#------------------------------------------------------------------------------
#$Date: 2016-03-23 22:48:03 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179491 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/88/4338855.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_4338855
loop_
_publ_author_name
'Gerasimchuk, Nikolay'
'Maher, Tiffany'
'Durham, Paul'
'Domasevitch, Konstantin V.'
'Wilking, Janet'
'Mokhir, Andrew'
_publ_section_title
;
 Tin(IV) cyanoximates: synthesis, characterization, and cytotoxicity.
;
_journal_issue                   18
_journal_name_full               'Inorganic chemistry'
_journal_page_first              7268
_journal_page_last               7284
_journal_paper_doi               10.1021/ic061354f
_journal_volume                  46
_journal_year                    2007
_chemical_formula_moiety         'C54 H46 N6 O8 Sn4, 2(C4 H10 O)'
_chemical_formula_sum            'C62 H66 N6 O10 Sn4'
_chemical_formula_weight         1529.97
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                91.1520(10)
_cell_angle_beta                 103.7770(10)
_cell_angle_gamma                100.7010(10)
_cell_formula_units_Z            1
_cell_length_a                   10.0983(4)
_cell_length_b                   12.3380(5)
_cell_length_c                   13.4727(6)
_cell_measurement_reflns_used    10137
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      2.92
_cell_volume                     1598.31(12)
_computing_cell_refinement       'SMART-NT (Bruker, 1998)'
_computing_data_collection       'SMART-NT (Bruker, 1998)'
_computing_data_reduction        'SMART-NT (Bruker, 1998)'
_computing_molecular_graphics    'Diamond 2.1e (Brandenburg, 1999)'
_computing_publication_material  'WinGX 1.700.00 (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      223(2)
_diffrn_measured_fraction_theta_full 0.955
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_device_type
'Siemens SMART CCD area-detector diffractometer'
_diffrn_measurement_method       '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  0.0134
_diffrn_reflns_av_sigmaI/netI    0.0184
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            10137
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         2.92
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    1.604
_exptl_absorpt_correction_T_max  0.7397
_exptl_absorpt_correction_T_min  0.6447
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.590
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             760
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.276
_refine_diff_density_min         -1.058
_refine_diff_density_rms         0.061
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.139
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     370
_refine_ls_number_reflns         6995
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.139
_refine_ls_R_factor_all          0.0398
_refine_ls_R_factor_gt           0.0322
_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)+(0.0359P)²+2.8535P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0777
_refine_ls_wR_factor_ref         0.0821
_reflns_number_gt                5895
_reflns_number_total             6995
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic061354f-file003.cif
_cod_data_source_block           c754
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      'P -1 '
_cod_database_code               4338855
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.03870(2) -0.029994(18) 0.242123(15) 0.02415(7) Uani 1 1 d .
Sn2 Sn 0.17300(2) -0.000984(16) 0.038356(15) 0.02169(6) Uani 1 1 d .
O1 O -0.1837(2) -0.0399(2) 0.21539(17) 0.0301(5) Uani 1 1 d .
O2 O -0.5340(3) -0.0058(3) 0.36503(19) 0.0464(7) Uani 1 1 d .
O3 O 0.2310(2) -0.0167(2) 0.20029(16) 0.0269(5) Uani 1 1 d .
H3A H 0.3196 -0.0176 0.2424 0.040 Uiso 1 1 calc R
O4 O -0.0028(2) -0.00516(18) 0.09211(15) 0.0222(4) Uani 1 1 d .
N1 N -0.2286(3) -0.0464(2) 0.3010(2) 0.0294(6) Uani 1 1 d .
N2 N -0.3467(3) -0.0560(3) 0.4666(2) 0.0496(9) Uani 1 1 d .
H2A H -0.2648 -0.0768 0.4709 0.074 Uiso 1 1 d R
H2B H -0.3805 -0.0540 0.5225 0.074 Uiso 1 1 d R
N3 N -0.5166(3) -0.0005(3) 0.1162(2) 0.0421(8) Uani 1 1 d .
C1 C -0.3563(3) -0.0340(3) 0.2888(2) 0.0291(7) Uani 1 1 d .
C2 C -0.4183(4) -0.0294(3) 0.3782(3) 0.0365(8) Uani 1 1 d .
C3 C -0.4423(3) -0.0150(3) 0.1910(3) 0.0309(7) Uani 1 1 d .
C4 C 0.0997(4) 0.1198(3) 0.3376(2) 0.0304(7) Uani 1 1 d .
C5 C 0.2099(5) 0.1991(3) 0.3245(3) 0.0453(9) Uani 1 1 d .
H5A H 0.2583 0.1837 0.2742 0.054 Uiso 1 1 d R
C6 C 0.2506(6) 0.2992(4) 0.3824(4) 0.0585(12) Uani 1 1 d .
H6A H 0.3268 0.3530 0.3716 0.070 Uiso 1 1 d R
C7 C 0.1804(6) 0.3215(4) 0.4546(4) 0.0565(11) Uani 1 1 d .
H7A H 0.2076 0.3909 0.4946 0.068 Uiso 1 1 d R
C8 C 0.0718(5) 0.2433(4) 0.4692(3) 0.0550(11) Uani 1 1 d .
H8A H 0.0241 0.2579 0.5202 0.066 Uiso 1 1 d R
C9 C 0.0312(4) 0.1429(4) 0.4112(3) 0.0434(9) Uani 1 1 d .
H9A H -0.0457 0.0892 0.4212 0.052 Uiso 1 1 d R
C10 C 0.0314(4) -0.1958(3) 0.2839(3) 0.0305(7) Uani 1 1 d .
C11 C -0.0923(4) -0.2744(3) 0.2527(3) 0.0411(8) Uani 1 1 d .
H11A H -0.1755 -0.2525 0.2153 0.049 Uiso 1 1 d R
C12 C -0.0950(5) -0.3832(4) 0.2764(4) 0.0557(11) Uani 1 1 d .
H12A H -0.1802 -0.4366 0.2548 0.067 Uiso 1 1 d R
C13 C 0.0228(6) -0.4154(4) 0.3305(4) 0.0586(12) Uani 1 1 d .
H13A H 0.0201 -0.4911 0.3465 0.070 Uiso 1 1 d R
C14 C 0.1457(5) -0.3393(4) 0.3610(4) 0.0548(11) Uani 1 1 d .
H14A H 0.2284 -0.3619 0.3985 0.066 Uiso 1 1 d R
C15 C 0.1499(4) -0.2301(4) 0.3378(3) 0.0426(9) Uani 1 1 d .
H15A H 0.2357 -0.1773 0.3593 0.051 Uiso 1 1 d R
C16 C 0.1859(3) -0.1643(3) -0.0055(2) 0.0268(6) Uani 1 1 d .
C17 C 0.1963(4) -0.2420(3) 0.0679(3) 0.0394(8) Uani 1 1 d .
H17A H 0.2168 -0.2189 0.1393 0.047 Uiso 1 1 d R
C18 C 0.1772(5) -0.3532(3) 0.0385(4) 0.0533(11) Uani 1 1 d .
H18A H 0.1855 -0.4066 0.0893 0.064 Uiso 1 1 d R
C19 C 0.1485(5) -0.3882(3) -0.0634(4) 0.0516(11) Uani 1 1 d .
H19A H 0.1317 -0.4657 -0.0831 0.062 Uiso 1 1 d R
C20 C 0.1416(5) -0.3116(3) -0.1365(3) 0.0459(9) Uani 1 1 d .
H20A H 0.1244 -0.3358 -0.2073 0.055 Uiso 1 1 d R
C21 C 0.1602(4) -0.2002(3) -0.1079(3) 0.0344(7) Uani 1 1 d .
H21A H 0.1551 -0.1475 -0.1595 0.041 Uiso 1 1 d R
C22 C 0.2650(3) 0.1663(3) 0.0308(2) 0.0266(6) Uani 1 1 d .
C23 C 0.3876(4) 0.2024(3) 0.0009(3) 0.0353(7) Uani 1 1 d .
H23A H 0.4427 0.1500 -0.0107 0.042 Uiso 1 1 d R
C24 C 0.4297(4) 0.3138(3) -0.0131(4) 0.0468(10) Uani 1 1 d .
H24A H 0.5149 0.3386 -0.0330 0.056 Uiso 1 1 d R
C25 C 0.3501(5) 0.3889(3) 0.0023(4) 0.0504(11) Uani 1 1 d .
H25A H 0.3774 0.4653 -0.0098 0.060 Uiso 1 1 d R
C26 C 0.2299(4) 0.3539(3) 0.0340(4) 0.0488(10) Uani 1 1 d .
H26A H 0.1767 0.4069 0.0475 0.059 Uiso 1 1 d R
C27 C 0.1870(4) 0.2430(3) 0.0475(3) 0.0360(8) Uani 1 1 d .
H27A H 0.1026 0.2193 0.0689 0.043 Uiso 1 1 d R
O5 O 0.5698(4) 0.4687(4) 0.3269(3) 0.0802(11) Uani 1 1 d .
C30 C 0.5704(7) 0.3697(6) 0.2744(5) 0.0841(18) Uani 1 1 d .
H30A H 0.6171 0.3855 0.2205 0.101 Uiso 1 1 d R
H30B H 0.4767 0.3324 0.2442 0.101 Uiso 1 1 d R
C31 C 0.6429(10) 0.2979(7) 0.3454(7) 0.119(3) Uani 1 1 d .
H31A H 0.6434 0.2302 0.3093 0.179 Uiso 1 1 d R
H31B H 0.7369 0.3353 0.3749 0.179 Uiso 1 1 d R
H31C H 0.5953 0.2818 0.3987 0.179 Uiso 1 1 d R
C32 C 0.4968(8) 0.5406(6) 0.2640(6) 0.092(2) Uani 1 1 d .
H32A H 0.3997 0.5076 0.2432 0.110 Uiso 1 1 d R
H32B H 0.5313 0.5508 0.2036 0.110 Uiso 1 1 d R
C33 C 0.5136(9) 0.6484(7) 0.3185(7) 0.119(3) Uani 1 1 d .
H33A H 0.4641 0.6961 0.2751 0.179 Uiso 1 1 d R
H33B H 0.4782 0.6378 0.3784 0.179 Uiso 1 1 d R
H33C H 0.6107 0.6814 0.3384 0.179 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'
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'
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_3
O4 Sn1 C10 117.29(11) .
O4 Sn1 O3 74.15(8) .
C10 Sn1 O3 94.45(11) .
O4 Sn1 C4 113.28(11) .
C10 Sn1 C4 129.25(13) .
O3 Sn1 C4 95.14(11) .
O4 Sn1 O1 81.65(8) .
C10 Sn1 O1 94.48(11) .
O3 Sn1 O1 155.69(8) .
C4 Sn1 O1 96.59(11) .
O4 Sn2 C22 108.34(11) .
O4 Sn2 C16 109.48(10) .
C22 Sn2 C16 141.68(12) .
O4 Sn2 O3 72.67(8) .
C22 Sn2 O3 100.55(11) .
C16 Sn2 O3 96.27(11) .
O4 Sn2 O4 72.60(9) 2
C22 Sn2 O4 92.44(10) 2
C16 Sn2 O4 92.99(10) 2
O3 Sn2 O4 145.19(8) 2
N1 O1 Sn1 113.41(18) .
Sn1 O3 Sn2 102.81(9) .
Sn1 O4 Sn2 110.15(9) .
Sn1 O4 Sn2 141.96(10) 2
Sn2 O4 Sn2 107.40(9) 2
C1 N1 O1 114.2(3) .
N1 C1 C3 122.9(3) .
N1 C1 C2 120.9(3) .
C3 C1 C2 116.0(3) .
O2 C2 N2 124.1(3) .
O2 C2 C1 118.8(3) .
N2 C2 C1 117.0(3) .
N3 C3 C1 176.1(4) .
C5 C4 C9 118.2(3) .
C5 C4 Sn1 119.1(3) .
C9 C4 Sn1 122.7(3) .
C4 C5 C6 121.3(4) .
C7 C6 C5 119.9(4) .
C8 C7 C6 119.5(4) .
C7 C8 C9 120.5(4) .
C4 C9 C8 120.6(4) .
C15 C10 C11 118.5(3) .
C15 C10 Sn1 121.0(3) .
C11 C10 Sn1 120.4(3) .
C12 C11 C10 120.1(4) .
C13 C12 C11 120.6(4) .
C12 C13 C14 120.0(4) .
C13 C14 C15 120.0(4) .
C14 C15 C10 120.8(4) .
C21 C16 C17 118.7(3) .
C21 C16 Sn2 121.3(2) .
C17 C16 Sn2 119.1(2) .
C18 C17 C16 120.2(4) .
C19 C18 C17 120.6(4) .
C20 C19 C18 119.6(4) .
C19 C20 C21 120.3(4) .
C20 C21 C16 120.6(4) .
C27 C22 C23 119.0(3) .
C27 C22 Sn2 115.5(2) .
C23 C22 Sn2 125.2(2) .
C22 C23 C24 120.1(3) .
C25 C24 C23 120.3(4) .
C24 C25 C26 119.8(4) .
C25 C26 C27 120.2(4) .
C26 C27 C22 120.6(3) .
C30 O5 C32 113.3(5) .
O5 C30 C31 110.1(6) .
O5 C32 C33 111.3(6) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sn1 O4 2.006(2) .
Sn1 C10 2.126(3) .
Sn1 O3 2.127(2) .
Sn1 C4 2.134(3) .
Sn1 O1 2.168(2) .
Sn2 O4 2.0641(19) .
Sn2 C22 2.116(3) .
Sn2 C16 2.124(3) .
Sn2 O3 2.143(2) .
Sn2 O4 2.159(2) 2
O1 N1 1.334(3) .
O2 C2 1.229(4) .
O4 Sn2 2.159(2) 2
N1 C1 1.298(4) .
N2 C2 1.320(5) .
N3 C3 1.143(5) .
C1 C3 1.445(4) .
C1 C2 1.489(5) .
C4 C5 1.386(5) .
C4 C9 1.389(5) .
C5 C6 1.387(6) .
C6 C7 1.384(7) .
C7 C8 1.375(7) .
C8 C9 1.391(6) .
C10 C15 1.387(5) .
C10 C11 1.401(5) .
C11 C12 1.383(6) .
C12 C13 1.370(7) .
C13 C14 1.378(7) .
C14 C15 1.385(6) .
C16 C21 1.388(5) .
C16 C17 1.391(5) .
C17 C18 1.385(5) .
C18 C19 1.377(6) .
C19 C20 1.376(6) .
C20 C21 1.387(5) .
C22 C27 1.385(5) .
C22 C23 1.390(5) .
C23 C24 1.392(5) .
C24 C25 1.376(6) .
C25 C26 1.380(6) .
C26 C27 1.385(5) .
O5 C30 1.401(8) .
O5 C32 1.422(8) .
C30 C31 1.476(10) .
C32 C33 1.467(10) .
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_4
O4 Sn1 O1 N1 -173.1(2) . .
C10 Sn1 O1 N1 69.9(2) . .
O3 Sn1 O1 N1 -178.8(2) . .
C4 Sn1 O1 N1 -60.5(2) . .
O4 Sn1 O3 Sn2 -3.48(9) . .
C10 Sn1 O3 Sn2 113.65(12) . .
C4 Sn1 O3 Sn2 -116.25(12) . .
O1 Sn1 O3 Sn2 2.4(3) . .
O4 Sn2 O3 Sn1 3.41(8) . .
C22 Sn2 O3 Sn1 109.50(12) . .
C16 Sn2 O3 Sn1 -105.08(12) . .
O4 Sn2 O3 Sn1 -0.6(2) 2 .
C10 Sn1 O4 Sn2 -83.06(14) . .
O3 Sn1 O4 Sn2 3.75(9) . .
C4 Sn1 O4 Sn2 92.57(13) . .
O1 Sn1 O4 Sn2 -173.81(12) . .
C10 Sn1 O4 Sn2 87.4(2) . 2
O3 Sn1 O4 Sn2 174.2(2) . 2
C4 Sn1 O4 Sn2 -97.0(2) . 2
O1 Sn1 O4 Sn2 -3.37(18) . 2
C22 Sn2 O4 Sn1 -99.42(13) . .
C16 Sn2 O4 Sn1 86.87(13) . .
O3 Sn2 O4 Sn1 -3.75(9) . .
O4 Sn2 O4 Sn1 173.84(17) 2 .
C22 Sn2 O4 Sn2 86.74(12) . 2
C16 Sn2 O4 Sn2 -86.97(12) . 2
O3 Sn2 O4 Sn2 -177.60(12) . 2
O4 Sn2 O4 Sn2 0.0 2 2
Sn1 O1 N1 C1 169.2(2) . .
O1 N1 C1 C3 0.1(5) . .
O1 N1 C1 C2 -174.7(3) . .
N1 C1 C2 O2 172.3(4) . .
C3 C1 C2 O2 -2.8(5) . .
N1 C1 C2 N2 -10.7(6) . .
C3 C1 C2 N2 174.2(4) . .
N1 C1 C3 N3 174(6) . .
C2 C1 C3 N3 -11(6) . .
O4 Sn1 C4 C5 -54.5(3) . .
C10 Sn1 C4 C5 120.5(3) . .
O3 Sn1 C4 C5 20.5(3) . .
O1 Sn1 C4 C5 -138.2(3) . .
O4 Sn1 C4 C9 123.7(3) . .
C10 Sn1 C4 C9 -61.3(4) . .
O3 Sn1 C4 C9 -161.3(3) . .
O1 Sn1 C4 C9 40.0(3) . .
C9 C4 C5 C6 -0.4(6) . .
Sn1 C4 C5 C6 177.9(4) . .
C4 C5 C6 C7 -0.3(8) . .
C5 C6 C7 C8 0.9(8) . .
C6 C7 C8 C9 -0.8(8) . .
C5 C4 C9 C8 0.5(6) . .
Sn1 C4 C9 C8 -177.8(3) . .
C7 C8 C9 C4 0.1(7) . .
O4 Sn1 C10 C15 115.6(3) . .
O3 Sn1 C10 C15 41.1(3) . .
C4 Sn1 C10 C15 -59.2(3) . .
O1 Sn1 C10 C15 -161.5(3) . .
O4 Sn1 C10 C11 -61.0(3) . .
O3 Sn1 C10 C11 -135.5(3) . .
C4 Sn1 C10 C11 124.2(3) . .
O1 Sn1 C10 C11 21.9(3) . .
C15 C10 C11 C12 0.6(6) . .
Sn1 C10 C11 C12 177.2(3) . .
C10 C11 C12 C13 0.0(7) . .
C11 C12 C13 C14 -0.6(8) . .
C12 C13 C14 C15 0.5(7) . .
C13 C14 C15 C10 0.1(7) . .
C11 C10 C15 C14 -0.6(6) . .
Sn1 C10 C15 C14 -177.2(3) . .
O4 Sn2 C16 C21 107.7(3) . .
C22 Sn2 C16 C21 -62.6(4) . .
O3 Sn2 C16 C21 -178.5(3) . .
O4 Sn2 C16 C21 35.1(3) 2 .
O4 Sn2 C16 C17 -61.0(3) . .
C22 Sn2 C16 C17 128.6(3) . .
O3 Sn2 C16 C17 12.7(3) . .
O4 Sn2 C16 C17 -133.6(3) 2 .
C21 C16 C17 C18 -1.9(6) . .
Sn2 C16 C17 C18 167.2(3) . .
C16 C17 C18 C19 0.4(7) . .
C17 C18 C19 C20 1.3(8) . .
C18 C19 C20 C21 -1.4(7) . .
C19 C20 C21 C16 -0.1(6) . .
C17 C16 C21 C20 1.8(5) . .
Sn2 C16 C21 C20 -167.0(3) . .
O4 Sn2 C22 C27 -8.7(3) . .
C16 Sn2 C22 C27 161.7(2) . .
O3 Sn2 C22 C27 -83.8(3) . .
O4 Sn2 C22 C27 63.8(3) 2 .
O4 Sn2 C22 C23 178.0(3) . .
C16 Sn2 C22 C23 -11.5(4) . .
O3 Sn2 C22 C23 103.0(3) . .
O4 Sn2 C22 C23 -109.5(3) 2 .
C27 C22 C23 C24 -0.8(6) . .
Sn2 C22 C23 C24 172.3(3) . .
C22 C23 C24 C25 -0.2(6) . .
C23 C24 C25 C26 1.6(7) . .
C24 C25 C26 C27 -2.0(7) . .
C25 C26 C27 C22 1.0(7) . .
C23 C22 C27 C26 0.4(6) . .
Sn2 C22 C27 C26 -173.3(3) . .
C32 O5 C30 C31 -177.7(6) . .
C30 O5 C32 C33 -172.9(6) . .
