# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2022

####################################################################### 
# 
# 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 2153702'
loop_
_audit_author_name
_audit_author_address
Yang
;Luoyang normal university
China
;
_audit_update_record             
;
2022-02-21 deposited with the CCDC.	2022-04-12 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/1
_shelx_SHELXL_version_number     2018/1
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C24 H22 Cd N4 O4'
_chemical_formula_weight         542.85

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'
Cd Cd -0.8075 1.2024 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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, -y, -z'

_cell_length_a                   11.0962(6)
_cell_length_b                   11.3601(6)
_cell_length_c                   11.4294(6)
_cell_angle_alpha                86.8290(10)
_cell_angle_beta                 61.8360(10)
_cell_angle_gamma                67.0680(10)
_cell_volume                     1154.99(11)
_cell_formula_units_Z            2
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    5519
_cell_measurement_theta_min      2.29
_cell_measurement_theta_max      28.33

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.561
_exptl_crystal_F_000             548
_exptl_transmission_factor_min   0.6870
_exptl_transmission_factor_max   0.7457
_exptl_crystal_size_max          0.160
_exptl_crystal_size_mid          0.130
_exptl_crystal_size_min          0.070
_exptl_absorpt_coefficient_mu    0.983
_shelx_estimated_absorpt_T_min   0.859
_shelx_estimated_absorpt_T_max   0.934
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   sadabs
_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            6254
_diffrn_reflns_av_unetI/netI     0.0149
_diffrn_reflns_av_R_equivalents  0.0080
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_theta_min         2.608
_diffrn_reflns_theta_max         26.019
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measured_fraction_theta_full 0.986
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_Laue_measured_fraction_full 0.986
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_point_group_measured_fraction_full 0.986
_reflns_number_total             4465
_reflns_number_gt                4239
_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       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2018/1 (Sheldrick, 2018)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_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)+(0.0287P)²+0.5373P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         4465
_refine_ls_number_parameters     298
_refine_ls_number_restraints     4
_refine_ls_R_factor_all          0.0260
_refine_ls_R_factor_gt           0.0242
_refine_ls_wR_factor_ref         0.0645
_refine_ls_wR_factor_gt          0.0632
_refine_ls_goodness_of_fit_ref   1.234
_refine_ls_restrained_S_all      1.277
_refine_ls_shift/su_max          0.001
_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
Cd1 Cd 0.10033(2) 0.87707(2) 0.33097(2) 0.03409(7) Uani 1 1 d . U . . .
O1 O 0.3538(2) 0.78936(19) 0.16755(18) 0.0507(4) Uani 1 1 d . . . . .
O2 O 0.2251(2) 0.71653(19) 0.11638(18) 0.0539(4) Uani 1 1 d . U . . .
O3 O -0.1373(2) 1.00618(19) 0.53544(18) 0.0516(4) Uani 1 1 d . U . . .
O4 O -0.1564(2) 0.9009(2) 0.39796(18) 0.0587(5) Uani 1 1 d . U . . .
N1 N 0.1128(3) 0.7055(2) 0.4475(2) 0.0475(5) Uani 1 1 d . . . . .
N2 N 0.0519(3) 0.59814(19) 0.6161(2) 0.0486(5) Uani 1 1 d . . . . .
N3 N 0.0821(2) 0.11222(17) 1.01015(19) 0.0401(4) Uani 1 1 d . . . . .
N4 N 0.0518(2) 0.03639(18) 1.19909(19) 0.0390(4) Uani 1 1 d . . . . .
C1 C 0.3439(3) 0.7230(2) 0.0907(2) 0.0388(5) Uani 1 1 d . . . . .
C2 C 0.4855(3) 0.6516(2) -0.0439(3) 0.0501(6) Uani 1 1 d . . . . .
H2A H 0.569156 0.603855 -0.028279 0.060 Uiso 1 1 calc R U . . .
H2AB H 0.469818 0.590103 -0.084445 0.060 Uiso 1 1 calc R U . . .
C3 C 0.5228(3) 0.7460(2) -0.1389(2) 0.0399(5) Uani 1 1 d . . . . .
C4 C 0.5056(3) 0.7510(3) -0.2515(3) 0.0494(6) Uani 1 1 d . . . . .
H4 H 0.472580 0.694500 -0.270299 0.059 Uiso 1 1 calc R U . . .
C5 C 0.5373(3) 0.8397(3) -0.3368(3) 0.0539(7) Uani 1 1 d . . . . .
H5 H 0.527089 0.840564 -0.413102 0.065 Uiso 1 1 calc R U . . .
C6 C 0.5837(3) 0.9267(3) -0.3101(3) 0.0457(6) Uani 1 1 d . . . . .
C7 C 0.6011(3) 0.9216(3) -0.1984(3) 0.0494(6) Uani 1 1 d . . . . .
H7 H 0.632470 0.979127 -0.178780 0.059 Uiso 1 1 calc R U . . .
C8 C 0.5724(3) 0.8317(3) -0.1147(3) 0.0474(6) Uani 1 1 d . . . . .
H8 H 0.586770 0.828808 -0.040505 0.057 Uiso 1 1 calc R U . . .
C9 C 0.6176(3) 1.0248(3) -0.4014(3) 0.0630(9) Uani 1 1 d . . . . .
H9A H 0.565227 1.040119 -0.452569 0.076 Uiso 1 1 calc R U . . .
H9AB H 0.582787 1.106174 -0.347778 0.076 Uiso 1 1 calc R U . . .
C10 C -0.2157(3) 0.9748(2) 0.5039(2) 0.0364(5) Uani 1 1 d . U . . .
C11 C 0.1937(4) 0.5751(3) 0.4008(3) 0.0655(9) Uani 1 1 d . . . . .
H11 H 0.263539 0.538277 0.311501 0.079 Uiso 1 1 calc R U . . .
C12 C 0.1569(4) 0.5087(3) 0.5031(3) 0.0704(10) Uani 1 1 d . . . . .
H12 H 0.195293 0.419164 0.498048 0.084 Uiso 1 1 calc R U . . .
C13 C 0.0276(3) 0.7147(2) 0.5774(2) 0.0448(6) Uani 1 1 d . . . . .
H13 H -0.041265 0.792506 0.635386 0.054 Uiso 1 1 calc R U . . .
C14 C -0.0255(3) 0.5737(3) 0.7547(3) 0.0581(8) Uani 1 1 d . . . . .
H14A H -0.102449 0.547281 0.764157 0.070 Uiso 1 1 calc R U . . .
H14B H -0.074344 0.653296 0.816819 0.070 Uiso 1 1 calc R U . . .
C15 C 0.0812(3) 0.4703(2) 0.7908(2) 0.0428(5) Uani 1 1 d . . . . .
C16 C 0.0673(3) 0.3543(2) 0.8166(2) 0.0384(5) Uani 1 1 d . . . . .
H16 H -0.008497 0.341252 0.812797 0.046 Uiso 1 1 calc R U . . .
C17 C 0.1660(3) 0.2573(2) 0.8483(2) 0.0421(5) Uani 1 1 d . . . . .
C18 C 0.2777(4) 0.2773(3) 0.8531(3) 0.0619(8) Uani 1 1 d . . . . .
H18 H 0.343640 0.212827 0.874672 0.074 Uiso 1 1 calc R U . . .
C19 C 0.2936(4) 0.3912(4) 0.8265(4) 0.0783(10) Uani 1 1 d . . . . .
H19 H 0.370616 0.403377 0.828953 0.094 Uiso 1 1 calc R U . . .
C20 C 0.1943(4) 0.4882(3) 0.7961(4) 0.0655(8) Uani 1 1 d . . . . .
H20 H 0.204207 0.565880 0.779155 0.079 Uiso 1 1 calc R U . . .
C21 C 0.1545(4) 0.1289(2) 0.8683(2) 0.0587(8) Uani 1 1 d . . . . .
H21A H 0.098066 0.120422 0.827886 0.070 Uiso 1 1 calc R U . . .
H21B H 0.254645 0.059964 0.821570 0.070 Uiso 1 1 calc R U . . .
C22 C -0.0680(3) 0.1667(2) 1.0992(3) 0.0480(6) Uani 1 1 d . . . . .
H22 H -0.143518 0.224400 1.083621 0.058 Uiso 1 1 calc R U . . .
C23 C -0.0849(3) 0.1202(2) 1.2143(3) 0.0478(6) Uani 1 1 d . . . . .
H23 H -0.176194 0.141804 1.292891 0.057 Uiso 1 1 calc R U . . .
C24 C 0.1497(3) 0.0347(2) 1.0739(2) 0.0388(5) Uani 1 1 d . . . . .
H24 H 0.252708 -0.014093 1.034931 0.047 Uiso 1 1 calc R 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
Cd1 N1 2.2947(19) . ?
Cd1 O1 2.3357(18) . ?
Cd1 O3 2.3445(18) 2_576 ?
Cd1 N4 2.3543(18) 1_564 ?
Cd1 O3 2.4725(18) . ?
Cd1 O4 2.4776(19) . ?
Cd1 O2 2.5651(18) . ?
O1 C1 1.258(3) . ?
O2 C1 1.239(3) . ?
O3 C10 1.251(3) . ?
O4 C10 1.239(3) . ?
N1 C13 1.314(3) . ?
N1 C11 1.373(3) . ?
N2 C13 1.338(3) . ?
N2 C12 1.364(4) . ?
N2 C14 1.475(3) . ?
N3 C24 1.341(3) . ?
N3 C22 1.364(3) . ?
N3 C21 1.471(3) . ?
N4 C24 1.322(3) . ?
N4 C23 1.372(3) . ?
C1 C2 1.535(3) . ?
C2 C3 1.514(3) . ?
C2 H2A 0.9700 . ?
C2 H2AB 0.9700 . ?
C3 C4 1.381(4) . ?
C3 C8 1.386(4) . ?
C4 C5 1.391(4) . ?
C4 H4 0.9300 . ?
C5 C6 1.384(4) . ?
C5 H5 0.9300 . ?
C6 C7 1.373(4) . ?
C6 C9 1.516(3) . ?
C7 C8 1.385(4) . ?
C7 H7 0.9300 . ?
C8 H8 0.9300 . ?
C9 C10 1.508(4) 1_654 ?
C9 H9A 0.9700 . ?
C9 H9AB 0.9700 . ?
C11 C12 1.339(4) . ?
C11 H11 0.9300 . ?
C12 H12 0.9300 . ?
C13 H13 0.9300 . ?
C14 C15 1.508(3) . ?
C14 H14A 0.9700 . ?
C14 H14B 0.9700 . ?
C15 C20 1.375(4) . ?
C15 C16 1.385(3) . ?
C16 C17 1.390(3) . ?
C16 H16 0.9300 . ?
C17 C18 1.370(4) . ?
C17 C21 1.509(3) . ?
C18 C19 1.372(5) . ?
C18 H18 0.9300 . ?
C19 C20 1.386(5) . ?
C19 H19 0.9300 . ?
C20 H20 0.9300 . ?
C21 H21A 0.9700 . ?
C21 H21B 0.9700 . ?
C22 C23 1.346(4) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 H24 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 Cd1 O1 96.12(7) . . ?
N1 Cd1 O3 94.72(8) . 2_576 ?
O1 Cd1 O3 92.95(7) . 2_576 ?
N1 Cd1 N4 166.05(8) . 1_564 ?
O1 Cd1 N4 89.38(7) . 1_564 ?
O3 Cd1 N4 97.80(7) 2_576 1_564 ?
N1 Cd1 O3 86.76(7) . . ?
O1 Cd1 O3 161.13(7) . . ?
O3 Cd1 O3 68.21(7) 2_576 . ?
N4 Cd1 O3 92.18(7) 1_564 . ?
N1 Cd1 O4 85.24(8) . . ?
O1 Cd1 O4 146.98(7) . . ?
O3 Cd1 O4 119.89(6) 2_576 . ?
N4 Cd1 O4 83.20(7) 1_564 . ?
O3 Cd1 O4 51.74(6) . . ?
N1 Cd1 O2 88.35(7) . . ?
O1 Cd1 O2 53.02(6) . . ?
O3 Cd1 O2 145.93(6) 2_576 . ?
N4 Cd1 O2 84.73(7) 1_564 . ?
O3 Cd1 O2 145.84(6) . . ?
O4 Cd1 O2 94.17(6) . . ?
C1 O1 Cd1 96.95(15) . . ?
C1 O2 Cd1 86.70(15) . . ?
C10 O3 Cd1 154.10(16) . 2_576 ?
C10 O3 Cd1 93.94(14) . . ?
Cd1 O3 Cd1 111.79(7) 2_576 . ?
C10 O4 Cd1 94.02(15) . . ?
C13 N1 C11 105.1(2) . . ?
C13 N1 Cd1 124.76(16) . . ?
C11 N1 Cd1 129.82(17) . . ?
C13 N2 C12 106.8(2) . . ?
C13 N2 C14 125.6(2) . . ?
C12 N2 C14 127.5(2) . . ?
C24 N3 C22 107.0(2) . . ?
C24 N3 C21 126.6(2) . . ?
C22 N3 C21 126.2(2) . . ?
C24 N4 C23 104.8(2) . . ?
C24 N4 Cd1 124.36(16) . 1_546 ?
C23 N4 Cd1 127.85(16) . 1_546 ?
O2 C1 O1 123.3(2) . . ?
O2 C1 C2 119.1(2) . . ?
O1 C1 C2 117.6(2) . . ?
C3 C2 C1 110.92(19) . . ?
C3 C2 H2A 109.5 . . ?
C1 C2 H2A 109.5 . . ?
C3 C2 H2AB 109.5 . . ?
C1 C2 H2AB 109.5 . . ?
H2A C2 H2AB 108.0 . . ?
C4 C3 C8 117.9(2) . . ?
C4 C3 C2 120.9(2) . . ?
C8 C3 C2 121.2(2) . . ?
C3 C4 C5 120.6(3) . . ?
C3 C4 H4 119.7 . . ?
C5 C4 H4 119.7 . . ?
C6 C5 C4 121.1(3) . . ?
C6 C5 H5 119.4 . . ?
C4 C5 H5 119.4 . . ?
C7 C6 C5 118.3(2) . . ?
C7 C6 C9 119.8(3) . . ?
C5 C6 C9 121.8(3) . . ?
C6 C7 C8 120.7(3) . . ?
C6 C7 H7 119.7 . . ?
C8 C7 H7 119.7 . . ?
C7 C8 C3 121.4(3) . . ?
C7 C8 H8 119.3 . . ?
C3 C8 H8 119.3 . . ?
C10 C9 C6 109.8(2) 1_654 . ?
C10 C9 H9A 109.7 1_654 . ?
C6 C9 H9A 109.7 . . ?
C10 C9 H9AB 109.7 1_654 . ?
C6 C9 H9AB 109.7 . . ?
H9A C9 H9AB 108.2 . . ?
O4 C10 O3 120.3(2) . . ?
O4 C10 C9 120.5(2) . 1_456 ?
O3 C10 C9 119.2(2) . 1_456 ?
C12 C11 N1 109.8(2) . . ?
C12 C11 H11 125.1 . . ?
N1 C11 H11 125.1 . . ?
C11 C12 N2 106.6(2) . . ?
C11 C12 H12 126.7 . . ?
N2 C12 H12 126.7 . . ?
N1 C13 N2 111.7(2) . . ?
N1 C13 H13 124.2 . . ?
N2 C13 H13 124.2 . . ?
N2 C14 C15 112.1(2) . . ?
N2 C14 H14A 109.2 . . ?
C15 C14 H14A 109.2 . . ?
N2 C14 H14B 109.2 . . ?
C15 C14 H14B 109.2 . . ?
H14A C14 H14B 107.9 . . ?
C20 C15 C16 119.2(2) . . ?
C20 C15 C14 121.0(2) . . ?
C16 C15 C14 119.7(3) . . ?
C15 C16 C17 120.4(2) . . ?
C15 C16 H16 119.8 . . ?
C17 C16 H16 119.8 . . ?
C18 C17 C16 119.3(2) . . ?
C18 C17 C21 121.0(3) . . ?
C16 C17 C21 119.6(3) . . ?
C17 C18 C19 120.8(3) . . ?
C17 C18 H18 119.6 . . ?
C19 C18 H18 119.6 . . ?
C18 C19 C20 119.7(3) . . ?
C18 C19 H19 120.1 . . ?
C20 C19 H19 120.1 . . ?
C15 C20 C19 120.4(3) . . ?
C15 C20 H20 119.8 . . ?
C19 C20 H20 119.8 . . ?
N3 C21 C17 113.9(2) . . ?
N3 C21 H21A 108.8 . . ?
C17 C21 H21A 108.8 . . ?
N3 C21 H21B 108.8 . . ?
C17 C21 H21B 108.8 . . ?
H21A C21 H21B 107.7 . . ?
C23 C22 N3 106.3(2) . . ?
C23 C22 H22 126.9 . . ?
N3 C22 H22 126.9 . . ?
C22 C23 N4 110.3(2) . . ?
C22 C23 H23 124.9 . . ?
N4 C23 H23 124.9 . . ?
N4 C24 N3 111.6(2) . . ?
N4 C24 H24 124.2 . . ?
N3 C24 H24 124.2 . . ?

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
Cd1 O2 C1 O1 2.0(2) . . . . ?
Cd1 O2 C1 C2 -175.27(19) . . . . ?
Cd1 O1 C1 O2 -2.3(3) . . . . ?
Cd1 O1 C1 C2 175.09(17) . . . . ?
O2 C1 C2 C3 106.1(3) . . . . ?
O1 C1 C2 C3 -71.4(3) . . . . ?
C1 C2 C3 C4 -109.8(3) . . . . ?
C1 C2 C3 C8 69.0(3) . . . . ?
C8 C3 C4 C5 -0.1(4) . . . . ?
C2 C3 C4 C5 178.7(2) . . . . ?
C3 C4 C5 C6 -1.3(4) . . . . ?
C4 C5 C6 C7 1.4(4) . . . . ?
C4 C5 C6 C9 -179.5(3) . . . . ?
C5 C6 C7 C8 -0.2(4) . . . . ?
C9 C6 C7 C8 -179.2(3) . . . . ?
C6 C7 C8 C3 -1.2(4) . . . . ?
C4 C3 C8 C7 1.3(4) . . . . ?
C2 C3 C8 C7 -177.5(2) . . . . ?
C7 C6 C9 C10 81.4(3) . . . 1_654 ?
C5 C6 C9 C10 -97.6(3) . . . 1_654 ?
Cd1 O4 C10 O3 -0.3(2) . . . . ?
Cd1 O4 C10 C9 -178.37(19) . . . 1_456 ?
Cd1 O3 C10 O4 173.8(3) 2_576 . . . ?
Cd1 O3 C10 O4 0.3(2) . . . . ?
Cd1 O3 C10 C9 -8.1(5) 2_576 . . 1_456 ?
Cd1 O3 C10 C9 178.39(18) . . . 1_456 ?
C13 N1 C11 C12 -0.6(4) . . . . ?
Cd1 N1 C11 C12 -174.2(3) . . . . ?
N1 C11 C12 N2 -0.3(4) . . . . ?
C13 N2 C12 C11 1.1(4) . . . . ?
C14 N2 C12 C11 179.1(3) . . . . ?
C11 N1 C13 N2 1.4(3) . . . . ?
Cd1 N1 C13 N2 175.35(18) . . . . ?
C12 N2 C13 N1 -1.6(4) . . . . ?
C14 N2 C13 N1 -179.6(3) . . . . ?
C13 N2 C14 C15 -137.6(3) . . . . ?
C12 N2 C14 C15 44.7(5) . . . . ?
N2 C14 C15 C20 64.1(4) . . . . ?
N2 C14 C15 C16 -114.7(3) . . . . ?
C20 C15 C16 C17 0.3(4) . . . . ?
C14 C15 C16 C17 179.1(2) . . . . ?
C15 C16 C17 C18 -0.3(4) . . . . ?
C15 C16 C17 C21 -176.5(2) . . . . ?
C16 C17 C18 C19 -0.3(5) . . . . ?
C21 C17 C18 C19 175.9(3) . . . . ?
C17 C18 C19 C20 0.8(6) . . . . ?
C16 C15 C20 C19 0.2(5) . . . . ?
C14 C15 C20 C19 -178.6(3) . . . . ?
C18 C19 C20 C15 -0.8(6) . . . . ?
C24 N3 C21 C17 -107.7(3) . . . . ?
C22 N3 C21 C17 76.7(4) . . . . ?
C18 C17 C21 N3 80.7(4) . . . . ?
C16 C17 C21 N3 -103.1(3) . . . . ?
C24 N3 C22 C23 0.4(3) . . . . ?
C21 N3 C22 C23 176.7(2) . . . . ?
N3 C22 C23 N4 -0.5(3) . . . . ?
C24 N4 C23 C22 0.5(3) . . . . ?
Cd1 N4 C23 C22 -160.35(18) 1_546 . . . ?
C23 N4 C24 N3 -0.2(3) . . . . ?
Cd1 N4 C24 N3 161.48(15) 1_546 . . . ?
C22 N3 C24 N4 -0.1(3) . . . . ?
C21 N3 C24 N4 -176.4(2) . . . . ?

_refine_diff_density_max         0.877
_refine_diff_density_min         -0.586
_refine_diff_density_rms         0.055

