#------------------------------------------------------------------------------
#$Date: 2021-09-06 13:10:33 +0200 (lun 06 de sep de 2021) $
#$Revision: 268759 $
#$URL: svn://www.crystallography.net/cod/cif/7/70/76/7707614.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_7707614
loop_
_publ_author_name
'Garg, Palak'
'Dange, Deepak'
'Jones, Cameron'
_publ_section_title
;
 Bulky arene-bridged bis(amide) and bis(amidinate) complexes of
 germanium(II) and tin(II).
;
_journal_issue                   26
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9118
_journal_page_last               9122
_journal_paper_doi               10.1039/d1dt01642c
_journal_volume                  50
_journal_year                    2021
_chemical_formula_sum            'C48 H92 N4 Si4 Sn2'
_chemical_formula_weight         1074.99
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_audit_update_record
;
2021-06-08 deposited with the CCDC.	2021-06-08 downloaded from the CCDC.
;
_cell_angle_alpha                111.3240(10)
_cell_angle_beta                 104.1690(10)
_cell_angle_gamma                90.3260(10)
_cell_formula_units_Z            1
_cell_length_a                   7.9922(4)
_cell_length_b                   12.3215(6)
_cell_length_c                   15.2347(8)
_cell_measurement_reflns_used    5009
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      25.49
_cell_measurement_theta_min      3.00
_cell_volume                     1347.56(12)
_computing_cell_refinement       'CrysAlisPro 1.171.39.46 (Rigaku OD, 2018)'
_computing_data_collection       'CrysAlisPro 1.171.39.46 (Rigaku OD, 2018)'
_computing_data_reduction        'CrysAlisPro 1.171.39.46 (Rigaku OD, 2018)'
_computing_molecular_graphics    xseed
_computing_publication_material  Ciftab
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'XtaLAB Synergy, Dualflex, HyPix'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0202
_diffrn_reflns_av_unetI/netI     0.0252
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            15024
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.498
_diffrn_reflns_theta_min         3.030
_diffrn_source                   'micro-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    1.050
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.926
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.46 (Rigaku Oxford Diffraction, 2018)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.325
_exptl_crystal_description       block
_exptl_crystal_F_000             564
_exptl_crystal_size_max          0.250
_exptl_crystal_size_mid          0.220
_exptl_crystal_size_min          0.180
_refine_diff_density_max         0.414
_refine_diff_density_min         -0.372
_refine_diff_density_rms         0.056
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     274
_refine_ls_number_reflns         5009
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.037
_refine_ls_R_factor_all          0.0242
_refine_ls_R_factor_gt           0.0205
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0167P)²+0.7905P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0441
_refine_ls_wR_factor_ref         0.0456
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4584
_reflns_number_total             5009
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1dt01642c2.cif
_cod_data_source_block           Cj1493
_cod_depositor_comments
'Adding full bibliography for 7707610--7707619.cif.'
_cod_database_code               7707614
_shelx_shelxl_version_number     2016/6
_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   0.779
_shelx_estimated_absorpt_t_max   0.834
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 0.53829(2) 0.02665(2) 0.77849(2) 0.01686(5) Uani 1 1 d . . . . .
Si1 Si 0.83796(6) 0.23804(4) 0.82787(4) 0.01182(11) Uani 1 1 d . . . . .
N1 N 0.67405(19) 0.13458(12) 0.73561(11) 0.0125(3) Uani 1 1 d . . . . .
C1 C 1.0112(3) 0.04947(19) 0.87376(16) 0.0318(5) Uani 1 1 d . . . . .
H1A H 1.107777 0.059056 0.847169 0.048 Uiso 1 1 calc R U . . .
H1B H 0.916951 -0.004406 0.821334 0.048 Uiso 1 1 calc R U . . .
H1C H 1.051005 0.017528 0.924676 0.048 Uiso 1 1 calc R U . . .
Si2 Si 0.67050(6) 0.24178(4) 0.33772(4) 0.01164(11) Uani 1 1 d . . . . .
N2 N 0.58187(19) 0.11629(12) 0.34683(10) 0.0112(3) Uani 1 1 d . . . . .
C2 C 0.9453(3) 0.16888(16) 0.91778(14) 0.0188(4) Uani 1 1 d . . . . .
H2 H 0.854015 0.155178 0.948342 0.023 Uiso 1 1 calc R U . . .
C3 C 1.0918(3) 0.25259(19) 1.00190(15) 0.0280(5) Uani 1 1 d . . . . .
H3A H 1.132225 0.218147 1.051083 0.042 Uiso 1 1 calc R U . . .
H3B H 1.048061 0.327665 1.031828 0.042 Uiso 1 1 calc R U . . .
H3C H 1.188264 0.265292 0.976370 0.042 Uiso 1 1 calc R U . . .
C4 C 0.6357(3) 0.34877(17) 0.96205(15) 0.0221(4) Uani 1 1 d . . . . .
H4A H 0.594163 0.421830 0.998607 0.033 Uiso 1 1 calc R U . . .
H4B H 0.704724 0.316764 1.007838 0.033 Uiso 1 1 calc R U . . .
H4C H 0.536310 0.292027 0.918242 0.033 Uiso 1 1 calc R U . . .
C5 C 0.7484(2) 0.37331(15) 0.90174(13) 0.0143(4) Uani 1 1 d . . . . .
H5 H 0.850695 0.428265 0.949482 0.017 Uiso 1 1 calc R U . . .
C6 C 0.6487(3) 0.43903(17) 0.84072(14) 0.0220(4) Uani 1 1 d . . . . .
H6A H 0.537924 0.393186 0.799700 0.033 Uiso 1 1 calc R U . . .
H6B H 0.717578 0.450585 0.799120 0.033 Uiso 1 1 calc R U . . .
H6C H 0.626876 0.515354 0.884321 0.033 Uiso 1 1 calc R U . . .
C7 C 1.0992(3) 0.40514(18) 0.83185(16) 0.0272(5) Uani 1 1 d . . . . .
H7A H 1.173661 0.401509 0.892053 0.041 Uiso 1 1 calc R U . . .
H7B H 1.020197 0.465430 0.848322 0.041 Uiso 1 1 calc R U . . .
H7C H 1.171291 0.424651 0.794995 0.041 Uiso 1 1 calc R U . . .
C8 C 0.9931(2) 0.28568(16) 0.76941(14) 0.0181(4) Uani 1 1 d . . . . .
H8 H 0.918671 0.295219 0.710053 0.022 Uiso 1 1 calc R U . . .
C9 C 1.1165(3) 0.19572(19) 0.73247(17) 0.0302(5) Uani 1 1 d . . . . .
H9A H 1.172933 0.219225 0.690898 0.045 Uiso 1 1 calc R U . . .
H9B H 1.050593 0.118574 0.694590 0.045 Uiso 1 1 calc R U . . .
H9C H 1.204837 0.191825 0.788301 0.045 Uiso 1 1 calc R U . . .
C10 C 0.6465(2) 0.12941(14) 0.63736(13) 0.0112(4) Uani 1 1 d . . . . .
C11 C 0.5441(2) 0.20484(15) 0.60362(13) 0.0121(4) Uani 1 1 d . . . . .
H11 H 0.489766 0.260659 0.646402 0.015 Uiso 1 1 calc R U . . .
C12 C 0.5201(2) 0.19998(14) 0.50891(13) 0.0112(4) Uani 1 1 d . . . . .
H12 H 0.448297 0.251756 0.487816 0.013 Uiso 1 1 calc R U . . .
C13 C 0.5994(2) 0.12043(14) 0.44396(12) 0.0106(4) Uani 1 1 d . . . . .
C14 C 0.6990(2) 0.04380(15) 0.47747(13) 0.0116(4) Uani 1 1 d . . . . .
H14 H 0.752725 -0.012449 0.434621 0.014 Uiso 1 1 calc R U . . .
C15 C 0.7214(2) 0.04771(15) 0.57160(13) 0.0121(4) Uani 1 1 d . . . . .
H15 H 0.789094 -0.006337 0.591779 0.014 Uiso 1 1 calc R U . . .
C16 C 0.8985(3) 0.36126(19) 0.53341(15) 0.0292(5) Uani 1 1 d . . . . .
H16A H 0.844983 0.309718 0.557317 0.044 Uiso 1 1 calc R U . . .
H16B H 0.834234 0.429940 0.539365 0.044 Uiso 1 1 calc R U . . .
H16C H 1.019166 0.386650 0.572271 0.044 Uiso 1 1 calc R U . . .
C17 C 0.8941(2) 0.29464(16) 0.42580(14) 0.0176(4) Uani 1 1 d . . . . .
H17 H 0.948463 0.351240 0.404999 0.021 Uiso 1 1 calc R U . . .
C18 C 1.0112(2) 0.19469(19) 0.41658(17) 0.0256(5) Uani 1 1 d . . . . .
H18A H 1.130217 0.227072 0.455171 0.038 Uiso 1 1 calc R U . . .
H18B H 1.009731 0.153898 0.347836 0.038 Uiso 1 1 calc R U . . .
H18C H 0.968425 0.139400 0.440844 0.038 Uiso 1 1 calc R U . . .
C19 C 0.6005(3) 0.47568(17) 0.35774(17) 0.0271(5) Uani 1 1 d . . . . .
H19A H 0.596505 0.456981 0.288950 0.041 Uiso 1 1 calc R U . . .
H19B H 0.720654 0.500067 0.397708 0.041 Uiso 1 1 calc R U . . .
H19C H 0.528859 0.539414 0.378975 0.041 Uiso 1 1 calc R U . . .
C20 C 0.5307(2) 0.36662(16) 0.36968(14) 0.0169(4) Uani 1 1 d . . . . .
H20 H 0.539811 0.390146 0.440938 0.020 Uiso 1 1 calc R U . . .
C21 C 0.3366(2) 0.33457(18) 0.31739(16) 0.0246(5) Uani 1 1 d . . . . .
H21A H 0.272015 0.399517 0.346265 0.037 Uiso 1 1 calc R U . . .
H21B H 0.295217 0.264092 0.324661 0.037 Uiso 1 1 calc R U . . .
H21C H 0.318686 0.319614 0.247843 0.037 Uiso 1 1 calc R U . . .
C22 C 0.8486(3) 0.26634(19) 0.20061(16) 0.0259(5) Uani 1 1 d . . . . .
H22A H 0.857978 0.235688 0.133144 0.039 Uiso 1 1 calc R U . . .
H22B H 0.956127 0.258024 0.244160 0.039 Uiso 1 1 calc R U . . .
H22C H 0.829421 0.349302 0.219775 0.039 Uiso 1 1 calc R U . . .
C23 C 0.6952(2) 0.19723(16) 0.20808(14) 0.0164(4) Uani 1 1 d . . . . .
H23 H 0.722256 0.113964 0.188387 0.020 Uiso 1 1 calc R U . . .
C24 C 0.5318(3) 0.19826(18) 0.12989(15) 0.0233(5) Uani 1 1 d . . . . .
H24A H 0.507474 0.279346 0.140872 0.035 Uiso 1 1 calc R U . . .
H24B H 0.432800 0.154979 0.134184 0.035 Uiso 1 1 calc R U . . .
H24C H 0.551139 0.161122 0.064883 0.035 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'
Si Si 0.0817 0.0704 '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'
N N 0.0061 0.0033 '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'
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
N2 Sn1 N1 106.96(6) 2_656 . ?
N1 Si1 C8 108.90(8) . . ?
N1 Si1 C5 112.44(8) . . ?
C8 Si1 C5 108.13(8) . . ?
N1 Si1 C2 107.92(8) . . ?
C8 Si1 C2 113.73(9) . . ?
C5 Si1 C2 105.79(8) . . ?
C10 N1 Si1 118.09(11) . . ?
C10 N1 Sn1 125.30(11) . . ?
Si1 N1 Sn1 116.60(8) . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
H1A C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
N2 Si2 C20 111.14(8) . . ?
N2 Si2 C17 110.59(8) . . ?
C20 Si2 C17 107.25(9) . . ?
N2 Si2 C23 107.25(8) . . ?
C20 Si2 C23 112.64(8) . . ?
C17 Si2 C23 107.94(9) . . ?
C13 N2 Si2 116.07(11) . . ?
C13 N2 Sn1 123.71(11) . 2_656 ?
Si2 N2 Sn1 120.22(8) . 2_656 ?
C1 C2 C3 109.55(17) . . ?
C1 C2 Si1 116.13(14) . . ?
C3 C2 Si1 112.14(14) . . ?
C1 C2 H2 106.1 . . ?
C3 C2 H2 106.1 . . ?
Si1 C2 H2 106.1 . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C5 C4 H4A 109.5 . . ?
C5 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C5 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C6 C5 C4 109.32(16) . . ?
C6 C5 Si1 113.80(13) . . ?
C4 C5 Si1 113.45(12) . . ?
C6 C5 H5 106.6 . . ?
C4 C5 H5 106.6 . . ?
Si1 C5 H5 106.6 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C8 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C9 C8 C7 108.86(16) . . ?
C9 C8 Si1 114.96(14) . . ?
C7 C8 Si1 114.87(14) . . ?
C9 C8 H8 105.8 . . ?
C7 C8 H8 105.8 . . ?
Si1 C8 H8 105.8 . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C8 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C15 C10 C11 117.34(16) . . ?
C15 C10 N1 120.82(16) . . ?
C11 C10 N1 121.84(16) . . ?
C12 C11 C10 121.35(17) . . ?
C12 C11 H11 119.3 . . ?
C10 C11 H11 119.3 . . ?
C11 C12 C13 121.27(16) . . ?
C11 C12 H12 119.4 . . ?
C13 C12 H12 119.4 . . ?
C14 C13 C12 117.14(16) . . ?
C14 C13 N2 120.41(16) . . ?
C12 C13 N2 122.46(15) . . ?
C15 C14 C13 121.60(17) . . ?
C15 C14 H14 119.2 . . ?
C13 C14 H14 119.2 . . ?
C14 C15 C10 121.27(16) . . ?
C14 C15 H15 119.4 . . ?
C10 C15 H15 119.4 . . ?
C17 C16 H16A 109.5 . . ?
C17 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C17 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C16 C17 C18 110.10(17) . . ?
C16 C17 Si2 115.89(14) . . ?
C18 C17 Si2 111.73(13) . . ?
C16 C17 H17 106.1 . . ?
C18 C17 H17 106.1 . . ?
Si2 C17 H17 106.1 . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 H19A 109.5 . . ?
C20 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C20 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 C19 110.72(16) . . ?
C21 C20 Si2 115.04(13) . . ?
C19 C20 Si2 112.27(13) . . ?
C21 C20 H20 106.0 . . ?
C19 C20 H20 106.0 . . ?
Si2 C20 H20 106.0 . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 H22A 109.5 . . ?
C23 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C23 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C22 C23 C24 108.65(16) . . ?
C22 C23 Si2 113.88(13) . . ?
C24 C23 Si2 115.83(14) . . ?
C22 C23 H23 105.9 . . ?
C24 C23 H23 105.9 . . ?
Si2 C23 H23 105.9 . . ?
C23 C24 H24A 109.5 . . ?
C23 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C23 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
_geom_bond_publ_flag
Sn1 N2 2.0753(14) 2_656 ?
Sn1 N1 2.0821(15) . ?
Si1 N1 1.7588(15) . ?
Si1 C8 1.894(2) . ?
Si1 C5 1.8974(18) . ?
Si1 C2 1.9028(19) . ?
N1 C10 1.436(2) . ?
C1 C2 1.535(3) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
Si2 N2 1.7617(15) . ?
Si2 C20 1.8957(19) . ?
Si2 C17 1.8964(19) . ?
Si2 C23 1.909(2) . ?
N2 C13 1.434(2) . ?
C2 C3 1.538(3) . ?
C2 H2 1.0000 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 C5 1.533(3) . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 C6 1.532(3) . ?
C5 H5 1.0000 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C8 1.537(3) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 C9 1.533(3) . ?
C8 H8 1.0000 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C15 1.393(2) . ?
C10 C11 1.396(2) . ?
C11 C12 1.387(2) . ?
C11 H11 0.9500 . ?
C12 C13 1.397(2) . ?
C12 H12 0.9500 . ?
C13 C14 1.395(2) . ?
C14 C15 1.384(2) . ?
C14 H14 0.9500 . ?
C15 H15 0.9500 . ?
C16 C17 1.535(3) . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 C18 1.537(3) . ?
C17 H17 1.0000 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C20 1.539(3) . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 C21 1.535(3) . ?
C20 H20 1.0000 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C23 1.539(3) . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 C24 1.541(3) . ?
C23 H23 1.0000 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
