 C3 C4 -179.4(7) . . . . ?
C2 C3 C4 C5 0.5(10) . . . . ?
C3 C4 C5 C6 0.0(9) . . . . ?
C3 C4 C5 C8 177.1(6) . . . . ?
C4 C5 C6 C7 0.0(9) . . . . ?
C8 C5 C6 C7 -177.2(6) . . . . ?
C5 C6 C7 C2 -0.5(10) . . . . ?
C3 C2 C7 C6 1.0(10) . . . . ?
C1 C2 C7 C6 179.3(7) . . . . ?
C6 C5 C8 N2 -176.7(5) . . . . ?
C4 C5 C8 N2 6.2(8) . . . . ?
C6 C5 C8 N3 5.1(8) . . . . ?
C4 C5 C8 N3 -172.0(5) . . . . ?
N2 C9 C10 C11 175.0(6) . . . . ?
N1 C9 C10 C11 -5.9(9) . . . . ?
N2 C9 C10 C15 -7.6(8) . . . . ?
N1 C9 C10 C15 171.5(6) . . . . ?
C15 C10 C11 C12 0.4(10) . . . . ?
C9 C10 C11 C12 177.8(6) . . . . ?
C10 C11 C12 C13 0.0(11) . . . . ?
C11 C12 C13 C14 0.0(11) . . . . ?
C11 C12 C13 C16 -178.3(6) . . . . ?
C12 C13 C14 C15 -0.3(11) . . . . ?
C16 C13 C14 C15 178.0(6) . . . . ?
C11 C10 C15 C14 -0.8(10) . . . . ?
C9 C10 C15 C14 -178.1(6) . . . . ?
C13 C14 C15 C10 0.7(11) . . . . ?
C14 C13 C16 O5 3.0(10) . . . . ?
C12 C13 C16 O5 -178.8(6) . . . . ?
C14 C13 C16 O6 -175.8(6) . . . . ?
C12 C13 C16 O6 2.4(10) . . . . ?
N1 C17 C18 C23 166.5(6) . . . . ?
N3 C17 C18 C23 -12.6(9) . . . . ?
N1 C17 C18 C19 -11.5(8) . . . . ?
N3 C17 C18 C19 169.4(5) . . . . ?
C23 C18 C19 C20 0.6(10) . . . . ?
C17 C18 C19 C20 178.7(6) . . . . ?
C18 C19 C20 C21 -1.6(10) . . . . ?
C19 C20 C21 C22 1.4(10) . . . . ?
C19 C20 C21 C24 -175.0(6) . . . . ?
C20 C21 C22 C23 -0.4(11) . . . . ?
C24 C21 C22 C23 176.0(7) . . . . ?
C19 C18 C23 C22 0.4(11) . . . . ?
C17 C18 C23 C22 -177.6(7) . . . . ?
C21 C22 C23 C18 -0.5(13) . . . . ?
C22 C21 C24 O1 -175.5(6) . . . . ?
C20 C21 C24 O1 0.7(8) . . . . ?
C22 C21 C24 O2 5.9(9) . . . . ?
C20 C21 C24 O2 -177.8(6) . . . . ?
N4 C25 C27 N7 1.0(10) . . . . ?
N5 C30 C31 N6 -4.6(10) . . . . ?
N3 C17 N1 C9 -0.2(8) . . . . ?
C18 C17 N1 C9 -179.3(5) . . . . ?
N2 C9 N1 C17 1.1(9) . . . . ?
C10 C9 N1 C17 -177.9(5) . . . . ?
N1 C9 N2 C8 -0.1(8) . . . . ?
C10 C9 N2 C8 179.0(5) . . . . ?
N3 C8 N2 C9 -2.0(8) . . . . ?
C5 C8 N2 C9 -180.0(5) . . . . ?
N1 C17 N3 C8 -1.6(8) . . . . ?
C18 C17 N3 C8 177.5(5) . . . . ?
N2 C8 N3 C17 2.7(8) . . . . ?
C5 C8 N3 C17 -179.3(5) . . . . ?
N7 C26 N4 C25 1.8(10) . . . . ?
N7 C26 N4 Co1 -174.6(6) . . . . ?
C27 C25 N4 C26 -1.7(9) . . . . ?
C27 C25 N4 Co1 174.4(5) . . . . ?
O1 Co1 N4 C26 145.1(6) . . . . ?
O5 Co1 N4 C26 -83.8(7) 4_465 . . . ?
N5 Co1 N4 C26 43.7(7) . . . . ?
O1 Co1 N4 C25 -30.5(6) . . . . ?
O5 Co1 N4 C25 100.6(6) 4_465 . . . ?
N5 Co1 N4 C25 -131.9(6) . . . . ?
N6 C29 N5 C30 1.1(10) . . . . ?
N6 C29 N5 Co1 -171.0(6) . . . . ?
C31 C30 N5 C29 2.2(9) . . . . ?
C31 C30 N5 Co1 175.1(5) . . . . ?
O1 Co1 N5 C29 163.4(7) . . . . ?
N4 Co1 N5 C29 -84.8(7) . . . . ?
O5 Co1 N5 C29 56.0(7) 4_465 . . . ?
O1 Co1 N5 C30 -7.4(5) . . . . ?
N4 Co1 N5 C30 104.4(5) . . . . ?
O5 Co1 N5 C30 -114.8(5) 4_465 . . . ?
N5 C29 N6 C31 -4.0(11) . . . . ?
N5 C29 N6 C32 174.3(9) . . . . ?
C30 C31 N6 C29 5.1(11) . . . . ?
C30 C31 N6 C32 -173.1(10) . . . . ?
C34 C32 N6 C29 97.0(16) . . . . ?
C34 C32 N6 C31 -85.1(16) . . . . ?
C25 C27 N7 C26 0.1(11) . . . . ?
C25 C27 N7 C28 159.2(12) . . . . ?
N4 C26 N7 C27 -1.2(12) . . . . ?
N4 C26 N7 C28 -162.3(13) . . . . ?
C33 C28 N7 C27 89(3) . . . . ?
C33 C28 N7 C26 -114.5(17) . . . . ?
O2 C24 O1 Co1 -2.4(7) . . . . ?
C21 C24 O1 Co1 179.1(4) . . . . ?
N4 Co1 O1 C24 71.2(4) . . . . ?
O5 Co1 O1 C24 -71.6(4) 4_465 . . . ?
N5 Co1 O1 C24 -177.8(4) . . . . ?
O6 C16 O5 Co1 4.2(7) . . . 4_666 ?
C13 C16 O5 Co1 -174.6(5) . . . 4_666 ?

_diffrn_measured_fraction_theta_max 0.967
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.982
_refine_diff_density_max         1.470
_refine_diff_density_min         -1.017
_refine_diff_density_rms         0.208
