# Supplementary Information (SI) for Organic & Biomolecular Chemistry.
# This journal is © The Royal Society of Chemistry 2025

####################################################################### 
# 
# 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_20241108_2_0m
_database_code_depnum_ccdc_archive 'CCDC 2502084'
loop_
_audit_author_name
_audit_author_address
'jian lei'
;Quanzhou normal university
China
;
_audit_update_record             
;
2025-11-11 deposited with the CCDC.	2026-01-05 downloaded from the CCDC.
;
_audit_creation_date             2024-11-08
_audit_creation_method           
;
Olex2 1.5
(compiled 2021.07.19 svn.r715e62df for OlexSys, GUI svn.r6383)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C24 H29 Cl N2 O8'
_chemical_formula_sum            'C24 H29 Cl N2 O8'
_chemical_formula_weight         508.94
_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'
Cl Cl 0.1484 0.1585 '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      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.8003(5)
_cell_length_b                   11.4521(6)
_cell_length_c                   12.3115(6)
_cell_angle_alpha                109.781(2)
_cell_angle_beta                 105.927(2)
_cell_angle_gamma                93.616(2)
_cell_volume                     1231.62(11)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9073
_cell_measurement_temperature    173.00
_cell_measurement_theta_max      57.175
_cell_measurement_theta_min      3.623
_shelx_estimated_absorpt_T_max   0.960
_shelx_estimated_absorpt_T_min   0.960
_exptl_absorpt_coefficient_mu    0.206
_exptl_absorpt_correction_T_max  0.7512
_exptl_absorpt_correction_T_min  0.5817
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1540 before and 0.0632 after correction.
The Ratio of minimum to maximum transmission is 0.7744.
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    1.372
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             536
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.2
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0473
_diffrn_reflns_av_unetI/netI     0.0495
_diffrn_reflns_Laue_measured_fraction_full 0.989
_diffrn_reflns_Laue_measured_fraction_max 0.984
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            15277
_diffrn_reflns_point_group_measured_fraction_full 0.989
_diffrn_reflns_point_group_measured_fraction_max 0.984
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.459
_diffrn_reflns_theta_min         1.852
_diffrn_ambient_temperature      173.00
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.4
_diffrn_source_power             0.07
_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                4236
_reflns_number_total             5012
_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 V8.40B (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         0.341
_refine_diff_density_min         -0.391
_refine_diff_density_rms         0.065
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     324
_refine_ls_number_reflns         5012
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0510
_refine_ls_R_factor_gt           0.0410
_refine_ls_restrained_S_all      1.061
_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)+(0.0710P)²+0.2558P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1155
_refine_ls_wR_factor_ref         0.1231
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(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), C15(H15), C16(H16), C18(H18), C19(H19)
2.b Idealised Me refined as rotating group:
 C1(H1A,H1B,H1C), C6(H6A,H6B,H6C), C7(H7A,H7B,H7C), C9(H9A,H9B,H9C), C10(H10A,
 H10B,H10C), C22(H22A,H22B,H22C), C23(H23A,H23B,H23C), C24(H24A,H24B,H24C)
;
_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
Cl1 Cl 0.83314(5) 0.61645(4) 0.01853(4) 0.03133(14) Uani 1 1 d . . . . .
O1 O 0.76680(12) 0.50798(10) 0.57044(9) 0.0240(3) Uani 1 1 d . . . . .
O2 O 0.75703(13) 0.30257(11) 0.45352(10) 0.0318(3) Uani 1 1 d . . . . .
O3 O 0.45635(13) 0.31570(9) 0.51181(9) 0.0246(3) Uani 1 1 d . . . . .
O4 O 0.32465(13) 0.12133(10) 0.40202(9) 0.0257(3) Uani 1 1 d . . . . .
O5 O 0.32502(13) -0.08445(10) 0.18048(10) 0.0257(3) Uani 1 1 d . . . . .
O6 O 0.13435(12) 0.00882(10) 0.13150(10) 0.0263(3) Uani 1 1 d . . . . .
O7 O 0.29527(13) -0.02260(10) -0.05665(9) 0.0262(3) Uani 1 1 d . . . . .
O8 O 0.35068(14) 0.14714(10) -0.09735(10) 0.0299(3) Uani 1 1 d . . . . .
N1 N 0.42750(13) 0.22005(11) 0.30767(10) 0.0171(3) Uani 1 1 d . . . . .
N2 N 0.59618(14) 0.42101(11) 0.39371(11) 0.0188(3) Uani 1 1 d . . . . .
H2 H 0.577550 0.497727 0.405662 0.023 Uiso 1 1 calc R U . . .
C1 C 0.2408(2) -0.09359(16) -0.18656(14) 0.0325(4) Uani 1 1 d . . . . .
H1A H 0.161282 -0.057509 -0.223669 0.049 Uiso 1 1 calc R U . . .
H1B H 0.206282 -0.181584 -0.201655 0.049 Uiso 1 1 calc R U . . .
H1C H 0.318176 -0.089683 -0.222203 0.049 Uiso 1 1 calc R U . . .
C2 C 0.34814(16) 0.10001(13) -0.02439(13) 0.0182(3) Uani 1 1 d . . . . .
C3 C 0.39837(16) 0.16761(13) 0.10893(13) 0.0178(3) Uani 1 1 d . . . . .
C4 C 0.36337(16) 0.12795(13) 0.19303(13) 0.0175(3) Uani 1 1 d . . . . .
C5 C 0.27499(16) 0.00514(13) 0.16993(13) 0.0181(3) Uani 1 1 d . . . . .
C6 C 0.0406(2) -0.11026(16) 0.09322(19) 0.0376(4) Uani 1 1 d . . . . .
H6A H 0.067438 -0.174672 0.030500 0.056 Uiso 1 1 calc R U . . .
H6B H -0.059497 -0.101234 0.060108 0.056 Uiso 1 1 calc R U . . .
H6C H 0.050256 -0.135480 0.163146 0.056 Uiso 1 1 calc R U . . .
C7 C 0.1919(3) -0.02542(19) 0.4445(2) 0.0530(6) Uani 1 1 d . . . . .
H7A H 0.109959 -0.031092 0.374926 0.080 Uiso 1 1 calc R U . . .
H7B H 0.156556 -0.046997 0.503627 0.080 Uiso 1 1 calc R U . . .
H7C H 0.254517 -0.084231 0.416509 0.080 Uiso 1 1 calc R U . . .
C8 C 0.2764(2) 0.10790(15) 0.50393(15) 0.0286(4) Uani 1 1 d . . . . .
C9 C 0.1807(2) 0.20407(19) 0.53588(18) 0.0392(4) Uani 1 1 d . . . . .
H9A H 0.237666 0.289010 0.570350 0.059 Uiso 1 1 calc R U . . .
H9B H 0.139528 0.190450 0.595632 0.059 Uiso 1 1 calc R U . . .
H9C H 0.102750 0.195054 0.462364 0.059 Uiso 1 1 calc R U . . .
C10 C 0.4052(2) 0.12084(18) 0.61128(16) 0.0361(4) Uani 1 1 d . . . . .
H10A H 0.466239 0.059715 0.584659 0.054 Uiso 1 1 calc R U . . .
H10B H 0.372073 0.104889 0.673992 0.054 Uiso 1 1 calc R U . . .
H10C H 0.460701 0.206299 0.644712 0.054 Uiso 1 1 calc R U . . .
C11 C 0.40600(17) 0.22590(13) 0.41917(13) 0.0186(3) Uani 1 1 d . . . . .
C12 C 0.50708(16) 0.31855(13) 0.29410(13) 0.0177(3) Uani 1 1 d . . . . .
C13 C 0.49005(16) 0.28924(13) 0.17369(13) 0.0174(3) Uani 1 1 d . . . . .
C14 C 0.56620(16) 0.36792(13) 0.12763(13) 0.0177(3) Uani 1 1 d . . . . .
C15 C 0.57018(17) 0.49814(13) 0.17008(13) 0.0198(3) Uani 1 1 d . . . . .
H15 H 0.517006 0.534526 0.223172 0.024 Uiso 1 1 calc R U . . .
C16 C 0.65079(17) 0.57502(14) 0.13571(13) 0.0212(3) Uani 1 1 d . . . . .
H16 H 0.653203 0.663511 0.164797 0.025 Uiso 1 1 calc R U . . .
C17 C 0.72722(17) 0.52071(14) 0.05869(14) 0.0211(3) Uani 1 1 d . . . . .
C18 C 0.72145(18) 0.39156(14) 0.01152(14) 0.0232(3) Uani 1 1 d . . . . .
H18 H 0.772327 0.355578 -0.043682 0.028 Uiso 1 1 calc R U . . .
C19 C 0.64025(17) 0.31568(14) 0.04617(14) 0.0212(3) Uani 1 1 d . . . . .
H19 H 0.635045 0.226931 0.013941 0.025 Uiso 1 1 calc R U . . .
C20 C 0.71268(17) 0.40101(14) 0.47253(14) 0.0216(3) Uani 1 1 d . . . . .
C21 C 0.88441(18) 0.51110(15) 0.67712(14) 0.0259(4) Uani 1 1 d . . . . .
C22 C 0.8376(2) 0.41495(17) 0.72523(17) 0.0397(5) Uani 1 1 d . . . . .
H22A H 0.743594 0.426484 0.736783 0.060 Uiso 1 1 calc R U . . .
H22B H 0.908686 0.426387 0.803190 0.060 Uiso 1 1 calc R U . . .
H22C H 0.830162 0.329850 0.666799 0.060 Uiso 1 1 calc R U . . .
C23 C 1.0224(2) 0.4925(2) 0.64538(17) 0.0448(5) Uani 1 1 d . . . . .
H23A H 1.009100 0.408314 0.583368 0.067 Uiso 1 1 calc R U . . .
H23B H 1.100729 0.500837 0.718395 0.067 Uiso 1 1 calc R U . . .
H23C H 1.046554 0.556241 0.613858 0.067 Uiso 1 1 calc R U . . .
C24 C 0.8997(2) 0.64470(16) 0.76579(15) 0.0307(4) Uani 1 1 d . . . . .
H24A H 0.918774 0.704443 0.728323 0.046 Uiso 1 1 calc R U . . .
H24B H 0.979884 0.660122 0.839872 0.046 Uiso 1 1 calc R U . . .
H24C H 0.810430 0.655752 0.786388 0.046 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
Cl1 C17 1.7405(15) . ?
O1 C20 1.3426(17) . ?
O1 C21 1.4789(19) . ?
O2 C20 1.2057(19) . ?
O3 C11 1.1979(17) . ?
O4 C8 1.5062(18) . ?
O4 C11 1.3154(18) . ?
O5 C5 1.1952(18) . ?
O6 C5 1.3373(19) . ?
O6 C6 1.4477(18) . ?
O7 C1 1.4494(18) . ?
O7 C2 1.3474(17) . ?
O8 C2 1.1990(18) . ?
N1 C4 1.3862(17) . ?
N1 C11 1.4254(18) . ?
N1 C12 1.4131(18) . ?
N2 H2 0.8800 . ?
N2 C12 1.3972(18) . ?
N2 C20 1.369(2) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
C2 C3 1.4779(19) . ?
C3 C4 1.375(2) . ?
C3 C13 1.4423(19) . ?
C4 C5 1.4998(19) . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C7 C8 1.518(2) . ?
C8 C9 1.513(3) . ?
C8 C10 1.513(3) . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C12 C13 1.363(2) . ?
C13 C14 1.4777(19) . ?
C14 C15 1.397(2) . ?
C14 C19 1.392(2) . ?
C15 H15 0.9500 . ?
C15 C16 1.388(2) . ?
C16 H16 0.9500 . ?
C16 C17 1.377(2) . ?
C17 C18 1.385(2) . ?
C18 H18 0.9500 . ?
C18 C19 1.386(2) . ?
C19 H19 0.9500 . ?
C21 C22 1.517(2) . ?
C21 C23 1.515(3) . ?
C21 C24 1.518(2) . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?

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
C20 O1 C21 120.79(12) . . ?
C11 O4 C8 120.23(11) . . ?
C5 O6 C6 114.64(13) . . ?
C2 O7 C1 114.97(12) . . ?
C4 N1 C11 127.76(12) . . ?
C4 N1 C12 107.69(11) . . ?
C12 N1 C11 124.13(11) . . ?
C12 N2 H2 120.3 . . ?
C20 N2 H2 120.3 . . ?
C20 N2 C12 119.42(12) . . ?
O7 C1 H1A 109.5 . . ?
O7 C1 H1B 109.5 . . ?
O7 C1 H1C 109.5 . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
O7 C2 C3 112.25(12) . . ?
O8 C2 O7 122.73(13) . . ?
O8 C2 C3 125.01(13) . . ?
C4 C3 C2 126.39(13) . . ?
C4 C3 C13 107.78(12) . . ?
C13 C3 C2 125.81(13) . . ?
N1 C4 C5 123.85(12) . . ?
C3 C4 N1 108.64(12) . . ?
C3 C4 C5 127.49(12) . . ?
O5 C5 O6 125.33(13) . . ?
O5 C5 C4 123.95(14) . . ?
O6 C5 C4 110.67(12) . . ?
O6 C6 H6A 109.5 . . ?
O6 C6 H6B 109.5 . . ?
O6 C6 H6C 109.5 . . ?
H6A C6 H6B 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
H7A C7 H7B 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
C8 C7 H7C 109.5 . . ?
O4 C8 C7 101.48(12) . . ?
O4 C8 C9 108.38(14) . . ?
O4 C8 C10 110.49(14) . . ?
C9 C8 C7 111.67(17) . . ?
C9 C8 C10 112.84(15) . . ?
C10 C8 C7 111.35(17) . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
C8 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C8 C10 H10A 109.5 . . ?
C8 C10 H10B 109.5 . . ?
C8 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
O3 C11 O4 127.67(14) . . ?
O3 C11 N1 122.54(13) . . ?
O4 C11 N1 109.78(12) . . ?
N2 C12 N1 122.32(12) . . ?
C13 C12 N1 108.89(12) . . ?
C13 C12 N2 128.57(13) . . ?
C3 C13 C14 129.57(13) . . ?
C12 C13 C3 106.98(12) . . ?
C12 C13 C14 123.23(13) . . ?
C15 C14 C13 119.92(13) . . ?
C19 C14 C13 121.26(13) . . ?
C19 C14 C15 118.76(13) . . ?
C14 C15 H15 119.6 . . ?
C16 C15 C14 120.88(14) . . ?
C16 C15 H15 119.6 . . ?
C15 C16 H16 120.6 . . ?
C17 C16 C15 118.80(14) . . ?
C17 C16 H16 120.6 . . ?
C16 C17 Cl1 119.30(11) . . ?
C16 C17 C18 121.76(14) . . ?
C18 C17 Cl1 118.94(12) . . ?
C17 C18 H18 120.6 . . ?
C17 C18 C19 118.90(14) . . ?
C19 C18 H18 120.6 . . ?
C14 C19 H19 119.6 . . ?
C18 C19 C14 120.82(13) . . ?
C18 C19 H19 119.6 . . ?
O1 C20 N2 108.61(13) . . ?
O2 C20 O1 127.32(15) . . ?
O2 C20 N2 124.07(14) . . ?
O1 C21 C22 109.56(14) . . ?
O1 C21 C23 110.53(13) . . ?
O1 C21 C24 101.75(13) . . ?
C22 C21 C24 111.37(14) . . ?
C23 C21 C22 113.09(17) . . ?
C23 C21 C24 109.98(15) . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C21 C24 H24A 109.5 . . ?
C21 C24 H24B 109.5 . . ?
C21 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?

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
Cl1 C17 C18 C19 178.24(12) . . . . ?
O7 C2 C3 C4 -17.5(2) . . . . ?
O7 C2 C3 C13 164.38(14) . . . . ?
O8 C2 C3 C4 161.29(16) . . . . ?
O8 C2 C3 C13 -16.8(2) . . . . ?
N1 C4 C5 O5 -81.74(19) . . . . ?
N1 C4 C5 O6 100.84(16) . . . . ?
N1 C12 C13 C3 -0.76(17) . . . . ?
N1 C12 C13 C14 -175.89(13) . . . . ?
N2 C12 C13 C3 173.84(15) . . . . ?
N2 C12 C13 C14 -1.3(3) . . . . ?
C1 O7 C2 O8 -0.3(2) . . . . ?
C1 O7 C2 C3 178.55(14) . . . . ?
C2 C3 C4 N1 -177.62(14) . . . . ?
C2 C3 C4 C5 4.1(2) . . . . ?
C2 C3 C13 C12 178.41(14) . . . . ?
C2 C3 C13 C14 -6.9(2) . . . . ?
C3 C4 C5 O5 96.3(2) . . . . ?
C3 C4 C5 O6 -81.14(19) . . . . ?
C3 C13 C14 C15 138.88(16) . . . . ?
C3 C13 C14 C19 -44.0(2) . . . . ?
C4 N1 C11 O3 -172.74(14) . . . . ?
C4 N1 C11 O4 6.7(2) . . . . ?
C4 N1 C12 N2 -173.76(13) . . . . ?
C4 N1 C12 C13 1.25(17) . . . . ?
C4 C3 C13 C12 0.00(17) . . . . ?
C4 C3 C13 C14 174.71(15) . . . . ?
C6 O6 C5 O5 -4.3(2) . . . . ?
C6 O6 C5 C4 173.11(13) . . . . ?
C8 O4 C11 O3 4.2(2) . . . . ?
C8 O4 C11 N1 -175.28(13) . . . . ?
C11 O4 C8 C7 -178.34(16) . . . . ?
C11 O4 C8 C9 63.98(19) . . . . ?
C11 O4 C8 C10 -60.13(19) . . . . ?
C11 N1 C4 C3 171.53(14) . . . . ?
C11 N1 C4 C5 -10.1(2) . . . . ?
C11 N1 C12 N2 13.2(2) . . . . ?
C11 N1 C12 C13 -171.84(14) . . . . ?
C12 N1 C4 C3 -1.24(16) . . . . ?
C12 N1 C4 C5 177.10(13) . . . . ?
C12 N1 C11 O3 -1.1(2) . . . . ?
C12 N1 C11 O4 178.40(13) . . . . ?
C12 N2 C20 O1 -169.69(13) . . . . ?
C12 N2 C20 O2 10.9(2) . . . . ?
C12 C13 C14 C15 -47.2(2) . . . . ?
C12 C13 C14 C19 129.93(16) . . . . ?
C13 C3 C4 N1 0.77(17) . . . . ?
C13 C3 C4 C5 -177.49(14) . . . . ?
C13 C14 C15 C16 174.70(14) . . . . ?
C13 C14 C19 C18 -174.46(14) . . . . ?
C14 C15 C16 C17 0.0(2) . . . . ?
C15 C14 C19 C18 2.7(2) . . . . ?
C15 C16 C17 Cl1 -178.05(12) . . . . ?
C15 C16 C17 C18 2.4(2) . . . . ?
C16 C17 C18 C19 -2.2(2) . . . . ?
C17 C18 C19 C14 -0.4(2) . . . . ?
C19 C14 C15 C16 -2.5(2) . . . . ?
C20 O1 C21 C22 -57.49(19) . . . . ?
C20 O1 C21 C23 67.77(19) . . . . ?
C20 O1 C21 C24 -175.45(13) . . . . ?
C20 N2 C12 N1 62.98(19) . . . . ?
C20 N2 C12 C13 -110.97(18) . . . . ?
C21 O1 C20 O2 -7.1(2) . . . . ?
C21 O1 C20 N2 173.58(12) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
