##############################################################################
###                                                                        ###
###        Electronic paper (Acta Crystallographica Section E)             ###
###                                                                        ###
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#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section E. It conforms to the requirements of Notes      #
# for Authors for Section E, and has been peer reviewed under the auspices   #
# of the IUCr Commission on Journals.                                        #
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# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
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data_global
_audit_creation_method     SHELXL97
_journal_date_recd_electronic     2006-10-09
_journal_date_accepted     2006-10-13
_journal_name_full     'Acta Crystallographica, Section E'
_journal_year     2006
_journal_volume     62
_journal_issue     11
_journal_page_first     m3018
_journal_page_last     m3019
_journal_paper_category     EM
_journal_coeditor_code     CI2191
_publ_contact_author_name     'Dr Seik Weng Ng'
_publ_contact_author_address
;
Department of Chemistry
University of Malaya
50603 Kuala Lumpur
Malaysia
;
_publ_contact_author_email     seikweng@um.edu.my
_publ_contact_author_fax     '03 7967 4193'
_publ_contact_author_phone     '03 7967 6778'
_publ_section_title
;\
(Acetone-4-phenylthiosemicarbazonato-κ²N,S)\
chlorodiphenyltin(IV) ethanol solvate
;
loop_
    _publ_author_name
    _publ_author_address
    'Swesi, Abdurazag T.'
;
School of Chemical Sciences and Food Technology
Universiti Kebangsaan Malaysia
Bangi 43600
Malaysia
;
    'Farina, Yang'
;
School of Chemical Sciences and Food Technology
Universiti Kebangsaan Malaysia
Bangi 43600
Malaysia
;
    'Venkatraman, Ramaiyer'
;
School of Chemical Sciences and Food Technology
Universiti Kebangsaan Malaysia
Bangi 43600
Malaysia
;
    'Ng, Seik Weng'
;
Department of Chemistry
University of Malaya
50603 Kuala Lumpur
Malaysia
;
data_I
_audit_creation_method     SHELXL97
_chemical_name_systematic
;
(Acetone-4-phenylthiosemicarbazonato-κ²N,S)chlorodiphenyltin(IV) ethanol
solvate
;
_chemical_name_common     ?
_chemical_formula_moiety     'C22 H22 Cl N3 S Sn , C2 H6 O'
_chemical_formula_sum     'C24 H28 Cl N3 O S Sn'
_chemical_formula_iupac     '[Sn (C6 H5)2 (C10 H12 N3 S) Cl] , C2 H6 O'
_chemical_formula_weight     560.69
_chemical_melting_point     ?
_symmetry_cell_setting     Monoclinic
_symmetry_space_group_name_H-M     'P 21/c'
_symmetry_space_group_name_Hall     '-P 2ybc'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, y+1/2, -z+1/2'
    '-x, -y, -z'
    'x, -y-1/2, z-1/2'
_cell_length_a     8.1100(10)
_cell_length_b     12.1950(10)
_cell_length_c     26.144(3)
_cell_angle_alpha     90.00
_cell_angle_beta     90.1460(10)
_cell_angle_gamma     90.00
_cell_volume     2585.7(5)
_cell_formula_units_Z     4
_cell_measurement_reflns_used     934
_cell_measurement_theta_min     2.9
_cell_measurement_theta_max     26.3
_cell_measurement_temperature     293(2)
_exptl_crystal_description     Block
_exptl_crystal_colour     Colourless
_exptl_crystal_size_max     0.34
_exptl_crystal_size_mid     0.14
_exptl_crystal_size_min     0.11
_exptl_crystal_density_diffrn     1.440
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     1136
_exptl_absorpt_coefficient_mu     1.192
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details     '(SADABS; Sheldrick, 1996)'
_exptl_absorpt_correction_T_min     0.6874
_exptl_absorpt_correction_T_max     0.8801
_diffrn_ambient_temperature     295(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Bruker APEX area-detector'
_diffrn_measurement_method     'ω and φ'
_diffrn_detector_area_resol_mean     ?
_diffrn_reflns_number     15470
_diffrn_reflns_av_R_equivalents     0.0276
_diffrn_reflns_av_sigmaI/netI     0.0369
_diffrn_reflns_theta_min     1.56
_diffrn_reflns_theta_max     27.50
_diffrn_reflns_theta_full     27.5
_diffrn_measured_fraction_theta_max     0.98
_diffrn_measured_fraction_theta_full     0.98
_diffrn_reflns_limit_h_min     -10
_diffrn_reflns_limit_h_max     10
_diffrn_reflns_limit_k_min     -15
_diffrn_reflns_limit_k_max     9
_diffrn_reflns_limit_l_min     -33
_diffrn_reflns_limit_l_max     32
_diffrn_standards_number     0
_diffrn_standards_interval_count     ?
_diffrn_standards_interval_time     ?
_diffrn_standards_decay_%     ?
_reflns_number_total     5817
_reflns_number_gt     4918
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.066
_refine_ls_R_factor_gt     0.051
_refine_ls_wR_factor_gt     0.106
_refine_ls_wR_factor_ref     0.112
_refine_ls_goodness_of_fit_ref     1.15
_refine_ls_restrained_S_all     1.15
_refine_ls_number_reflns     5817
_refine_ls_number_parameters     285
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
       'calc w = 1/[σ²(Fo²)+(0.0509P)²+0.7047P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.001
_refine_ls_shift/su_mean     0.001
_refine_diff_density_max     0.70
_refine_diff_density_min     -0.64
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
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'
    'Cl' 'Cl' 0.1484 0.1585
                         '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'
_computing_data_collection     'SMART (Bruker, 2003)'
_computing_cell_refinement     'SAINT (Bruker, 2003)'
_computing_data_reduction     SAINT
_computing_structure_solution     'SHELXS97 (Sheldrick, 1997)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'X-SEED (Barbour, 2001)'
_computing_publication_material     SHELXL97
loop_
    _atom_site_type_symbol
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    Sn Sn1 0.65958(3) 0.65338(2) 0.638688(9) 0.04038(10) Uani d . 1 . .
    Cl Cl1 0.38412(13) 0.68585(11) 0.67883(4) 0.0616(3) Uani d . 1 . .
    S S1 0.61306(13) 0.46426(9) 0.66021(4) 0.0569(3) Uani d . 1 . .
    O O1 0.4676(5) 0.6918(4) 0.80383(15) 0.0964(12) Uani d . 1 . .
    H H1O 0.4660 0.6898 0.7713 0.116 Uiso calc R 1 . .
    N N1 0.7819(4) 0.2930(3) 0.63489(12) 0.0489(8) Uani d . 1 . .
    H H1N 0.7080 0.2683 0.6548 0.059(13) Uiso calc R 1 . .
    N N2 0.9022(4) 0.4521(2) 0.60526(12) 0.0438(7) Uani d . 1 . .
    N N3 0.8934(4) 0.5665(2) 0.60337(11) 0.0395(7) Uani d . 1 . .
    C C1 0.8833(5) 0.2124(3) 0.61206(15) 0.0464(9) Uani d . 1 . .
    C C2 0.8509(7) 0.1072(4) 0.6275(2) 0.0774(15) Uani d . 1 . .
    H H2 0.7719 0.0938 0.6525 0.093 Uiso calc R 1 . .
    C C3 0.9364(8) 0.0214(4) 0.6058(3) 0.102(2) Uani d . 1 . .
    H H3 0.9156 -0.0498 0.6168 0.122 Uiso calc R 1 . .
    C C4 1.0514(8) 0.0389(4) 0.5685(2) 0.0883(17) Uani d . 1 . .
    H H4 1.1042 -0.0199 0.5528 0.106 Uiso calc R 1 . .
    C C5 1.0869(7) 0.1440(4) 0.5546(2) 0.0725(14) Uani d . 1 . .
    H H5 1.1683 0.1573 0.5304 0.087 Uiso calc R 1 . .
    C C6 1.0031(6) 0.2308(4) 0.57630(17) 0.0596(11) Uani d . 1 . .
    H H6 1.0281 0.3022 0.5665 0.072 Uiso calc R 1 . .
    C C7 0.7844(5) 0.4041(3) 0.62982(14) 0.0429(8) Uani d . 1 . .
    C C8 1.0164(5) 0.6123(3) 0.58131(14) 0.0437(8) Uani d . 1 . .
    C C9 1.1585(6) 0.5500(4) 0.5603(2) 0.0701(14) Uani d . 1 . .
    H H9A 1.2065 0.5060 0.5869 0.105 Uiso calc R 1 . .
    H H9B 1.2395 0.6004 0.5476 0.105 Uiso calc R 1 . .
    H H9C 1.1212 0.5035 0.5330 0.105 Uiso calc R 1 . .
    C C10 1.0238(5) 0.7334(3) 0.57600(17) 0.0578(11) Uani d . 1 . .
    H H10A 0.9172 0.7641 0.5830 0.087 Uiso calc R 1 . .
    H H10B 1.0562 0.7520 0.5418 0.087 Uiso calc R 1 . .
    H H10C 1.1028 0.7625 0.5998 0.087 Uiso calc R 1 . .
    C C11 0.7893(5) 0.7567(3) 0.69048(13) 0.0431(8) Uani d . 1 . .
    C C12 0.9487(5) 0.7355(4) 0.70626(15) 0.0553(10) Uani d . 1 . .
    H H12 1.0032 0.6738 0.6940 0.066 Uiso calc R 1 . .
    C C13 1.0280(6) 0.8045(5) 0.74003(18) 0.0725(14) Uani d . 1 . .
    H H13 1.1347 0.7886 0.7509 0.087 Uiso calc R 1 . .
    C C14 0.9498(7) 0.8964(5) 0.75756(19) 0.0780(15) Uani d . 1 . .
    H H14 1.0046 0.9434 0.7799 0.094 Uiso calc R 1 . .
    C C15 0.7927(7) 0.9199(4) 0.74265(18) 0.0699(13) Uani d . 1 . .
    H H15 0.7402 0.9826 0.7547 0.084 Uiso calc R 1 . .
    C C16 0.7116(6) 0.8496(3) 0.70940(17) 0.0571(11) Uani d . 1 . .
    H H16 0.6036 0.8649 0.6996 0.069 Uiso calc R 1 . .
    C C17 0.5804(4) 0.7092(3) 0.56581(14) 0.0456(9) Uani d . 1 . .
    C C18 0.5019(6) 0.8090(4) 0.56081(18) 0.0643(12) Uani d . 1 . .
    H H18 0.4869 0.8529 0.5895 0.077 Uiso calc R 1 . .
    C C19 0.4450(7) 0.8449(5) 0.5137(2) 0.0862(18) Uani d . 1 . .
    H H19 0.3941 0.9129 0.5107 0.103 Uiso calc R 1 . .
    C C20 0.4641(6) 0.7797(6) 0.4717(2) 0.0863(18) Uani d . 1 . .
    H H20 0.4256 0.8035 0.4401 0.104 Uiso calc R 1 . .
    C C21 0.5390(7) 0.6802(5) 0.47576(19) 0.0780(15) Uani d . 1 . .
    H H21 0.5508 0.6360 0.4470 0.094 Uiso calc R 1 . .
    C C22 0.5971(6) 0.6452(4) 0.52235(16) 0.0592(11) Uani d . 1 . .
    H H22 0.6486 0.5772 0.5248 0.071 Uiso calc R 1 . .
    C C23 0.6293(9) 0.6696(6) 0.8216(3) 0.098(2) Uani d . 1 . .
    H H23A 0.6350 0.6832 0.8581 0.118 Uiso calc R 1 . .
    H H23B 0.7064 0.7186 0.8049 0.118 Uiso calc R 1 . .
    C C24 0.6754(11) 0.5594(7) 0.8116(3) 0.154(4) Uani d . 1 . .
    H H24A 0.6127 0.5112 0.8331 0.231 Uiso calc R 1 . .
    H H24B 0.7908 0.5502 0.8187 0.231 Uiso calc R 1 . .
    H H24C 0.6540 0.5425 0.7764 0.231 Uiso calc R 1 . .
loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Sn1 C11 . 2.126(4) yes
    Sn1 C17 . 2.121(4) yes
    Sn1 N3 . 2.362(3) yes
    Sn1 S1 . 2.4040(10)
                      yes
    Sn1 Cl1 . 2.5020(10)
                       yes
    S1 C7 . 1.763(4) ?
    O1 C23 . 1.416(8) ?
    O1 H1O . 0.85 ?
    N1 C7 . 1.361(5) ?
    N1 C1 . 1.415(5) ?
    N1 H1N . 0.85 ?
    N2 C7 . 1.292(5) ?
    N2 N3 . 1.398(4) ?
    N3 C8 . 1.282(5) ?
    C1 C6 . 1.369(6) ?
    C1 C2 . 1.370(6) ?
    C2 C3 . 1.378(7) ?
    C2 H2 . 0.93 ?
    C3 C4 . 1.369(8) ?
    C3 H3 . 0.93 ?
    C4 C5 . 1.363(7) ?
    C4 H4 . 0.93 ?
    C5 C6 . 1.381(6) ?
    C5 H5 . 0.93 ?
    C6 H6 . 0.93 ?
    C8 C10 . 1.485(6) ?
    C8 C9 . 1.486(5) ?
    C9 H9A . 0.96 ?
    C9 H9B . 0.96 ?
    C9 H9C . 0.96 ?
    C10 H10A . 0.96 ?
    C10 H10B . 0.96 ?
    C10 H10C . 0.96 ?
    C11 C12 . 1.380(5) ?
    C11 C16 . 1.388(5) ?
    C12 C13 . 1.379(6) ?
    C12 H12 . 0.93 ?
    C13 C14 . 1.368(7) ?
    C13 H13 . 0.93 ?
    C14 C15 . 1.362(7) ?
    C14 H14 . 0.93 ?
    C15 C16 . 1.385(6) ?
    C15 H15 . 0.93 ?
    C16 H16 . 0.93 ?
    C17 C18 . 1.380(6) ?
    C17 C22 . 1.386(5) ?
    C18 C19 . 1.384(7) ?
    C18 H18 . 0.93 ?
    C19 C20 . 1.365(8) ?
    C19 H19 . 0.93 ?
    C20 C21 . 1.361(8) ?
    C20 H20 . 0.93 ?
    C21 C22 . 1.373(7) ?
    C21 H21 . 0.93 ?
    C22 H22 . 0.93 ?
    C23 C24 . 1.418(9) ?
    C23 H23A . 0.97 ?
    C23 H23B . 0.97 ?
    C24 H24A . 0.96 ?
    C24 H24B . 0.96 ?
    C24 H24C . 0.96 ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    C11 Sn1 C17 . . 122.0(2) yes
    C11 Sn1 N3 . . 96.80(10)
                           yes
    C11 Sn1 S1 . . 119.80(10)
                            yes
    C11 Sn1 Cl1 . . 94.60(10)
                            yes
    C17 Sn1 N3 . . 92.00(10)
                           yes
    C17 Sn1 S1 . . 118.10(10)
                            yes
    C17 Sn1 Cl1 . . 93.30(10)
                            yes
    N3 Sn1 S1 . . 77.75(8) yes
    N3 Sn1 Cl1 . . 162.44(8) yes
    S1 Sn1 Cl1 . . 85.00(4) yes
    C7 S1 Sn1 . . 99.75(14) ?
    C23 O1 H1O . . 109.5 ?
    C7 N1 C1 . . 129.9(3) ?
    C7 N1 H1N . . 115.0 ?
    C1 N1 H1N . . 115.0 ?
    C7 N2 N3 . . 115.6(3) ?
    C8 N3 N2 . . 114.3(3) ?
    C8 N3 Sn1 . . 127.4(3) ?
    N2 N3 Sn1 . . 118.3(2) ?
    C6 C1 C2 . . 119.5(4) ?
    C6 C1 N1 . . 126.0(4) ?
    C2 C1 N1 . . 114.5(4) ?
    C3 C2 C1 . . 119.5(5) ?
    C3 C2 H2 . . 120.3 ?
    C1 C2 H2 . . 120.3 ?
    C4 C3 C2 . . 121.3(5) ?
    C4 C3 H3 . . 119.3 ?
    C2 C3 H3 . . 119.3 ?
    C3 C4 C5 . . 118.7(5) ?
    C3 C4 H4 . . 120.6 ?
    C5 C4 H4 . . 120.6 ?
    C4 C5 C6 . . 120.5(5) ?
    C4 C5 H5 . . 119.7 ?
    C6 C5 H5 . . 119.7 ?
    C1 C6 C5 . . 120.3(4) ?
    C1 C6 H6 . . 119.8 ?
    C5 C6 H6 . . 119.8 ?
    N2 C7 N1 . . 120.7(3) ?
    N2 C7 S1 . . 128.3(3) ?
    N1 C7 S1 . . 111.0(3) ?
    N3 C8 C10 . . 120.5(3) ?
    N3 C8 C9 . . 123.3(4) ?
    C10 C8 C9 . . 116.2(3) ?
    C8 C9 H9A . . 109.5 ?
    C8 C9 H9B . . 109.5 ?
    H9A C9 H9B . . 109.5 ?
    C8 C9 H9C . . 109.5 ?
    H9A C9 H9C . . 109.5 ?
    H9B C9 H9C . . 109.5 ?
    C8 C10 H10A . . 109.5 ?
    C8 C10 H10B . . 109.5 ?
    H10A C10 H10B . . 109.5 ?
    C8 C10 H10C . . 109.5 ?
    H10A C10 H10C . . 109.5 ?
    H10B C10 H10C . . 109.5 ?
    C12 C11 C16 . . 118.2(4) ?
    C12 C11 Sn1 . . 122.7(3) ?
    C16 C11 Sn1 . . 119.1(3) ?
    C13 C12 C11 . . 120.8(4) ?
    C13 C12 H12 . . 119.6 ?
    C11 C12 H12 . . 119.6 ?
    C14 C13 C12 . . 120.0(4) ?
    C14 C13 H13 . . 120.0 ?
    C12 C13 H13 . . 120.0 ?
    C15 C14 C13 . . 120.7(4) ?
    C15 C14 H14 . . 119.7 ?
    C13 C14 H14 . . 119.7 ?
    C14 C15 C16 . . 119.5(4) ?
    C14 C15 H15 . . 120.3 ?
    C16 C15 H15 . . 120.3 ?
    C15 C16 C11 . . 120.9(4) ?
    C15 C16 H16 . . 119.6 ?
    C11 C16 H16 . . 119.6 ?
    C18 C17 C22 . . 117.7(4) ?
    C18 C17 Sn1 . . 120.5(3) ?
    C22 C17 Sn1 . . 121.7(3) ?
    C17 C18 C19 . . 121.0(5) ?
    C17 C18 H18 . . 119.5 ?
    C19 C18 H18 . . 119.5 ?
    C20 C19 C18 . . 119.6(5) ?
    C20 C19 H19 . . 120.2 ?
    C18 C19 H19 . . 120.2 ?
    C21 C20 C19 . . 120.5(5) ?
    C21 C20 H20 . . 119.7 ?
    C19 C20 H20 . . 119.7 ?
    C20 C21 C22 . . 119.9(5) ?
    C20 C21 H21 . . 120.0 ?
    C22 C21 H21 . . 120.0 ?
    C21 C22 C17 . . 121.2(5) ?
    C21 C22 H22 . . 119.4 ?
    C17 C22 H22 . . 119.4 ?
    O1 C23 C24 . . 111.5(6) ?
    O1 C23 H23A . . 109.3 ?
    C24 C23 H23A . . 109.3 ?
    O1 C23 H23B . . 109.3 ?
    C24 C23 H23B . . 109.3 ?
    H23A C23 H23B . . 108.0 ?
    C23 C24 H24A . . 109.5 ?
    C23 C24 H24B . . 109.5 ?
    H24A C24 H24B . . 109.5 ?
    C23 C24 H24C . . 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_site_symmetry_1
    _geom_torsion_site_symmetry_2
    _geom_torsion_site_symmetry_3
    _geom_torsion_site_symmetry_4
    _geom_torsion
    _geom_torsion_publ_flag
    C17 Sn1 S1 C7 . . . . 82.48(17) ?
    C11 Sn1 S1 C7 . . . . -94.04(17) ?
    N3 Sn1 S1 C7 . . . . -3.16(15) ?
    Cl1 Sn1 S1 C7 . . . . 173.54(13) ?
    C7 N2 N3 C8 . . . . 176.2(3) ?
    C7 N2 N3 Sn1 . . . . -4.7(4) ?
    C17 Sn1 N3 C8 . . . . 65.4(3) ?
    C11 Sn1 N3 C8 . . . . -57.1(3) ?
    S1 Sn1 N3 C8 . . . . -176.3(3) ?
    Cl1 Sn1 N3 C8 . . . . 172.8(2) ?
    C17 Sn1 N3 N2 . . . . -113.5(3) ?
    C11 Sn1 N3 N2 . . . . 123.9(3) ?
    S1 Sn1 N3 N2 . . . . 4.8(2) ?
    Cl1 Sn1 N3 N2 . . . . -6.1(4) ?
    C7 N1 C1 C6 . . . . -4.4(7) ?
    C7 N1 C1 C2 . . . . 177.3(4) ?
    C6 C1 C2 C3 . . . . -1.7(8) ?
    N1 C1 C2 C3 . . . . 176.7(5) ?
    C1 C2 C3 C4 . . . . -1.1(10) ?
    C2 C3 C4 C5 . . . . 3.4(11) ?
    C3 C4 C5 C6 . . . . -2.9(10) ?
    C2 C1 C6 C5 . . . . 2.2(7) ?
    N1 C1 C6 C5 . . . . -176.0(4) ?
    C4 C5 C6 C1 . . . . 0.2(9) ?
    N3 N2 C7 N1 . . . . -178.8(3) ?
    N3 N2 C7 S1 . . . . 1.1(5) ?
    C1 N1 C7 N2 . . . . -7.9(6) ?
    C1 N1 C7 S1 . . . . 172.1(3) ?
    Sn1 S1 C7 N2 . . . . 2.6(4) ?
    Sn1 S1 C7 N1 . . . . -177.4(2) ?
    N2 N3 C8 C10 . . . . 179.5(3) ?
    Sn1 N3 C8 C10 . . . . 0.5(5) ?
    N2 N3 C8 C9 . . . . -1.2(6) ?
    Sn1 N3 C8 C9 . . . . 179.8(3) ?
    C17 Sn1 C11 C12 . . . . -117.0(3) ?
    N3 Sn1 C11 C12 . . . . -20.3(4) ?
    S1 Sn1 C11 C12 . . . . 59.4(4) ?
    Cl1 Sn1 C11 C12 . . . . 146.3(3) ?
    C17 Sn1 C11 C16 . . . . 63.0(4) ?
    N3 Sn1 C11 C16 . . . . 159.6(3) ?
    S1 Sn1 C11 C16 . . . . -120.6(3) ?
    Cl1 Sn1 C11 C16 . . . . -33.8(3) ?
    C16 C11 C12 C13 . . . . 0.2(6) ?
    Sn1 C11 C12 C13 . . . . -179.8(4) ?
    C11 C12 C13 C14 . . . . -1.2(8) ?
    C12 C13 C14 C15 . . . . 1.1(9) ?
    C13 C14 C15 C16 . . . . 0.0(9) ?
    C14 C15 C16 C11 . . . . -1.0(8) ?
    C12 C11 C16 C15 . . . . 0.9(6) ?
    Sn1 C11 C16 C15 . . . . -179.1(4) ?
    C11 Sn1 C17 C18 . . . . -46.4(4) ?
    N3 Sn1 C17 C18 . . . . -145.7(4) ?
    S1 Sn1 C17 C18 . . . . 137.1(3) ?
    Cl1 Sn1 C17 C18 . . . . 51.0(4) ?
    C11 Sn1 C17 C22 . . . . 137.1(3) ?
    N3 Sn1 C17 C22 . . . . 37.8(3) ?
    S1 Sn1 C17 C22 . . . . -39.4(4) ?
    Cl1 Sn1 C17 C22 . . . . -125.4(3) ?
    C22 C17 C18 C19 . . . . -1.4(7) ?
    Sn1 C17 C18 C19 . . . . -178.0(4) ?
    C17 C18 C19 C20 . . . . 1.2(8) ?
    C18 C19 C20 C21 . . . . -0.3(9) ?
    C19 C20 C21 C22 . . . . -0.5(9) ?
    C20 C21 C22 C17 . . . . 0.3(8) ?
    C18 C17 C22 C21 . . . . 0.6(7) ?
    Sn1 C17 C22 C21 . . . . 177.2(4) ?
loop_
    _geom_hbond_atom_site_label_D
    _geom_hbond_atom_site_label_H
    _geom_hbond_atom_site_label_A
    _geom_hbond_site_symmetry_A
    _geom_hbond_distance_DH
    _geom_hbond_distance_HA
    _geom_hbond_distance_DA
    _geom_hbond_angle_DHA
    _geom_hbond_publ_flag
    O1 H1O Cl1 . 0.85 2.51 3.336(4) 166 yes
    N1 H1N O1 2_646 0.85 2.02 2.863(5) 172 yes
