#------------------------------------------------------------------------------
#$Date: 2019-11-08 02:11:11 +0200 (Fri, 08 Nov 2019) $
#$Revision: 224686 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/83/7058398.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_7058398
loop_
_publ_author_name
'Chen, Shuai'
'Nie, Jia-Jia'
'Wang, Shuo'
'Li, Qian-Li'
'Zhang, Ru-Fen'
'Li, Yong-Xin'
'Ma, Chun-Lin'
_publ_section_title
;
 Syntheses, characterization, DNA/BSA binding, and in vitro cytostatic
 activity of fluorobenzenetelluronic triorganotin(iv) esters
;
_journal_issue                   24
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              9516
_journal_paper_doi               10.1039/C9NJ00487D
_journal_volume                  43
_journal_year                    2019
_chemical_formula_sum            'C24 H46 F2 O8 Sn4 Te2'
_chemical_formula_weight         1230.57
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2019-05-16 deposited with the CCDC.    2019-05-21 downloaded from the CCDC.
;
_cell_angle_alpha                99.6890(15)
_cell_angle_beta                 104.181(2)
_cell_angle_gamma                101.966(2)
_cell_formula_units_Z            2
_cell_length_a                   10.6072(6)
_cell_length_b                   10.6659(6)
_cell_length_c                   18.7874(13)
_cell_measurement_reflns_used    4998
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.172
_cell_measurement_theta_min      2.666
_cell_volume                     1961.4(2)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0250
_diffrn_reflns_av_unetI/netI     0.0405
_diffrn_reflns_Laue_measured_fraction_full 0.983
_diffrn_reflns_Laue_measured_fraction_max 0.983
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            10028
_diffrn_reflns_point_group_measured_fraction_full 0.983
_diffrn_reflns_point_group_measured_fraction_max 0.983
_diffrn_reflns_theta_full        25.015
_diffrn_reflns_theta_max         25.015
_diffrn_reflns_theta_min         2.298
_exptl_absorpt_coefficient_mu    4.020
_exptl_absorpt_correction_T_max  0.570
_exptl_absorpt_correction_T_min  0.283
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.084
_exptl_crystal_description       block
_exptl_crystal_F_000             1152
_exptl_crystal_size_max          0.430
_exptl_crystal_size_mid          0.270
_exptl_crystal_size_min          0.140
_refine_diff_density_max         0.658
_refine_diff_density_min         -0.884
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.994
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     383
_refine_ls_number_reflns         6813
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.0491
_refine_ls_R_factor_gt           0.0337
_refine_ls_shift/su_max          0.039
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0474P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0806
_refine_ls_wR_factor_ref         0.0874
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5338
_reflns_number_total             6813
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9nj00487d2.cif
_cod_data_source_block           complex1
_cod_depositor_comments
'Adding full bibliography for 7058398--7058403.cif.'
_cod_database_code               7058398
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.277
_shelx_estimated_absorpt_t_max   0.603
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Sn1 Sn -0.01327(5) -0.05841(4) 0.75356(3) 0.05288(14) Uani 1 1 d . U . . .
Sn2 Sn 0.34200(5) 0.20093(4) 0.96879(3) 0.05121(13) Uani 1 1 d . U . . .
Sn3 Sn 0.57012(5) 0.38750(4) 0.29450(2) 0.04427(12) Uani 1 1 d . . . . .
Sn4 Sn 0.46323(4) 0.79324(4) 0.36079(3) 0.04570(13) Uani 1 1 d . . . . .
Te1 Te -0.00132(4) 0.08121(4) 0.94062(2) 0.04239(12) Uani 1 1 d . U . . .
Te2 Te 0.59421(4) 0.58272(3) 0.46637(2) 0.03412(10) Uani 1 1 d . . . . .
F1 F -0.2997(9) 0.4193(8) 0.9894(5) 0.143(3) Uani 0.833(9) 1 d . . P A 1
F2 F 1.0637(7) 0.8895(9) 0.4610(5) 0.106(3) Uani 0.637(7) 1 d . . P B 1
F1' F -0.058(4) 0.503(4) 0.834(3) 0.143(3) Uani 0.167(9) 1 d . . P A 2
F2' F 1.0919(13) 0.6017(15) 0.6212(10) 0.106(3) Uani 0.363(7) 1 d . . P B 2
O1 O -0.0560(4) 0.0742(4) 1.0338(2) 0.0466(10) Uani 1 1 d . . . . .
O2 O -0.1737(5) -0.0382(4) 0.8791(3) 0.0561(12) Uani 1 1 d . . . . .
H2 H -0.186979 -0.105282 0.895006 0.084 Uiso 1 1 calc R U . . .
O3 O 0.0633(4) 0.0705(4) 0.8550(2) 0.0492(11) Uani 1 1 d . . . . .
O4 O 0.1730(4) 0.1908(4) 1.0013(2) 0.0455(10) Uani 1 1 d . . . . .
O5 O 0.5694(4) 0.7416(4) 0.5238(2) 0.0444(10) Uani 1 1 d . . . . .
H5 H 0.519544 0.721009 0.549412 0.067 Uiso 1 1 calc R U . . .
O6 O 0.4000(4) 0.5005(4) 0.4472(2) 0.0371(9) Uani 1 1 d . . . . .
O7 O 0.6100(4) 0.4234(4) 0.4076(2) 0.0394(9) Uani 1 1 d . . . . .
O8 O 0.5626(4) 0.6527(4) 0.3790(2) 0.0397(9) Uani 1 1 d . . . . .
C1 C -0.2089(9) 0.3908(8) 0.9553(5) 0.078(2) Uani 1 1 d . . . . .
H1 H -0.271962 0.409858 0.979267 0.093 Uiso 0.167(9) 1 calc R U P A 2
C2 C -0.1680(8) 0.2776(7) 0.9626(5) 0.069(2) Uani 1 1 d . . . . .
H2A H -0.201477 0.223623 0.991373 0.083 Uiso 1 1 calc R U . . .
C3 C -0.0779(7) 0.2467(6) 0.9268(4) 0.0483(16) Uani 1 1 d . . . . .
C4 C -0.0320(8) 0.3260(7) 0.8830(5) 0.072(2) Uani 1 1 d . . . . .
H4 H 0.026445 0.304167 0.856269 0.086 Uiso 1 1 calc R U . . .
C5 C -0.0759(11) 0.4410(9) 0.8799(6) 0.090(3) Uani 1 1 d . . . . .
H5A H -0.042971 0.496522 0.851600 0.108 Uiso 0.833(9) 1 calc R U P A 1
C6 C -0.1641(9) 0.4747(8) 0.9162(5) 0.076(2) Uani 1 1 d . . . . .
H6 H -0.191726 0.551628 0.914019 0.091 Uiso 1 1 calc R U . . .
C7 C -0.2085(9) -0.0389(9) 0.7019(5) 0.087(3) Uani 1 1 d . . . . .
H7A H -0.274123 -0.094368 0.718148 0.131 Uiso 1 1 calc R U . . .
H7B H -0.228452 -0.064690 0.648068 0.131 Uiso 1 1 calc R U . . .
H7C H -0.210823 0.051120 0.716295 0.131 Uiso 1 1 calc R U . . .
C8 C 0.0066(9) -0.2427(7) 0.7782(5) 0.080(2) Uani 1 1 d . . . . .
H8A H 0.098643 -0.246247 0.786185 0.120 Uiso 1 1 calc R U . . .
H8B H -0.050193 -0.313117 0.736610 0.120 Uiso 1 1 calc R U . . .
H8C H -0.019570 -0.251736 0.822877 0.120 Uiso 1 1 calc R U . . .
C9 C 0.1300(9) 0.0293(8) 0.7014(5) 0.081(2) Uani 1 1 d . . . . .
H9A H 0.142393 0.123045 0.712131 0.122 Uiso 1 1 calc R U . . .
H9B H 0.097322 -0.005517 0.647775 0.122 Uiso 1 1 calc R U . . .
H9C H 0.214402 0.009773 0.720815 0.122 Uiso 1 1 calc R U . . .
C10 C 0.3573(8) 0.0128(8) 0.9185(4) 0.074(2) Uani 1 1 d . . . . .
H10A H 0.449314 0.017231 0.920215 0.111 Uiso 1 1 calc R U . . .
H10B H 0.302116 -0.013543 0.866987 0.111 Uiso 1 1 calc R U . . .
H10C H 0.327271 -0.050389 0.945687 0.111 Uiso 1 1 calc R U . . .
C11 C 0.3486(9) 0.3352(8) 0.8972(5) 0.081(3) Uani 1 1 d . . . . .
H11A H 0.268164 0.307108 0.855396 0.122 Uiso 1 1 calc R U . . .
H11B H 0.425686 0.337521 0.878803 0.122 Uiso 1 1 calc R U . . .
H11C H 0.354989 0.421489 0.925123 0.122 Uiso 1 1 calc R U . . .
C12 C 0.4810(8) 0.2813(8) 1.0783(4) 0.075(2) Uani 1 1 d . . . . .
H12A H 0.469373 0.365475 1.098760 0.112 Uiso 1 1 calc R U . . .
H12B H 0.571277 0.291791 1.074919 0.112 Uiso 1 1 calc R U . . .
H12C H 0.465013 0.222851 1.110714 0.112 Uiso 1 1 calc R U . . .
C13 C 0.8066(6) 0.6595(6) 0.5019(3) 0.0400(14) Uani 1 1 d . . . . .
C14 C 0.8848(7) 0.6060(8) 0.5514(4) 0.066(2) Uani 1 1 d . . . . .
H14 H 0.845259 0.543603 0.574004 0.079 Uiso 1 1 calc R U . . .
C15 C 1.0246(8) 0.6465(9) 0.5674(5) 0.077(2) Uani 1 1 d . . . . .
H15 H 1.077619 0.608817 0.600250 0.092 Uiso 0.637(7) 1 calc R U P B 1
C16 C 1.0849(7) 0.7383(7) 0.5368(4) 0.0625(19) Uani 1 1 d . . . . .
H16 H 1.178083 0.762812 0.547011 0.075 Uiso 1 1 calc R U . . .
C17 C 1.0066(8) 0.7933(8) 0.4912(5) 0.070(2) Uani 1 1 d . . . . .
H17 H 1.047604 0.859888 0.471776 0.085 Uiso 0.363(7) 1 calc R U P B 2
C18 C 0.8658(7) 0.7552(7) 0.4715(4) 0.0577(18) Uani 1 1 d . . . . .
H18 H 0.814066 0.793890 0.438638 0.069 Uiso 1 1 calc R U . . .
C19 C 0.3683(7) 0.3952(7) 0.2501(4) 0.073(2) Uani 1 1 d . . . . .
H19A H 0.327816 0.407070 0.290371 0.109 Uiso 1 1 calc R U . . .
H19B H 0.318407 0.314408 0.213988 0.109 Uiso 1 1 calc R U . . .
H19C H 0.367438 0.467605 0.225959 0.109 Uiso 1 1 calc R U . . .
C20 C 0.5880(8) 0.1887(7) 0.2754(4) 0.069(2) Uani 1 1 d . . . . .
H20A H 0.663505 0.184463 0.256288 0.103 Uiso 1 1 calc R U . . .
H20B H 0.507259 0.132046 0.239280 0.103 Uiso 1 1 calc R U . . .
H20C H 0.601339 0.160626 0.321981 0.103 Uiso 1 1 calc R U . . .
C21 C 0.7260(8) 0.5180(8) 0.2697(4) 0.071(2) Uani 1 1 d . . . . .
H21A H 0.691609 0.585479 0.250011 0.107 Uiso 1 1 calc R U . . .
H21B H 0.757828 0.469686 0.233008 0.107 Uiso 1 1 calc R U . . .
H21C H 0.798950 0.557583 0.315009 0.107 Uiso 1 1 calc R U . . .
C22 C 0.2727(8) 0.7304(8) 0.3788(5) 0.078(2) Uani 1 1 d . . . . .
H22A H 0.220777 0.651584 0.341540 0.117 Uiso 1 1 calc R U . . .
H22B H 0.226076 0.798216 0.374847 0.117 Uiso 1 1 calc R U . . .
H22C H 0.285044 0.713014 0.428218 0.117 Uiso 1 1 calc R U . . .
C23 C 0.5949(8) 0.9750(6) 0.4289(4) 0.067(2) Uani 1 1 d . . . . .
H23A H 0.626117 0.966444 0.479873 0.101 Uiso 1 1 calc R U . . .
H23B H 0.547581 1.042598 0.427857 0.101 Uiso 1 1 calc R U . . .
H23C H 0.670443 0.998150 0.409767 0.101 Uiso 1 1 calc R U . . .
C24 C 0.4536(8) 0.7837(8) 0.2458(4) 0.070(2) Uani 1 1 d . . . . .
H24A H 0.542832 0.798081 0.240516 0.105 Uiso 1 1 calc R U . . .
H24B H 0.413283 0.850301 0.229023 0.105 Uiso 1 1 calc R U . . .
H24C H 0.400166 0.698485 0.215928 0.105 Uiso 1 1 calc R U . . .
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'
Te Te -0.5308 1.6751 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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_1
_geom_angle_site_symmetry_3
O3 Sn1 C7 108.6(3) . .
O3 Sn1 C8 104.0(3) . .
C7 Sn1 C8 119.0(4) . .
O3 Sn1 C9 97.0(3) . .
C7 Sn1 C9 110.7(4) . .
C8 Sn1 C9 114.7(3) . .
O4 Sn2 C11 108.2(3) . .
O4 Sn2 C10 112.5(3) . .
C11 Sn2 C10 113.0(3) . .
O4 Sn2 C12 96.6(3) . .
C11 Sn2 C12 112.6(3) . .
C10 Sn2 C12 112.7(3) . .
O7 Sn3 C19 107.1(2) . .
O7 Sn3 C21 107.5(2) . .
C19 Sn3 C21 118.5(3) . .
O7 Sn3 C20 98.0(2) . .
C19 Sn3 C20 111.5(3) . .
C21 Sn3 C20 112.0(3) . .
O8 Sn4 C22 107.4(2) . .
O8 Sn4 C24 99.1(2) . .
C22 Sn4 C24 113.7(3) . .
O8 Sn4 C23 106.5(2) . .
C22 Sn4 C23 118.2(3) . .
C24 Sn4 C23 109.9(3) . .
O3 Te1 O4 89.18(18) . .
O3 Te1 O2 90.1(2) . .
O4 Te1 O2 176.83(18) . .
O3 Te1 O1 93.03(17) . 2_557
O4 Te1 O1 89.09(17) . 2_557
O2 Te1 O1 87.87(18) . 2_557
O3 Te1 O1 172.25(17) . .
O4 Te1 O1 89.33(17) . .
O2 Te1 O1 91.01(19) . .
O1 Te1 O1 79.34(17) 2_557 .
O3 Te1 C3 95.9(2) . .
O4 Te1 C3 92.2(2) . .
O2 Te1 C3 90.9(2) . .
O1 Te1 C3 171.0(2) 2_557 .
O1 Te1 C3 91.7(2) . .
O3 Te1 Te1 132.80(13) . 2_557
O4 Te1 Te1 88.97(12) . 2_557
O2 Te1 Te1 89.28(13) . 2_557
O1 Te1 Te1 39.78(12) 2_557 2_557
O1 Te1 Te1 39.56(11) . 2_557
C3 Te1 Te1 131.29(18) . 2_557
O8 Te2 O7 90.14(16) . .
O8 Te2 O5 89.13(17) . .
O7 Te2 O5 177.41(17) . .
O8 Te2 O6 172.12(16) . 2_666
O7 Te2 O6 89.60(16) . 2_666
O5 Te2 O6 90.79(16) . 2_666
O8 Te2 O6 92.59(16) . .
O7 Te2 O6 89.42(16) . .
O5 Te2 O6 88.13(16) . .
O6 Te2 O6 79.54(16) 2_666 .
O8 Te2 C13 96.1(2) . .
O7 Te2 C13 90.9(2) . .
O5 Te2 C13 91.7(2) . .
O6 Te2 C13 91.79(19) 2_666 .
O6 Te2 C13 171.32(19) . .
O8 Te2 Te2 132.24(12) . 2_666
O7 Te2 Te2 89.36(11) . 2_666
O5 Te2 Te2 89.29(12) . 2_666
O6 Te2 Te2 39.88(11) 2_666 2_666
O6 Te2 Te2 39.66(10) . 2_666
C13 Te2 Te2 131.67(16) . 2_666
Te1 O1 Te1 100.66(17) 2_557 .
Te1 O2 H2 109.5 . .
Te1 O3 Sn1 129.5(2) . .
Te1 O4 Sn2 123.5(2) . .
Te2 O5 H5 109.5 . .
Te2 O6 Te2 100.46(16) 2_666 .
Te2 O7 Sn3 122.49(19) . .
Te2 O8 Sn4 126.7(2) . .
C6 C1 F1 117.1(8) . .
C6 C1 C2 124.5(9) . .
F1 C1 C2 118.4(9) . .
C6 C1 H1 117.8 . .
C2 C1 H1 117.8 . .
C3 C2 C1 118.7(8) . .
C3 C2 H2A 120.7 . .
C1 C2 H2A 120.7 . .
C2 C3 C4 119.8(6) . .
C2 C3 Te1 120.8(5) . .
C4 C3 Te1 119.3(5) . .
C3 C4 C5 118.1(8) . .
C3 C4 H4 120.9 . .
C5 C4 H4 120.9 . .
F1' C5 C6 114.2(18) . .
F1' C5 C4 121.5(19) . .
C6 C5 C4 122.9(9) . .
C6 C5 H5A 118.5 . .
C4 C5 H5A 118.5 . .
C1 C6 C5 115.9(8) . .
C1 C6 H6 122.0 . .
C5 C6 H6 122.0 . .
Sn1 C7 H7A 109.5 . .
Sn1 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
Sn1 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
Sn1 C8 H8A 109.5 . .
Sn1 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
Sn1 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
Sn1 C9 H9A 109.5 . .
Sn1 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
Sn1 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
Sn2 C10 H10A 109.5 . .
Sn2 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
Sn2 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
Sn2 C11 H11A 109.5 . .
Sn2 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
Sn2 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
Sn2 C12 H12A 109.5 . .
Sn2 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
Sn2 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C18 C13 C14 120.0(6) . .
C18 C13 Te2 120.3(5) . .
C14 C13 Te2 119.5(5) . .
C13 C14 C15 119.0(7) . .
C13 C14 H14 120.5 . .
C15 C14 H14 120.5 . .
F2' C15 C16 122.5(9) . .
F2' C15 C14 115.0(9) . .
C16 C15 C14 122.0(7) . .
C16 C15 H15 119.0 . .
C14 C15 H15 119.0 . .
C17 C16 C15 117.9(7) . .
C17 C16 H16 121.1 . .
C15 C16 H16 121.1 . .
C16 C17 F2 119.8(7) . .
C16 C17 C18 123.1(7) . .
F2 C17 C18 117.2(7) . .
C16 C17 H17 118.5 . .
C18 C17 H17 118.5 . .
C13 C18 C17 118.0(6) . .
C13 C18 H18 121.0 . .
C17 C18 H18 121.0 . .
Sn3 C19 H19A 109.5 . .
Sn3 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
Sn3 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
Sn3 C20 H20A 109.5 . .
Sn3 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
Sn3 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
Sn3 C21 H21A 109.5 . .
Sn3 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
Sn3 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
Sn4 C22 H22A 109.5 . .
Sn4 C22 H22B 109.5 . .
H22A C22 H22B 109.5 . .
Sn4 C22 H22C 109.5 . .
H22A C22 H22C 109.5 . .
H22B C22 H22C 109.5 . .
Sn4 C23 H23A 109.5 . .
Sn4 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
Sn4 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
Sn4 C24 H24A 109.5 . .
Sn4 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
Sn4 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sn1 O3 2.019(4) .
Sn1 C7 2.129(8) .
Sn1 C8 2.134(7) .
Sn1 C9 2.144(7) .
Sn2 O4 2.019(4) .
Sn2 C11 2.125(7) .
Sn2 C10 2.125(7) .
Sn2 C12 2.131(7) .
Sn3 O7 2.014(4) .
Sn3 C19 2.123(7) .
Sn3 C21 2.128(7) .
Sn3 C20 2.146(6) .
Sn4 O8 2.032(4) .
Sn4 C22 2.121(7) .
Sn4 C24 2.121(7) .
Sn4 C23 2.124(6) .
Te1 O3 1.893(4) .
Te1 O4 1.926(4) .
Te1 O2 1.951(4) .
Te1 O1 1.973(4) 2_557
Te1 O1 1.982(4) .
Te1 C3 2.119(6) .
Te1 Te1 3.0446(8) 2_557
Te2 O8 1.899(4) .
Te2 O7 1.927(4) .
Te2 O5 1.952(4) .
Te2 O6 1.972(4) 2_666
Te2 O6 1.981(4) .
Te2 C13 2.123(6) .
Te2 Te2 3.0382(7) 2_666
F1 C1 1.337(10) .
F2 C17 1.360(9) .
F1' C5 1.20(4) .
F2' C15 1.307(15) .
O2 H2 0.8200 .
O5 H5 0.8200 .
C1 C6 1.335(12) .
C1 C2 1.382(10) .
C1 H1 0.9300 .
C2 C3 1.358(10) .
C2 H2A 0.9300 .
C3 C4 1.374(9) .
C4 C5 1.404(11) .
C4 H4 0.9300 .
C5 C6 1.358(12) .
C5 H5A 0.9300 .
C6 H6 0.9300 .
C7 H7A 0.9600 .
C7 H7B 0.9600 .
C7 H7C 0.9600 .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 H9A 0.9600 .
C9 H9B 0.9600 .
C9 H9C 0.9600 .
C10 H10A 0.9600 .
C10 H10B 0.9600 .
C10 H10C 0.9600 .
C11 H11A 0.9600 .
C11 H11B 0.9600 .
C11 H11C 0.9600 .
C12 H12A 0.9600 .
C12 H12B 0.9600 .
C12 H12C 0.9600 .
C13 C18 1.367(9) .
C13 C14 1.370(9) .
C14 C15 1.396(10) .
C14 H14 0.9300 .
C15 C16 1.345(10) .
C15 H15 0.9300 .
C16 C17 1.338(10) .
C16 H16 0.9300 .
C17 C18 1.400(10) .
C17 H17 0.9300 .
C18 H18 0.9300 .
C19 H19A 0.9600 .
C19 H19B 0.9600 .
C19 H19C 0.9600 .
C20 H20A 0.9600 .
C20 H20B 0.9600 .
C20 H20C 0.9600 .
C21 H21A 0.9600 .
C21 H21B 0.9600 .
C21 H21C 0.9600 .
C22 H22A 0.9600 .
C22 H22B 0.9600 .
C22 H22C 0.9600 .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
