#------------------------------------------------------------------------------
#$Date: 2016-03-21 15:17:06 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178742 $
#$URL: svn://www.crystallography.net/cod/cif/4/08/53/4085340.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4085340
loop_
_publ_author_name
'Chlupatý, Tomáš'
'R°užičková, Zdeňka'
'Horáček, Michal'
'Alonso, Mercedes'
'De Proft, Frank'
'Kampová, Hana'
'Brus, Jiří'
'R°užička, Aleš'
_publ_section_title
;
 Oxidative Additions of Homoleptic Tin(II) Amidinate
;
_journal_issue                   3
_journal_name_full               Organometallics
_journal_page_first              606
_journal_paper_doi               10.1021/om501074m
_journal_volume                  34
_journal_year                    2015
_chemical_formula_moiety         'C40 H62 Cl4 N4 O2 Sn, 4(C4 H8 O)'
_chemical_formula_sum            'C56 H94 Cl4 N4 O6 Sn'
_chemical_formula_weight         1179.84
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90
_cell_angle_beta                 90.562(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   20.8783(6)
_cell_length_b                   17.8702(4)
_cell_length_c                   16.2240(3)
_cell_measurement_reflns_used    48138
_cell_measurement_temperature    150(1)
_cell_measurement_theta_max      28.5
_cell_measurement_theta_min      1
_cell_volume                     6052.9(2)
_computing_cell_refinement       'COLLECT and DENZO'
_computing_data_collection
'COLLECT (Hooft, 1998) and DENZO (Otwinowski & Minor, 1997)'
_computing_data_reduction        'COLLECT and DENZO'
_computing_molecular_graphics    'PLATON (Spek, 2003)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR92 (Altomare et al., 1994)'
_diffrn_ambient_temperature      150(1)
_diffrn_detector_area_resol_mean 9.091
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker Nonius KappaCCD area detector'
_diffrn_measurement_method       'φ and ω scans to fill the Ewald sphere'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0414
_diffrn_reflns_av_sigmaI/netI    0.0227
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            48070
_diffrn_reflns_theta_full        28.50
_diffrn_reflns_theta_max         28.50
_diffrn_reflns_theta_min         2.92
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.648
_exptl_absorpt_correction_T_max  0.835
_exptl_absorpt_correction_T_min  0.791
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details
;
Gaussian integration (Coppens, 1970)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.295
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2496
_exptl_crystal_size_max          0.47
_exptl_crystal_size_mid          0.38
_exptl_crystal_size_min          0.36
_refine_diff_density_max         1.386
_refine_diff_density_min         -0.811
_refine_diff_density_rms         0.099
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.129
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     321
_refine_ls_number_reflns         7628
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.129
_refine_ls_R_factor_all          0.0512
_refine_ls_R_factor_gt           0.0402
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0538P)²+18.9788P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1036
_refine_ls_wR_factor_ref         0.1173
_reflns_number_gt                6679
_reflns_number_total             7628
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om501074m_si_001.cif
_cod_data_source_block           tch130416Sn1
_cod_depositor_comments
'Adding full bibliography for 4085339--4085346.cif.'
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4085340
loop_
_symmetry_equiv_pos_as_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'
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Sn1 Sn 0.0000 0.213770(12) 0.2500 0.01778(8) Uani 1 2 d S
Cl1 Cl 0.14812(3) -0.00531(4) 0.27380(5) 0.03454(16) Uani 1 1 d .
Cl2 Cl 0.07416(4) -0.15879(4) 0.26501(5) 0.04209(19) Uani 1 1 d .
O1 O 0.06399(8) 0.12610(10) 0.25463(11) 0.0220(3) Uani 1 1 d .
C1 C 0.04539(12) 0.27959(13) 0.12025(15) 0.0214(5) Uani 1 1 d .
C10 C 0.16077(17) 0.43139(19) 0.3252(2) 0.0446(8) Uani 1 1 d .
H10A H 0.1704 0.4694 0.2845 0.053 Uiso 1 1 d R
H10B H 0.1493 0.4565 0.3760 0.053 Uiso 1 1 d R
N2 N 0.06739(10) 0.29054(12) 0.19608(13) 0.0235(4) Uani 1 1 d .
C20 C 0.03295(14) -0.07535(14) 0.25598(15) 0.0274(5) Uani 1 1 d .
N1 N -0.00537(10) 0.23451(12) 0.11964(13) 0.0228(4) Uani 1 1 d .
C18 C 0.03401(11) 0.06040(13) 0.25351(14) 0.0202(4) Uani 1 1 d .
C2 C -0.03461(12) 0.20136(15) 0.04615(15) 0.0235(5) Uani 1 1 d .
H2 H -0.0226 0.2316 -0.0017 0.028 Uiso 1 1 d R
C8 C 0.12100(12) 0.33864(14) 0.21928(16) 0.0252(5) Uani 1 1 d .
H8 H 0.1293 0.3731 0.1737 0.030 Uiso 1 1 d R
C19 C 0.06576(13) -0.00720(15) 0.25988(15) 0.0249(5) Uani 1 1 d .
C14 C 0.07196(13) 0.31494(15) 0.04401(16) 0.0271(5) Uani 1 1 d .
H14A H 0.0710 0.2788 -0.0006 0.032 Uiso 1 1 d R
H14B H 0.1162 0.3292 0.0538 0.032 Uiso 1 1 d R
C15 C 0.03319(17) 0.38359(18) 0.0192(2) 0.0402(7) Uani 1 1 d .
H15A H 0.0339 0.4193 0.0642 0.048 Uiso 1 1 d R
H15B H -0.0110 0.3691 0.0094 0.048 Uiso 1 1 d R
C3 C -0.10748(14) 0.2021(2) 0.0524(2) 0.0380(7) Uani 1 1 d .
H3A H -0.1224 0.2531 0.0585 0.046 Uiso 1 1 d R
H3B H -0.1203 0.1741 0.1008 0.046 Uiso 1 1 d R
C9 C 0.10390(14) 0.38439(16) 0.2951(2) 0.0329(6) Uani 1 1 d .
H9A H 0.0904 0.3511 0.3388 0.040 Uiso 1 1 d R
H9B H 0.0683 0.4173 0.2817 0.040 Uiso 1 1 d R
C13 C 0.18072(13) 0.29185(17) 0.2341(2) 0.0352(6) Uani 1 1 d .
H13A H 0.1926 0.2670 0.1833 0.042 Uiso 1 1 d R
H13B H 0.1717 0.2536 0.2748 0.042 Uiso 1 1 d R
C11 C 0.21915(16) 0.3839(2) 0.3405(2) 0.0456(8) Uani 1 1 d .
H11A H 0.2113 0.3498 0.3858 0.055 Uiso 1 1 d R
H11B H 0.2548 0.4159 0.3560 0.055 Uiso 1 1 d R
C5 C -0.1135(2) 0.0894(2) -0.0399(2) 0.0514(9) Uani 1 1 d .
H5A H -0.1318 0.0706 -0.0910 0.062 Uiso 1 1 d R
H5B H -0.1270 0.0568 0.0044 0.062 Uiso 1 1 d R
C7 C -0.01089(16) 0.12200(18) 0.03254(19) 0.0377(7) Uani 1 1 d .
H7A H -0.0215 0.0913 0.0798 0.045 Uiso 1 1 d R
H7B H 0.0353 0.1224 0.0270 0.045 Uiso 1 1 d R
C4 C -0.13764(17) 0.1672(2) -0.0251(2) 0.0507(9) Uani 1 1 d .
H4A H -0.1837 0.1655 -0.0184 0.061 Uiso 1 1 d R
H4B H -0.1286 0.1984 -0.0725 0.061 Uiso 1 1 d R
C12 C 0.23672(15) 0.3401(2) 0.2646(3) 0.0480(8) Uani 1 1 d .
H12A H 0.2731 0.3082 0.2772 0.058 Uiso 1 1 d R
H12B H 0.2492 0.3743 0.2212 0.058 Uiso 1 1 d R
C27 C 0.2827(4) 0.1409(5) 0.3735(6) 0.131(3) Uani 1 1 d .
H27A H 0.2806 0.1815 0.4130 0.158 Uiso 1 1 d R
H27B H 0.2477 0.1460 0.3342 0.158 Uiso 1 1 d R
C6 C -0.04153(19) 0.08844(19) -0.0449(2) 0.0451(8) Uani 1 1 d .
H6A H -0.0282 0.1169 -0.0927 0.054 Uiso 1 1 d R
H6B H -0.0269 0.0373 -0.0517 0.054 Uiso 1 1 d R
C22 C 0.2412(3) 0.1059(5) 0.0828(5) 0.120(3) Uani 1 1 d .
H22A H 0.2522 0.0534 0.0893 0.144 Uiso 1 1 d R
H22B H 0.2645 0.1356 0.1232 0.144 Uiso 1 1 d R
C21 C 0.1726(2) 0.1172(2) 0.0883(3) 0.0631(11) Uani 1 1 d .
H21A H 0.1501 0.0731 0.0684 0.076 Uiso 1 1 d R
H21B H 0.1597 0.1264 0.1446 0.076 Uiso 1 1 d R
O3 O 0.3352(4) 0.0270(5) 0.3948(5) 0.195(4) Uani 1 1 d .
C24 C 0.1840(4) 0.1494(6) -0.0300(4) 0.136(4) Uani 1 1 d .
H24A H 0.1804 0.1853 -0.0747 0.163 Uiso 1 1 d R
H24B H 0.1622 0.1038 -0.0464 0.163 Uiso 1 1 d R
C25 C 0.3772(4) 0.0725(5) 0.3605(8) 0.150(4) Uani 1 1 d .
H25A H 0.3982 0.0478 0.3150 0.180 Uiso 1 1 d R
H25B H 0.4095 0.0857 0.4013 0.180 Uiso 1 1 d R
C16 C 0.0594(2) 0.4210(2) -0.0583(3) 0.0616(11) Uani 1 1 d .
H16A H 0.0357 0.4669 -0.0682 0.074 Uiso 1 1 d R
H16B H 0.1039 0.4344 -0.0487 0.074 Uiso 1 1 d R
C23 C 0.2507(4) 0.1339(5) -0.0103(7) 0.175(5) Uani 1 1 d .
H23A H 0.2770 0.1785 -0.0123 0.210 Uiso 1 1 d R
H23B H 0.2683 0.0956 -0.0458 0.210 Uiso 1 1 d R
C17 C 0.0557(3) 0.3735(4) -0.1338(3) 0.0893(18) Uani 1 1 d .
H17A H 0.0819 0.3298 -0.1263 0.107 Uiso 1 1 d R
H17B H 0.0704 0.4012 -0.1806 0.107 Uiso 1 1 d R
H17C H 0.0120 0.3586 -0.1428 0.107 Uiso 1 1 d R
C26 C 0.3437(6) 0.1390(5) 0.3313(9) 0.212(7) Uani 1 1 d .
H26A H 0.3376 0.1373 0.2720 0.254 Uiso 1 1 d R
H26B H 0.3684 0.1833 0.3453 0.254 Uiso 1 1 d R
O2 O 0.1570(3) 0.1771(3) 0.0398(3) 0.1212(17) Uani 1 1 d .
C28 C 0.2807(4) 0.0688(5) 0.4150(6) 0.125(3) Uani 1 1 d .
H28A H 0.2795 0.0762 0.4742 0.150 Uiso 1 1 d R
H28B H 0.2422 0.0423 0.3983 0.150 Uiso 1 1 d R
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'
O O 0.0106 0.0060 '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'
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'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1 0 0 0.172
-1 0 -1 0.223
1 0 -1 0.191
0 0 1 0.176
0 -1 0 0.146
0 1 0 0.182
0 -1 1 0.147
0 -1 -1 0.213
0 1 -1 0.237
0 1 1 0.210
-1 0 1 0.179
1 0 1 0.202
-1 0 0 0.192
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
O1 Sn1 O1 80.97(9) 2 .
O1 Sn1 N1 101.23(8) 2 2
O1 Sn1 N1 93.88(8) . 2
O1 Sn1 N1 93.88(8) 2 .
O1 Sn1 N1 101.23(8) . .
N1 Sn1 N1 160.14(12) 2 .
O1 Sn1 N2 94.19(8) 2 2
O1 Sn1 N2 153.45(8) . 2
N1 Sn1 N2 61.26(8) 2 2
N1 Sn1 N2 105.16(8) . 2
O1 Sn1 N2 153.44(8) 2 .
O1 Sn1 N2 94.19(8) . .
N1 Sn1 N2 105.16(8) 2 .
N1 Sn1 N2 61.26(8) . .
N2 Sn1 N2 100.99(12) 2 .
O1 Sn1 C1 97.61(7) 2 2
O1 Sn1 C1 123.80(7) . 2
N1 Sn1 C1 30.75(8) 2 2
N1 Sn1 C1 134.69(8) . 2
N2 Sn1 C1 30.56(8) 2 2
N2 Sn1 C1 106.57(8) . 2
O1 Sn1 C1 123.79(7) 2 .
O1 Sn1 C1 97.60(7) . .
N1 Sn1 C1 134.69(8) 2 .
N1 Sn1 C1 30.75(8) . .
N2 Sn1 C1 106.57(8) 2 .
N2 Sn1 C1 30.56(8) . .
C1 Sn1 C1 126.17(11) 2 .
C18 O1 Sn1 111.45(14) . .
N2 C1 N1 111.4(2) . .
N2 C1 C14 125.2(2) . .
N1 C1 C14 123.3(2) . .
N2 C1 Sn1 55.94(13) . .
N1 C1 Sn1 55.63(12) . .
C14 C1 Sn1 177.99(18) . .
C11 C10 C9 111.6(3) . .
C11 C10 H10A 109.5 . .
C9 C10 H10A 109.4 . .
C11 C10 H10B 109.1 . .
C9 C10 H10B 109.2 . .
H10A C10 H10B 107.9 . .
C1 N2 C8 125.9(2) . .
C1 N2 Sn1 93.50(15) . .
C8 N2 Sn1 140.60(17) . .
C20 C20 C19 119.40(15) 2 .
C20 C20 Cl2 120.29(10) 2 .
C19 C20 Cl2 120.3(2) . .
C1 N1 C2 125.3(2) . .
C1 N1 Sn1 93.62(15) . .
C2 N1 Sn1 138.70(17) . .
O1 C18 C19 123.0(2) . .
O1 C18 C18 118.04(12) . 2
C19 C18 C18 118.92(15) . 2
N1 C2 C7 111.3(2) . .
N1 C2 C3 110.6(2) . .
C7 C2 C3 110.1(2) . .
N1 C2 H2 108.3 . .
C7 C2 H2 108.3 . .
C3 C2 H2 108.1 . .
N2 C8 C13 110.1(2) . .
N2 C8 C9 109.9(2) . .
C13 C8 C9 111.5(2) . .
N2 C8 H8 108.5 . .
C13 C8 H8 108.3 . .
C9 C8 H8 108.5 . .
C18 C19 C20 121.6(2) . .
C18 C19 Cl1 117.9(2) . .
C20 C19 Cl1 120.5(2) . .
C1 C14 C15 111.0(2) . .
C1 C14 H14A 109.3 . .
C15 C14 H14A 109.4 . .
C1 C14 H14B 109.6 . .
C15 C14 H14B 109.6 . .
H14A C14 H14B 108.0 . .
C14 C15 C16 112.1(3) . .
C14 C15 H15A 109.1 . .
C16 C15 H15A 109.1 . .
C14 C15 H15B 109.3 . .
C16 C15 H15B 109.2 . .
H15A C15 H15B 107.8 . .
C2 C3 C4 110.1(3) . .
C2 C3 H3A 109.7 . .
C4 C3 H3A 109.7 . .
C2 C3 H3B 109.5 . .
C4 C3 H3B 109.8 . .
H3A C3 H3B 108.0 . .
C8 C9 C10 111.4(3) . .
C8 C9 H9A 109.5 . .
C10 C9 H9A 109.5 . .
C8 C9 H9B 109.3 . .
C10 C9 H9B 109.2 . .
H9A C9 H9B 108.0 . .
C8 C13 C12 111.3(3) . .
C8 C13 H13A 109.5 . .
C12 C13 H13A 109.3 . .
C8 C13 H13B 109.3 . .
C12 C13 H13B 109.3 . .
H13A C13 H13B 108.0 . .
C10 C11 C12 111.2(3) . .
C10 C11 H11A 109.6 . .
C12 C11 H11A 109.7 . .
C10 C11 H11B 109.2 . .
C12 C11 H11B 109.0 . .
H11A C11 H11B 108.0 . .
C4 C5 C6 110.9(3) . .
C4 C5 H5A 109.3 . .
C6 C5 H5A 109.6 . .
C4 C5 H5B 109.8 . .
C6 C5 H5B 109.2 . .
H5A C5 H5B 108.0 . .
C2 C7 C6 110.6(2) . .
C2 C7 H7A 109.6 . .
C6 C7 H7A 109.4 . .
C2 C7 H7B 109.5 . .
C6 C7 H7B 109.6 . .
H7A C7 H7B 108.1 . .
C5 C4 C3 111.9(3) . .
C5 C4 H4A 109.0 . .
C3 C4 H4A 108.7 . .
C5 C4 H4B 109.7 . .
C3 C4 H4B 109.6 . .
H4A C4 H4B 107.9 . .
C11 C12 C13 111.4(3) . .
C11 C12 H12A 109.2 . .
C13 C12 H12A 109.3 . .
C11 C12 H12B 109.6 . .
C13 C12 H12B 109.2 . .
H12A C12 H12B 107.9 . .
C26 C27 C28 103.2(7) . .
C26 C27 H27A 112.0 . .
C28 C27 H27A 110.8 . .
C26 C27 H27B 110.5 . .
C28 C27 H27B 111.3 . .
H27A C27 H27B 109.0 . .
C5 C6 C7 111.2(3) . .
C5 C6 H6A 109.3 . .
C7 C6 H6A 109.3 . .
C5 C6 H6B 109.5 . .
C7 C6 H6B 109.5 . .
H6A C6 H6B 108.1 . .
C21 C22 C23 98.3(5) . .
C21 C22 H22A 111.1 . .
C23 C22 H22A 111.8 . .
C21 C22 H22B 111.7 . .
C23 C22 H22B 113.6 . .
H22A C22 H22B 109.9 . .
O2 C21 C22 107.7(5) . .
O2 C21 C24 42.2(3) . .
C22 C21 C24 81.7(4) . .
O2 C21 H21A 109.4 . .
C22 C21 H21A 110.1 . .
C24 C21 H21A 88.7 . .
O2 C21 H21B 110.1 . .
C22 C21 H21B 111.4 . .
C24 C21 H21B 152.1 . .
H21A C21 H21B 108.2 . .
C25 O3 C28 108.3(8) . .
O2 C24 C23 106.9(7) . .
O2 C24 C21 42.3(3) . .
C23 C24 C21 81.8(5) . .
O2 C24 H24A 110.6 . .
C23 C24 H24A 111.0 . .
C21 C24 H24A 152.8 . .
O2 C24 H24B 109.6 . .
C23 C24 H24B 110.3 . .
C21 C24 H24B 87.8 . .
H24A C24 H24B 108.5 . .
O3 C25 C26 108.7(7) . .
O3 C25 H25A 110.3 . .
C26 C25 H25A 110.1 . .
O3 C25 H25B 108.8 . .
C26 C25 H25B 110.7 . .
H25A C25 H25B 108.3 . .
C17 C16 C15 114.2(4) . .
C17 C16 H16A 108.8 . .
C15 C16 H16A 108.6 . .
C17 C16 H16B 108.3 . .
C15 C16 H16B 109.0 . .
H16A C16 H16B 107.7 . .
C24 C23 C22 98.1(5) . .
C24 C23 H23A 112.2 . .
C22 C23 H23A 111.3 . .
C24 C23 H23B 111.9 . .
C22 C23 H23B 112.9 . .
H23A C23 H23B 110.0 . .
C16 C17 H17A 109.5 . .
C16 C17 H17B 110.0 . .
H17A C17 H17B 109.5 . .
C16 C17 H17C 108.9 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C27 C26 C25 106.6(8) . .
C27 C26 H26A 111.2 . .
C25 C26 H26A 110.8 . .
C27 C26 H26B 109.7 . .
C25 C26 H26B 109.7 . .
H26A C26 H26B 108.8 . .
C24 O2 C21 95.5(5) . .
O3 C28 C27 109.6(7) . .
O3 C28 H28A 109.5 . .
C27 C28 H28A 109.9 . .
O3 C28 H28B 110.3 . .
C27 C28 H28B 109.4 . .
H28A C28 H28B 108.2 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sn1 O1 2.0599(17) 2
Sn1 O1 2.0600(17) .
Sn1 N1 2.149(2) 2
Sn1 N1 2.149(2) .
Sn1 N2 2.156(2) 2
Sn1 N2 2.157(2) .
Sn1 C1 2.598(2) 2
Sn1 C1 2.598(2) .
Cl1 C19 1.732(3) .
Cl2 C20 1.727(3) .
O1 C18 1.331(3) .
C1 N2 1.324(3) .
C1 N1 1.331(3) .
C1 C14 1.500(3) .
C10 C11 1.504(5) .
C10 C9 1.531(4) .
C10 H10A 0.9700 .
C10 H10B 0.9699 .
N2 C8 1.458(3) .
C20 C20 1.388(6) 2
C20 C19 1.398(4) .
N1 C2 1.460(3) .
C18 C19 1.381(3) .
C18 C18 1.423(5) 2
C2 C7 1.519(4) .
C2 C3 1.526(4) .
C2 H2 0.9801 .
C8 C13 1.518(4) .
C8 C9 1.522(4) .
C8 H8 0.9799 .
C14 C15 1.522(4) .
C14 H14A 0.9701 .
C14 H14B 0.9698 .
C15 C16 1.530(4) .
C15 H15A 0.9700 .
C15 H15B 0.9700 .
C3 C4 1.533(4) .
C3 H3A 0.9701 .
C3 H3B 0.9700 .
C9 H9A 0.9700 .
C9 H9B 0.9701 .
C13 C12 1.531(4) .
C13 H13A 0.9699 .
C13 H13B 0.9700 .
C11 C12 1.507(5) .
C11 H11A 0.9700 .
C11 H11B 0.9702 .
C5 C4 1.498(6) .
C5 C6 1.506(5) .
C5 H5A 0.9699 .
C5 H5B 0.9701 .
C7 C6 1.527(4) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C4 H4A 0.9701 .
C4 H4B 0.9699 .
C12 H12A 0.9702 .
C12 H12B 0.9700 .
C27 C26 1.452(11) .
C27 C28 1.454(10) .
C27 H27A 0.9700 .
C27 H27B 0.9700 .
C6 H6A 0.9699 .
C6 H6B 0.9699 .
C22 C21 1.451(8) .
C22 C23 1.606(11) .
C22 H22A 0.9699 .
C22 H22B 0.9700 .
C21 O2 1.367(6) .
C21 C24 2.020(9) .
C21 H21A 0.9700 .
C21 H21B 0.9699 .
O3 C25 1.322(11) .
O3 C28 1.403(9) .
C24 O2 1.363(8) .
C24 C23 1.451(11) .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 C26 1.456(14) .
C25 H25A 0.9699 .
C25 H25B 0.9700 .
C16 C17 1.492(7) .
C16 H16A 0.9699 .
C16 H16B 0.9700 .
C23 H23A 0.9700 .
C23 H23B 0.9701 .
C17 H17A 0.9599 .
C17 H17B 0.9598 .
C17 H17C 0.9601 .
C26 H26A 0.9699 .
C26 H26B 0.9700 .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
