#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/01/2220178.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_2220178
loop_
_publ_author_name
'Amini, Mostafa M.'
'Hajiashrafi, Taraneh'
'Kharat, Ali Nemati'
'Ng, Seik Weng'
_publ_section_title
cyclo-Hexa-μ₂-diphenylacetato-κ¹²O:O'-hexa-μ₃-oxido-hexakis[phenyltin(IV)]
_journal_coeditor_code           HB2814
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1614
_journal_paper_doi               10.1107/S1600536808038567
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac          '[Sn6 (C6 H5)6 (C14 H11 O2)6 O6]'
_chemical_formula_moiety         'C120 H96 O18 Sn6'
_chemical_formula_sum            'C120 H96 O18 Sn6'
_chemical_formula_weight         2538.11
_chemical_name_systematic
;
cyclo-Hexa-μ₂-diphenylacetato-κ¹²O:O'-hexa-μ₃-
oxido-hexakis[phenyltin(IV)]
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_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                103.3680(10)
_cell_angle_beta                 111.7160(10)
_cell_angle_gamma                92.5820(10)
_cell_formula_units_Z            1
_cell_length_a                   12.9375(2)
_cell_length_b                   14.7406(2)
_cell_length_c                   14.8043(2)
_cell_measurement_reflns_used    9896
_cell_measurement_temperature    112(2)
_cell_measurement_theta_max      32.5
_cell_measurement_theta_min      2.4
_cell_volume                     2525.06(7)
_computing_cell_refinement       'SAINT (Bruker, 2004)'
_computing_data_collection       'APEX2 (Bruker, 2004)'
_computing_data_reduction        'SAINT (Bruker, 2004)'
_computing_molecular_graphics    'X-SEED (Barbour, 2001)'
_computing_publication_material  'publCIF (Westrip, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      112(2)
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type  'Bruker APEXII'
_diffrn_measurement_method       'φ and ω'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'medium-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0413
_diffrn_reflns_av_sigmaI/netI    0.0446
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            37375
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.43
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.532
_exptl_absorpt_correction_T_max  0.781
_exptl_absorpt_correction_T_min  0.701
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.669
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             1260
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.17
_refine_diff_density_max         0.939
_refine_diff_density_min         -2.311
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.176
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     541
_refine_ls_number_reflns         11415
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.176
_refine_ls_R_factor_all          0.0459
_refine_ls_R_factor_gt           0.0337
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0656P)²+0.8272P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0968
_refine_ls_wR_factor_ref         0.1175
_reflns_number_gt                9692
_reflns_number_total             11415
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            hb2814.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan' changed
to 'multi-scan' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        2525.06(6)
_cod_database_code               2220178
_cod_database_fobs_code          2220178
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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
Sn Sn1 0.53479(2) 0.665112(17) 0.603202(18) 0.00889(7) Uani d . 1
Sn Sn2 0.41572(2) 0.479921(17) 0.623742(18) 0.00872(7) Uani d . 1
Sn Sn3 0.65401(2) 0.436746(17) 0.615334(18) 0.00909(7) Uani d . 1
O O1 0.4513(2) 0.78091(19) 0.5569(2) 0.0138(6) Uani d . 1
O O2 0.3127(2) 0.70644(19) 0.4092(2) 0.0134(6) Uani d . 1
O O3 0.4792(2) 0.71780(18) 0.7232(2) 0.0126(5) Uani d . 1
O O4 0.3990(2) 0.58887(18) 0.7415(2) 0.0134(6) Uani d . 1
O O5 0.4928(2) 0.42566(19) 0.7539(2) 0.0131(5) Uani d . 1
O O6 0.6614(2) 0.40039(19) 0.7504(2) 0.0133(6) Uani d . 1
O O7 0.3820(2) 0.57419(18) 0.53567(19) 0.0096(5) Uani d . 1
O O8 0.5761(2) 0.54875(18) 0.65948(19) 0.0099(5) Uani d . 1
O O9 0.4812(2) 0.37808(18) 0.54526(19) 0.0100(5) Uani d . 1
C C1 0.68854(19) 0.75777(16) 0.69348(17) 0.0130(8) Uani d G 1
C C2 0.7322(2) 0.82506(19) 0.66001(16) 0.0198(9) Uani d G 1
H H2 0.7016 0.8237 0.5906 0.024 Uiso calc R 1
C C3 0.8206(2) 0.89432(17) 0.7281(2) 0.0286(11) Uani d G 1
H H3 0.8504 0.9403 0.7053 0.034 Uiso calc R 1
C C4 0.8653(2) 0.89630(19) 0.8297(2) 0.0292(11) Uani d G 1
H H4 0.9257 0.9436 0.8763 0.035 Uiso calc R 1
C C5 0.8216(2) 0.8290(2) 0.86321(15) 0.0335(12) Uani d G 1
H H5 0.8522 0.8304 0.9326 0.040 Uiso calc R 1
C C6 0.7333(2) 0.75976(19) 0.79508(19) 0.0251(10) Uani d G 1
H H6 0.7034 0.7138 0.8180 0.030 Uiso calc R 1
C C7 0.25612(17) 0.40475(17) 0.5900(2) 0.0135(8) Uani d G 1
C C8 0.1648(2) 0.45162(14) 0.5880(2) 0.0214(9) Uani d G 1
H H8 0.1717 0.5179 0.5972 0.026 Uiso calc R 1
C C9 0.06332(19) 0.4015(2) 0.5725(3) 0.0281(11) Uani d G 1
H H9 0.0009 0.4336 0.5711 0.034 Uiso calc R 1
C C10 0.05322(19) 0.3045(2) 0.5590(3) 0.0364(13) Uani d G 1
H H10 -0.0161 0.2703 0.5484 0.044 Uiso calc R 1
C C11 0.1446(2) 0.25768(14) 0.5610(3) 0.0339(12) Uani d G 1
H H11 0.1377 0.1914 0.5518 0.041 Uiso calc R 1
C C12 0.2460(2) 0.30777(17) 0.5765(2) 0.0229(9) Uani d G 1
H H12 0.3085 0.2757 0.5779 0.028 Uiso calc R 1
C C13 0.82641(15) 0.49468(18) 0.68507(19) 0.0124(7) Uani d G 1
C C14 0.86491(19) 0.57261(18) 0.66235(19) 0.0182(8) Uani d G 1
H H14 0.8135 0.6012 0.6165 0.022 Uiso calc R 1
C C15 0.9786(2) 0.60878(17) 0.7066(2) 0.0259(10) Uani d G 1
H H15 1.0049 0.6620 0.6911 0.031 Uiso calc R 1
C C16 1.05382(16) 0.5670(2) 0.7737(2) 0.0276(10) Uani d G 1
H H16 1.1315 0.5917 0.8039 0.033 Uiso calc R 1
C C17 1.01532(19) 0.4891(2) 0.7964(2) 0.0262(10) Uani d G 1
H H17 1.0667 0.4605 0.8422 0.031 Uiso calc R 1
C C18 0.9016(2) 0.45292(16) 0.7521(2) 0.0191(9) Uani d G 1
H H18 0.8753 0.3997 0.7676 0.023 Uiso calc R 1
C C19 0.3723(3) 0.7794(3) 0.4741(3) 0.0126(8) Uani d . 1
C C20 0.3523(3) 0.8741(3) 0.4514(3) 0.0135(8) Uani d . 1
H H20 0.3833 0.9233 0.5175 0.016 Uiso calc R 1
C C21 0.22811(16) 0.88231(19) 0.40101(19) 0.0155(8) Uani d G 1
C C22 0.1608(2) 0.82467(17) 0.30603(19) 0.0199(9) Uani d G 1
H H22 0.1920 0.7789 0.2711 0.024 Uiso calc R 1
C C23 0.0479(2) 0.83396(19) 0.26215(17) 0.0267(10) Uani d G 1
H H23 0.0019 0.7946 0.1972 0.032 Uiso calc R 1
C C24 0.00225(16) 0.9009(2) 0.3133(2) 0.0271(10) Uani d G 1
H H24 -0.0749 0.9072 0.2833 0.033 Uiso calc R 1
C C25 0.0695(2) 0.95852(19) 0.4082(2) 0.0264(10) Uani d G 1
H H25 0.0384 1.0043 0.4432 0.032 Uiso calc R 1
C C26 0.1825(2) 0.94924(18) 0.45212(16) 0.0207(9) Uani d G 1
H H26 0.2285 0.9886 0.5170 0.025 Uiso calc R 1
C C27 0.4212(2) 0.89411(18) 0.38980(19) 0.0149(8) Uani d G 1
C C28 0.5037(2) 0.84157(16) 0.3770(2) 0.0194(9) Uani d G 1
H H28 0.5175 0.7884 0.4035 0.023 Uiso calc R 1
C C29 0.5661(2) 0.86681(19) 0.3254(2) 0.0240(9) Uani d G 1
H H29 0.6225 0.8309 0.3167 0.029 Uiso calc R 1
C C30 0.5459(2) 0.94460(19) 0.2867(2) 0.0251(10) Uani d G 1
H H30 0.5885 0.9619 0.2514 0.030 Uiso calc R 1
C C31 0.4634(2) 0.99714(16) 0.2995(2) 0.0226(9) Uani d G 1
H H31 0.4496 1.0503 0.2730 0.027 Uiso calc R 1
C C32 0.4010(2) 0.97190(17) 0.3511(2) 0.0189(9) Uani d G 1
H H32 0.3446 1.0078 0.3598 0.023 Uiso calc R 1
C C33 0.4280(3) 0.6769(3) 0.7630(3) 0.0110(7) Uani d . 1
C C34 0.3966(3) 0.7386(3) 0.8440(3) 0.0131(8) Uani d . 1
H H34 0.3771 0.6968 0.8816 0.016 Uiso calc R 1
C C35 0.4958(2) 0.81260(17) 0.92017(18) 0.0152(8) Uani d G 1
C C36 0.5220(2) 0.89622(19) 0.89992(17) 0.0242(10) Uani d G 1
H H36 0.4782 0.9082 0.8375 0.029 Uiso calc R 1
C C37 0.6122(3) 0.96228(16) 0.9709(2) 0.0311(11) Uani d G 1
H H37 0.6301 1.0194 0.9571 0.037 Uiso calc R 1
C C38 0.6763(2) 0.94472(19) 1.0622(2) 0.0322(11) Uani d G 1
H H38 0.7379 0.9899 1.1108 0.039 Uiso calc R 1
C C39 0.6501(2) 0.8611(2) 1.08246(17) 0.0322(11) Uani d G 1
H H39 0.6939 0.8491 1.1448 0.039 Uiso calc R 1
C C40 0.5599(2) 0.79503(16) 1.0114(2) 0.0253(10) Uani d G 1
H H40 0.5420 0.7379 1.0253 0.030 Uiso calc R 1
C C41 0.29135(18) 0.78216(19) 0.79501(19) 0.0138(8) Uani d G 1
C C42 0.2700(2) 0.8122(2) 0.7083(2) 0.0235(10) Uani d G 1
H H42 0.3210 0.8049 0.6755 0.028 Uiso calc R 1
C C43 0.1739(2) 0.8529(2) 0.66953(19) 0.0290(11) Uani d G 1
H H43 0.1593 0.8734 0.6103 0.035 Uiso calc R 1
C C44 0.09925(19) 0.8636(2) 0.7175(2) 0.0267(10) Uani d G 1
H H44 0.0336 0.8914 0.6910 0.032 Uiso calc R 1
C C45 0.1206(2) 0.8335(2) 0.8042(2) 0.0235(9) Uani d G 1
H H45 0.0696 0.8408 0.8370 0.028 Uiso calc R 1
C C46 0.2167(2) 0.7928(2) 0.84299(17) 0.0196(9) Uani d G 1
H H46 0.2313 0.7723 0.9023 0.023 Uiso calc R 1
C C47 0.5914(3) 0.4068(3) 0.7913(3) 0.0128(7) Uani d . 1
C C48 0.6309(3) 0.3932(3) 0.8978(3) 0.0147(8) Uani d . 1
H H48 0.5642 0.3636 0.9048 0.018 Uiso calc R 1
C C49 0.72011(19) 0.32657(17) 0.9159(2) 0.0163(8) Uani d G 1
C C50 0.8342(2) 0.36122(15) 0.9587(2) 0.0242(10) Uani d G 1
H H50 0.8583 0.4271 0.9769 0.029 Uiso calc R 1
C C51 0.91314(17) 0.2995(2) 0.9748(2) 0.0306(11) Uani d G 1
H H51 0.9911 0.3231 1.0041 0.037 Uiso calc R 1
C C52 0.8779(2) 0.20305(19) 0.9482(2) 0.0296(11) Uani d G 1
H H52 0.9319 0.1608 0.9592 0.035 Uiso calc R 1
C C53 0.7638(3) 0.16840(14) 0.9054(2) 0.0282(11) Uani d G 1
H H53 0.7398 0.1025 0.8872 0.034 Uiso calc R 1
C C54 0.68492(18) 0.23016(18) 0.8892(2) 0.0226(9) Uani d G 1
H H54 0.6069 0.2065 0.8600 0.027 Uiso calc R 1
C C55 0.6707(2) 0.49094(15) 0.97491(17) 0.0147(8) Uani d G 1
C C56 0.6557(2) 0.50229(16) 1.06492(19) 0.0197(9) Uani d G 1
H H56 0.6152 0.4527 1.0748 0.024 Uiso calc R 1
C C57 0.7000(2) 0.58622(19) 1.14048(16) 0.0238(10) Uani d G 1
H H57 0.6898 0.5940 1.2020 0.029 Uiso calc R 1
C C58 0.7593(2) 0.65881(16) 1.12602(18) 0.0233(9) Uani d G 1
H H58 0.7896 0.7162 1.1777 0.028 Uiso calc R 1
C C59 0.7743(2) 0.64746(16) 1.0360(2) 0.0241(10) Uani d G 1
H H59 0.8148 0.6971 1.0261 0.029 Uiso calc R 1
C C60 0.7300(2) 0.56353(18) 0.96046(16) 0.0214(9) Uani d G 1
H H60 0.7402 0.5558 0.8989 0.026 Uiso calc R 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'
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'
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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
O9 Sn1 O8 2_666 . 104.81(10)
O9 Sn1 O7 2_666 . 78.30(10)
O8 Sn1 O7 . . 77.31(10)
O9 Sn1 C1 2_666 . 110.39(10)
O8 Sn1 C1 . . 98.50(10)
O7 Sn1 C1 . . 171.19(10)
O9 Sn1 O3 2_666 . 155.57(10)
O8 Sn1 O3 . . 88.52(10)
O7 Sn1 O3 . . 84.99(10)
C1 Sn1 O3 . . 87.17(10)
O9 Sn1 O1 2_666 . 84.06(10)
O8 Sn1 O1 . . 163.51(10)
O7 Sn1 O1 . . 91.25(10)
C1 Sn1 O1 . . 91.14(10)
O3 Sn1 O1 . . 78.56(10)
O9 Sn1 Sn3 2_666 2_666 40.85(7)
O8 Sn1 Sn3 . 2_666 100.18(7)
O7 Sn1 Sn3 . 2_666 39.51(7)
C1 Sn1 Sn3 . 2_666 149.24(7)
O3 Sn1 Sn3 . 2_666 117.45(7)
O1 Sn1 Sn3 . 2_666 77.25(7)
O9 Sn1 Sn2 2_666 . 100.89(7)
O8 Sn1 Sn2 . . 39.88(7)
O7 Sn1 Sn2 . . 39.46(7)
C1 Sn1 Sn2 . . 134.14(7)
O3 Sn1 Sn2 . . 76.13(7)
O1 Sn1 Sn2 . . 125.52(7)
Sn3 Sn1 Sn2 2_666 . 73.199(8)
O7 Sn2 O9 . . 101.76(10)
O7 Sn2 O8 . . 77.64(10)
O9 Sn2 O8 . . 78.04(10)
O7 Sn2 C7 . . 104.87(10)
O9 Sn2 C7 . . 100.46(10)
O8 Sn2 C7 . . 177.34(10)
O7 Sn2 O4 . . 87.45(10)
O9 Sn2 O4 . . 162.12(10)
O8 Sn2 O4 . . 89.21(10)
C7 Sn2 O4 . . 91.78(10)
O7 Sn2 O5 . . 159.26(10)
O9 Sn2 O5 . . 87.69(10)
O8 Sn2 O5 . . 86.49(10)
C7 Sn2 O5 . . 91.27(10)
O4 Sn2 O5 . . 78.98(10)
O7 Sn3 O8 2_666 . 104.46(10)
O7 Sn3 C13 2_666 . 102.46(10)
O8 Sn3 C13 . . 102.73(10)
O7 Sn3 O9 2_666 . 77.53(10)
O8 Sn3 O9 . . 77.49(10)
C13 Sn3 O9 . . 179.77(11)
O7 Sn3 O2 2_666 2_666 88.73(10)
O8 Sn3 O2 . 2_666 155.77(10)
C13 Sn3 O2 . 2_666 93.90(10)
O9 Sn3 O2 . 2_666 85.87(10)
O7 Sn3 O6 2_666 . 160.60(10)
O8 Sn3 O6 . . 85.71(10)
C13 Sn3 O6 . . 91.05(10)
O9 Sn3 O6 . . 88.91(10)
O2 Sn3 O6 2_666 . 76.39(10)
O7 Sn3 Sn1 2_666 2_666 39.98(7)
O8 Sn3 Sn1 . 2_666 100.15(7)
C13 Sn3 Sn1 . 2_666 140.36(7)
O9 Sn3 Sn1 . 2_666 39.57(7)
O2 Sn3 Sn1 2_666 2_666 76.81(7)
O6 Sn3 Sn1 . 2_666 122.72(7)
O7 Sn3 Sn2 2_666 . 99.93(7)
O8 Sn3 Sn2 . . 39.57(7)
C13 Sn3 Sn2 . . 140.41(8)
O9 Sn3 Sn2 . . 39.79(7)
O2 Sn3 Sn2 2_666 . 118.92(7)
O6 Sn3 Sn2 . . 77.22(7)
Sn1 Sn3 Sn2 2_666 . 73.224(8)
C19 O1 Sn1 . . 128.6(2)
C19 O2 Sn3 . 2_666 129.8(3)
C33 O3 Sn1 . . 131.7(2)
C33 O4 Sn2 . . 128.0(2)
C47 O5 Sn2 . . 129.2(2)
C47 O6 Sn3 . . 129.6(3)
Sn2 O7 Sn3 . 2_666 134.38(13)
Sn2 O7 Sn1 . . 100.58(11)
Sn3 O7 Sn1 2_666 . 100.51(11)
Sn3 O8 Sn1 . . 130.74(13)
Sn3 O8 Sn2 . . 101.15(11)
Sn1 O8 Sn2 . . 100.40(11)
Sn1 O9 Sn2 2_666 . 134.17(13)
Sn1 O9 Sn3 2_666 . 99.58(10)
Sn2 O9 Sn3 . . 99.57(11)
C2 C1 C6 . . 120.0
C2 C1 Sn1 . . 123.29(14)
C6 C1 Sn1 . . 115.69(13)
C1 C2 C3 . . 120.0
C1 C2 H2 . . 120.0
C3 C2 H2 . . 120.0
C4 C3 C2 . . 120.0
C4 C3 H3 . . 120.0
C2 C3 H3 . . 120.0
C3 C4 C5 . . 120.0
C3 C4 H4 . . 120.0
C5 C4 H4 . . 120.0
C4 C5 C6 . . 120.0
C4 C5 H5 . . 120.0
C6 C5 H5 . . 120.0
C5 C6 C1 . . 120.0
C5 C6 H6 . . 120.0
C1 C6 H6 . . 120.0
C8 C7 C12 . . 120.0
C8 C7 Sn2 . . 121.10(14)
C12 C7 Sn2 . . 118.76(13)
C7 C8 C9 . . 120.0
C7 C8 H8 . . 120.0
C9 C8 H8 . . 120.0
C8 C9 C10 . . 120.0
C8 C9 H9 . . 120.0
C10 C9 H9 . . 120.0
C9 C10 C11 . . 120.0
C9 C10 H10 . . 120.0
C11 C10 H10 . . 120.0
C12 C11 C10 . . 120.0
C12 C11 H11 . . 120.0
C10 C11 H11 . . 120.0
C11 C12 C7 . . 120.0
C11 C12 H12 . . 120.0
C7 C12 H12 . . 120.0
C14 C13 C18 . . 120.0
C14 C13 Sn3 . . 120.39(13)
C18 C13 Sn3 . . 119.59(13)
C13 C14 C15 . . 120.0
C13 C14 H14 . . 120.0
C15 C14 H14 . . 120.0
C16 C15 C14 . . 120.0
C16 C15 H15 . . 120.0
C14 C15 H15 . . 120.0
C15 C16 C17 . . 120.0
C15 C16 H16 . . 120.0
C17 C16 H16 . . 120.0
C18 C17 C16 . . 120.0
C18 C17 H17 . . 120.0
C16 C17 H17 . . 120.0
C17 C18 C13 . . 120.0
C17 C18 H18 . . 120.0
C13 C18 H18 . . 120.0
O2 C19 O1 . . 125.2(4)
O2 C19 C20 . . 118.3(3)
O1 C19 C20 . . 116.5(3)
C19 C20 C21 . . 113.3(3)
C19 C20 C27 . . 109.1(3)
C21 C20 C27 . . 112.9(3)
C19 C20 H20 . . 107.1
C21 C20 H20 . . 107.1
C27 C20 H20 . . 107.1
C22 C21 C26 . . 120.0
C22 C21 C20 . . 121.4(2)
C26 C21 C20 . . 118.6(2)
C23 C22 C21 . . 120.0
C23 C22 H22 . . 120.0
C21 C22 H22 . . 120.0
C24 C23 C22 . . 120.0
C24 C23 H23 . . 120.0
C22 C23 H23 . . 120.0
C23 C24 C25 . . 120.0
C23 C24 H24 . . 120.0
C25 C24 H24 . . 120.0
C26 C25 C24 . . 120.0
C26 C25 H25 . . 120.0
C24 C25 H25 . . 120.0
C25 C26 C21 . . 120.0
C25 C26 H26 . . 120.0
C21 C26 H26 . . 120.0
C28 C27 C32 . . 120.0
C28 C27 C20 . . 123.3(2)
C32 C27 C20 . . 116.6(2)
C29 C28 C27 . . 120.0
C29 C28 H28 . . 120.0
C27 C28 H28 . . 120.0
C28 C29 C30 . . 120.0
C28 C29 H29 . . 120.0
C30 C29 H29 . . 120.0
C31 C30 C29 . . 120.0
C31 C30 H30 . . 120.0
C29 C30 H30 . . 120.0
C32 C31 C30 . . 120.0
C32 C31 H31 . . 120.0
C30 C31 H31 . . 120.0
C31 C32 C27 . . 120.0
C31 C32 H32 . . 120.0
C27 C32 H32 . . 120.0
O3 C33 O4 . . 125.9(4)
O3 C33 C34 . . 117.2(3)
O4 C33 C34 . . 116.9(3)
C33 C34 C35 . . 111.4(3)
C33 C34 C41 . . 110.1(3)
C35 C34 C41 . . 112.7(3)
C33 C34 H34 . . 107.5
C35 C34 H34 . . 107.5
C41 C34 H34 . . 107.5
C36 C35 C40 . . 120.0
C36 C35 C34 . . 121.4(2)
C40 C35 C34 . . 118.6(2)
C37 C36 C35 . . 120.0
C37 C36 H36 . . 120.0
C35 C36 H36 . . 120.0
C36 C37 C38 . . 120.0
C36 C37 H37 . . 120.0
C38 C37 H37 . . 120.0
C39 C38 C37 . . 120.0
C39 C38 H38 . . 120.0
C37 C38 H38 . . 120.0
C40 C39 C38 . . 120.0
C40 C39 H39 . . 120.0
C38 C39 H39 . . 120.0
C39 C40 C35 . . 120.0
C39 C40 H40 . . 120.0
C35 C40 H40 . . 120.0
C42 C41 C46 . . 120.0
C42 C41 C34 . . 123.3(2)
C46 C41 C34 . . 116.7(2)
C41 C42 C43 . . 120.0
C41 C42 H42 . . 120.0
C43 C42 H42 . . 120.0
C42 C43 C44 . . 120.0
C42 C43 H43 . . 120.0
C44 C43 H43 . . 120.0
C45 C44 C43 . . 120.0
C45 C44 H44 . . 120.0
C43 C44 H44 . . 120.0
C44 C45 C46 . . 120.0
C44 C45 H45 . . 120.0
C46 C45 H45 . . 120.0
C45 C46 C41 . . 120.0
C45 C46 H46 . . 120.0
C41 C46 H46 . . 120.0
O6 C47 O5 . . 126.3(4)
O6 C47 C48 . . 116.8(3)
O5 C47 C48 . . 116.9(3)
C47 C48 C49 . . 112.2(3)
C47 C48 C55 . . 108.7(3)
C49 C48 C55 . . 113.2(3)
C47 C48 H48 . . 107.5
C49 C48 H48 . . 107.5
C55 C48 H48 . . 107.5
C50 C49 C54 . . 120.0
C50 C49 C48 . . 121.2(2)
C54 C49 C48 . . 118.8(2)
C49 C50 C51 . . 120.0
C49 C50 H50 . . 120.0
C51 C50 H50 . . 120.0
C52 C51 C50 . . 120.0
C52 C51 H51 . . 120.0
C50 C51 H51 . . 120.0
C51 C52 C53 . . 120.0
C51 C52 H52 . . 120.0
C53 C52 H52 . . 120.0
C54 C53 C52 . . 120.0
C54 C53 H53 . . 120.0
C52 C53 H53 . . 120.0
C53 C54 C49 . . 120.0
C53 C54 H54 . . 120.0
C49 C54 H54 . . 120.0
C56 C55 C60 . . 120.0
C56 C55 C48 . . 118.2(2)
C60 C55 C48 . . 121.5(2)
C55 C56 C57 . . 120.0
C55 C56 H56 . . 120.0
C57 C56 H56 . . 120.0
C58 C57 C56 . . 120.0
C58 C57 H57 . . 120.0
C56 C57 H57 . . 120.0
C57 C58 C59 . . 120.0
C57 C58 H58 . . 120.0
C59 C58 H58 . . 120.0
C60 C59 C58 . . 120.0
C60 C59 H59 . . 120.0
C58 C59 H59 . . 120.0
C59 C60 C55 . . 120.0
C59 C60 H60 . . 120.0
C55 C60 H60 . . 120.0
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 O9 2_666 2.070(3) y
Sn1 O8 . 2.082(3) y
Sn1 O7 . 2.094(3) y
Sn1 O3 . 2.153(3) y
Sn1 O1 . 2.170(3) y
Sn1 C1 . 2.1336(18) y
Sn2 O7 . 2.072(3) y
Sn2 O9 . 2.088(3) y
Sn2 O8 . 2.089(3) y
Sn2 O4 . 2.163(3) y
Sn2 O5 . 2.171(3) y
Sn2 C7 . 2.1250(18) y
Sn3 O7 2_666 2.073(3) y
Sn3 O8 . 2.076(3) y
Sn3 O9 . 2.125(3) y
Sn3 O2 2_666 2.148(3) y
Sn3 O6 . 2.158(3) y
Sn3 C13 . 2.1181(18) y
O1 C19 . 1.267(5) ?
O2 C19 . 1.255(5) ?
O2 Sn3 2_666 2.148(3) ?
O3 C33 . 1.252(5) ?
O4 C33 . 1.266(4) ?
O5 C47 . 1.261(5) ?
O6 C47 . 1.257(5) ?
O7 Sn3 2_666 2.073(3) ?
O9 Sn1 2_666 2.070(3) ?
C1 C2 . 1.3900 ?
C1 C6 . 1.3900 ?
C2 C3 . 1.3900 ?
C2 H2 . 0.9500 ?
C3 C4 . 1.3900 ?
C3 H3 . 0.9500 ?
C4 C5 . 1.3900 ?
C4 H4 . 0.9500 ?
C5 C6 . 1.3900 ?
C5 H5 . 0.9500 ?
C6 H6 . 0.9500 ?
C7 C8 . 1.3900 ?
C7 C12 . 1.3900 ?
C8 C9 . 1.3900 ?
C8 H8 . 0.9500 ?
C9 C10 . 1.3900 ?
C9 H9 . 0.9500 ?
C10 C11 . 1.3900 ?
C10 H10 . 0.9500 ?
C11 C12 . 1.3900 ?
C11 H11 . 0.9500 ?
C12 H12 . 0.9500 ?
C13 C14 . 1.3900 ?
C13 C18 . 1.3900 ?
C14 C15 . 1.3900 ?
C14 H14 . 0.9500 ?
C15 C16 . 1.3900 ?
C15 H15 . 0.9500 ?
C16 C17 . 1.3900 ?
C16 H16 . 0.9500 ?
C17 C18 . 1.3900 ?
C17 H17 . 0.9500 ?
C18 H18 . 0.9500 ?
C19 C20 . 1.522(5) ?
C20 C21 . 1.524(4) ?
C20 C27 . 1.554(4) ?
C20 H20 . 1.0000 ?
C21 C22 . 1.3900 ?
C21 C26 . 1.3900 ?
C22 C23 . 1.3900 ?
C22 H22 . 0.9500 ?
C23 C24 . 1.3900 ?
C23 H23 . 0.9500 ?
C24 C25 . 1.3900 ?
C24 H24 . 0.9500 ?
C25 C26 . 1.3900 ?
C25 H25 . 0.9500 ?
C26 H26 . 0.9500 ?
C27 C28 . 1.3900 ?
C27 C32 . 1.3900 ?
C28 C29 . 1.3900 ?
C28 H28 . 0.9500 ?
C29 C30 . 1.3900 ?
C29 H29 . 0.9500 ?
C30 C31 . 1.3900 ?
C30 H30 . 0.9500 ?
C31 C32 . 1.3900 ?
C31 H31 . 0.9500 ?
C32 H32 . 0.9500 ?
C33 C34 . 1.523(5) ?
C34 C35 . 1.531(4) ?
C34 C41 . 1.535(4) ?
C34 H34 . 1.0000 ?
C35 C36 . 1.3900 ?
C35 C40 . 1.3900 ?
C36 C37 . 1.3900 ?
C36 H36 . 0.9500 ?
C37 C38 . 1.3900 ?
C37 H37 . 0.9500 ?
C38 C39 . 1.3900 ?
C38 H38 . 0.9500 ?
C39 C40 . 1.3900 ?
C39 H39 . 0.9500 ?
C40 H40 . 0.9500 ?
C41 C42 . 1.3900 ?
C41 C46 . 1.3900 ?
C42 C43 . 1.3900 ?
C42 H42 . 0.9500 ?
C43 C44 . 1.3900 ?
C43 H43 . 0.9500 ?
C44 C45 . 1.3900 ?
C44 H44 . 0.9500 ?
C45 C46 . 1.3900 ?
C45 H45 . 0.9500 ?
C46 H46 . 0.9500 ?
C47 C48 . 1.532(5) ?
C48 C49 . 1.538(4) ?
C48 C55 . 1.543(4) ?
C48 H48 . 1.0000 ?
C49 C50 . 1.3900 ?
C49 C54 . 1.3900 ?
C50 C51 . 1.3900 ?
C50 H50 . 0.9500 ?
C51 C52 . 1.3900 ?
C51 H51 . 0.9500 ?
C52 C53 . 1.3900 ?
C52 H52 . 0.9500 ?
C53 C54 . 1.3900 ?
C53 H53 . 0.9500 ?
C54 H54 . 0.9500 ?
C55 C56 . 1.3900 ?
C55 C60 . 1.3900 ?
C56 C57 . 1.3900 ?
C56 H56 . 0.9500 ?
C57 C58 . 1.3900 ?
C57 H57 . 0.9500 ?
C58 C59 . 1.3900 ?
C58 H58 . 0.9500 ?
C59 C60 . 1.3900 ?
C59 H59 . 0.9500 ?
C60 H60 . 0.9500 ?
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_4
_geom_torsion
O9 Sn1 O1 C19 2_666 . 38.1(3)
O8 Sn1 O1 C19 . . -85.5(5)
O7 Sn1 O1 C19 . . -40.0(3)
C1 Sn1 O1 C19 . . 148.5(3)
O3 Sn1 O1 C19 . . -124.6(3)
Sn3 Sn1 O1 C19 2_666 . -2.8(3)
Sn2 Sn1 O1 C19 . . -61.0(3)
O9 Sn1 O3 C33 2_666 . 85.9(4)
O8 Sn1 O3 C33 . . -38.3(3)
O7 Sn1 O3 C33 . . 39.1(3)
C1 Sn1 O3 C33 . . -136.9(3)
O1 Sn1 O3 C33 . . 131.4(3)
O7 Sn2 O4 C33 . . -35.7(3)
O9 Sn2 O4 C33 . . 86.0(4)
O8 Sn2 O4 C33 . . 41.9(3)
C7 Sn2 O4 C33 . . -140.5(3)
O5 Sn2 O4 C33 . . 128.5(3)
O7 Sn2 O5 C47 . . -70.5(4)
O9 Sn2 O5 C47 . . 47.5(3)
O8 Sn2 O5 C47 . . -30.7(3)
C7 Sn2 O5 C47 . . 147.9(3)
O4 Sn2 O5 C47 . . -120.5(3)
O7 Sn3 O6 C47 2_666 . -86.2(4)
O8 Sn3 O6 C47 . . 36.5(3)
C13 Sn3 O6 C47 . . 139.2(3)
O9 Sn3 O6 C47 . . -41.0(3)
O2 Sn3 O6 C47 2_666 . -127.0(3)
O9 Sn2 O7 Sn3 . 2_666 26.1(2)
O8 Sn2 O7 Sn3 . 2_666 100.93(18)
C7 Sn2 O7 Sn3 . 2_666 -78.16(18)
O4 Sn2 O7 Sn3 . 2_666 -169.33(18)
O5 Sn2 O7 Sn3 . 2_666 141.8(2)
O9 Sn2 O7 Sn1 . . -90.12(11)
O8 Sn2 O7 Sn1 . . -15.33(10)
C7 Sn2 O7 Sn1 . . 165.57(10)
O4 Sn2 O7 Sn1 . . 74.41(11)
O5 Sn2 O7 Sn1 . . 25.6(3)
O9 Sn1 O7 Sn2 2_666 . 123.71(12)
O8 Sn1 O7 Sn2 . . 15.40(10)
O3 Sn1 O7 Sn2 . . -74.21(11)
O1 Sn1 O7 Sn2 . . -152.62(11)
O9 Sn1 O7 Sn3 2_666 2_666 -15.61(10)
O8 Sn1 O7 Sn3 . 2_666 -123.92(12)
O3 Sn1 O7 Sn3 . 2_666 146.47(11)
O1 Sn1 O7 Sn3 . 2_666 68.07(11)
O7 Sn3 O8 Sn1 2_666 . -26.24(19)
C13 Sn3 O8 Sn1 . . 80.43(17)
O9 Sn3 O8 Sn1 . . -99.64(17)
O2 Sn3 O8 Sn1 2_666 . -147.4(2)
O6 Sn3 O8 Sn1 . . 170.53(17)
O7 Sn3 O8 Sn2 2_666 . 88.14(11)
C13 Sn3 O8 Sn2 . . -165.20(10)
O9 Sn3 O8 Sn2 . . 14.74(10)
O2 Sn3 O8 Sn2 2_666 . -33.0(3)
O6 Sn3 O8 Sn2 . . -75.09(11)
O9 Sn1 O8 Sn3 2_666 . 25.36(19)
O7 Sn1 O8 Sn3 . . 99.42(17)
C1 Sn1 O8 Sn3 . . -88.47(17)
O3 Sn1 O8 Sn3 . . -175.38(17)
O1 Sn1 O8 Sn3 . . 146.4(3)
O9 Sn1 O8 Sn2 2_666 . -89.33(11)
O7 Sn1 O8 Sn2 . . -15.27(10)
C1 Sn1 O8 Sn2 . . 156.85(11)
O3 Sn1 O8 Sn2 . . 69.93(11)
O1 Sn1 O8 Sn2 . . 31.7(4)
O7 Sn2 O8 Sn3 . . -120.03(12)
O9 Sn2 O8 Sn3 . . -14.98(10)
O4 Sn2 O8 Sn3 . . 152.40(11)
O5 Sn2 O8 Sn3 . . 73.40(11)
O7 Sn2 O8 Sn1 . . 15.41(10)
O9 Sn2 O8 Sn1 . . 120.47(12)
O4 Sn2 O8 Sn1 . . -72.15(11)
O5 Sn2 O8 Sn1 . . -151.16(12)
O7 Sn2 O9 Sn1 . 2_666 -24.5(2)
O8 Sn2 O9 Sn1 . 2_666 -98.97(18)
C7 Sn2 O9 Sn1 . 2_666 83.26(18)
O4 Sn2 O9 Sn1 . 2_666 -144.3(3)
O5 Sn2 O9 Sn1 . 2_666 174.13(18)
O7 Sn2 O9 Sn3 . . 89.02(11)
O8 Sn2 O9 Sn3 . . 14.54(10)
C7 Sn2 O9 Sn3 . . -163.23(10)
O4 Sn2 O9 Sn3 . . -30.8(4)
O5 Sn2 O9 Sn3 . . -72.36(11)
O7 Sn3 O9 Sn1 2_666 2_666 15.37(10)
O8 Sn3 O9 Sn1 . 2_666 123.49(11)
O2 Sn3 O9 Sn1 2_666 2_666 -74.24(11)
O6 Sn3 O9 Sn1 . 2_666 -150.67(11)
O7 Sn3 O9 Sn2 2_666 . -122.79(11)
O8 Sn3 O9 Sn2 . . -14.67(10)
O2 Sn3 O9 Sn2 2_666 . 147.60(11)
O6 Sn3 O9 Sn2 . . 71.17(11)
Sn1 Sn3 O9 Sn2 2_666 . -138.16(15)
O9 Sn1 C1 C2 2_666 . 38.31(19)
O8 Sn1 C1 C2 . . 147.65(17)
O3 Sn1 C1 C2 . . -124.27(17)
O1 Sn1 C1 C2 . . -45.78(17)
O9 Sn1 C1 C6 2_666 . -153.31(15)
O8 Sn1 C1 C6 . . -43.97(16)
O3 Sn1 C1 C6 . . 44.12(15)
O1 Sn1 C1 C6 . . 122.61(15)
C6 C1 C2 C3 . . 0.0
Sn1 C1 C2 C3 . . 167.9(2)
C1 C2 C3 C4 . . 0.0
C2 C3 C4 C5 . . 0.0
C3 C4 C5 C6 . . 0.0
C4 C5 C6 C1 . . 0.0
C2 C1 C6 C5 . . 0.0
Sn1 C1 C6 C5 . . -168.79(19)
O7 Sn2 C7 C8 . . -46.94(18)
O9 Sn2 C7 C8 . . -152.21(16)
O4 Sn2 C7 C8 . . 40.90(17)
O5 Sn2 C7 C8 . . 119.91(17)
O7 Sn2 C7 C12 . . 137.38(16)
O9 Sn2 C7 C12 . . 32.10(17)
O4 Sn2 C7 C12 . . -134.79(17)
O5 Sn2 C7 C12 . . -55.78(17)
C12 C7 C8 C9 . . 0.0
Sn2 C7 C8 C9 . . -175.6(2)
C7 C8 C9 C10 . . 0.0
C8 C9 C10 C11 . . 0.0
C9 C10 C11 C12 . . 0.0
C10 C11 C12 C7 . . 0.0
C8 C7 C12 C11 . . 0.0
Sn2 C7 C12 C11 . . 175.7(2)
O7 Sn3 C13 C14 2_666 . 48.36(17)
O8 Sn3 C13 C14 . . -59.83(17)
O2 Sn3 C13 C14 2_666 . 137.91(16)
O6 Sn3 C13 C14 . . -145.66(16)
Sn1 Sn3 C13 C14 2_666 . 63.94(19)
Sn2 Sn3 C13 C14 . . -74.62(18)
O7 Sn3 C13 C18 2_666 . -130.11(16)
O8 Sn3 C13 C18 . . 121.71(16)
O2 Sn3 C13 C18 2_666 . -40.55(16)
O6 Sn3 C13 C18 . . 35.87(16)
Sn1 Sn3 C13 C18 2_666 . -114.53(14)
Sn2 Sn3 C13 C18 . . 106.92(15)
C18 C13 C14 C15 . . 0.0
Sn3 C13 C14 C15 . . -178.5(2)
C13 C14 C15 C16 . . 0.0
C14 C15 C16 C17 . . 0.0
C15 C16 C17 C18 . . 0.0
C16 C17 C18 C13 . . 0.0
C14 C13 C18 C17 . . 0.0
Sn3 C13 C18 C17 . . 178.47(19)
Sn3 O2 C19 O1 2_666 . -21.4(6)
Sn3 O2 C19 C20 2_666 . 156.3(3)
Sn1 O1 C19 O2 . . 14.0(6)
Sn1 O1 C19 C20 . . -163.7(2)
O2 C19 C20 C21 . . 41.0(5)
O1 C19 C20 C21 . . -141.1(3)
O2 C19 C20 C27 . . -85.6(4)
O1 C19 C20 C27 . . 92.2(4)
C19 C20 C21 C22 . . -63.7(4)
C27 C20 C21 C22 . . 60.9(3)
C19 C20 C21 C26 . . 116.3(3)
C27 C20 C21 C26 . . -119.0(3)
C26 C21 C22 C23 . . 0.0
C20 C21 C22 C23 . . -179.9(3)
C21 C22 C23 C24 . . 0.0
C22 C23 C24 C25 . . 0.0
C23 C24 C25 C26 . . 0.0
C24 C25 C26 C21 . . 0.0
C22 C21 C26 C25 . . 0.0
C20 C21 C26 C25 . . 179.9(3)
C19 C20 C27 C28 . . -11.7(4)
C21 C20 C27 C28 . . -138.6(2)
C19 C20 C27 C32 . . 171.7(2)
C21 C20 C27 C32 . . 44.8(3)
C32 C27 C28 C29 . . 0.0
C20 C27 C28 C29 . . -176.5(3)
C27 C28 C29 C30 . . 0.0
C28 C29 C30 C31 . . 0.0
C29 C30 C31 C32 . . 0.0
C30 C31 C32 C27 . . 0.0
C28 C27 C32 C31 . . 0.0
C20 C27 C32 C31 . . 176.8(3)
Sn1 O3 C33 O4 . . 2.6(6)
Sn1 O3 C33 C34 . . -176.8(2)
Sn2 O4 C33 O3 . . -4.8(5)
Sn2 O4 C33 C34 . . 174.6(2)
O3 C33 C34 C35 . . -46.6(4)
O4 C33 C34 C35 . . 133.9(3)
O3 C33 C34 C41 . . 79.2(4)
O4 C33 C34 C41 . . -100.3(4)
C33 C34 C35 C36 . . 81.7(3)
C41 C34 C35 C36 . . -42.7(4)
C33 C34 C35 C40 . . -98.8(3)
C41 C34 C35 C40 . . 136.9(2)
C40 C35 C36 C37 . . 0.0
C34 C35 C36 C37 . . 179.6(3)
C35 C36 C37 C38 . . 0.0
C36 C37 C38 C39 . . 0.0
C37 C38 C39 C40 . . 0.0
C38 C39 C40 C35 . . 0.0
C36 C35 C40 C39 . . 0.0
C34 C35 C40 C39 . . -179.6(3)
C33 C34 C41 C42 . . -36.9(4)
C35 C34 C41 C42 . . 88.1(3)
C33 C34 C41 C46 . . 144.5(3)
C35 C34 C41 C46 . . -90.5(3)
C46 C41 C42 C43 . . 0.0
C34 C41 C42 C43 . . -178.6(3)
C41 C42 C43 C44 . . 0.0
C42 C43 C44 C45 . . 0.0
C43 C44 C45 C46 . . 0.0
C44 C45 C46 C41 . . 0.0
C42 C41 C46 C45 . . 0.0
C34 C41 C46 C45 . . 178.7(3)
Sn3 O6 C47 O5 . . 9.6(6)
Sn3 O6 C47 C48 . . -168.4(2)
Sn2 O5 C47 O6 . . -13.1(6)
Sn2 O5 C47 C48 . . 165.0(2)
O6 C47 C48 C49 . . -29.8(5)
O5 C47 C48 C49 . . 151.9(3)
O6 C47 C48 C55 . . 96.2(4)
O5 C47 C48 C55 . . -82.1(4)
C47 C48 C49 C50 . . 93.4(3)
C55 C48 C49 C50 . . -30.1(4)
C47 C48 C49 C54 . . -87.0(3)
C55 C48 C49 C54 . . 149.5(2)
C54 C49 C50 C51 . . 0.0
C48 C49 C50 C51 . . 179.6(3)
C49 C50 C51 C52 . . 0.0
C50 C51 C52 C53 . . 0.0
C51 C52 C53 C54 . . 0.0
C52 C53 C54 C49 . . 0.0
C50 C49 C54 C53 . . 0.0
C48 C49 C54 C53 . . -179.6(3)
C47 C48 C55 C56 . . 147.7(2)
C49 C48 C55 C56 . . -87.0(3)
C47 C48 C55 C60 . . -38.7(4)
C49 C48 C55 C60 . . 86.7(3)
C60 C55 C56 C57 . . 0.0
C48 C55 C56 C57 . . 173.8(3)
C55 C56 C57 C58 . . 0.0
C56 C57 C58 C59 . . 0.0
C57 C58 C59 C60 . . 0.0
C58 C59 C60 C55 . . 0.0
C56 C55 C60 C59 . . 0.0
C48 C55 C60 C59 . . -173.5(3)
