#------------------------------------------------------------------------------
#$Date: 2021-10-06 18:39:16 +0300 (Wed, 06 Oct 2021) $
#$Revision: 269719 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/81/7708120.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_7708120
loop_
_publ_author_name
'Zhu, Qihao'
'Fettinger, James C.'
'Power, Philip P.'
_publ_section_title
;
 Hydrostannylation of carbon dioxide by a hydridostannylene molybdenum
 complex.
;
_journal_issue                   36
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12555
_journal_page_last               12562
_journal_paper_doi               10.1039/d1dt02473f
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety         'C42 H50 Mo O7 Sn'
_chemical_formula_sum            'C42 H50 Mo O7 Sn'
_chemical_formula_weight         881.45
_space_group_crystal_system      monoclinic
_space_group_IT_number           11
_space_group_name_Hall           '-P 2yb'
_space_group_name_H-M_alt        'P 1 21/m 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_date             2021-01-26
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2021-05-25 deposited with the CCDC.	2021-08-16 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90.8178(10)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.6205(6)
_cell_length_b                   18.6744(13)
_cell_length_c                   12.8381(9)
_cell_measurement_reflns_used    9985
_cell_measurement_temperature    90(2)
_cell_measurement_theta_max      30.56
_cell_measurement_theta_min      2.36
_cell_volume                     2066.5(2)
_computing_cell_refinement       'SAINT (8.38a) (Bruker, 2017)'
_computing_data_collection       'Apex3 (2019.1) (Bruker, 2019)'
_computing_data_reduction        'SAINT (8.38a) (Bruker, 2017)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT (Sheldrick, 2014)'
_diffrn_ambient_temperature      90.15
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0281
_diffrn_reflns_av_unetI/netI     0.0225
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            24632
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.631
_diffrn_reflns_theta_min         1.925
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.953
_exptl_absorpt_correction_T_max  0.6971
_exptl_absorpt_correction_T_min  0.6162
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0672 before and 0.0418 after correction.
The Ratio of minimum to maximum transmission is 0.8839.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.417
_exptl_crystal_description       Block
_exptl_crystal_F_000             900
_exptl_crystal_size_max          0.476
_exptl_crystal_size_mid          0.456
_exptl_crystal_size_min          0.268
_refine_diff_density_max         1.128
_refine_diff_density_min         -0.575
_refine_diff_density_rms         0.078
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.078
_refine_ls_hydrogen_treatment    refU
_refine_ls_matrix_type           full
_refine_ls_number_parameters     281
_refine_ls_number_reflns         6555
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.078
_refine_ls_R_factor_all          0.0313
_refine_ls_R_factor_gt           0.0248
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0286P)²+1.0689P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0607
_refine_ls_wR_factor_ref         0.0643
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5706
_reflns_number_total             6555
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1dt02473f4.cif
_cod_data_source_block           qz70fmi
_cod_depositor_comments
'Adding full bibliography for 7708118--7708120.cif.'
_cod_database_code               7708120
_shelx_shelxl_version_number     2017/1
_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_max   0.784
_shelx_estimated_absorpt_t_min   0.660
_olex2_refinement_description
;
1.a Ternary CH refined with riding coordinates:
 C11(H11), C14(H14), C17(H17)
1.b Aromatic/amide H refined with riding coordinates:
 C3(H3), C4(H4), C7(H7), C9(H9)
1.c Idealised Me refined as rotating group:
 C12(H12A,H12B,H12C), C13(H13A,H13B,H13C), C15(H15A,H15B,H15C), C16(H16A,H16B,
 H16C), C18(H18A,H18B,H18C), C19(H19A,H19B,H19C)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, 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 0.69324(2) 0.250000 0.69730(2) 0.01617(4) Uani 1 2 d S T P . .
Mo1 Mo 0.75300(2) 0.250000 0.48961(2) 0.02058(5) Uani 1 2 d S T P . .
C1 C 0.5378(2) 0.250000 0.82761(16) 0.0134(4) Uani 1 2 d S T P . .
C2 C 0.48220(17) 0.31533(7) 0.86577(11) 0.0134(2) Uani 1 1 d . . . . .
C3 C 0.36723(18) 0.31455(8) 0.94136(12) 0.0168(3) Uani 1 1 d . . . . .
H3 H 0.328434 0.358439 0.967827 0.015(4) Uiso 1 1 calc R . . . .
C4 C 0.3092(3) 0.250000 0.97812(17) 0.0179(4) Uani 1 2 d S T P . .
H4 H 0.229559 0.250000 1.028529 0.025(7) Uiso 1 2 calc RS T P . .
C5 C 0.54855(17) 0.38476(7) 0.82728(11) 0.0136(3) Uani 1 1 d . . . . .
C6 C 0.67287(18) 0.41763(7) 0.88255(11) 0.0152(3) Uani 1 1 d . . . . .
C7 C 0.73435(18) 0.48120(8) 0.84391(12) 0.0168(3) Uani 1 1 d . . . . .
H7 H 0.818283 0.503289 0.880319 0.019(5) Uiso 1 1 calc R . . . .
C8 C 0.67615(18) 0.51336(7) 0.75324(11) 0.0154(3) Uani 1 1 d . . . . .
C9 C 0.55320(18) 0.48068(8) 0.70123(11) 0.0160(3) Uani 1 1 d . . . . .
H9 H 0.512580 0.502280 0.639638 0.017(5) Uiso 1 1 calc R . . . .
C10 C 0.48701(17) 0.41688(7) 0.73658(11) 0.0146(3) Uani 1 1 d . . . . .
C11 C 0.73315(19) 0.38667(8) 0.98530(12) 0.0195(3) Uani 1 1 d . . . . .
H11 H 0.705249 0.334706 0.986617 0.023(5) Uiso 1 1 calc R . . . .
C12 C 0.9091(2) 0.39237(10) 1.00023(15) 0.0289(4) Uani 1 1 d . . . . .
H12A H 0.960599 0.374476 0.937825 0.042(7) Uiso 1 1 calc GR . . . .
H12B H 0.941689 0.363730 1.060661 0.035(6) Uiso 1 1 calc GR . . . .
H12C H 0.937872 0.442552 1.011771 0.039(6) Uiso 1 1 calc GR . . . .
C13 C 0.6518(3) 0.42294(12) 1.07638(14) 0.0345(4) Uani 1 1 d . . . . .
H13A H 0.678900 0.473897 1.077901 0.045(7) Uiso 1 1 calc GR . . . .
H13B H 0.685179 0.400379 1.141876 0.059(8) Uiso 1 1 calc GR . . . .
H13C H 0.539231 0.417765 1.067696 0.050(7) Uiso 1 1 calc GR . . . .
C14 C 0.74529(19) 0.58225(8) 0.71134(12) 0.0177(3) Uani 1 1 d . . . . .
H14 H 0.681127 0.597069 0.649515 0.021(5) Uiso 1 1 calc R . . . .
C15 C 0.9112(2) 0.57088(9) 0.67418(15) 0.0270(4) Uani 1 1 d . . . . .
H15A H 0.978140 0.558201 0.733700 0.028(5) Uiso 1 1 calc GR . . . .
H15B H 0.949178 0.615065 0.642214 0.034(6) Uiso 1 1 calc GR . . . .
H15C H 0.912597 0.532076 0.622808 0.029(5) Uiso 1 1 calc GR . . . .
C16 C 0.7401(2) 0.64332(8) 0.79046(13) 0.0232(3) Uani 1 1 d . . . . .
H16A H 0.632085 0.653060 0.808597 0.032(6) Uiso 1 1 calc GR . . . .
H16B H 0.786136 0.686410 0.760197 0.026(5) Uiso 1 1 calc GR . . . .
H16C H 0.798731 0.629651 0.853328 0.029(6) Uiso 1 1 calc GR . . . .
C17 C 0.34252(18) 0.38702(8) 0.68219(12) 0.0177(3) Uani 1 1 d . . . . .
H17 H 0.337943 0.334424 0.696456 0.022(5) Uiso 1 1 calc R . . . .
C18 C 0.3417(2) 0.39761(9) 0.56442(13) 0.0223(3) Uani 1 1 d . . . . .
H18A H 0.332961 0.448778 0.548439 0.028(5) Uiso 1 1 calc GR . . . .
H18B H 0.253338 0.371995 0.533304 0.031(6) Uiso 1 1 calc GR . . . .
H18C H 0.438399 0.378865 0.535828 0.029(6) Uiso 1 1 calc GR . . . .
C19 C 0.1976(2) 0.42169(11) 0.72837(15) 0.0282(4) Uani 1 1 d . . . . .
H19A H 0.201172 0.473573 0.717155 0.033(6) Uiso 1 1 calc GR . . . .
H19B H 0.194459 0.411724 0.803257 0.043(7) Uiso 1 1 calc GR . . . .
H19C H 0.104678 0.401940 0.694218 0.033(6) Uiso 1 1 calc GR . . . .
C20 C 0.9556(3) 0.250000 0.7933(2) 0.0345(6) Uani 1 2 d S T P . .
H20 H 1.066(3) 0.250000 0.829(2) 0.021(7) Uiso 1 2 d S T P . .
O20 O 0.88962(15) 0.30863(7) 0.77213(11) 0.0300(3) Uani 1 1 d . . . . .
C21 C 0.8183(4) 0.250000 0.3398(2) 0.0367(6) Uani 1 2 d S T P . .
O21 O 0.8570(3) 0.250000 0.25534(18) 0.0551(7) Uani 1 2 d S T P . .
C22 C 0.9789(3) 0.250000 0.5381(2) 0.0291(5) Uani 1 2 d S T P . .
O22 O 1.1055(2) 0.250000 0.56685(19) 0.0408(5) Uani 1 2 d S T P . .
C23 C 0.7577(2) 0.14004(10) 0.48934(15) 0.0289(4) Uani 1 1 d . . . . .
O23 O 0.76517(19) 0.07921(7) 0.48755(13) 0.0432(4) Uani 1 1 d . . . . .
C24 C 0.5244(3) 0.250000 0.44004(19) 0.0272(5) Uani 1 2 d S T P . .
O24 O 0.3997(3) 0.250000 0.40888(16) 0.0374(5) Uani 1 2 d S T P . .
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'
Mo Mo -1.6832 0.6857 '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_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Sn1 Mo1 152.54(5) . . ?
C1 Sn1 C20 100.42(9) . . ?
C1 Sn1 O20 98.18(6) . 4_565 ?
C1 Sn1 O20 98.18(6) . . ?
C20 Sn1 Mo1 107.05(7) . . ?
O20 Sn1 Mo1 105.64(4) . . ?
O20 Sn1 Mo1 105.65(4) 4_565 . ?
O20 Sn1 C20 29.52(4) . . ?
O20 Sn1 C20 29.52(4) 4_565 . ?
O20 Sn1 O20 59.02(7) . 4_565 ?
C21 Mo1 Sn1 174.64(10) . . ?
C21 Mo1 C22 90.73(13) . . ?
C21 Mo1 C23 89.57(5) . 4_565 ?
C21 Mo1 C23 89.57(5) . . ?
C21 Mo1 C24 89.10(12) . . ?
C22 Mo1 Sn1 83.91(8) . . ?
C22 Mo1 C23 88.94(5) . . ?
C22 Mo1 C23 88.94(6) . 4_565 ?
C22 Mo1 C24 179.83(10) . . ?
C23 Mo1 Sn1 90.33(5) . . ?
C23 Mo1 Sn1 90.33(5) 4_565 . ?
C23 Mo1 C23 177.70(10) . 4_565 ?
C23 Mo1 C24 91.06(5) . . ?
C23 Mo1 C24 91.06(5) 4_565 . ?
C24 Mo1 Sn1 96.26(7) . . ?
C2 C1 Sn1 119.35(9) 4_565 . ?
C2 C1 Sn1 119.35(9) . . ?
C2 C1 C2 120.98(19) 4_565 . ?
C1 C2 C5 120.13(13) . . ?
C3 C2 C1 118.90(14) . . ?
C3 C2 C5 120.95(13) . . ?
C2 C3 H3 119.8 . . ?
C4 C3 C2 120.48(14) . . ?
C4 C3 H3 119.8 . . ?
C3 C4 C3 120.2(2) . 4_565 ?
C3 C4 H4 119.9 . . ?
C3 C4 H4 119.9 4_565 . ?
C6 C5 C2 119.84(12) . . ?
C10 C5 C2 119.93(13) . . ?
C10 C5 C6 120.23(13) . . ?
C5 C6 C11 121.00(13) . . ?
C7 C6 C5 118.65(13) . . ?
C7 C6 C11 120.27(13) . . ?
C6 C7 H7 119.0 . . ?
C6 C7 C8 121.93(14) . . ?
C8 C7 H7 119.0 . . ?
C7 C8 C14 121.40(13) . . ?
C9 C8 C7 118.38(13) . . ?
C9 C8 C14 120.22(13) . . ?
C8 C9 H9 119.0 . . ?
C8 C9 C10 122.07(13) . . ?
C10 C9 H9 119.0 . . ?
C5 C10 C17 121.27(13) . . ?
C9 C10 C5 118.73(13) . . ?
C9 C10 C17 119.80(13) . . ?
C6 C11 H11 107.7 . . ?
C6 C11 C12 114.02(14) . . ?
C6 C11 C13 109.82(14) . . ?
C12 C11 H11 107.7 . . ?
C13 C11 H11 107.7 . . ?
C13 C11 C12 109.75(15) . . ?
C11 C12 H12A 109.5 . . ?
C11 C12 H12B 109.5 . . ?
C11 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C11 C13 H13A 109.5 . . ?
C11 C13 H13B 109.5 . . ?
C11 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C8 C14 H14 107.5 . . ?
C8 C14 C15 111.48(13) . . ?
C8 C14 C16 112.40(13) . . ?
C15 C14 H14 107.5 . . ?
C16 C14 H14 107.5 . . ?
C16 C14 C15 110.33(14) . . ?
C14 C15 H15A 109.5 . . ?
C14 C15 H15B 109.5 . . ?
C14 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C14 C16 H16A 109.5 . . ?
C14 C16 H16B 109.5 . . ?
C14 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C10 C17 H17 108.0 . . ?
C10 C17 C19 109.45(13) . . ?
C18 C17 C10 113.50(13) . . ?
C18 C17 H17 108.0 . . ?
C18 C17 C19 109.66(13) . . ?
C19 C17 H17 108.0 . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C17 C19 H19A 109.5 . . ?
C17 C19 H19B 109.5 . . ?
C17 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
Sn1 C20 H20 176.9(16) . . ?
O20 C20 Sn1 60.27(12) . . ?
O20 C20 Sn1 60.27(12) 4_565 . ?
O20 C20 H20 119.78(12) 4_565 . ?
O20 C20 H20 119.78(12) . . ?
O20 C20 O20 120.4(2) . 4_565 ?
C20 O20 Sn1 90.21(13) . . ?
O21 C21 Mo1 179.2(3) . . ?
O22 C22 Mo1 179.0(2) . . ?
O23 C23 Mo1 177.65(17) . . ?
O24 C24 Mo1 177.5(2) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Sn1 Mo1 2.7229(3) . ?
Sn1 C1 2.158(2) . ?
Sn1 C20 2.560(3) . ?
Sn1 O20 2.2228(13) . ?
Sn1 O20 2.2228(12) 4_565 ?
Mo1 C21 2.011(3) . ?
Mo1 C22 2.036(3) . ?
Mo1 C23 2.0538(19) . ?
Mo1 C23 2.0539(19) 4_565 ?
Mo1 C24 2.062(3) . ?
C1 C2 1.4018(17) 4_565 ?
C1 C2 1.4018(17) . ?
C2 C3 1.397(2) . ?
C2 C5 1.5036(19) . ?
C3 H3 0.9500 . ?
C3 C4 1.3903(18) . ?
C4 H4 0.9500 . ?
C5 C6 1.417(2) . ?
C5 C10 1.4069(19) . ?
C6 C7 1.394(2) . ?
C6 C11 1.525(2) . ?
C7 H7 0.9500 . ?
C7 C8 1.397(2) . ?
C8 C9 1.386(2) . ?
C8 C14 1.519(2) . ?
C9 H9 0.9500 . ?
C9 C10 1.400(2) . ?
C10 C17 1.525(2) . ?
C11 H11 1.0000 . ?
C11 C12 1.530(2) . ?
C11 C13 1.530(3) . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14 1.0000 . ?
C14 C15 1.529(2) . ?
C14 C16 1.528(2) . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17 1.0000 . ?
C17 C18 1.525(2) . ?
C17 C19 1.534(2) . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20 1.05(3) . ?
C20 O20 1.2615(19) 4_565 ?
C20 O20 1.2614(19) . ?
C21 O21 1.140(4) . ?
C22 O22 1.147(3) . ?
C23 O23 1.138(2) . ?
C24 O24 1.142(3) . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Sn1 C1 C2 C3 172.18(11) . . . . ?
Sn1 C1 C2 C5 -9.2(2) . . . . ?
C1 C2 C3 C4 0.1(2) . . . . ?
C1 C2 C5 C6 -93.22(18) . . . . ?
C1 C2 C5 C10 86.79(19) . . . . ?
C2 C1 C2 C3 -1.4(3) 4_565 . . . ?
C2 C1 C2 C5 177.24(12) 4_565 . . . ?
C2 C3 C4 C3 1.2(3) . . . 4_565 ?
C2 C5 C6 C7 178.65(13) . . . . ?
C2 C5 C6 C11 -4.6(2) . . . . ?
C2 C5 C10 C9 -178.61(13) . . . . ?
C2 C5 C10 C17 6.6(2) . . . . ?
C3 C2 C5 C6 85.37(18) . . . . ?
C3 C2 C5 C10 -94.62(17) . . . . ?
C5 C2 C3 C4 -178.54(16) . . . . ?
C5 C6 C7 C8 0.5(2) . . . . ?
C5 C6 C11 C12 142.95(15) . . . . ?
C5 C6 C11 C13 -93.43(18) . . . . ?
C5 C10 C17 C18 -148.08(14) . . . . ?
C5 C10 C17 C19 89.05(17) . . . . ?
C6 C5 C10 C9 1.4(2) . . . . ?
C6 C5 C10 C17 -173.40(14) . . . . ?
C6 C7 C8 C9 0.3(2) . . . . ?
C6 C7 C8 C14 -179.36(14) . . . . ?
C7 C6 C11 C12 -40.4(2) . . . . ?
C7 C6 C11 C13 83.27(19) . . . . ?
C7 C8 C9 C10 -0.2(2) . . . . ?
C7 C8 C14 C15 66.47(19) . . . . ?
C7 C8 C14 C16 -58.0(2) . . . . ?
C8 C9 C10 C5 -0.6(2) . . . . ?
C8 C9 C10 C17 174.28(14) . . . . ?
C9 C8 C14 C15 -113.17(16) . . . . ?
C9 C8 C14 C16 122.35(16) . . . . ?
C9 C10 C17 C18 37.2(2) . . . . ?
C9 C10 C17 C19 -85.69(17) . . . . ?
C10 C5 C6 C7 -1.4(2) . . . . ?
C10 C5 C6 C11 175.39(14) . . . . ?
C11 C6 C7 C8 -176.26(14) . . . . ?
C14 C8 C9 C10 179.41(14) . . . . ?
O20 C20 O20 Sn1 -3.6(3) 4_565 . . . ?
