# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 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_HZ_15_0m_a
_database_code_depnum_ccdc_archive 'CCDC 2097117'
loop_
_audit_author_name
_audit_author_address
boyer
;qwdsa
China
;
_audit_update_record             
;
2021-07-17 deposited with the CCDC.	2022-10-10 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C24 H23 N O4 S2'
_chemical_formula_weight         453.55

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'
S S 0.1246 0.1234 '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                   11.278(6)
_cell_length_b                   12.642(7)
_cell_length_c                   16.165(9)
_cell_angle_alpha                90
_cell_angle_beta                 104.281(8)
_cell_angle_gamma                90
_cell_volume                     2234(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    2849
_cell_measurement_theta_min      2.46
_cell_measurement_theta_max      22.87

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.349
_exptl_crystal_F_000             952
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.110
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.070
_exptl_absorpt_coefficient_mu    0.269
_shelx_estimated_absorpt_T_min   0.971
_shelx_estimated_absorpt_T_max   0.981
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_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            13745
_diffrn_reflns_av_unetI/netI     0.0441
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         1.992
_diffrn_reflns_theta_max         27.579
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.988
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.988
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             5109
_reflns_number_gt                3321
_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 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_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)+(0.0750P)²] 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         5109
_refine_ls_number_parameters     282
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0793
_refine_ls_R_factor_gt           0.0472
_refine_ls_wR_factor_ref         0.1419
_refine_ls_wR_factor_gt          0.1233
_refine_ls_goodness_of_fit_ref   1.012
_refine_ls_restrained_S_all      1.012
_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
S1 S 0.82636(6) 0.76879(5) 0.54987(3) 0.0665(2) Uani 1 1 d . . . . .
S2 S 0.63214(5) 0.37853(4) 0.52393(3) 0.05148(18) Uani 1 1 d . . . . .
O1 O 0.94531(16) 0.79418(15) 0.54004(11) 0.0825(6) Uani 1 1 d . . . . .
O2 O 0.7997(2) 0.77191(15) 0.63145(10) 0.0875(6) Uani 1 1 d . . . . .
O3 O 0.55929(14) 0.41525(13) 0.57881(10) 0.0640(4) Uani 1 1 d . . . . .
O4 O 0.57402(15) 0.33673(13) 0.44126(10) 0.0663(4) Uani 1 1 d . . . . .
N1 N 0.80158(17) 0.64561(15) 0.51799(10) 0.0564(5) Uani 1 1 d . . . . .
C1 C 0.4491(4) 1.0213(3) 0.2987(3) 0.1415(16) Uani 1 1 d . . . . .
H1 H 0.369827 1.002567 0.306024 0.212 Uiso 1 1 calc R U . . .
H23 H 0.454147 1.002714 0.242083 0.212 Uiso 1 1 calc R U . . .
H3 H 0.461565 1.096004 0.307055 0.212 Uiso 1 1 calc R U . . .
C2 C 0.5470(3) 0.9618(2) 0.3636(2) 0.0856(9) Uani 1 1 d . . . . .
C3 C 0.5142(3) 0.9040(2) 0.4263(2) 0.0870(9) Uani 1 1 d . . . . .
H22 H 0.432994 0.903528 0.429415 0.104 Uiso 1 1 calc R U . . .
C4 C 0.5992(3) 0.8470(2) 0.48425(18) 0.0745(8) Uani 1 1 d . . . . .
H21 H 0.575825 0.808303 0.526524 0.089 Uiso 1 1 calc R U . . .
C5 C 0.7200(2) 0.84739(18) 0.47959(14) 0.0591(6) Uani 1 1 d . . . . .
C6 C 0.7265(2) 0.57450(17) 0.54624(12) 0.0509(5) Uani 1 1 d . . . . .
H18 H 0.682969 0.590446 0.586604 0.061 Uiso 1 1 calc R U . . .
C7 C 0.72428(18) 0.48192(17) 0.50901(12) 0.0463(5) Uani 1 1 d . . . . .
C8 C 0.73117(19) 0.28023(15) 0.57917(13) 0.0460(5) Uani 1 1 d . . . . .
C9 C 0.7555(2) 0.27472(17) 0.66669(14) 0.0558(6) Uani 1 1 d . . . . .
H17 H 0.723263 0.325057 0.697018 0.067 Uiso 1 1 calc R U . . .
C10 C 0.8278(2) 0.19409(18) 0.70920(14) 0.0616(6) Uani 1 1 d . . . . .
H12 H 0.843392 0.190460 0.768368 0.074 Uiso 1 1 calc R U . . .
C11 C 0.8776(2) 0.11892(18) 0.66631(15) 0.0577(6) Uani 1 1 d . . . . .
C12 C 0.9547(3) 0.0312(2) 0.71377(19) 0.0873(9) Uani 1 1 d . . . . .
H14 H 0.972890 0.045278 0.773950 0.131 Uiso 1 1 calc R U . . .
H13 H 1.029608 0.026572 0.695845 0.131 Uiso 1 1 calc R U . . .
H2 H 0.911062 -0.034470 0.701926 0.131 Uiso 1 1 calc R U . . .
C13 C 0.8028(2) 0.48116(18) 0.44625(15) 0.0600(6) Uani 1 1 d . . . . .
H10 H 0.756212 0.459396 0.390072 0.072 Uiso 1 1 calc R U . . .
H11 H 0.872363 0.434299 0.464872 0.072 Uiso 1 1 calc R U . . .
C14 C 0.8444(2) 0.59805(18) 0.44583(13) 0.0533(5) Uani 1 1 d . . . . .
H9 H 0.933940 0.600868 0.458952 0.064 Uiso 1 1 calc R U . . .
C15 C 0.79219(19) 0.65309(16) 0.36187(12) 0.0458(5) Uani 1 1 d . . . . .
C16 C 0.6673(2) 0.66006(18) 0.33029(13) 0.0531(5) Uani 1 1 d . . . . .
H8 H 0.615219 0.631676 0.361013 0.064 Uiso 1 1 calc R U . . .
C17 C 0.6198(2) 0.70895(19) 0.25341(14) 0.0649(7) Uani 1 1 d . . . . .
H4 H 0.535543 0.715092 0.232764 0.078 Uiso 1 1 calc R U . . .
C18 C 0.6960(3) 0.7486(2) 0.20717(15) 0.0725(8) Uani 1 1 d . . . . .
H7 H 0.663172 0.780473 0.154659 0.087 Uiso 1 1 calc R U . . .
C19 C 0.8198(3) 0.7418(2) 0.23733(16) 0.0718(8) Uani 1 1 d . . . . .
H5 H 0.871182 0.768904 0.205501 0.086 Uiso 1 1 calc R U . . .
C20 C 0.8687(2) 0.69449(18) 0.31562(14) 0.0586(6) Uani 1 1 d . . . . .
H6 H 0.953076 0.690674 0.336898 0.070 Uiso 1 1 calc R U . . .
C21 C 0.8534(2) 0.12668(18) 0.57866(16) 0.0627(6) Uani 1 1 d . . . . .
H16 H 0.887233 0.077250 0.548544 0.075 Uiso 1 1 calc R U . . .
C22 C 0.7805(2) 0.20555(18) 0.53469(14) 0.0580(6) Uani 1 1 d . . . . .
H15 H 0.764515 0.208757 0.475486 0.070 Uiso 1 1 calc R U . . .
C23 C 0.7540(3) 0.90683(19) 0.41742(15) 0.0643(6) Uani 1 1 d . . . . .
H19 H 0.835157 0.908306 0.414117 0.077 Uiso 1 1 calc R U . . .
C24 C 0.6672(3) 0.9632(2) 0.36106(18) 0.0781(8) Uani 1 1 d . . . . .
H20 H 0.690391 1.003823 0.319711 0.094 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
S1 O2 1.4234(18) . ?
S1 O1 1.426(2) . ?
S1 N1 1.642(2) . ?
S1 C5 1.745(3) . ?
S2 O3 1.4272(16) . ?
S2 O4 1.4362(18) . ?
S2 C7 1.723(2) . ?
S2 C8 1.760(2) . ?
N1 C6 1.388(3) . ?
N1 C14 1.495(3) . ?
C1 C2 1.521(4) . ?
C1 H1 0.9600 . ?
C1 H23 0.9600 . ?
C1 H3 0.9600 . ?
C2 C24 1.366(4) . ?
C2 C3 1.372(4) . ?
C3 C4 1.368(4) . ?
C3 H22 0.9300 . ?
C4 C5 1.383(3) . ?
C4 H21 0.9300 . ?
C5 C23 1.383(3) . ?
C6 C7 1.314(3) . ?
C6 H18 0.9300 . ?
C7 C13 1.502(3) . ?
C8 C9 1.375(3) . ?
C8 C22 1.384(3) . ?
C9 C10 1.379(3) . ?
C9 H17 0.9300 . ?
C10 C11 1.375(3) . ?
C10 H12 0.9300 . ?
C11 C21 1.379(3) . ?
C11 C12 1.499(3) . ?
C12 H14 0.9600 . ?
C12 H13 0.9600 . ?
C12 H2 0.9600 . ?
C13 C14 1.551(3) . ?
C13 H10 0.9700 . ?
C13 H11 0.9700 . ?
C14 C15 1.509(3) . ?
C14 H9 0.9800 . ?
C15 C20 1.377(3) . ?
C15 C16 1.377(3) . ?
C16 C17 1.373(3) . ?
C16 H8 0.9300 . ?
C17 C18 1.366(3) . ?
C17 H4 0.9300 . ?
C18 C19 1.363(4) . ?
C18 H7 0.9300 . ?
C19 C20 1.386(3) . ?
C19 H5 0.9300 . ?
C20 H6 0.9300 . ?
C21 C22 1.373(3) . ?
C21 H16 0.9300 . ?
C22 H15 0.9300 . ?
C23 C24 1.363(4) . ?
C23 H19 0.9300 . ?
C24 H20 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
O2 S1 O1 121.09(11) . . ?
O2 S1 N1 104.98(10) . . ?
O1 S1 N1 105.69(11) . . ?
O2 S1 C5 108.60(13) . . ?
O1 S1 C5 108.30(12) . . ?
N1 S1 C5 107.41(10) . . ?
O3 S2 O4 119.83(11) . . ?
O3 S2 C7 107.45(10) . . ?
O4 S2 C7 107.54(10) . . ?
O3 S2 C8 107.75(10) . . ?
O4 S2 C8 107.40(10) . . ?
C7 S2 C8 106.10(11) . . ?
C6 N1 C14 109.71(18) . . ?
C6 N1 S1 125.55(16) . . ?
C14 N1 S1 124.31(14) . . ?
C2 C1 H1 109.5 . . ?
C2 C1 H23 109.5 . . ?
H1 C1 H23 109.5 . . ?
C2 C1 H3 109.5 . . ?
H1 C1 H3 109.5 . . ?
H23 C1 H3 109.5 . . ?
C24 C2 C3 118.6(3) . . ?
C24 C2 C1 122.0(3) . . ?
C3 C2 C1 119.4(3) . . ?
C4 C3 C2 121.0(3) . . ?
C4 C3 H22 119.5 . . ?
C2 C3 H22 119.5 . . ?
C3 C4 C5 119.6(2) . . ?
C3 C4 H21 120.2 . . ?
C5 C4 H21 120.2 . . ?
C23 C5 C4 119.7(3) . . ?
C23 C5 S1 120.9(2) . . ?
C4 C5 S1 119.41(19) . . ?
C7 C6 N1 111.7(2) . . ?
C7 C6 H18 124.1 . . ?
N1 C6 H18 124.1 . . ?
C6 C7 C13 111.56(19) . . ?
C6 C7 S2 123.74(16) . . ?
C13 C7 S2 124.47(17) . . ?
C9 C8 C22 119.8(2) . . ?
C9 C8 S2 119.89(16) . . ?
C22 C8 S2 120.29(17) . . ?
C8 C9 C10 119.6(2) . . ?
C8 C9 H17 120.2 . . ?
C10 C9 H17 120.2 . . ?
C11 C10 C9 121.7(2) . . ?
C11 C10 H12 119.2 . . ?
C9 C10 H12 119.2 . . ?
C10 C11 C21 117.8(2) . . ?
C10 C11 C12 120.7(2) . . ?
C21 C11 C12 121.4(2) . . ?
C11 C12 H14 109.5 . . ?
C11 C12 H13 109.5 . . ?
H14 C12 H13 109.5 . . ?
C11 C12 H2 109.5 . . ?
H14 C12 H2 109.5 . . ?
H13 C12 H2 109.5 . . ?
C7 C13 C14 103.08(18) . . ?
C7 C13 H10 111.1 . . ?
C14 C13 H10 111.1 . . ?
C7 C13 H11 111.1 . . ?
C14 C13 H11 111.1 . . ?
H10 C13 H11 109.1 . . ?
N1 C14 C15 112.75(18) . . ?
N1 C14 C13 102.91(16) . . ?
C15 C14 C13 113.07(18) . . ?
N1 C14 H9 109.3 . . ?
C15 C14 H9 109.3 . . ?
C13 C14 H9 109.3 . . ?
C20 C15 C16 119.7(2) . . ?
C20 C15 C14 120.4(2) . . ?
C16 C15 C14 119.96(18) . . ?
C17 C16 C15 120.0(2) . . ?
C17 C16 H8 120.0 . . ?
C15 C16 H8 120.0 . . ?
C18 C17 C16 120.2(2) . . ?
C18 C17 H4 119.9 . . ?
C16 C17 H4 119.9 . . ?
C19 C18 C17 120.5(2) . . ?
C19 C18 H7 119.7 . . ?
C17 C18 H7 119.7 . . ?
C18 C19 C20 119.7(2) . . ?
C18 C19 H5 120.1 . . ?
C20 C19 H5 120.1 . . ?
C15 C20 C19 119.9(2) . . ?
C15 C20 H6 120.0 . . ?
C19 C20 H6 120.0 . . ?
C22 C21 C11 121.7(2) . . ?
C22 C21 H16 119.2 . . ?
C11 C21 H16 119.2 . . ?
C21 C22 C8 119.5(2) . . ?
C21 C22 H15 120.3 . . ?
C8 C22 H15 120.3 . . ?
C24 C23 C5 119.2(3) . . ?
C24 C23 H19 120.4 . . ?
C5 C23 H19 120.4 . . ?
C23 C24 C2 121.8(2) . . ?
C23 C24 H20 119.1 . . ?
C2 C24 H20 119.1 . . ?

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
O2 S1 N1 C6 23.1(2) . . . . ?
O1 S1 N1 C6 152.21(18) . . . . ?
C5 S1 N1 C6 -92.34(19) . . . . ?
O2 S1 N1 C14 -165.14(18) . . . . ?
O1 S1 N1 C14 -36.1(2) . . . . ?
C5 S1 N1 C14 79.4(2) . . . . ?
C24 C2 C3 C4 -1.3(5) . . . . ?
C1 C2 C3 C4 178.1(3) . . . . ?
C2 C3 C4 C5 -0.2(4) . . . . ?
C3 C4 C5 C23 1.2(4) . . . . ?
C3 C4 C5 S1 -176.4(2) . . . . ?
O2 S1 C5 C23 143.55(18) . . . . ?
O1 S1 C5 C23 10.3(2) . . . . ?
N1 S1 C5 C23 -103.42(19) . . . . ?
O2 S1 C5 C4 -38.9(2) . . . . ?
O1 S1 C5 C4 -172.11(19) . . . . ?
N1 S1 C5 C4 74.2(2) . . . . ?
C14 N1 C6 C7 7.0(2) . . . . ?
S1 N1 C6 C7 179.72(15) . . . . ?
N1 C6 C7 C13 -0.6(3) . . . . ?
N1 C6 C7 S2 -175.35(14) . . . . ?
O3 S2 C7 C6 2.6(2) . . . . ?
O4 S2 C7 C6 132.87(19) . . . . ?
C8 S2 C7 C6 -112.43(19) . . . . ?
O3 S2 C7 C13 -171.44(17) . . . . ?
O4 S2 C7 C13 -41.2(2) . . . . ?
C8 S2 C7 C13 73.51(19) . . . . ?
O3 S2 C8 C9 -20.0(2) . . . . ?
O4 S2 C8 C9 -150.37(18) . . . . ?
C7 S2 C8 C9 94.84(19) . . . . ?
O3 S2 C8 C22 157.17(18) . . . . ?
O4 S2 C8 C22 26.8(2) . . . . ?
C7 S2 C8 C22 -87.99(19) . . . . ?
C22 C8 C9 C10 -0.7(3) . . . . ?
S2 C8 C9 C10 176.52(17) . . . . ?
C8 C9 C10 C11 0.5(4) . . . . ?
C9 C10 C11 C21 0.3(4) . . . . ?
C9 C10 C11 C12 -179.2(2) . . . . ?
C6 C7 C13 C14 -5.5(2) . . . . ?
S2 C7 C13 C14 169.14(15) . . . . ?
C6 N1 C14 C15 112.3(2) . . . . ?
S1 N1 C14 C15 -60.6(2) . . . . ?
C6 N1 C14 C13 -9.8(2) . . . . ?
S1 N1 C14 C13 177.31(16) . . . . ?
C7 C13 C14 N1 8.8(2) . . . . ?
C7 C13 C14 C15 -113.1(2) . . . . ?
N1 C14 C15 C20 123.7(2) . . . . ?
C13 C14 C15 C20 -120.0(2) . . . . ?
N1 C14 C15 C16 -57.7(3) . . . . ?
C13 C14 C15 C16 58.6(3) . . . . ?
C20 C15 C16 C17 -0.6(3) . . . . ?
C14 C15 C16 C17 -179.2(2) . . . . ?
C15 C16 C17 C18 1.5(4) . . . . ?
C16 C17 C18 C19 -1.2(4) . . . . ?
C17 C18 C19 C20 -0.1(4) . . . . ?
C16 C15 C20 C19 -0.7(3) . . . . ?
C14 C15 C20 C19 177.9(2) . . . . ?
C18 C19 C20 C15 1.0(4) . . . . ?
C10 C11 C21 C22 -1.0(4) . . . . ?
C12 C11 C21 C22 178.5(2) . . . . ?
C11 C21 C22 C8 0.9(4) . . . . ?
C9 C8 C22 C21 0.0(3) . . . . ?
S2 C8 C22 C21 -177.18(18) . . . . ?
C4 C5 C23 C24 -0.7(4) . . . . ?
S1 C5 C23 C24 176.8(2) . . . . ?
C5 C23 C24 C2 -0.7(4) . . . . ?
C3 C2 C24 C23 1.8(4) . . . . ?
C1 C2 C24 C23 -177.6(3) . . . . ?

_refine_diff_density_max         0.261
_refine_diff_density_min         -0.260
_refine_diff_density_rms         0.043



