# Electronic Supplementary Material (ESI) for ChemComm.
# 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 
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data_190625_zjut_kn_0m_pl
_database_code_depnum_ccdc_archive 'CCDC 1961004'
loop_
_audit_author_name
_audit_author_address
pyrazole-pyran-quinoline
;Zhejiang University of Technology
China
;
_audit_update_record             
;
2020-11-25 deposited with the CCDC.	2021-04-06 downloaded from the CCDC.
;
_audit_creation_date             2019-06-26
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2016/6
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C24 H19 N3 O3'
_chemical_formula_sum            'C24 H19 N3 O3'
_chemical_formula_weight         397.42
_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 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 '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      orthorhombic
_space_group_IT_number           61
_space_group_name_H-M_alt        'P b c a'
_space_group_name_Hall           '-P 2ac 2ab'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'-x-1/2, y-1/2, z'
'x, -y-1/2, z-1/2'

_cell_length_a                   14.7277(5)
_cell_length_b                   12.2930(4)
_cell_length_c                   21.1373(7)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     3826.9(2)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    9152
_cell_measurement_temperature    170(2)
_cell_measurement_theta_max      72.07
_cell_measurement_theta_min      3.60
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    0.753
_exptl_absorpt_correction_T_max  0.7536
_exptl_absorpt_correction_T_min  0.6106
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1152 before and 0.0498 after correction.
The Ratio of minimum to maximum transmission is 0.8102.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.380
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1664
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.23
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0268
_diffrn_reflns_av_unetI/netI     0.0222
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            23639
_diffrn_reflns_point_group_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         72.067
_diffrn_reflns_theta_min         4.183
_diffrn_ambient_temperature      170.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                3612
_reflns_number_total             3741
_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 V8.38A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.38A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         0.241
_refine_diff_density_min         -0.216
_refine_diff_density_rms         0.040
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.082
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     273
_refine_ls_number_reflns         3741
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0390
_refine_ls_R_factor_gt           0.0380
_refine_ls_restrained_S_all      1.082
_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)+(0.0462P)²+1.2918P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0979
_refine_ls_wR_factor_ref         0.0988
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C12(H12)
2.b Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C3(H3), C4(H4), C7(H7), C20(H20), C21(H21), C22(H22),
 C23(H23), C24(H24)
2.c X=CH2 refined with riding coordinates:
 C17(H17A,H17B)
2.d Idealised Me refined as rotating group:
 C16(H16A,H16B,H16C), C18(H18A,H18B,H18C)
;
_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 0.37510(6) -0.05430(7) 0.50058(4) 0.0301(2) Uani 1 1 d . . . . .
O2 O 0.18654(7) -0.03154(7) 0.41492(5) 0.0357(2) Uani 1 1 d . . . . .
O3 O 0.12725(7) 0.05002(8) 0.32926(5) 0.0392(2) Uani 1 1 d . . . . .
N1 N 0.30692(7) -0.00756(8) 0.59046(5) 0.0267(2) Uani 1 1 d . . . . .
N2 N 0.48023(7) -0.03064(9) 0.35144(5) 0.0296(2) Uani 1 1 d . . . . .
N3 N 0.46430(7) -0.08198(8) 0.40834(5) 0.0269(2) Uani 1 1 d . . . . .
C1 C 0.16766(9) 0.22645(11) 0.64391(6) 0.0343(3) Uani 1 1 d . . . . .
H1 H 0.142260 0.292207 0.628283 0.041 Uiso 1 1 calc R . . . .
C2 C 0.15443(10) 0.19709(12) 0.70557(6) 0.0388(3) Uani 1 1 d . . . . .
H2 H 0.119479 0.242595 0.732534 0.047 Uiso 1 1 calc R . . . .
C3 C 0.19198(10) 0.10016(12) 0.72966(6) 0.0369(3) Uani 1 1 d . . . . .
H3 H 0.182294 0.081086 0.772686 0.044 Uiso 1 1 calc R . . . .
C4 C 0.24230(9) 0.03323(11) 0.69160(6) 0.0321(3) Uani 1 1 d . . . . .
H4 H 0.267695 -0.031765 0.708278 0.039 Uiso 1 1 calc R . . . .
C5 C 0.25646(8) 0.06100(10) 0.62735(5) 0.0264(2) Uani 1 1 d . . . . .
C6 C 0.21933(8) 0.15870(10) 0.60327(6) 0.0276(3) Uani 1 1 d . . . . .
C7 C 0.23800(8) 0.18504(10) 0.53939(5) 0.0265(2) Uani 1 1 d . . . . .
H7 H 0.214337 0.250362 0.521927 0.032 Uiso 1 1 calc R . . . .
C8 C 0.28951(8) 0.11793(10) 0.50249(5) 0.0244(2) Uani 1 1 d . . . . .
C9 C 0.32164(8) 0.02134(9) 0.53247(5) 0.0246(2) Uani 1 1 d . . . . .
C10 C 0.40399(8) -0.02258(10) 0.44252(5) 0.0250(2) Uani 1 1 d . . . . .
C11 C 0.38023(8) 0.06773(10) 0.40975(5) 0.0252(2) Uani 1 1 d . . . . .
C12 C 0.31165(8) 0.14747(9) 0.43407(5) 0.0245(2) Uani 1 1 d . . . . .
H12 H 0.340310 0.221220 0.433973 0.029 Uiso 1 1 calc R . . . .
C13 C 0.43010(8) 0.05919(10) 0.35296(6) 0.0279(3) Uani 1 1 d . . . . .
C14 C 0.22723(8) 0.15237(9) 0.39272(5) 0.0245(2) Uani 1 1 d . . . . .
C15 C 0.17900(8) 0.04769(10) 0.38144(6) 0.0271(3) Uani 1 1 d . . . . .
C16 C 0.07650(12) -0.04782(13) 0.31637(8) 0.0502(4) Uani 1 1 d . . . . .
H16A H 0.052529 -0.044994 0.273149 0.075 Uiso 1 1 calc GR . . . .
H16B H 0.026054 -0.053827 0.346399 0.075 Uiso 1 1 calc GR . . . .
H16C H 0.116433 -0.111137 0.320792 0.075 Uiso 1 1 calc GR . . . .
C17 C 0.19613(9) 0.24519(11) 0.36921(6) 0.0305(3) Uani 1 1 d . . . . .
H17A H 0.142114 0.245724 0.344646 0.037 Uiso 1 1 calc R . . . .
H17B H 0.227874 0.311139 0.376927 0.037 Uiso 1 1 calc R . . . .
C18 C 0.43131(10) 0.13788(11) 0.29894(6) 0.0386(3) Uani 1 1 d . . . . .
H18A H 0.457998 0.206820 0.312948 0.058 Uiso 1 1 calc GR . . . .
H18B H 0.369089 0.150544 0.284253 0.058 Uiso 1 1 calc GR . . . .
H18C H 0.467632 0.107795 0.264261 0.058 Uiso 1 1 calc GR . . . .
C19 C 0.50498(8) -0.18500(10) 0.42094(6) 0.0274(3) Uani 1 1 d . . . . .
C20 C 0.49515(8) -0.23562(11) 0.47927(6) 0.0324(3) Uani 1 1 d . . . . .
H20 H 0.462134 -0.200988 0.512214 0.039 Uiso 1 1 calc R . . . .
C21 C 0.53387(9) -0.33708(11) 0.48912(7) 0.0368(3) Uani 1 1 d . . . . .
H21 H 0.526548 -0.372175 0.528835 0.044 Uiso 1 1 calc R . . . .
C22 C 0.58306(9) -0.38779(11) 0.44174(7) 0.0393(3) Uani 1 1 d . . . . .
H22 H 0.609496 -0.457254 0.448719 0.047 Uiso 1 1 calc R . . . .
C23 C 0.59318(10) -0.33602(12) 0.38422(7) 0.0395(3) Uani 1 1 d . . . . .
H23 H 0.627353 -0.370162 0.351681 0.047 Uiso 1 1 calc R . . . .
C24 C 0.55440(9) -0.23518(11) 0.37310(6) 0.0340(3) Uani 1 1 d . . . . .
H24 H 0.561490 -0.200662 0.333195 0.041 Uiso 1 1 calc R . . . .


_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 C9 1.3924(14) . ?
O1 C10 1.3562(14) . ?
O2 C15 1.2090(15) . ?
O3 C15 1.3409(15) . ?
O3 C16 1.4421(18) . ?
N1 C5 1.3677(16) . ?
N1 C9 1.2945(15) . ?
N2 N3 1.3784(14) . ?
N2 C13 1.3288(16) . ?
N3 C10 1.3579(15) . ?
N3 C19 1.4261(16) . ?
C1 H1 0.9500 . ?
C1 C2 1.3663(19) . ?
C1 C6 1.4180(17) . ?
C2 H2 0.9500 . ?
C2 C3 1.409(2) . ?
C3 H3 0.9500 . ?
C3 C4 1.3686(19) . ?
C4 H4 0.9500 . ?
C4 C5 1.4158(16) . ?
C5 C6 1.4146(17) . ?
C6 C7 1.4155(16) . ?
C7 H7 0.9500 . ?
C7 C8 1.3654(17) . ?
C8 C9 1.4266(16) . ?
C8 C12 1.5264(15) . ?
C10 C11 1.3545(17) . ?
C11 C12 1.4984(16) . ?
C11 C13 1.4112(17) . ?
C12 H12 1.0000 . ?
C12 C14 1.5211(15) . ?
C13 C18 1.4965(18) . ?
C14 C15 1.4891(17) . ?
C14 C17 1.3260(17) . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17A 0.9500 . ?
C17 H17B 0.9500 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C20 1.3887(18) . ?
C19 C24 1.3902(18) . ?
C20 H20 0.9500 . ?
C20 C21 1.3872(18) . ?
C21 H21 0.9500 . ?
C21 C22 1.384(2) . ?
C22 H22 0.9500 . ?
C22 C23 1.380(2) . ?
C23 H23 0.9500 . ?
C23 C24 1.385(2) . ?
C24 H24 0.9500 . ?

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
C10 O1 C9 115.05(9) . . ?
C15 O3 C16 115.61(11) . . ?
C9 N1 C5 117.50(10) . . ?
C13 N2 N3 105.36(10) . . ?
N2 N3 C19 119.87(10) . . ?
C10 N3 N2 109.23(10) . . ?
C10 N3 C19 130.77(10) . . ?
C2 C1 H1 120.0 . . ?
C2 C1 C6 119.96(13) . . ?
C6 C1 H1 120.0 . . ?
C1 C2 H2 119.6 . . ?
C1 C2 C3 120.80(12) . . ?
C3 C2 H2 119.6 . . ?
C2 C3 H3 119.7 . . ?
C4 C3 C2 120.57(12) . . ?
C4 C3 H3 119.7 . . ?
C3 C4 H4 120.0 . . ?
C3 C4 C5 119.91(12) . . ?
C5 C4 H4 120.0 . . ?
N1 C5 C4 118.58(11) . . ?
N1 C5 C6 121.88(10) . . ?
C6 C5 C4 119.54(11) . . ?
C5 C6 C1 119.22(11) . . ?
C5 C6 C7 117.54(11) . . ?
C7 C6 C1 123.22(12) . . ?
C6 C7 H7 119.5 . . ?
C8 C7 C6 120.97(11) . . ?
C8 C7 H7 119.5 . . ?
C7 C8 C9 115.69(10) . . ?
C7 C8 C12 121.07(10) . . ?
C9 C8 C12 123.23(10) . . ?
O1 C9 C8 121.89(10) . . ?
N1 C9 O1 111.70(10) . . ?
N1 C9 C8 126.40(11) . . ?
O1 C10 N3 122.14(10) . . ?
C11 C10 O1 128.12(11) . . ?
C11 C10 N3 109.73(10) . . ?
C10 C11 C12 122.34(10) . . ?
C10 C11 C13 103.86(11) . . ?
C13 C11 C12 133.73(11) . . ?
C8 C12 H12 107.9 . . ?
C11 C12 C8 108.27(9) . . ?
C11 C12 H12 107.9 . . ?
C11 C12 C14 112.32(9) . . ?
C14 C12 C8 112.28(9) . . ?
C14 C12 H12 107.9 . . ?
N2 C13 C11 111.81(11) . . ?
N2 C13 C18 120.81(11) . . ?
C11 C13 C18 127.38(11) . . ?
C15 C14 C12 116.59(10) . . ?
C17 C14 C12 122.12(11) . . ?
C17 C14 C15 121.26(11) . . ?
O2 C15 O3 123.42(11) . . ?
O2 C15 C14 123.97(11) . . ?
O3 C15 C14 112.60(10) . . ?
O3 C16 H16A 109.5 . . ?
O3 C16 H16B 109.5 . . ?
O3 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C14 C17 H17A 120.0 . . ?
C14 C17 H17B 120.0 . . ?
H17A C17 H17B 120.0 . . ?
C13 C18 H18A 109.5 . . ?
C13 C18 H18B 109.5 . . ?
C13 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 N3 121.32(11) . . ?
C20 C19 C24 120.11(12) . . ?
C24 C19 N3 118.57(11) . . ?
C19 C20 H20 120.2 . . ?
C21 C20 C19 119.55(12) . . ?
C21 C20 H20 120.2 . . ?
C20 C21 H21 119.6 . . ?
C22 C21 C20 120.76(13) . . ?
C22 C21 H21 119.6 . . ?
C21 C22 H22 120.5 . . ?
C23 C22 C21 119.08(13) . . ?
C23 C22 H22 120.5 . . ?
C22 C23 H23 119.4 . . ?
C22 C23 C24 121.17(13) . . ?
C24 C23 H23 119.4 . . ?
C19 C24 H24 120.3 . . ?
C23 C24 C19 119.32(13) . . ?
C23 C24 H24 120.3 . . ?

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 C10 C11 C12 -2.53(19) . . . . ?
O1 C10 C11 C13 -179.87(11) . . . . ?
N1 C5 C6 C1 -179.95(11) . . . . ?
N1 C5 C6 C7 -1.48(17) . . . . ?
N2 N3 C10 O1 179.43(10) . . . . ?
N2 N3 C10 C11 -0.62(13) . . . . ?
N2 N3 C19 C20 175.77(11) . . . . ?
N2 N3 C19 C24 -4.94(16) . . . . ?
N3 N2 C13 C11 -0.69(13) . . . . ?
N3 N2 C13 C18 178.79(11) . . . . ?
N3 C10 C11 C12 177.53(10) . . . . ?
N3 C10 C11 C13 0.19(13) . . . . ?
N3 C19 C20 C21 178.38(11) . . . . ?
N3 C19 C24 C23 -179.02(11) . . . . ?
C1 C2 C3 C4 -0.2(2) . . . . ?
C1 C6 C7 C8 178.82(12) . . . . ?
C2 C1 C6 C5 0.12(19) . . . . ?
C2 C1 C6 C7 -178.25(13) . . . . ?
C2 C3 C4 C5 -0.4(2) . . . . ?
C3 C4 C5 N1 -179.90(12) . . . . ?
C3 C4 C5 C6 0.83(19) . . . . ?
C4 C5 C6 C1 -0.70(17) . . . . ?
C4 C5 C6 C7 177.77(11) . . . . ?
C5 N1 C9 O1 178.85(10) . . . . ?
C5 N1 C9 C8 -0.70(18) . . . . ?
C5 C6 C7 C8 0.41(17) . . . . ?
C6 C1 C2 C3 0.3(2) . . . . ?
C6 C7 C8 C9 0.42(17) . . . . ?
C6 C7 C8 C12 -178.50(10) . . . . ?
C7 C8 C9 O1 -179.82(10) . . . . ?
C7 C8 C9 N1 -0.31(18) . . . . ?
C7 C8 C12 C11 171.28(10) . . . . ?
C7 C8 C12 C14 -64.15(14) . . . . ?
C8 C12 C14 C15 -66.82(13) . . . . ?
C8 C12 C14 C17 111.27(12) . . . . ?
C9 O1 C10 N3 172.89(10) . . . . ?
C9 O1 C10 C11 -7.04(17) . . . . ?
C9 N1 C5 C4 -177.65(11) . . . . ?
C9 N1 C5 C6 1.60(17) . . . . ?
C9 C8 C12 C11 -7.56(15) . . . . ?
C9 C8 C12 C14 117.01(12) . . . . ?
C10 O1 C9 N1 -171.18(10) . . . . ?
C10 O1 C9 C8 8.40(15) . . . . ?
C10 N3 C19 C20 -8.95(19) . . . . ?
C10 N3 C19 C24 170.33(12) . . . . ?
C10 C11 C12 C8 9.23(15) . . . . ?
C10 C11 C12 C14 -115.32(12) . . . . ?
C10 C11 C13 N2 0.32(14) . . . . ?
C10 C11 C13 C18 -179.11(12) . . . . ?
C11 C12 C14 C15 55.48(13) . . . . ?
C11 C12 C14 C17 -126.42(12) . . . . ?
C12 C8 C9 O1 -0.92(17) . . . . ?
C12 C8 C9 N1 178.59(11) . . . . ?
C12 C11 C13 N2 -176.57(12) . . . . ?
C12 C11 C13 C18 4.0(2) . . . . ?
C12 C14 C15 O2 20.76(17) . . . . ?
C12 C14 C15 O3 -158.12(10) . . . . ?
C13 N2 N3 C10 0.79(13) . . . . ?
C13 N2 N3 C19 177.00(10) . . . . ?
C13 C11 C12 C8 -174.34(12) . . . . ?
C13 C11 C12 C14 61.10(17) . . . . ?
C16 O3 C15 O2 2.77(19) . . . . ?
C16 O3 C15 C14 -178.34(12) . . . . ?
C17 C14 C15 O2 -157.35(12) . . . . ?
C17 C14 C15 O3 23.77(16) . . . . ?
C19 N3 C10 O1 3.77(19) . . . . ?
C19 N3 C10 C11 -176.28(11) . . . . ?
C19 C20 C21 C22 0.8(2) . . . . ?
C20 C19 C24 C23 0.28(19) . . . . ?
C20 C21 C22 C23 0.0(2) . . . . ?
C21 C22 C23 C24 -0.6(2) . . . . ?
C22 C23 C24 C19 0.5(2) . . . . ?
C24 C19 C20 C21 -0.89(19) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
