# Electronic Supplementary Material (ESI) for Nanoscale.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# 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_1_a
_database_code_depnum_ccdc_archive 'CCDC 2053165'
loop_
_audit_author_name
_audit_author_address
'Xinde Duan'
;Nanjing University
China
;
_audit_update_record             
;
2020-12-30 deposited with the CCDC.	2021-09-27 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C50 H44 Co N4 O22'
_chemical_formula_weight         1111.82

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'
Co Co 0.3494 0.9721 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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.
;

loop_
_space_group_symop_operation_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'

_cell_length_a                   11.7612(6)
_cell_length_b                   13.5991(7)
_cell_length_c                   14.6943(7)
_cell_angle_alpha                90
_cell_angle_beta                 101.831(2)
_cell_angle_gamma                90
_cell_volume                     2300.3(2)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9194
_cell_measurement_temperature    296.15
_cell_measurement_theta_max      27.51
_cell_measurement_theta_min      2.32

_exptl_crystal_description       BLOCK
_exptl_crystal_colour            ?
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.605
_exptl_crystal_F_000             1150
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.240
_exptl_crystal_size_mid          0.160
_exptl_crystal_size_min          0.100
_exptl_absorpt_coefficient_mu    0.470
_shelx_estimated_absorpt_T_min   0.896
_shelx_estimated_absorpt_T_max   0.955
_exptl_absorpt_correction_type   MULTI-SCAN
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.6353
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.0987 before and 0.0491 after correction.
The Ratio of minimum to maximum transmission is 0.8521.
The λ/2 correction factor is 0.00150.
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            19744
_diffrn_reflns_av_unetI/netI     0.0337
_diffrn_reflns_av_R_equivalents  0.0355
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.061
_diffrn_reflns_theta_max         27.547
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             5270
_reflns_number_gt                4384
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0394P)²+1.9545P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         5270
_refine_ls_number_parameters     372
_refine_ls_number_restraints     8
_refine_ls_R_factor_all          0.0495
_refine_ls_R_factor_gt           0.0375
_refine_ls_wR_factor_ref         0.0935
_refine_ls_wR_factor_gt          0.0876
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_restrained_S_all      1.026
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Co1 Co 0.500000 0.500000 0.000000 0.01099(9) Uani 1 2 d S . P . .
O9 O 0.82285(11) 0.04608(9) 0.47471(9) 0.0161(3) Uani 1 1 d . . . . .
O1 O 0.47670(12) 0.50912(10) 0.13913(9) 0.0190(3) Uani 1 1 d . . . . .
O8 O 0.71119(11) 0.05378(10) 0.60431(9) 0.0187(3) Uani 1 1 d D . . . .
O3 O 0.44969(13) 0.64662(10) 0.37044(9) 0.0217(3) Uani 1 1 d D . . . .
O10 O 0.76791(11) 0.14269(10) 0.35043(9) 0.0210(3) Uani 1 1 d . . . . .
O5 O 0.27936(13) 0.51593(10) 0.56035(9) 0.0236(3) Uani 1 1 d D . . . .
O7 O 0.58742(13) 0.06584(12) 0.72781(9) 0.0271(3) Uani 1 1 d D . . . .
N1 N 0.44638(13) 0.64275(11) -0.03184(10) 0.0146(3) Uani 1 1 d . . . . .
O11 O 0.22473(15) 0.64564(12) 0.67685(11) 0.0338(4) Uani 1 1 d D . . . .
O2 O 0.59234(13) 0.59471(12) 0.25020(10) 0.0305(4) Uani 1 1 d D . . . .
O6 O 0.40690(13) 0.11466(13) 0.68555(10) 0.0331(4) Uani 1 1 d . . . . .
O4 O 0.34401(15) 0.65376(11) 0.50657(10) 0.0320(4) Uani 1 1 d . . . . .
N2 N 0.44104(14) 0.80397(11) -0.04299(10) 0.0163(3) Uani 1 1 d . . . . .
C16 C 0.63731(15) 0.11914(12) 0.45128(12) 0.0129(3) Uani 1 1 d . . . . .
C17 C 0.54588(15) 0.16314(12) 0.38984(12) 0.0137(3) Uani 1 1 d . . . . .
H17 H 0.556234 0.179770 0.330685 0.016 Uiso 1 1 calc R U . . .
C8 C 0.50738(16) 0.53477(13) 0.22029(12) 0.0156(4) Uani 1 1 d . . . . .
C20 C 0.49441(16) 0.72564(13) 0.00288(13) 0.0165(4) Uani 1 1 d . . . . .
H20 H 0.557262 0.729562 0.052796 0.020 Uiso 1 1 calc R U . . .
C12 C 0.43936(15) 0.18334(12) 0.41325(12) 0.0132(3) Uani 1 1 d . . . . .
C5 C 0.41908(15) 0.39444(13) 0.28512(12) 0.0146(3) Uani 1 1 d . . . . .
H5A H 0.434882 0.358798 0.235138 0.018 Uiso 1 1 calc R U . . .
C7 C 0.34083(15) 0.40361(13) 0.42133(12) 0.0148(3) Uani 1 1 d . . . . .
H7A H 0.306001 0.373848 0.465642 0.018 Uiso 1 1 calc R U . . .
C6 C 0.36697(15) 0.34638(12) 0.34952(12) 0.0128(3) Uani 1 1 d . . . . .
C15 C 0.62380(15) 0.09547(12) 0.54153(12) 0.0135(3) Uani 1 1 d . . . . .
C19 C 0.75010(15) 0.10121(13) 0.42256(12) 0.0146(3) Uani 1 1 d . . . . .
C23 C 0.47063(16) 0.90446(13) -0.02172(13) 0.0162(4) Uani 1 1 d . . . . .
C2 C 0.36523(15) 0.50398(13) 0.42881(12) 0.0152(3) Uani 1 1 d . . . . .
C4 C 0.44858(15) 0.49383(13) 0.29244(12) 0.0147(3) Uani 1 1 d . . . . .
C14 C 0.51887(16) 0.11756(13) 0.56812(12) 0.0146(3) Uani 1 1 d . . . . .
C3 C 0.42255(16) 0.55030(13) 0.36517(12) 0.0152(4) Uani 1 1 d . . . . .
C25 C 0.52123(17) 1.06357(13) -0.06891(13) 0.0184(4) Uani 1 1 d . . . . .
H25 H 0.535699 1.106637 -0.114371 0.022 Uiso 1 1 calc R U . . .
C9 C 0.34168(15) 0.23502(13) 0.34352(12) 0.0137(3) Uani 1 1 d . . . . .
C13 C 0.42832(15) 0.16004(13) 0.50327(12) 0.0152(4) Uani 1 1 d . . . . .
H13 H 0.358323 0.173147 0.520961 0.018 Uiso 1 1 calc R U . . .
C18 C 0.49895(17) 0.09936(14) 0.66396(13) 0.0196(4) Uani 1 1 d . . . . .
C1 C 0.32913(17) 0.56440(14) 0.50182(13) 0.0191(4) Uani 1 1 d . . . . .
C22 C 0.35288(19) 0.76858(14) -0.11162(14) 0.0258(4) Uani 1 1 d . . . . .
H22 H 0.300783 0.805289 -0.154599 0.031 Uiso 1 1 calc R U . . .
C24 C 0.49124(17) 0.96663(14) -0.09101(13) 0.0188(4) Uani 1 1 d . . . . .
H24 H 0.485092 0.943767 -0.151468 0.023 Uiso 1 1 calc R U . . .
C11 C 0.33687(17) 0.19624(13) 0.24431(13) 0.0189(4) Uani 1 1 d . . . . .
H11A H 0.410998 0.205708 0.227860 0.028 Uiso 1 1 calc R U . . .
H11B H 0.278375 0.231404 0.201407 0.028 Uiso 1 1 calc R U . . .
H11C H 0.318229 0.127433 0.241837 0.028 Uiso 1 1 calc R U . . .
C10 C 0.22225(16) 0.21387(14) 0.36590(13) 0.0185(4) Uani 1 1 d . . . . .
H10A H 0.209648 0.144126 0.365890 0.028 Uiso 1 1 calc R U . . .
H10B H 0.162921 0.244118 0.319774 0.028 Uiso 1 1 calc R U . . .
H10C H 0.219452 0.240139 0.426041 0.028 Uiso 1 1 calc R U . . .
C21 C 0.35754(18) 0.66947(14) -0.10375(14) 0.0238(4) Uani 1 1 d . . . . .
H21 H 0.307966 0.625907 -0.141416 0.029 Uiso 1 1 calc R U . . .
H3 H 0.427(2) 0.6677(18) 0.4177(12) 0.036 Uiso 1 1 d D U . . .
H5 H 0.262(2) 0.5555(15) 0.6003(13) 0.036 Uiso 1 1 d D U . . .
H8 H 0.7622(17) 0.0428(19) 0.5720(15) 0.036 Uiso 1 1 d D U . . .
H7 H 0.6453(15) 0.0582(19) 0.7020(16) 0.036 Uiso 1 1 d D U . . .
H2 H 0.6326(19) 0.6093(18) 0.2096(13) 0.036 Uiso 1 1 d D U . . .
H11D H 0.1799(18) 0.6401(16) 0.7150(14) 0.036 Uiso 1 1 d D U . . .
H11E H 0.242(2) 0.7057(9) 0.6721(16) 0.036 Uiso 1 1 d D U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds 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 N1 2.0649(15) 3_665 ?
Co1 N1 2.0650(14) . ?
Co1 O1 2.1212(12) 3_665 ?
Co1 O1 2.1212(12) . ?
Co1 O9 2.1341(12) 4_565 ?
Co1 O9 2.1341(12) 2_655 ?
O9 C19 1.270(2) . ?
O1 C8 1.224(2) . ?
O8 C15 1.356(2) . ?
O8 H8 0.851(10) . ?
O3 C3 1.347(2) . ?
O3 H3 0.845(10) . ?
O10 C19 1.256(2) . ?
O5 C1 1.313(2) . ?
O5 H5 0.850(10) . ?
O7 C18 1.331(2) . ?
O7 H7 0.850(10) . ?
N1 C20 1.316(2) . ?
N1 C21 1.374(2) . ?
O11 H11D 0.848(9) . ?
O11 H11E 0.849(9) . ?
O2 C8 1.295(2) . ?
O2 H2 0.858(10) . ?
O6 C18 1.207(2) . ?
O4 C1 1.228(2) . ?
N2 C20 1.345(2) . ?
N2 C22 1.376(2) . ?
N2 C23 1.429(2) . ?
C16 C17 1.390(2) . ?
C16 C15 1.405(2) . ?
C16 C19 1.492(2) . ?
C17 C12 1.393(2) . ?
C17 H17 0.9300 . ?
C8 C4 1.488(2) . ?
C20 H20 0.9300 . ?
C12 C13 1.392(2) . ?
C12 C9 1.543(2) . ?
C5 C6 1.392(2) . ?
C5 C4 1.394(3) . ?
C5 H5A 0.9300 . ?
C7 C2 1.395(3) . ?
C7 C6 1.395(2) . ?
C7 H7A 0.9300 . ?
C6 C9 1.542(2) . ?
C15 C14 1.401(2) . ?
C23 C24 1.383(3) . ?
C23 C25 1.385(3) 3_675 ?
C2 C3 1.409(2) . ?
C2 C1 1.481(2) . ?
C4 C3 1.400(2) . ?
C14 C13 1.400(2) . ?
C14 C18 1.495(2) . ?
C25 C24 1.386(3) . ?
C25 H25 0.9300 . ?
C9 C10 1.534(2) . ?
C9 C11 1.540(2) . ?
C13 H13 0.9300 . ?
C22 C21 1.353(3) . ?
C22 H22 0.9300 . ?
C24 H24 0.9300 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C21 H21 0.9300 . ?

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
N1 Co1 N1 180.0 3_665 . ?
N1 Co1 O1 93.99(5) 3_665 3_665 ?
N1 Co1 O1 86.01(5) . 3_665 ?
N1 Co1 O1 86.01(5) 3_665 . ?
N1 Co1 O1 93.99(5) . . ?
O1 Co1 O1 180.0 3_665 . ?
N1 Co1 O9 90.30(5) 3_665 4_565 ?
N1 Co1 O9 89.70(5) . 4_565 ?
O1 Co1 O9 97.44(5) 3_665 4_565 ?
O1 Co1 O9 82.56(5) . 4_565 ?
N1 Co1 O9 89.70(5) 3_665 2_655 ?
N1 Co1 O9 90.30(5) . 2_655 ?
O1 Co1 O9 82.56(5) 3_665 2_655 ?
O1 Co1 O9 97.44(5) . 2_655 ?
O9 Co1 O9 180.00(6) 4_565 2_655 ?
C19 O9 Co1 142.32(12) . 2_645 ?
C8 O1 Co1 152.29(13) . . ?
C15 O8 H8 102.5(17) . . ?
C3 O3 H3 105.4(18) . . ?
C1 O5 H5 109.6(18) . . ?
C18 O7 H7 108.0(17) . . ?
C20 N1 C21 105.66(15) . . ?
C20 N1 Co1 129.09(12) . . ?
C21 N1 Co1 124.87(12) . . ?
H11D O11 H11E 109.5(14) . . ?
C8 O2 H2 114.1(17) . . ?
C20 N2 C22 107.11(15) . . ?
C20 N2 C23 125.45(15) . . ?
C22 N2 C23 127.42(16) . . ?
C17 C16 C15 119.32(16) . . ?
C17 C16 C19 120.06(16) . . ?
C15 C16 C19 120.57(16) . . ?
C16 C17 C12 122.67(16) . . ?
C16 C17 H17 118.7 . . ?
C12 C17 H17 118.7 . . ?
O1 C8 O2 124.27(17) . . ?
O1 C8 C4 120.04(17) . . ?
O2 C8 C4 115.66(15) . . ?
N1 C20 N2 111.40(16) . . ?
N1 C20 H20 124.3 . . ?
N2 C20 H20 124.3 . . ?
C13 C12 C17 116.98(16) . . ?
C13 C12 C9 122.20(16) . . ?
C17 C12 C9 120.71(15) . . ?
C6 C5 C4 122.70(16) . . ?
C6 C5 H5A 118.7 . . ?
C4 C5 H5A 118.7 . . ?
C2 C7 C6 122.14(16) . . ?
C2 C7 H7A 118.9 . . ?
C6 C7 H7A 118.9 . . ?
C5 C6 C7 116.64(16) . . ?
C5 C6 C9 121.93(15) . . ?
C7 C6 C9 121.41(15) . . ?
O8 C15 C14 119.20(15) . . ?
O8 C15 C16 121.41(16) . . ?
C14 C15 C16 119.38(16) . . ?
O10 C19 O9 124.49(16) . . ?
O10 C19 C16 118.50(16) . . ?
O9 C19 C16 116.99(15) . . ?
C24 C23 C25 121.87(17) . 3_675 ?
C24 C23 N2 119.69(16) . . ?
C25 C23 N2 118.44(16) 3_675 . ?
C7 C2 C3 120.27(16) . . ?
C7 C2 C1 121.02(16) . . ?
C3 C2 C1 118.70(16) . . ?
C5 C4 C3 120.06(16) . . ?
C5 C4 C8 116.91(16) . . ?
C3 C4 C8 123.03(16) . . ?
C13 C14 C15 119.29(16) . . ?
C13 C14 C18 117.73(16) . . ?
C15 C14 C18 122.97(16) . . ?
O3 C3 C4 119.42(16) . . ?
O3 C3 C2 122.46(16) . . ?
C4 C3 C2 118.09(16) . . ?
C23 C25 C24 119.20(17) 3_675 . ?
C23 C25 H25 120.4 3_675 . ?
C24 C25 H25 120.4 . . ?
C10 C9 C11 106.33(15) . . ?
C10 C9 C6 110.25(14) . . ?
C11 C9 C6 111.07(14) . . ?
C10 C9 C12 111.23(14) . . ?
C11 C9 C12 110.51(14) . . ?
C6 C9 C12 107.50(14) . . ?
C12 C13 C14 122.32(16) . . ?
C12 C13 H13 118.8 . . ?
C14 C13 H13 118.8 . . ?
O6 C18 O7 119.17(17) . . ?
O6 C18 C14 122.78(17) . . ?
O7 C18 C14 118.04(16) . . ?
O4 C1 O5 122.50(17) . . ?
O4 C1 C2 122.12(17) . . ?
O5 C1 C2 115.38(17) . . ?
C21 C22 N2 105.93(17) . . ?
C21 C22 H22 127.0 . . ?
N2 C22 H22 127.0 . . ?
C23 C24 C25 118.93(17) . . ?
C23 C24 H24 120.5 . . ?
C25 C24 H24 120.5 . . ?
C9 C11 H11A 109.5 . . ?
C9 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C9 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C22 C21 N1 109.90(17) . . ?
C22 C21 H21 125.1 . . ?
N1 C21 H21 125.1 . . ?

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
C15 C16 C17 C12 -1.3(3) . . . . ?
C19 C16 C17 C12 -178.81(16) . . . . ?
Co1 O1 C8 O2 10.5(4) . . . . ?
Co1 O1 C8 C4 -167.24(19) . . . . ?
C21 N1 C20 N2 0.0(2) . . . . ?
Co1 N1 C20 N2 173.04(12) . . . . ?
C22 N2 C20 N1 0.0(2) . . . . ?
C23 N2 C20 N1 178.87(16) . . . . ?
C16 C17 C12 C13 1.8(3) . . . . ?
C16 C17 C12 C9 178.23(16) . . . . ?
C4 C5 C6 C7 2.4(3) . . . . ?
C4 C5 C6 C9 -176.25(16) . . . . ?
C2 C7 C6 C5 0.0(3) . . . . ?
C2 C7 C6 C9 178.70(16) . . . . ?
C17 C16 C15 O8 -179.03(16) . . . . ?
C19 C16 C15 O8 -1.6(3) . . . . ?
C17 C16 C15 C14 -0.6(3) . . . . ?
C19 C16 C15 C14 176.85(16) . . . . ?
Co1 O9 C19 O10 10.7(3) 2_645 . . . ?
Co1 O9 C19 C16 -167.76(13) 2_645 . . . ?
C17 C16 C19 O10 13.3(2) . . . . ?
C15 C16 C19 O10 -164.12(16) . . . . ?
C17 C16 C19 O9 -168.14(16) . . . . ?
C15 C16 C19 O9 14.4(2) . . . . ?
C20 N2 C23 C24 127.6(2) . . . . ?
C22 N2 C23 C24 -53.8(3) . . . . ?
C20 N2 C23 C25 -51.8(3) . . . 3_675 ?
C22 N2 C23 C25 126.7(2) . . . 3_675 ?
C6 C7 C2 C3 -2.8(3) . . . . ?
C6 C7 C2 C1 175.66(16) . . . . ?
C6 C5 C4 C3 -2.1(3) . . . . ?
C6 C5 C4 C8 178.03(16) . . . . ?
O1 C8 C4 C5 39.3(3) . . . . ?
O2 C8 C4 C5 -138.63(18) . . . . ?
O1 C8 C4 C3 -140.56(19) . . . . ?
O2 C8 C4 C3 41.5(3) . . . . ?
O8 C15 C14 C13 -179.61(16) . . . . ?
C16 C15 C14 C13 2.0(3) . . . . ?
O8 C15 C14 C18 1.4(3) . . . . ?
C16 C15 C14 C18 -177.02(16) . . . . ?
C5 C4 C3 O3 -178.83(16) . . . . ?
C8 C4 C3 O3 1.1(3) . . . . ?
C5 C4 C3 C2 -0.7(3) . . . . ?
C8 C4 C3 C2 179.15(16) . . . . ?
C7 C2 C3 O3 -178.89(17) . . . . ?
C1 C2 C3 O3 2.6(3) . . . . ?
C7 C2 C3 C4 3.1(3) . . . . ?
C1 C2 C3 C4 -175.40(16) . . . . ?
C5 C6 C9 C10 -139.02(17) . . . . ?
C7 C6 C9 C10 42.4(2) . . . . ?
C5 C6 C9 C11 -21.4(2) . . . . ?
C7 C6 C9 C11 159.99(16) . . . . ?
C5 C6 C9 C12 99.58(19) . . . . ?
C7 C6 C9 C12 -79.0(2) . . . . ?
C13 C12 C9 C10 -26.3(2) . . . . ?
C17 C12 C9 C10 157.52(16) . . . . ?
C13 C12 C9 C11 -144.13(17) . . . . ?
C17 C12 C9 C11 39.7(2) . . . . ?
C13 C12 C9 C6 94.51(19) . . . . ?
C17 C12 C9 C6 -81.70(19) . . . . ?
C17 C12 C13 C14 -0.4(3) . . . . ?
C9 C12 C13 C14 -176.78(16) . . . . ?
C15 C14 C13 C12 -1.4(3) . . . . ?
C18 C14 C13 C12 177.60(16) . . . . ?
C13 C14 C18 O6 4.2(3) . . . . ?
C15 C14 C18 O6 -176.82(19) . . . . ?
C13 C14 C18 O7 -175.10(17) . . . . ?
C15 C14 C18 O7 3.9(3) . . . . ?
C7 C2 C1 O4 -175.93(19) . . . . ?
C3 C2 C1 O4 2.5(3) . . . . ?
C7 C2 C1 O5 3.5(3) . . . . ?
C3 C2 C1 O5 -178.03(16) . . . . ?
C20 N2 C22 C21 -0.1(2) . . . . ?
C23 N2 C22 C21 -178.86(18) . . . . ?
C25 C23 C24 C25 0.2(3) 3_675 . . . ?
N2 C23 C24 C25 -179.22(17) . . . . ?
C23 C25 C24 C23 -0.2(3) 3_675 . . . ?
N2 C22 C21 N1 0.1(2) . . . . ?
C20 N1 C21 C22 0.0(2) . . . . ?
Co1 N1 C21 C22 -173.46(14) . . . . ?

_refine_diff_density_max         0.361
_refine_diff_density_min         -0.513
_refine_diff_density_rms         0.061

