# Supplementary Information (SI) for Journal of Materials Chemistry C.
# 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_mo_0126_12_0m
_database_code_depnum_ccdc_archive 'CCDC 2410635'
loop_
_audit_author_name
_audit_author_address
'Chen Chen'
;heilongjiang University
China
;
_audit_update_record             
;
2024-12-16 deposited with the CCDC.	2025-01-31 downloaded from the CCDC.
;
_audit_creation_date             2024-01-31
_audit_creation_method           
;
Olex2 1.5
(compiled 2023.08.24 svn.re1ec1418 for OlexSys, GUI svn.r6817)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'Cl6 Sn, 2(C8 H20 N)'
_chemical_formula_sum            'C16 H40 Cl6 N2 Sn'
_chemical_formula_weight         591.89
_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'
Sn Sn -0.6537 1.4246 '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                   13.9341(5)
_cell_length_b                   14.4459(4)
_cell_length_c                   12.8883(3)
_cell_angle_alpha                90
_cell_angle_beta                 91.4280(10)
_cell_angle_gamma                90
_cell_volume                     2593.49(13)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9928
_cell_measurement_temperature    150.00
_cell_measurement_theta_max      26.37
_cell_measurement_theta_min      2.55
_shelx_estimated_absorpt_T_max   0.856
_shelx_estimated_absorpt_T_min   0.739
_exptl_absorpt_coefficient_mu    1.608
_exptl_absorpt_correction_T_max  0.0276
_exptl_absorpt_correction_T_min  0.0107
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0647 before and 0.0488 after correction.
The Ratio of minimum to maximum transmission is 0.3877.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    1.516
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1208
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0325
_diffrn_reflns_av_unetI/netI     0.0158
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            25585
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.398
_diffrn_reflns_theta_min         2.031
_diffrn_ambient_temperature      150.00
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_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           30.0
_diffrn_source_power             1.5
_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                2286
_reflns_number_total             2667
_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 (Bruker, 2018)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.38A (Bruker, 2018)'
_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 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         0.273
_refine_diff_density_min         -0.351
_refine_diff_density_rms         0.071
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.060
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     159
_refine_ls_number_reflns         2667
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0277
_refine_ls_R_factor_gt           0.0209
_refine_ls_restrained_S_all      1.060
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0286P)²+1.5316P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0522
_refine_ls_wR_factor_ref         0.0550
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Others
 Sof(C00B)=Sof(H00A)=Sof(H00B)=Sof(H00C)=Sof(C00D)=Sof(H00D)=Sof(H00E)=
 Sof(C00F)=Sof(H00H)=Sof(H00I)=Sof(C3)=Sof(H3A)=Sof(H3B)=Sof(H3C)=1-FVAR(1)
 Sof(C00E)=Sof(H00F)=Sof(H00G)=Sof(C1)=Sof(H1A)=Sof(H1B)=Sof(C2)=Sof(H2A)=
 Sof(H2B)=Sof(H2C)=Sof(C4)=Sof(H4A)=Sof(H4B)=Sof(H4C)=FVAR(1)
3.a Secondary CH2 refined with riding coordinates:
 C006(H00J,H00K), C007(H00L,H00M), C00D(H00D,H00E), C00E(H00F,H00G), C00F(H00H,
 H00I), C1(H1A,H1B)
3.b Idealised Me refined as rotating group:
 C009(H00N,H00O,H00P), C00A(H00Q,H00R,H00S), C00B(H00A,H00B,H00C), C3(H3A,H3B,
 H3C), C2(H2A,H2B,H2C), C4(H4A,H4B,H4C)
;
_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
Sn01 Sn 0.250000 0.750000 0.500000 0.03117(7) Uani 1 2 d S . P . .
Cl02 Cl 0.21683(4) 0.91624(4) 0.50472(4) 0.04365(13) Uani 1 1 d . . . . .
Cl03 Cl 0.41665(4) 0.78085(4) 0.46008(5) 0.04918(15) Uani 1 1 d . . . . .
Cl04 Cl 0.20712(5) 0.74908(4) 0.31741(4) 0.04747(14) Uani 1 1 d . . . . .
N005 N 0.500000 0.50864(16) 0.250000 0.0337(5) Uani 1 2 d S T P . .
C006 C 0.46786(16) 0.56792(15) 0.15817(15) 0.0397(5) Uani 1 1 d . . . . .
H00J H 0.524753 0.599869 0.130770 0.048 Uiso 1 1 calc R U . . .
H00K H 0.442190 0.526714 0.102729 0.048 Uiso 1 1 calc R U . . .
C007 C 0.41597(15) 0.44952(15) 0.28330(16) 0.0398(5) Uani 1 1 d . . . . .
H00L H 0.365643 0.490704 0.310416 0.048 Uiso 1 1 calc R U . . .
H00M H 0.388546 0.417534 0.221438 0.048 Uiso 1 1 calc R U . . .
N008 N 0.500000 1.0095(2) 0.250000 0.0634(9) Uani 1 2 d S T P . .
C009 C 0.39279(18) 0.63954(17) 0.18164(19) 0.0536(6) Uani 1 1 d . . . . .
H00N H 0.375501 0.673511 0.118063 0.080 Uiso 1 1 calc R U . . .
H00O H 0.418391 0.682812 0.233938 0.080 Uiso 1 1 calc R U . . .
H00P H 0.335671 0.608860 0.208169 0.080 Uiso 1 1 calc R U . . .
C00A C 0.44123(18) 0.37759(17) 0.36533(17) 0.0493(6) Uani 1 1 d . . . . .
H00Q H 0.489391 0.334975 0.338504 0.074 Uiso 1 1 calc R U . . .
H00R H 0.383429 0.342841 0.382813 0.074 Uiso 1 1 calc R U . . .
H00S H 0.467170 0.408490 0.427636 0.074 Uiso 1 1 calc R U . . .
C00B C 0.3827(8) 1.1000(8) 0.3892(8) 0.0445(18) Uani 0.516(4) 1 d . . P A 2
H00A H 0.327880 1.090280 0.341410 0.067 Uiso 0.516(4) 1 calc R U P A 2
H00B H 0.413461 1.159229 0.373547 0.067 Uiso 0.516(4) 1 calc R U P A 2
H00C H 0.360523 1.100804 0.460755 0.067 Uiso 0.516(4) 1 calc R U P A 2
C00D C 0.4552(3) 1.0214(3) 0.3766(3) 0.0385(10) Uani 0.516(4) 1 d . . P A 2
H00D H 0.424305 0.962460 0.396332 0.046 Uiso 0.516(4) 1 calc R U P A 2
H00E H 0.509976 1.031911 0.425593 0.046 Uiso 0.516(4) 1 calc R U P A 2
C00E C 0.4459(3) 0.9225(3) 0.2344(3) 0.0402(11) Uani 0.484(4) 1 d . . P A 1
H00F H 0.427557 0.899435 0.303476 0.048 Uiso 0.484(4) 1 calc R U P A 1
H00G H 0.489936 0.876309 0.204814 0.048 Uiso 0.484(4) 1 calc R U P A 1
C00F C 0.4108(3) 0.9992(3) 0.1880(3) 0.0431(11) Uani 0.516(4) 1 d . . P A 2
H00H H 0.429287 0.993432 0.114617 0.052 Uiso 0.516(4) 1 calc R U P A 2
H00I H 0.375190 1.058260 0.193752 0.052 Uiso 0.516(4) 1 calc R U P A 2
C1 C 0.4503(4) 1.0951(3) 0.2591(3) 0.0452(12) Uani 0.484(4) 1 d . . P A 1
H1A H 0.401560 1.102320 0.202472 0.054 Uiso 0.484(4) 1 calc R U P A 1
H1B H 0.495454 1.147949 0.257050 0.054 Uiso 0.484(4) 1 calc R U P A 1
C3 C 0.3403(6) 0.9224(6) 0.2085(5) 0.0465(15) Uani 0.516(4) 1 d . . P A 2
H3A H 0.286850 0.925785 0.157831 0.070 Uiso 0.516(4) 1 calc R U P A 2
H3B H 0.315773 0.929038 0.278725 0.070 Uiso 0.516(4) 1 calc R U P A 2
H3C H 0.372651 0.862462 0.202344 0.070 Uiso 0.516(4) 1 calc R U P A 2
C2 C 0.3576(7) 0.9257(8) 0.1670(6) 0.057(2) Uani 0.484(4) 1 d . . P A 1
H2A H 0.318862 0.979508 0.185635 0.085 Uiso 0.484(4) 1 calc R U P A 1
H2B H 0.320210 0.869013 0.176869 0.085 Uiso 0.484(4) 1 calc R U P A 1
H2C H 0.375602 0.930512 0.094205 0.085 Uiso 0.484(4) 1 calc R U P A 1
C4 C 0.4031(9) 1.0896(9) 0.3635(8) 0.049(2) Uani 0.484(4) 1 d . . P A 1
H4A H 0.452615 1.087039 0.418719 0.073 Uiso 0.484(4) 1 calc R U P A 1
H4B H 0.363254 1.033726 0.366121 0.073 Uiso 0.484(4) 1 calc R U P A 1
H4C H 0.362742 1.144326 0.373171 0.073 Uiso 0.484(4) 1 calc R U P A 1


_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
Sn01 Cl02 2.4466(5) 7_566 ?
Sn01 Cl02 2.4466(5) . ?
Sn01 Cl03 2.4321(6) 7_566 ?
Sn01 Cl03 2.4321(6) . ?
Sn01 Cl04 2.4135(5) . ?
Sn01 Cl04 2.4134(5) 7_566 ?
N005 C006 1.519(2) . ?
N005 C006 1.519(2) 2_655 ?
N005 C007 1.520(2) 2_655 ?
N005 C007 1.520(2) . ?
C006 H00J 0.9900 . ?
C006 H00K 0.9900 . ?
C006 C009 1.507(3) . ?
C007 H00L 0.9900 . ?
C007 H00M 0.9900 . ?
C007 C00A 1.518(3) . ?
N008 C00D 1.770(4) 2_655 ?
N008 C00D 1.770(4) . ?
N008 C00E 1.476(5) 2_655 ?
N008 C00E 1.476(5) . ?
N008 C00F 1.469(4) 2_655 ?
N008 C00F 1.469(4) . ?
N008 C1 1.424(5) 2_655 ?
N008 C1 1.424(5) . ?
C009 H00N 0.9800 . ?
C009 H00O 0.9800 . ?
C009 H00P 0.9800 . ?
C00A H00Q 0.9800 . ?
C00A H00R 0.9800 . ?
C00A H00S 0.9800 . ?
C00B H00A 0.9800 . ?
C00B H00B 0.9800 . ?
C00B H00C 0.9800 . ?
C00B C00D 1.531(10) . ?
C00D H00D 0.9900 . ?
C00D H00E 0.9900 . ?
C00E H00F 0.9900 . ?
C00E H00G 0.9900 . ?
C00E C2 1.489(11) . ?
C00F H00H 0.9900 . ?
C00F H00I 0.9900 . ?
C00F C3 1.510(8) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C1 C4 1.514(9) . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 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
Cl02 Sn01 Cl02 180.0 7_566 . ?
Cl03 Sn01 Cl02 89.58(2) 7_566 . ?
Cl03 Sn01 Cl02 90.42(2) . . ?
Cl03 Sn01 Cl02 90.42(2) 7_566 7_566 ?
Cl03 Sn01 Cl02 89.58(2) . 7_566 ?
Cl03 Sn01 Cl03 180.0 7_566 . ?
Cl04 Sn01 Cl02 89.275(17) 7_566 7_566 ?
Cl04 Sn01 Cl02 90.725(17) 7_566 . ?
Cl04 Sn01 Cl02 89.273(17) . . ?
Cl04 Sn01 Cl02 90.726(17) . 7_566 ?
Cl04 Sn01 Cl03 90.53(2) 7_566 7_566 ?
Cl04 Sn01 Cl03 90.53(2) . . ?
Cl04 Sn01 Cl03 89.47(2) . 7_566 ?
Cl04 Sn01 Cl03 89.47(2) 7_566 . ?
Cl04 Sn01 Cl04 180.00(3) 7_566 . ?
C006 N005 C006 111.4(2) 2_655 . ?
C006 N005 C007 108.12(11) . 2_655 ?
C006 N005 C007 108.82(12) . . ?
C006 N005 C007 108.12(11) 2_655 . ?
C006 N005 C007 108.81(12) 2_655 2_655 ?
C007 N005 C007 111.6(2) 2_655 . ?
N005 C006 H00J 108.5 . . ?
N005 C006 H00K 108.5 . . ?
H00J C006 H00K 107.5 . . ?
C009 C006 N005 115.03(17) . . ?
C009 C006 H00J 108.5 . . ?
C009 C006 H00K 108.5 . . ?
N005 C007 H00L 108.6 . . ?
N005 C007 H00M 108.6 . . ?
H00L C007 H00M 107.6 . . ?
C00A C007 N005 114.50(17) . . ?
C00A C007 H00L 108.6 . . ?
C00A C007 H00M 108.6 . . ?
C00D N008 C00D 168.8(3) 2_655 . ?
C00E N008 C00D 91.0(2) 2_655 2_655 ?
C00E N008 C00D 98.5(2) . 2_655 ?
C00E N008 C00E 63.4(4) . 2_655 ?
C00F N008 C00D 101.4(2) . . ?
C00F N008 C00D 79.7(2) 2_655 . ?
C00F N008 C00F 168.4(4) . 2_655 ?
C1 N008 C00D 69.9(2) 2_655 2_655 ?
C1 N008 C00D 100.1(3) . 2_655 ?
C1 N008 C00E 167.4(2) 2_655 . ?
C1 N008 C00E 120.2(3) 2_655 2_655 ?
C1 N008 C00E 120.2(3) . . ?
C1 N008 C00E 167.4(2) . 2_655 ?
C1 N008 C00F 74.1(3) 2_655 2_655 ?
C1 N008 C00F 116.7(3) . 2_655 ?
C1 N008 C1 59.4(4) 2_655 . ?
C006 C009 H00N 109.5 . . ?
C006 C009 H00O 109.5 . . ?
C006 C009 H00P 109.5 . . ?
H00N C009 H00O 109.5 . . ?
H00N C009 H00P 109.5 . . ?
H00O C009 H00P 109.5 . . ?
C007 C00A H00Q 109.5 . . ?
C007 C00A H00R 109.5 . . ?
C007 C00A H00S 109.5 . . ?
H00Q C00A H00R 109.5 . . ?
H00Q C00A H00S 109.5 . . ?
H00R C00A H00S 109.5 . . ?
H00A C00B H00B 109.5 . . ?
H00A C00B H00C 109.5 . . ?
H00B C00B H00C 109.5 . . ?
C00D C00B H00A 109.5 . . ?
C00D C00B H00B 109.5 . . ?
C00D C00B H00C 109.5 . . ?
N008 C00D H00D 108.6 . . ?
N008 C00D H00E 108.6 . . ?
C00B C00D N008 114.7(4) . . ?
C00B C00D H00D 108.6 . . ?
C00B C00D H00E 108.6 . . ?
H00D C00D H00E 107.6 . . ?
N008 C00E H00F 107.9 . . ?
N008 C00E H00G 107.9 . . ?
N008 C00E C2 117.7(5) . . ?
H00F C00E H00G 107.2 . . ?
C2 C00E H00F 107.9 . . ?
C2 C00E H00G 107.9 . . ?
N008 C00F H00H 106.9 . . ?
N008 C00F H00I 106.9 . . ?
N008 C00F C3 121.6(4) . . ?
H00H C00F H00I 106.7 . . ?
C3 C00F H00H 106.9 . . ?
C3 C00F H00I 106.9 . . ?
N008 C1 H1A 110.9 . . ?
N008 C1 H1B 110.9 . . ?
N008 C1 C4 104.5(6) . . ?
H1A C1 H1B 108.9 . . ?
C4 C1 H1A 110.9 . . ?
C4 C1 H1B 110.9 . . ?
C00F C3 H3A 109.5 . . ?
C00F C3 H3B 109.5 . . ?
C00F C3 H3C 109.5 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C00E C2 H2A 109.5 . . ?
C00E C2 H2B 109.5 . . ?
C00E C2 H2C 109.5 . . ?
H2A C2 H2B 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C4 H4A 109.5 . . ?
C1 C4 H4B 109.5 . . ?
C1 C4 H4C 109.5 . . ?
H4A C4 H4B 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 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
C006 N005 C006 C009 -53.24(16) 2_655 . . . ?
C006 N005 C007 C00A -66.5(2) 2_655 . . . ?
C006 N005 C007 C00A 172.35(18) . . . . ?
C007 N005 C006 C009 -172.75(19) 2_655 . . . ?
C007 N005 C006 C009 65.9(2) . . . . ?
C007 N005 C007 C00A 53.12(15) 2_655 . . . ?
C00D N008 C00D C00B 39.1(6) 2_655 . . . ?
C00D N008 C00F C3 -58.2(5) . . . . ?
C00D N008 C00F C3 133.1(5) 2_655 . . . ?
C00E N008 C00E C2 -156.5(7) 2_655 . . . ?
C00E N008 C1 C4 70.3(7) . . . . ?
C00E N008 C1 C4 -32.6(16) 2_655 . . . ?
C00F N008 C00D C00B 136.1(6) 2_655 . . . ?
C00F N008 C00D C00B -55.7(7) . . . . ?
C00F N008 C00F C3 36.3(5) 2_655 . . . ?
C1 N008 C00E C2 37.3(6) . . . . ?
C1 N008 C00E C2 -47.0(15) 2_655 . . . ?
C1 N008 C1 C4 -124.3(8) 2_655 . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
