#------------------------------------------------------------------------------
#$Date: 2021-09-09 01:55:46 +0300 (Thu, 09 Sep 2021) $
#$Revision: 269053 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/82/7708249.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_7708249
loop_
_publ_author_name
'Johnson, Andrew Lee'
'Paish, James David'
'Snook, Michael'
_publ_section_title
;
 Evaluation of Sn(II) Aminoalkoxide Precursors for Atomic Layer Deposition
 of SnO Thin Films. Invitation: Dalton Transactions web collection themed
 around the topic of tin chemistry
;
_journal_name_full               'Dalton Transactions'
_journal_paper_doi               10.1039/D1DT02480A
_journal_year                    2021
_chemical_formula_moiety         'C12 H16 F12 N2 O2 Sn'
_chemical_formula_sum            'C12 H16 F12 N2 O2 Sn'
_chemical_formula_weight         566.96
_chemical_properties_physical
Air-sensitive,Moisture-sensitive,Oxygen-sensitive
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2021-01-12 deposited with the CCDC.	2021-09-08 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 94.4840(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.5031(2)
_cell_length_b                   8.29960(10)
_cell_length_c                   12.5214(2)
_cell_measurement_reflns_used    8910
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      73.1810
_cell_measurement_theta_min      4.4170
_cell_volume                     1917.00(4)
_computing_cell_refinement       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_molecular_graphics
'ORTEP3 for Windows - Farrugia, L. J. J. Appl. Crystallogr. 1997, 30, 565'
_computing_publication_material
;
 'WinGX publication routines, Farrugia, 
 L. J., J. Appl. Crystallogr., 1999, 32, 837-838
;
_computing_structure_refinement
;
 SHELXL-2018/3 (Sheldrick, 2018)
 Sheldrick GM (2008) Acta Crystallogr A64:112--122 and 
 C. B. Hübschle, G. M. Sheldrick and B. Dittrich
 ShelXle: a Qt graphical user interface for SHELXL
 J. Appl. Cryst., 44, (2011) 1281-1284.
;
_computing_structure_solution
; 
 SHELXT
 Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.
;
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      150.00(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 8.1150
_diffrn_detector_type            EosS2
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, EosS2'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0343
_diffrn_reflns_av_unetI/netI     0.0283
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.987
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            13270
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.987
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         73.407
_diffrn_reflns_theta_min         4.795
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Cu) X-ray Source'
_exptl_absorpt_coefficient_mu    11.814
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.20108
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.43 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.964
_exptl_crystal_description       block
_exptl_crystal_F_000             1104
_exptl_crystal_recrystallization_method
'Re-crystallisation from solvent: Hexane'
_exptl_crystal_size_max          0.320
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.998
_refine_diff_density_min         -0.474
_refine_diff_density_rms         0.090
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.044
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     296
_refine_ls_number_reflns         3815
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.044
_refine_ls_R_factor_all          0.0353
_refine_ls_R_factor_gt           0.0339
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0523P)²+2.1823P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0894
_refine_ls_wR_factor_ref         0.0909
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3623
_reflns_number_total             3815
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1dt02480a2.cif
_cod_data_source_block           3d
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7708249
_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   0.116
_shelx_estimated_absorpt_t_max   0.385
_oxdiff_exptl_absorpt_empirical_full_min 0.534
_oxdiff_exptl_absorpt_empirical_full_max 3.396
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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 0.23737(2) 0.46813(3) 0.55345(2) 0.03072(10) Uani 1 1 d . . . . .
F1 F 0.44360(17) 0.3549(5) 0.5429(2) 0.0794(10) Uani 1 1 d . . . . .
F2 F 0.50642(12) 0.3786(4) 0.6913(2) 0.0612(7) Uani 1 1 d . . . . .
F3 F 0.44199(15) 0.1695(3) 0.6614(3) 0.0773(9) Uani 1 1 d . . . . .
F4 F 0.32280(18) 0.4416(4) 0.8558(3) 0.0695(8) Uani 1 1 d . . . . .
F5 F 0.37641(17) 0.2181(3) 0.8354(2) 0.0692(8) Uani 1 1 d . . . . .
F6 F 0.43915(17) 0.4329(4) 0.8693(2) 0.0687(8) Uani 1 1 d . . . . .
F7 F 0.07121(13) 0.6080(4) 0.5394(2) 0.0581(7) Uani 1 1 d . . . . .
F8 F 0.0701(2) 0.8048(4) 0.6478(4) 0.1071(15) Uani 1 1 d . . . . .
F9 F 0.00277(14) 0.6045(6) 0.6695(3) 0.0932(12) Uani 1 1 d . . . . .
F10 F 0.14225(19) 0.7915(4) 0.8297(3) 0.0755(9) Uani 1 1 d . . . . .
F11 F 0.06882(16) 0.6046(4) 0.8710(2) 0.0676(8) Uani 1 1 d . . . . .
F12 F 0.1832(2) 0.5699(5) 0.8902(2) 0.0852(10) Uani 1 1 d . . . . .
O1 O 0.31570(12) 0.3474(3) 0.6466(2) 0.0423(6) Uani 1 1 d . . . . .
O2 O 0.19449(12) 0.6031(3) 0.6735(2) 0.0341(5) Uani 1 1 d . . . . .
N1 N 0.33560(16) 0.6623(4) 0.5921(3) 0.0386(7) Uani 1 1 d . . . . .
N2 N 0.15280(15) 0.2858(4) 0.6438(3) 0.0346(6) Uani 1 1 d . . . . .
C1 C 0.37787(17) 0.4114(4) 0.6941(3) 0.0347(7) Uani 1 1 d . . . . .
C2 C 0.38355(19) 0.5992(5) 0.6813(3) 0.0403(8) Uani 1 1 d . . . . .
H2A H 0.371188 0.651412 0.748571 0.048 Uiso 1 1 calc R U . . .
H2B H 0.434259 0.627911 0.669578 0.048 Uiso 1 1 calc R U . . .
C3 C 0.3716(3) 0.6745(6) 0.4898(4) 0.0593(12) Uani 1 1 d . . . . .
H3A H 0.415085 0.741629 0.500953 0.089 Uiso 1 1 calc R U . . .
H3B H 0.338036 0.723239 0.434588 0.089 Uiso 1 1 calc R U . . .
H3C H 0.385246 0.566593 0.466817 0.089 Uiso 1 1 calc R U . . .
C4 C 0.3106(2) 0.8256(5) 0.6195(4) 0.0521(10) Uani 1 1 d . . . . .
H4A H 0.285228 0.820414 0.685213 0.078 Uiso 1 1 calc R U . . .
H4B H 0.277653 0.866856 0.560796 0.078 Uiso 1 1 calc R U . . .
H4C H 0.352548 0.897547 0.630661 0.078 Uiso 1 1 calc R U . . .
C5 C 0.4427(2) 0.3269(5) 0.6476(3) 0.0459(9) Uani 1 1 d . . . . .
C6 C 0.3800(2) 0.3752(5) 0.8145(4) 0.0475(9) Uani 1 1 d . . . . .
C21 C 0.13000(19) 0.5640(4) 0.7118(3) 0.0337(7) Uani 1 1 d . . . . .
C22 C 0.1241(6) 0.3826(8) 0.7285(8) 0.0398(19) Uani 0.71(2) 1 d . . P A 1
H22A H 0.150491 0.354048 0.797730 0.048 Uiso 0.71(2) 1 calc R U P A 1
H22B H 0.072457 0.354506 0.733275 0.048 Uiso 0.71(2) 1 calc R U P A 1
C23 C 0.0963(5) 0.2354(15) 0.5595(7) 0.058(2) Uani 0.71(2) 1 d . . P A 1
H23A H 0.059256 0.171561 0.591988 0.087 Uiso 0.71(2) 1 calc R U P A 1
H23B H 0.118606 0.170324 0.505628 0.087 Uiso 0.71(2) 1 calc R U P A 1
H23C H 0.073829 0.331181 0.525262 0.087 Uiso 0.71(2) 1 calc R U P A 1
C24 C 0.1899(4) 0.1447(10) 0.6859(11) 0.054(2) Uani 0.71(2) 1 d . . P A 1
H24A H 0.157446 0.082329 0.728213 0.082 Uiso 0.71(2) 1 calc R U P A 1
H24B H 0.232905 0.177124 0.731529 0.082 Uiso 0.71(2) 1 calc R U P A 1
H24C H 0.204757 0.078508 0.626578 0.082 Uiso 0.71(2) 1 calc R U P A 1
C22A C 0.0966(10) 0.3837(18) 0.6917(18) 0.031(4) Uani 0.29(2) 1 d . . P A 2
H22C H 0.084288 0.335531 0.760241 0.037 Uiso 0.29(2) 1 calc R U P A 2
H22D H 0.052093 0.388407 0.642513 0.037 Uiso 0.29(2) 1 calc R U P A 2
C23A C 0.1191(13) 0.162(3) 0.573(2) 0.059(6) Uani 0.29(2) 1 d . . P A 2
H23D H 0.082935 0.102726 0.610056 0.089 Uiso 0.29(2) 1 calc R U P A 2
H23E H 0.156416 0.087156 0.551390 0.089 Uiso 0.29(2) 1 calc R U P A 2
H23F H 0.095519 0.213388 0.508501 0.089 Uiso 0.29(2) 1 calc R U P A 2
C24A C 0.1913(10) 0.190(3) 0.739(2) 0.048(6) Uani 0.29(2) 1 d . . P A 2
H24D H 0.154893 0.138285 0.779933 0.072 Uiso 0.29(2) 1 calc R U P A 2
H24E H 0.220875 0.263418 0.784935 0.072 Uiso 0.29(2) 1 calc R U P A 2
H24F H 0.222538 0.106965 0.710463 0.072 Uiso 0.29(2) 1 calc R U P A 2
C25 C 0.0682(2) 0.6466(5) 0.6431(4) 0.0484(10) Uani 1 1 d . . . . .
C26 C 0.1306(2) 0.6334(6) 0.8264(4) 0.0508(10) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sn Sn 0.0259 5.4591 '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
O1 Sn1 O2 98.32(11) . . ?
O1 Sn1 N1 74.24(10) . . ?
O2 Sn1 N1 79.75(10) . . ?
O1 Sn1 N2 83.50(10) . . ?
O2 Sn1 N2 73.29(10) . . ?
N1 Sn1 N2 141.93(10) . . ?
C1 O1 Sn1 126.4(2) . . ?
C21 O2 Sn1 121.4(2) . . ?
C2 N1 C4 109.3(3) . . ?
C2 N1 C3 113.2(3) . . ?
C4 N1 C3 107.8(3) . . ?
C2 N1 Sn1 108.1(2) . . ?
C4 N1 Sn1 114.1(2) . . ?
C3 N1 Sn1 104.4(3) . . ?
C24 N2 C22 111.8(6) . . ?
C23A N2 C22A 110.6(10) . . ?
C24 N2 C23 108.7(5) . . ?
C22 N2 C23 113.2(5) . . ?
C23A N2 C24A 104.6(12) . . ?
C22A N2 C24A 105.5(11) . . ?
C24 N2 Sn1 111.1(4) . . ?
C22 N2 Sn1 105.7(3) . . ?
C23A N2 Sn1 113.5(9) . . ?
C22A N2 Sn1 109.5(6) . . ?
C23 N2 Sn1 106.2(4) . . ?
C24A N2 Sn1 112.8(7) . . ?
O1 C1 C6 107.9(3) . . ?
O1 C1 C5 108.3(3) . . ?
C6 C1 C5 108.8(3) . . ?
O1 C1 C2 113.8(3) . . ?
C6 C1 C2 107.3(3) . . ?
C5 C1 C2 110.6(3) . . ?
N1 C2 C1 113.0(3) . . ?
N1 C2 H2A 109.0 . . ?
C1 C2 H2A 109.0 . . ?
N1 C2 H2B 109.0 . . ?
C1 C2 H2B 109.0 . . ?
H2A C2 H2B 107.8 . . ?
N1 C3 H3A 109.5 . . ?
N1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
N1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
N1 C4 H4A 109.5 . . ?
N1 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
N1 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
F3 C5 F2 106.4(3) . . ?
F3 C5 F1 107.7(4) . . ?
F2 C5 F1 105.7(4) . . ?
F3 C5 C1 112.6(4) . . ?
F2 C5 C1 112.8(3) . . ?
F1 C5 C1 111.2(3) . . ?
F4 C6 F5 106.0(4) . . ?
F4 C6 F6 107.2(4) . . ?
F5 C6 F6 107.5(4) . . ?
F4 C6 C1 109.9(3) . . ?
F5 C6 C1 112.7(4) . . ?
F6 C6 C1 113.1(3) . . ?
O2 C21 C22 111.0(4) . . ?
O2 C21 C25 109.3(3) . . ?
C22 C21 C25 117.3(6) . . ?
O2 C21 C26 107.2(3) . . ?
C22 C21 C26 103.7(4) . . ?
C25 C21 C26 107.7(3) . . ?
O2 C21 C22A 119.8(6) . . ?
C25 C21 C22A 93.8(9) . . ?
C26 C21 C22A 117.4(8) . . ?
N2 C22 C21 114.1(5) . . ?
N2 C22 H22A 108.7 . . ?
C21 C22 H22A 108.7 . . ?
N2 C22 H22B 108.7 . . ?
C21 C22 H22B 108.7 . . ?
H22A C22 H22B 107.6 . . ?
N2 C23 H23A 109.5 . . ?
N2 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
N2 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
N2 C24 H24A 109.5 . . ?
N2 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
N2 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
N2 C22A C21 107.2(9) . . ?
N2 C22A H22C 110.3 . . ?
C21 C22A H22C 110.3 . . ?
N2 C22A H22D 110.3 . . ?
C21 C22A H22D 110.3 . . ?
H22C C22A H22D 108.5 . . ?
N2 C23A H23D 109.5 . . ?
N2 C23A H23E 109.5 . . ?
H23D C23A H23E 109.5 . . ?
N2 C23A H23F 109.5 . . ?
H23D C23A H23F 109.5 . . ?
H23E C23A H23F 109.5 . . ?
N2 C24A H24D 109.5 . . ?
N2 C24A H24E 109.5 . . ?
H24D C24A H24E 109.5 . . ?
N2 C24A H24F 109.5 . . ?
H24D C24A H24F 109.5 . . ?
H24E C24A H24F 109.5 . . ?
F8 C25 F9 105.9(4) . . ?
F8 C25 F7 106.2(4) . . ?
F9 C25 F7 106.6(4) . . ?
F8 C25 C21 113.8(4) . . ?
F9 C25 C21 113.4(4) . . ?
F7 C25 C21 110.4(3) . . ?
F12 C26 F10 105.4(4) . . ?
F12 C26 F11 106.8(4) . . ?
F10 C26 F11 107.8(4) . . ?
F12 C26 C21 111.4(4) . . ?
F10 C26 C21 112.8(4) . . ?
F11 C26 C21 112.2(4) . . ?
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 O1 2.050(2) . ?
Sn1 O2 2.081(2) . ?
Sn1 N1 2.449(3) . ?
Sn1 N2 2.509(3) . ?
F1 C5 1.332(5) . ?
F2 C5 1.332(5) . ?
F3 C5 1.318(5) . ?
F4 C6 1.332(5) . ?
F5 C6 1.333(5) . ?
F6 C6 1.335(5) . ?
F7 C25 1.343(5) . ?
F8 C25 1.314(5) . ?
F9 C25 1.326(5) . ?
F10 C26 1.329(6) . ?
F11 C26 1.333(5) . ?
F12 C26 1.320(6) . ?
O1 C1 1.361(4) . ?
O2 C21 1.360(4) . ?
N1 C2 1.467(5) . ?
N1 C4 1.480(5) . ?
N1 C3 1.492(5) . ?
N2 C24 1.437(8) . ?
N2 C22 1.463(8) . ?
N2 C23A 1.468(17) . ?
N2 C22A 1.482(16) . ?
N2 C23 1.486(7) . ?
N2 C24A 1.556(18) . ?
C1 C6 1.535(6) . ?
C1 C5 1.543(5) . ?
C1 C2 1.571(5) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C21 C22 1.525(8) . ?
C21 C25 1.538(6) . ?
C21 C26 1.545(6) . ?
C21 C22A 1.631(15) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C22A H22C 0.9900 . ?
C22A H22D 0.9900 . ?
C23A H23D 0.9800 . ?
C23A H23E 0.9800 . ?
C23A H23F 0.9800 . ?
C24A H24D 0.9800 . ?
C24A H24E 0.9800 . ?
C24A H24F 0.9800 . ?
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 O1 C1 C6 124.6(3) . . . . ?
Sn1 O1 C1 C5 -117.9(3) . . . . ?
Sn1 O1 C1 C2 5.5(5) . . . . ?
C4 N1 C2 C1 147.2(3) . . . . ?
C3 N1 C2 C1 -92.6(4) . . . . ?
Sn1 N1 C2 C1 22.5(3) . . . . ?
O1 C1 C2 N1 -20.1(4) . . . . ?
C6 C1 C2 N1 -139.5(3) . . . . ?
C5 C1 C2 N1 102.0(3) . . . . ?
O1 C1 C5 F3 -57.8(4) . . . . ?
C6 C1 C5 F3 59.2(4) . . . . ?
C2 C1 C5 F3 176.8(3) . . . . ?
O1 C1 C5 F2 -178.3(3) . . . . ?
C6 C1 C5 F2 -61.3(4) . . . . ?
C2 C1 C5 F2 56.3(4) . . . . ?
O1 C1 C5 F1 63.1(4) . . . . ?
C6 C1 C5 F1 -179.8(4) . . . . ?
C2 C1 C5 F1 -62.2(4) . . . . ?
O1 C1 C6 F4 -60.3(4) . . . . ?
C5 C1 C6 F4 -177.5(3) . . . . ?
C2 C1 C6 F4 62.8(4) . . . . ?
O1 C1 C6 F5 57.7(4) . . . . ?
C5 C1 C6 F5 -59.5(4) . . . . ?
C2 C1 C6 F5 -179.2(3) . . . . ?
O1 C1 C6 F6 179.9(3) . . . . ?
C5 C1 C6 F6 62.7(5) . . . . ?
C2 C1 C6 F6 -57.0(4) . . . . ?
Sn1 O2 C21 C22 42.9(6) . . . . ?
Sn1 O2 C21 C25 -88.0(3) . . . . ?
Sn1 O2 C21 C26 155.5(2) . . . . ?
Sn1 O2 C21 C22A 18.3(11) . . . . ?
C24 N2 C22 C21 141.8(9) . . . . ?
C23 N2 C22 C21 -95.0(11) . . . . ?
Sn1 N2 C22 C21 20.8(9) . . . . ?
O2 C21 C22 N2 -40.3(10) . . . . ?
C25 C21 C22 N2 86.3(8) . . . . ?
C26 C21 C22 N2 -155.1(7) . . . . ?
C23A N2 C22A C21 -149.5(19) . . . . ?
C24A N2 C22A C21 98.0(16) . . . . ?
Sn1 N2 C22A C21 -23.7(16) . . . . ?
O2 C21 C22A N2 7.7(18) . . . . ?
C25 C21 C22A N2 122.6(13) . . . . ?
C26 C21 C22A N2 -125.2(10) . . . . ?
O2 C21 C25 F8 -64.1(5) . . . . ?
C22 C21 C25 F8 168.5(5) . . . . ?
C26 C21 C25 F8 52.1(5) . . . . ?
C22A C21 C25 F8 172.5(7) . . . . ?
O2 C21 C25 F9 174.8(3) . . . . ?
C22 C21 C25 F9 47.3(5) . . . . ?
C26 C21 C25 F9 -69.0(4) . . . . ?
C22A C21 C25 F9 51.4(7) . . . . ?
O2 C21 C25 F7 55.3(4) . . . . ?
C22 C21 C25 F7 -72.2(5) . . . . ?
C26 C21 C25 F7 171.4(3) . . . . ?
C22A C21 C25 F7 -68.2(7) . . . . ?
O2 C21 C26 F12 -61.5(5) . . . . ?
C22 C21 C26 F12 56.0(6) . . . . ?
C25 C21 C26 F12 -179.1(4) . . . . ?
C22A C21 C26 F12 76.8(10) . . . . ?
O2 C21 C26 F10 56.7(5) . . . . ?
C22 C21 C26 F10 174.2(5) . . . . ?
C25 C21 C26 F10 -60.8(4) . . . . ?
C22A C21 C26 F10 -165.0(9) . . . . ?
O2 C21 C26 F11 178.7(3) . . . . ?
C22 C21 C26 F11 -63.8(6) . . . . ?
C25 C21 C26 F11 61.2(5) . . . . ?
C22A C21 C26 F11 -43.0(10) . . . . ?
