# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2023

####################################################################### 
# 
# 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. 
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data_21gtu91_bih_2_0m
_database_code_depnum_ccdc_archive 'CCDC 2155032'
loop_
_audit_author_name
_audit_author_address
'Yunus Zorlu'
;Gebze Technical University
Turkey
;
_audit_update_record             
;
2022-02-27 deposited with the CCDC.	2023-05-11 downloaded from the CCDC.
;
_audit_creation_date             2021-04-05
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C24 H21 N7 O2'
_chemical_formula_sum            'C24 H21 N7 O2'
_chemical_formula_weight         439.48
_chemical_melting_point          ?
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'

_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.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   26.325(4)
_cell_length_b                   8.6403(14)
_cell_length_c                   22.014(4)
_cell_angle_alpha                90
_cell_angle_beta                 117.940(2)
_cell_angle_gamma                90
_cell_volume                     4423.7(12)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    1794
_cell_measurement_temperature    298
_cell_measurement_theta_max      21.98
_cell_measurement_theta_min      2.56
_shelx_estimated_absorpt_T_max   0.993
_shelx_estimated_absorpt_T_min   0.972
_exptl_absorpt_coefficient_mu    0.089
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.4945
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1573 before and 0.0689 after correction.
The Ratio of minimum to maximum transmission is 0.6632.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.320
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             1840
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
-1.00 0.00 3.00 0.0790
0.00 0.00 -1.00 0.0030
1.00 0.00 0.00 0.0140
3.00 1.00 3.00 0.0940
-2.00 1.00 0.00 0.1490
-2.00 0.00 1.00 0.0570
-3.00 -1.00 1.00 0.0320
2.00 1.00 1.00 0.1080
1.00 0.00 -1.00 0.0050
3.00 1.00 -1.00 0.0740

_exptl_crystal_size_max          0.321
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.082
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0735
_diffrn_reflns_av_unetI/netI     0.0710
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            13333
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        24.996
_diffrn_reflns_theta_max         24.996
_diffrn_reflns_theta_min         1.751
_diffrn_ambient_temperature      298
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           0.99
_diffrn_source_power             0.0495
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                2448
_reflns_number_total             3877
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40A (Bruker, 2019)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40A (Bruker, 2019)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_refine_diff_density_max         0.218
_refine_diff_density_min         -0.161
_refine_diff_density_rms         0.041
_refine_ls_extinction_coef       0.0011(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.060
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     300
_refine_ls_number_reflns         3877
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0939
_refine_ls_R_factor_gt           0.0528
_refine_ls_restrained_S_all      1.060
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0627P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1299
_refine_ls_wR_factor_ref         0.1460
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 N2(H2), N6(H6), C1(H1), C2(H2A), C3(H3), C4(H4), C5(H5), C14(H14), C15(H15),
 C16(H16), C17(H17), C18(H18), C21(H21), C22(H22), C24(H24), C25(H25)
2.b X=CH2 refined with riding coordinates:
 C10(H10A,H10B)
2.c Idealised Me refined as rotating group:
 C8(H8A,H8B,H8C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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
O1 O 0.58253(8) 0.7680(3) 0.46201(10) 0.1059(8) Uani 1 1 d . . . . .
O2 O 0.56408(9) 0.8576(3) 0.36264(11) 0.1158(10) Uani 1 1 d . . . . .
N1 N 0.24414(7) 0.1181(2) 0.42158(9) 0.0443(5) Uani 1 1 d . . . . .
N2 N 0.29226(7) 0.1920(2) 0.42710(9) 0.0474(5) Uani 1 1 d . . . . .
H2 H 0.3244 0.1887 0.4643 0.057 Uiso 1 1 calc R U . . .
N3 N 0.23912(7) 0.2652(2) 0.31120(8) 0.0439(5) Uani 1 1 d . . . . .
N4 N 0.25401(7) 0.3597(2) 0.27067(8) 0.0430(5) Uani 1 1 d . . . . .
N5 N 0.33014(7) 0.3588(2) 0.37300(8) 0.0403(5) Uani 1 1 d . . . . .
N6 N 0.33287(7) 0.5116(2) 0.28284(8) 0.0430(5) Uani 1 1 d . . . . .
H6 H 0.3116 0.5395 0.2409 0.052 Uiso 1 1 calc R U . . .
N7 N 0.55087(9) 0.7825(3) 0.40021(12) 0.0751(7) Uani 1 1 d . . . . .
C1 C 0.18350(11) -0.0873(3) 0.51329(13) 0.0574(7) Uani 1 1 d . . . . .
H1 H 0.2128 -0.0775 0.5582 0.069 Uiso 1 1 calc R U . . .
C2 C 0.13197(12) -0.1527(3) 0.50161(15) 0.0702(8) Uani 1 1 d . . . . .
H2A H 0.1266 -0.1845 0.5386 0.084 Uiso 1 1 calc R U . . .
C3 C 0.08887(12) -0.1712(4) 0.43632(16) 0.0762(9) Uani 1 1 d . . . . .
H3 H 0.0543 -0.2166 0.4285 0.091 Uiso 1 1 calc R U . . .
C4 C 0.09679(11) -0.1225(4) 0.38232(15) 0.0840(10) Uani 1 1 d . . . . .
H4 H 0.0676 -0.1350 0.3375 0.101 Uiso 1 1 calc R U . . .
C5 C 0.14798(10) -0.0548(3) 0.39421(13) 0.0677(8) Uani 1 1 d . . . . .
H5 H 0.1527 -0.0210 0.3571 0.081 Uiso 1 1 calc R U . . .
C6 C 0.19268(9) -0.0361(3) 0.46024(11) 0.0430(6) Uani 1 1 d . . . . .
C7 C 0.24695(9) 0.0405(3) 0.47249(11) 0.0420(6) Uani 1 1 d . . . . .
C8 C 0.30021(10) 0.0213(3) 0.53991(11) 0.0582(7) Uani 1 1 d . . . . .
H8A H 0.3330 0.0127 0.5320 0.087 Uiso 1 1 calc R U . . .
H8B H 0.2970 -0.0707 0.5623 0.087 Uiso 1 1 calc R U . . .
H8C H 0.3048 0.1094 0.5686 0.087 Uiso 1 1 calc R U . . .
C9 C 0.28652(8) 0.2711(2) 0.37055(10) 0.0387(5) Uani 1 1 d . . . . .
C10 C 0.22520(10) 0.3563(3) 0.15264(12) 0.0587(7) Uani 1 1 d . . . . .
H10A H 0.2597 0.3068 0.1633 0.070 Uiso 1 1 calc R U . . .
H10B H 0.1993 0.3780 0.1071 0.070 Uiso 1 1 calc R U . . .
C11 C 0.21299(9) 0.3954(3) 0.20173(11) 0.0429(6) Uani 1 1 d . . . . .
C12 C 0.16135(9) 0.4810(3) 0.19356(12) 0.0480(6) Uani 1 1 d . . . . .
C14 C 0.15948(11) 0.5480(3) 0.24897(14) 0.0658(7) Uani 1 1 d . . . . .
H14 H 0.1910 0.5387 0.2924 0.079 Uiso 1 1 calc R U . . .
C15 C 0.11170(14) 0.6288(4) 0.24148(19) 0.0890(10) Uani 1 1 d . . . . .
H15 H 0.1111 0.6724 0.2798 0.107 Uiso 1 1 calc R U . . .
C16 C 0.06563(14) 0.6449(4) 0.1784(2) 0.1003(11) Uani 1 1 d . . . . .
H16 H 0.0336 0.7001 0.1734 0.120 Uiso 1 1 calc R U . . .
C17 C 0.06636(12) 0.5805(4) 0.12276(18) 0.0895(10) Uani 1 1 d . . . . .
H17 H 0.0348 0.5921 0.0796 0.107 Uiso 1 1 calc R U . . .
C18 C 0.11349(10) 0.4981(3) 0.12955(13) 0.0676(8) Uani 1 1 d . . . . .
H18 H 0.1133 0.4536 0.0910 0.081 Uiso 1 1 calc R U . . .
C19 C 0.30812(8) 0.4131(2) 0.30968(10) 0.0368(5) Uani 1 1 d . . . . .
C20 C 0.38826(8) 0.5730(2) 0.31468(10) 0.0377(5) Uani 1 1 d . . . . .
C21 C 0.42850(9) 0.5405(3) 0.38237(11) 0.0495(6) Uani 1 1 d . . . . .
H21 H 0.4195 0.4726 0.4087 0.059 Uiso 1 1 calc R U . . .
C22 C 0.48181(9) 0.6103(3) 0.40984(12) 0.0557(7) Uani 1 1 d . . . . .
H22 H 0.5087 0.5916 0.4553 0.067 Uiso 1 1 calc R U . . .
C23 C 0.49507(9) 0.7068(3) 0.37020(11) 0.0499(6) Uani 1 1 d . . . . .
C24 C 0.45647(9) 0.7379(3) 0.30297(11) 0.0498(6) Uani 1 1 d . . . . .
H24 H 0.4663 0.8036 0.2766 0.060 Uiso 1 1 calc R U . . .
C25 C 0.40305(8) 0.6701(3) 0.27547(11) 0.0435(6) Uani 1 1 d . . . . .
H25 H 0.3765 0.6896 0.2299 0.052 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
O1 N7 1.224(3) . ?
O2 N7 1.223(3) . ?
N1 N2 1.372(2) . ?
N1 C7 1.278(3) . ?
N2 H2 0.8600 . ?
N2 C9 1.365(3) . ?
N3 N4 1.394(2) . ?
N3 C9 1.319(2) . ?
N4 C11 1.425(3) . ?
N4 C19 1.354(2) . ?
N5 C9 1.356(3) . ?
N5 C19 1.320(2) . ?
N6 H6 0.8600 . ?
N6 C19 1.364(3) . ?
N6 C20 1.393(2) . ?
N7 C23 1.454(3) . ?
C1 H1 0.9300 . ?
C1 C2 1.378(3) . ?
C1 C6 1.372(3) . ?
C2 H2A 0.9300 . ?
C2 C3 1.360(4) . ?
C3 H3 0.9300 . ?
C3 C4 1.366(4) . ?
C4 H4 0.9300 . ?
C4 C5 1.377(3) . ?
C5 H5 0.9300 . ?
C5 C6 1.386(3) . ?
C6 C7 1.480(3) . ?
C7 C8 1.499(3) . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C10 H10A 0.9300 . ?
C10 H10B 0.9300 . ?
C10 C11 1.308(3) . ?
C11 C12 1.482(3) . ?
C12 C14 1.372(3) . ?
C12 C18 1.390(3) . ?
C14 H14 0.9300 . ?
C14 C15 1.379(4) . ?
C15 H15 0.9300 . ?
C15 C16 1.356(4) . ?
C16 H16 0.9300 . ?
C16 C17 1.354(4) . ?
C17 H17 0.9300 . ?
C17 C18 1.377(4) . ?
C18 H18 0.9300 . ?
C20 C21 1.394(3) . ?
C20 C25 1.384(3) . ?
C21 H21 0.9300 . ?
C21 C22 1.380(3) . ?
C22 H22 0.9300 . ?
C22 C23 1.365(3) . ?
C23 C24 1.373(3) . ?
C24 H24 0.9300 . ?
C24 C25 1.375(3) . ?
C25 H25 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
C7 N1 N2 119.66(17) . . ?
N1 N2 H2 121.7 . . ?
C9 N2 N1 116.70(16) . . ?
C9 N2 H2 121.7 . . ?
C9 N3 N4 101.08(16) . . ?
N3 N4 C11 120.57(16) . . ?
C19 N4 N3 108.75(16) . . ?
C19 N4 C11 130.46(18) . . ?
C19 N5 C9 102.25(16) . . ?
C19 N6 H6 115.9 . . ?
C19 N6 C20 128.27(17) . . ?
C20 N6 H6 115.9 . . ?
O1 N7 C23 118.4(2) . . ?
O2 N7 O1 123.0(2) . . ?
O2 N7 C23 118.6(2) . . ?
C2 C1 H1 119.2 . . ?
C6 C1 H1 119.2 . . ?
C6 C1 C2 121.6(2) . . ?
C1 C2 H2A 119.8 . . ?
C3 C2 C1 120.4(3) . . ?
C3 C2 H2A 119.8 . . ?
C2 C3 H3 120.3 . . ?
C2 C3 C4 119.5(3) . . ?
C4 C3 H3 120.3 . . ?
C3 C4 H4 120.0 . . ?
C3 C4 C5 120.0(3) . . ?
C5 C4 H4 120.0 . . ?
C4 C5 H5 119.2 . . ?
C4 C5 C6 121.5(2) . . ?
C6 C5 H5 119.2 . . ?
C1 C6 C5 117.0(2) . . ?
C1 C6 C7 121.9(2) . . ?
C5 C6 C7 121.1(2) . . ?
N1 C7 C6 114.86(18) . . ?
N1 C7 C8 124.7(2) . . ?
C6 C7 C8 120.4(2) . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N3 C9 N2 122.23(19) . . ?
N3 C9 N5 116.84(19) . . ?
N5 C9 N2 120.92(18) . . ?
H10A C10 H10B 120.0 . . ?
C11 C10 H10A 120.0 . . ?
C11 C10 H10B 120.0 . . ?
N4 C11 C12 115.57(19) . . ?
C10 C11 N4 117.8(2) . . ?
C10 C11 C12 126.5(2) . . ?
C14 C12 C11 121.0(2) . . ?
C14 C12 C18 117.6(2) . . ?
C18 C12 C11 121.3(2) . . ?
C12 C14 H14 119.4 . . ?
C12 C14 C15 121.2(3) . . ?
C15 C14 H14 119.4 . . ?
C14 C15 H15 119.9 . . ?
C16 C15 C14 120.2(3) . . ?
C16 C15 H15 119.9 . . ?
C15 C16 H16 120.0 . . ?
C17 C16 C15 119.9(3) . . ?
C17 C16 H16 120.0 . . ?
C16 C17 H17 119.7 . . ?
C16 C17 C18 120.6(3) . . ?
C18 C17 H17 119.7 . . ?
C12 C18 H18 119.7 . . ?
C17 C18 C12 120.5(3) . . ?
C17 C18 H18 119.7 . . ?
N4 C19 N6 120.82(18) . . ?
N5 C19 N4 111.07(18) . . ?
N5 C19 N6 128.10(17) . . ?
N6 C20 C21 123.61(19) . . ?
C25 C20 N6 116.79(17) . . ?
C25 C20 C21 119.60(19) . . ?
C20 C21 H21 120.4 . . ?
C22 C21 C20 119.2(2) . . ?
C22 C21 H21 120.4 . . ?
C21 C22 H22 120.0 . . ?
C23 C22 C21 119.9(2) . . ?
C23 C22 H22 120.0 . . ?
C22 C23 N7 119.4(2) . . ?
C22 C23 C24 121.8(2) . . ?
C24 C23 N7 118.8(2) . . ?
C23 C24 H24 120.7 . . ?
C23 C24 C25 118.6(2) . . ?
C25 C24 H24 120.7 . . ?
C20 C25 H25 119.6 . . ?
C24 C25 C20 120.83(19) . . ?
C24 C25 H25 119.6 . . ?

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
O1 N7 C23 C22 -6.3(4) . . . . ?
O1 N7 C23 C24 171.9(3) . . . . ?
O2 N7 C23 C22 173.7(3) . . . . ?
O2 N7 C23 C24 -8.1(4) . . . . ?
N1 N2 C9 N3 -6.5(3) . . . . ?
N1 N2 C9 N5 174.16(19) . . . . ?
N2 N1 C7 C6 -179.11(18) . . . . ?
N2 N1 C7 C8 -0.6(3) . . . . ?
N3 N4 C11 C10 -120.9(2) . . . . ?
N3 N4 C11 C12 61.8(3) . . . . ?
N3 N4 C19 N5 0.7(2) . . . . ?
N3 N4 C19 N6 -178.47(18) . . . . ?
N4 N3 C9 N2 -179.15(19) . . . . ?
N4 N3 C9 N5 0.2(2) . . . . ?
N4 C11 C12 C14 12.9(3) . . . . ?
N4 C11 C12 C18 -168.0(2) . . . . ?
N6 C20 C21 C22 -178.3(2) . . . . ?
N6 C20 C25 C24 178.9(2) . . . . ?
N7 C23 C24 C25 -177.9(2) . . . . ?
C1 C2 C3 C4 -0.8(5) . . . . ?
C1 C6 C7 N1 -162.0(2) . . . . ?
C1 C6 C7 C8 19.5(3) . . . . ?
C2 C1 C6 C5 -0.7(4) . . . . ?
C2 C1 C6 C7 177.3(2) . . . . ?
C2 C3 C4 C5 -0.2(5) . . . . ?
C3 C4 C5 C6 0.8(5) . . . . ?
C4 C5 C6 C1 -0.3(4) . . . . ?
C4 C5 C6 C7 -178.4(3) . . . . ?
C5 C6 C7 N1 15.9(3) . . . . ?
C5 C6 C7 C8 -162.6(2) . . . . ?
C6 C1 C2 C3 1.3(4) . . . . ?
C7 N1 N2 C9 179.16(19) . . . . ?
C9 N3 N4 C11 -175.71(19) . . . . ?
C9 N3 N4 C19 -0.5(2) . . . . ?
C9 N5 C19 N4 -0.6(2) . . . . ?
C9 N5 C19 N6 178.6(2) . . . . ?
C10 C11 C12 C14 -164.0(2) . . . . ?
C10 C11 C12 C18 15.1(4) . . . . ?
C11 N4 C19 N5 175.3(2) . . . . ?
C11 N4 C19 N6 -3.9(3) . . . . ?
C11 C12 C14 C15 179.4(2) . . . . ?
C11 C12 C18 C17 -178.7(2) . . . . ?
C12 C14 C15 C16 -0.7(5) . . . . ?
C14 C12 C18 C17 0.4(4) . . . . ?
C14 C15 C16 C17 0.5(5) . . . . ?
C15 C16 C17 C18 0.2(5) . . . . ?
C16 C17 C18 C12 -0.7(5) . . . . ?
C18 C12 C14 C15 0.3(4) . . . . ?
C19 N4 C11 C10 65.1(3) . . . . ?
C19 N4 C11 C12 -112.2(3) . . . . ?
C19 N5 C9 N2 179.57(19) . . . . ?
C19 N5 C9 N3 0.2(3) . . . . ?
C19 N6 C20 C21 0.0(4) . . . . ?
C19 N6 C20 C25 179.4(2) . . . . ?
C20 N6 C19 N4 -177.6(2) . . . . ?
C20 N6 C19 N5 3.4(4) . . . . ?
C20 C21 C22 C23 -1.7(4) . . . . ?
C21 C20 C25 C24 -1.6(3) . . . . ?
C21 C22 C23 N7 178.5(2) . . . . ?
C21 C22 C23 C24 0.4(4) . . . . ?
C22 C23 C24 C25 0.3(4) . . . . ?
C23 C24 C25 C20 0.3(3) . . . . ?
C25 C20 C21 C22 2.3(3) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
