#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/69/2226947.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2226947
loop_
_publ_author_name
'Basu, Smita'
'Masharing, Cheerfulman'
'Das, Babulal'
_publ_section_title
;
 {4-[(3-Formyl-4-hydroxyphenyl)diazenyl]benzoato}triphenyltin
;
_journal_coeditor_code           IS2569
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m927
_journal_paper_doi               10.1107/S160053681002708X
_journal_volume                  66
_journal_year                    2010
_chemical_formula_iupac          '[Sn (C6 H5)3 (C14 H9 N2 O4)]'
_chemical_formula_moiety         'C32 H24 N2 O4 Sn'
_chemical_formula_sum            'C32 H24 N2 O4 Sn'
_chemical_formula_weight         619.22
_chemical_name_systematic
;
{4-[(3-Formyl-4-hydroxyphenyl)diazenyl]benzoato}triphenyltin
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/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                90.00
_cell_angle_beta                 97.2620(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.3751(2)
_cell_length_b                   48.8458(11)
_cell_length_c                   6.9742(2)
_cell_measurement_reflns_used    9937
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.32
_cell_measurement_theta_min      0.83
_cell_volume                     2830.18(12)
_computing_cell_refinement       'SAINT (Bruker, 2001)'
_computing_data_collection       'SMART (Bruker, 2001)'
_computing_data_reduction        'SAINT (Bruker, 2001)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Bruker SMART APEX CCD area-detector'
_diffrn_measurement_method       'φ and ω scans'
_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  0.0588
_diffrn_reflns_av_sigmaI/netI    0.0567
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       57
_diffrn_reflns_limit_k_min       -57
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_limit_l_min       -8
_diffrn_reflns_number            29857
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.67
_exptl_absorpt_coefficient_mu    0.942
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.453
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plates
_exptl_crystal_F_000             1248
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.310
_refine_diff_density_min         -0.440
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.946
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     353
_refine_ls_number_reflns         4891
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.946
_refine_ls_R_factor_all          0.0587
_refine_ls_R_factor_gt           0.0335
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0230P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0538
_refine_ls_wR_factor_ref         0.0578
_reflns_number_gt                3415
_reflns_number_total             4891
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            is2569.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2226947
_cod_database_fobs_code          2226947
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'
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
C C1 0.6547(3) 0.11657(6) 0.9304(5) 0.0516(8) Uani d . 1 . .
C C2 0.6036(3) 0.09446(5) 0.7896(4) 0.0442(7) Uani d . 1 . .
C C3 0.5061(3) 0.07333(6) 0.8418(4) 0.0516(8) Uani d . 1 . .
H H3A 0.4803 0.0724 0.9674 0.062 Uiso calc R 1 . .
C C4 0.4479(3) 0.05383(6) 0.7093(5) 0.0526(8) Uani d . 1 . .
H H4 0.3820 0.0399 0.7448 0.063 Uiso calc R 1 . .
C C5 0.4873(3) 0.05497(6) 0.5236(5) 0.0463(8) Uani d . 1 . .
C C6 0.5886(3) 0.07506(6) 0.4717(4) 0.0569(8) Uani d . 1 . .
H H6 0.6189 0.0753 0.3480 0.068 Uiso calc R 1 . .
C C7 0.6451(3) 0.09494(6) 0.6040(5) 0.0545(8) Uani d . 1 . .
H H7 0.7116 0.1088 0.5678 0.065 Uiso calc R 1 . .
C C8 0.2627(4) 0.00218(6) 0.2606(5) 0.0519(8) Uani d . 1 . .
C C9 0.1587(4) -0.01790(6) 0.3020(5) 0.0625(9) Uani d . 1 . .
H H9 0.1308 -0.0194 0.4265 0.075 Uiso calc R 1 . .
C C10 0.0936(4) -0.03626(6) 0.1580(5) 0.0586(9) Uani d . 1 . .
C C11 0.1364(4) -0.03351(7) -0.0275(6) 0.0622(9) Uani d . 1 . .
C C12 0.2416(4) -0.01337(7) -0.0683(5) 0.0742(10) Uani d . 1 . .
H H12 0.2702 -0.0118 -0.1924 0.089 Uiso calc R 1 . .
C C13 0.3043(4) 0.00436(6) 0.0740(5) 0.0671(9) Uani d . 1 . .
H H13 0.3753 0.0180 0.0457 0.081 Uiso calc R 1 . .
C C14 -0.0161(4) -0.05678(8) 0.2034(6) 0.0924(12) Uani d . 1 . .
H H14 -0.0394 -0.0578 0.3300 0.111 Uiso calc R 1 . .
C C15 0.9102(4) 0.19239(5) 0.9057(4) 0.0453(7) Uani d . 1 . .
C C16 1.0741(4) 0.19735(6) 0.9357(4) 0.0615(9) Uani d . 1 . .
H H16 1.1375 0.1881 1.0341 0.074 Uiso calc R 1 . .
C C17 1.1451(5) 0.21562(8) 0.8234(6) 0.0850(11) Uani d . 1 . .
H H17 1.2558 0.2184 0.8452 0.102 Uiso calc R 1 . .
C C18 1.0549(7) 0.22972(7) 0.6805(6) 0.0909(14) Uani d . 1 . .
H H18 1.1036 0.2423 0.6065 0.109 Uiso calc R 1 . .
C C19 0.8933(6) 0.22542(7) 0.6457(5) 0.0817(11) Uani d . 1 . .
H H19 0.8316 0.2350 0.5476 0.098 Uiso calc R 1 . .
C C20 0.8212(4) 0.20680(6) 0.7567(5) 0.0623(9) Uani d . 1 . .
H H20 0.7109 0.2038 0.7312 0.075 Uiso calc R 1 . .
C C21 0.9745(3) 0.14332(5) 1.2753(4) 0.0449(8) Uani d . 1 . .
C C22 0.9802(4) 0.14661(6) 1.4718(5) 0.0633(9) Uani d . 1 . .
H H22 0.9087 0.1586 1.5199 0.076 Uiso calc R 1 . .
C C23 1.0892(5) 0.13256(8) 1.5982(5) 0.0833(11) Uani d . 1 . .
H H23 1.0906 0.1349 1.7307 0.100 Uiso calc R 1 . .
C C24 1.1959(4) 0.11507(7) 1.5296(7) 0.0837(11) Uani d . 1 . .
H H24 1.2694 0.1054 1.6150 0.100 Uiso calc R 1 . .
C C25 1.1942(4) 0.11190(7) 1.3350(7) 0.0903(12) Uani d . 1 . .
H H25 1.2673 0.1002 1.2871 0.108 Uiso calc R 1 . .
C C26 1.0847(4) 0.12598(7) 1.2107(5) 0.0737(10) Uani d . 1 . .
H H26 1.0849 0.1237 1.0783 0.088 Uiso calc R 1 . .
C C27 0.6131(3) 0.18359(6) 1.2020(4) 0.0494(8) Uani d . 1 . .
C C28 0.5985(4) 0.21167(7) 1.1858(4) 0.0658(9) Uani d . 1 . .
H H28 0.6671 0.2213 1.1149 0.079 Uiso calc R 1 . .
C C29 0.4843(5) 0.22580(7) 1.2725(5) 0.0891(12) Uani d . 1 . .
H H29 0.4754 0.2447 1.2585 0.107 Uiso calc R 1 . .
C C30 0.3850(4) 0.21211(9) 1.3783(5) 0.0871(12) Uani d . 1 . .
H H30 0.3084 0.2217 1.4371 0.105 Uiso calc R 1 . .
C C31 0.3965(4) 0.18456(9) 1.3989(5) 0.0833(11) Uani d . 1 . .
H H31 0.3279 0.1753 1.4714 0.100 Uiso calc R 1 . .
C C32 0.5107(4) 0.17018(6) 1.3119(5) 0.0695(10) Uani d . 1 . .
H H32 0.5187 0.1513 1.3275 0.083 Uiso calc R 1 . .
N N1 0.4264(3) 0.03633(5) 0.3724(3) 0.0567(7) Uani d . 1 . .
N N2 0.3234(3) 0.01978(5) 0.4159(4) 0.0568(7) Uani d . 1 . .
O O1 0.6276(3) 0.11589(4) 1.0984(3) 0.0693(6) Uani d . 1 . .
O O2 0.7321(2) 0.13706(4) 0.8634(3) 0.0578(6) Uani d . 1 . .
O O3 0.0779(3) -0.05032(5) -0.1753(3) 0.0941(8) Uani d . 1 . .
H H3 0.0189 -0.0619 -0.1356 0.141 Uiso calc R 1 . .
O O4 -0.0820(3) -0.07322(5) 0.0854(4) 0.1118(10) Uani d . 1 . .
Sn Sn1 0.80328(2) 0.164169(4) 1.08190(3) 0.04767(10) Uani d . 1 . .
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'
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'
Sn Sn -0.6537 1.4246 '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'
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
O1 C1 O2 . . 121.5(3) ?
O1 C1 C2 . . 122.8(3) ?
O2 C1 C2 . . 115.7(3) ?
C7 C2 C3 . . 118.8(3) ?
C7 C2 C1 . . 121.4(3) ?
C3 C2 C1 . . 119.7(3) ?
C4 C3 C2 . . 120.6(3) ?
C4 C3 H3A . . 119.7 ?
C2 C3 H3A . . 119.7 ?
C3 C4 C5 . . 119.8(3) ?
C3 C4 H4 . . 120.1 ?
C5 C4 H4 . . 120.1 ?
C6 C5 C4 . . 120.3(3) ?
C6 C5 N1 . . 115.6(3) ?
C4 C5 N1 . . 124.0(3) ?
C5 C6 C7 . . 119.8(3) ?
C5 C6 H6 . . 120.1 ?
C7 C6 H6 . . 120.1 ?
C6 C7 C2 . . 120.5(3) ?
C6 C7 H7 . . 119.7 ?
C2 C7 H7 . . 119.7 ?
C9 C8 C13 . . 119.6(3) ?
C9 C8 N2 . . 116.6(3) ?
C13 C8 N2 . . 123.8(3) ?
C8 C9 C10 . . 120.5(3) ?
C8 C9 H9 . . 119.8 ?
C10 C9 H9 . . 119.8 ?
C11 C10 C9 . . 118.8(3) ?
C11 C10 C14 . . 121.6(3) ?
C9 C10 C14 . . 119.6(3) ?
O3 C11 C12 . . 117.0(3) ?
O3 C11 C10 . . 122.4(3) ?
C12 C11 C10 . . 120.6(3) ?
C13 C12 C11 . . 119.9(3) ?
C13 C12 H12 . . 120.0 ?
C11 C12 H12 . . 120.0 ?
C12 C13 C8 . . 120.7(3) ?
C12 C13 H13 . . 119.7 ?
C8 C13 H13 . . 119.7 ?
O4 C14 C10 . . 124.0(4) ?
O4 C14 H14 . . 118.0 ?
C10 C14 H14 . . 118.0 ?
C16 C15 C20 . . 116.9(3) ?
C16 C15 Sn1 . . 120.7(2) ?
C20 C15 Sn1 . . 122.5(2) ?
C17 C16 C15 . . 121.4(3) ?
C17 C16 H16 . . 119.3 ?
C15 C16 H16 . . 119.3 ?
C18 C17 C16 . . 120.5(4) ?
C18 C17 H17 . . 119.8 ?
C16 C17 H17 . . 119.8 ?
C17 C18 C19 . . 120.0(4) ?
C17 C18 H18 . . 120.0 ?
C19 C18 H18 . . 120.0 ?
C18 C19 C20 . . 119.8(4) ?
C18 C19 H19 . . 120.1 ?
C20 C19 H19 . . 120.1 ?
C19 C20 C15 . . 121.4(3) ?
C19 C20 H20 . . 119.3 ?
C15 C20 H20 . . 119.3 ?
C26 C21 C22 . . 117.4(3) ?
C26 C21 Sn1 . . 121.4(2) ?
C22 C21 Sn1 . . 121.2(2) ?
C23 C22 C21 . . 121.3(3) ?
C23 C22 H22 . . 119.4 ?
C21 C22 H22 . . 119.4 ?
C24 C23 C22 . . 120.0(3) ?
C24 C23 H23 . . 120.0 ?
C22 C23 H23 . . 120.0 ?
C25 C24 C23 . . 119.6(3) ?
C25 C24 H24 . . 120.2 ?
C23 C24 H24 . . 120.2 ?
C24 C25 C26 . . 119.7(4) ?
C24 C25 H25 . . 120.1 ?
C26 C25 H25 . . 120.1 ?
C25 C26 C21 . . 121.9(3) ?
C25 C26 H26 . . 119.0 ?
C21 C26 H26 . . 119.0 ?
C28 C27 C32 . . 117.4(3) ?
C28 C27 Sn1 . . 118.4(2) ?
C32 C27 Sn1 . . 123.8(2) ?
C29 C28 C27 . . 121.3(3) ?
C29 C28 H28 . . 119.3 ?
C27 C28 H28 . . 119.3 ?
C30 C29 C28 . . 120.0(3) ?
C30 C29 H29 . . 120.0 ?
C28 C29 H29 . . 120.0 ?
C29 C30 C31 . . 120.4(3) ?
C29 C30 H30 . . 119.8 ?
C31 C30 H30 . . 119.8 ?
C30 C31 C32 . . 120.0(3) ?
C30 C31 H31 . . 120.0 ?
C32 C31 H31 . . 120.0 ?
C27 C32 C31 . . 120.8(3) ?
C27 C32 H32 . . 119.6 ?
C31 C32 H32 . . 119.6 ?
N2 N1 C5 . . 115.1(2) ?
N1 N2 C8 . . 113.4(3) ?
C1 O2 Sn1 . . 109.81(19) ?
C11 O3 H3 . . 109.5 ?
O2 Sn1 C21 . . 105.94(9) ?
O2 Sn1 C27 . . 114.91(9) ?
C21 Sn1 C27 . . 116.72(11) ?
O2 Sn1 C15 . . 95.37(9) ?
C21 Sn1 C15 . . 112.52(12) ?
C27 Sn1 C15 . . 109.42(11) ?
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
C1 O1 . 1.222(3) ?
C1 O2 . 1.310(3) ?
C1 C2 . 1.486(4) ?
C2 C7 . 1.382(3) ?
C2 C3 . 1.393(3) ?
C3 C4 . 1.373(3) ?
C3 H3A . 0.9300 ?
C4 C5 . 1.377(4) ?
C4 H4 . 0.9300 ?
C5 C6 . 1.375(3) ?
C5 N1 . 1.437(3) ?
C6 C7 . 1.381(3) ?
C6 H6 . 0.9300 ?
C7 H7 . 0.9300 ?
C8 C9 . 1.367(4) ?
C8 C13 . 1.393(4) ?
C8 N2 . 1.425(3) ?
C9 C10 . 1.404(4) ?
C9 H9 . 0.9300 ?
C10 C11 . 1.392(4) ?
C10 C14 . 1.422(4) ?
C11 O3 . 1.360(3) ?
C11 C12 . 1.374(4) ?
C12 C13 . 1.371(4) ?
C12 H12 . 0.9300 ?
C13 H13 . 0.9300 ?
C14 O4 . 1.230(4) ?
C14 H14 . 0.9300 ?
C15 C16 . 1.384(4) ?
C15 C20 . 1.391(4) ?
C15 Sn1 . 2.119(3) ?
C16 C17 . 1.371(4) ?
C16 H16 . 0.9300 ?
C17 C18 . 1.360(5) ?
C17 H17 . 0.9300 ?
C18 C19 . 1.360(4) ?
C18 H18 . 0.9300 ?
C19 C20 . 1.382(4) ?
C19 H19 . 0.9300 ?
C20 H20 . 0.9300 ?
C21 C26 . 1.370(4) ?
C21 C22 . 1.374(4) ?
C21 Sn1 . 2.104(3) ?
C22 C23 . 1.371(4) ?
C22 H22 . 0.9300 ?
C23 C24 . 1.366(4) ?
C23 H23 . 0.9300 ?
C24 C25 . 1.364(4) ?
C24 H24 . 0.9300 ?
C25 C26 . 1.366(4) ?
C25 H25 . 0.9300 ?
C26 H26 . 0.9300 ?
C27 C28 . 1.381(3) ?
C27 C32 . 1.384(4) ?
C27 Sn1 . 2.116(3) ?
C28 C29 . 1.380(4) ?
C28 H28 . 0.9300 ?
C29 C30 . 1.355(4) ?
C29 H29 . 0.9300 ?
C30 C31 . 1.356(4) ?
C30 H30 . 0.9300 ?
C31 C32 . 1.387(4) ?
C31 H31 . 0.9300 ?
C32 H32 . 0.9300 ?
N1 N2 . 1.248(3) ?
O2 Sn1 . 2.0498(18) ?
O3 H3 . 0.8200 ?
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
O1 C1 C2 C7 . . . . -175.7(3) ?
O2 C1 C2 C7 . . . . 4.0(4) ?
O1 C1 C2 C3 . . . . 7.1(4) ?
O2 C1 C2 C3 . . . . -173.2(2) ?
C7 C2 C3 C4 . . . . -2.1(4) ?
C1 C2 C3 C4 . . . . 175.2(3) ?
C2 C3 C4 C5 . . . . 0.6(4) ?
C3 C4 C5 C6 . . . . 2.0(4) ?
C3 C4 C5 N1 . . . . -177.0(2) ?
C4 C5 C6 C7 . . . . -3.0(4) ?
N1 C5 C6 C7 . . . . 176.0(2) ?
C5 C6 C7 C2 . . . . 1.5(4) ?
C3 C2 C7 C6 . . . . 1.1(4) ?
C1 C2 C7 C6 . . . . -176.2(3) ?
C13 C8 C9 C10 . . . . 0.0(4) ?
N2 C8 C9 C10 . . . . -179.7(3) ?
C8 C9 C10 C11 . . . . -0.4(4) ?
C8 C9 C10 C14 . . . . -179.2(3) ?
C9 C10 C11 O3 . . . . -179.5(3) ?
C14 C10 C11 O3 . . . . -0.8(5) ?
C9 C10 C11 C12 . . . . 0.7(5) ?
C14 C10 C11 C12 . . . . 179.4(3) ?
O3 C11 C12 C13 . . . . 179.7(3) ?
C10 C11 C12 C13 . . . . -0.5(5) ?
C11 C12 C13 C8 . . . . 0.1(5) ?
C9 C8 C13 C12 . . . . 0.2(5) ?
N2 C8 C13 C12 . . . . 179.8(3) ?
C11 C10 C14 O4 . . . . -0.7(6) ?
C9 C10 C14 O4 . . . . 178.0(3) ?
C20 C15 C16 C17 . . . . -0.1(4) ?
Sn1 C15 C16 C17 . . . . -179.8(2) ?
C15 C16 C17 C18 . . . . 1.0(5) ?
C16 C17 C18 C19 . . . . -1.2(5) ?
C17 C18 C19 C20 . . . . 0.3(5) ?
C18 C19 C20 C15 . . . . 0.6(5) ?
C16 C15 C20 C19 . . . . -0.8(4) ?
Sn1 C15 C20 C19 . . . . 179.0(2) ?
C26 C21 C22 C23 . . . . -1.6(5) ?
Sn1 C21 C22 C23 . . . . 178.5(2) ?
C21 C22 C23 C24 . . . . 0.6(5) ?
C22 C23 C24 C25 . . . . 0.6(5) ?
C23 C24 C25 C26 . . . . -0.7(6) ?
C24 C25 C26 C21 . . . . -0.3(5) ?
C22 C21 C26 C25 . . . . 1.5(5) ?
Sn1 C21 C26 C25 . . . . -178.6(3) ?
C32 C27 C28 C29 . . . . -1.2(5) ?
Sn1 C27 C28 C29 . . . . -175.4(2) ?
C27 C28 C29 C30 . . . . 0.9(5) ?
C28 C29 C30 C31 . . . . -0.3(6) ?
C29 C30 C31 C32 . . . . 0.1(6) ?
C28 C27 C32 C31 . . . . 1.1(5) ?
Sn1 C27 C32 C31 . . . . 174.9(2) ?
C30 C31 C32 C27 . . . . -0.6(5) ?
C6 C5 N1 N2 . . . . -173.7(2) ?
C4 C5 N1 N2 . . . . 5.3(4) ?
C5 N1 N2 C8 . . . . 178.3(2) ?
C9 C8 N2 N1 . . . . 175.0(2) ?
C13 C8 N2 N1 . . . . -4.6(4) ?
O1 C1 O2 Sn1 . . . . 3.0(3) ?
C2 C1 O2 Sn1 . . . . -176.74(18) ?
C1 O2 Sn1 C21 . . . . 66.29(19) ?
C1 O2 Sn1 C27 . . . . -64.1(2) ?
C1 O2 Sn1 C15 . . . . -178.44(19) ?
C26 C21 Sn1 O2 . . . . 38.5(2) ?
C22 C21 Sn1 O2 . . . . -141.6(2) ?
C26 C21 Sn1 C27 . . . . 167.8(2) ?
C22 C21 Sn1 C27 . . . . -12.2(3) ?
C26 C21 Sn1 C15 . . . . -64.5(3) ?
C22 C21 Sn1 C15 . . . . 115.5(2) ?
C28 C27 Sn1 O2 . . . . -117.3(2) ?
C32 C27 Sn1 O2 . . . . 68.9(3) ?
C28 C27 Sn1 C21 . . . . 117.7(2) ?
C32 C27 Sn1 C21 . . . . -56.0(3) ?
C28 C27 Sn1 C15 . . . . -11.5(3) ?
C32 C27 Sn1 C15 . . . . 174.8(2) ?
C16 C15 Sn1 O2 . . . . -115.4(2) ?
C20 C15 Sn1 O2 . . . . 64.9(2) ?
C16 C15 Sn1 C21 . . . . -5.7(3) ?
C20 C15 Sn1 C21 . . . . 174.6(2) ?
C16 C15 Sn1 C27 . . . . 125.8(2) ?
C20 C15 Sn1 C27 . . . . -53.9(2) ?
