data_mo190514d
_audit_creation_date               2019-05-14
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number       '2014/7'
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.

Sheldrick, G.M. (2015). Acta Cryst. C71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           'C29 H33 B O4 Si'
_chemical_formula_sum              'C29 H33 B O4 Si'
_chemical_formula_weight           484.45
_chemical_absolute_configuration   unk
_chemical_melting_point            ?
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'
 'B' 'B' 0.0013 0.0007 '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'
 'Si' 'Si' 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system        'triclinic'
_space_group_IT_number             1
_space_group_name_H-M_alt          'P 1'
_space_group_name_Hall             'P 1'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'

_cell_length_a                     6.264(2)
_cell_length_b                     9.621(4)
_cell_length_c                     11.639(4)
_cell_angle_alpha                  91.385(6)
_cell_angle_beta                   96.470(6)
_cell_angle_gamma                  100.453(6)
_cell_volume                       684.6(4)
_cell_formula_units_Z              1
_cell_measurement_reflns_used      1823
_cell_measurement_temperature      150.15
_cell_measurement_theta_max        28.70
_cell_measurement_theta_min        2.721
_shelx_estimated_absorpt_T_max     0.986
_shelx_estimated_absorpt_T_min     0.974
_exptl_absorpt_coefficient_mu      0.117
_exptl_absorpt_correction_T_max    1.0000
_exptl_absorpt_correction_T_min    0.4359
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details    
 'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.0911 before and 0.0434 after correction. The Ratio of minimum to maximum transmission is 0.4359. The λ/2 correction factor is 0.00150.'
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              colourless
_exptl_crystal_colour_primary      colourless
_exptl_crystal_density_diffrn      1.175
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         needle
_exptl_crystal_F_000               258
_exptl_crystal_size_max            0.23
_exptl_crystal_size_mid            0.12
_exptl_crystal_size_min            0.12
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0293
_diffrn_reflns_av_unetI/netI       0.0685
_diffrn_reflns_Laue_measured_fraction_full  0.960
_diffrn_reflns_Laue_measured_fraction_max  0.887
_diffrn_reflns_limit_h_max         7
_diffrn_reflns_limit_h_min         -8
_diffrn_reflns_limit_k_max         13
_diffrn_reflns_limit_k_min         -13
_diffrn_reflns_limit_l_max         14
_diffrn_reflns_limit_l_min         -15
_diffrn_reflns_number              5206
_diffrn_reflns_point_group_measured_fraction_full  0.688
_diffrn_reflns_point_group_measured_fraction_max  0.611
_diffrn_reflns_theta_full          25.242
_diffrn_reflns_theta_max           29.185
_diffrn_reflns_theta_min           1.763
_diffrn_ambient_temperature        150.15
_diffrn_detector_area_resol_mean   ?
_diffrn_measured_fraction_theta_full  0.960
_diffrn_measured_fraction_theta_max  0.887
_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_source                     ?
_diffrn_standards_number           0
_reflns_Friedel_coverage           0.376
_reflns_Friedel_fraction_full      0.416
_reflns_Friedel_fraction_max       0.334
_reflns_number_gt                  3698
_reflns_number_total               4527
_reflns_special_details
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression       'I > 2σ(I)'
_computing_cell_refinement         'SAINT v8.37A (Bruker, 2015)'
_computing_data_collection         ?
_computing_data_reduction          'SAINT v8.37A (Bruker, 2015)'
_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      'XT (Sheldrick, 2015)'
_refine_diff_density_max           0.426
_refine_diff_density_min           -0.510
_refine_diff_density_rms           0.061
_refine_ls_abs_structure_details
;
 Flack x determined using 884 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack     0.00(15)
_refine_ls_extinction_coef         .
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.014
_refine_ls_hydrogen_treatment      constr
_refine_ls_matrix_type             full
_refine_ls_number_parameters       321
_refine_ls_number_reflns           4527
_refine_ls_number_restraints       3
_refine_ls_R_factor_all            0.0716
_refine_ls_R_factor_gt             0.0564
_refine_ls_restrained_S_all        1.013
_refine_ls_shift/su_max            0.000
_refine_ls_shift/su_mean           0.000
_refine_ls_structure_factor_coef   Fsqd
_refine_ls_weighting_details      
 'w=1/[σ²(Fo²)+(0.0929P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.1388
_refine_ls_wR_factor_ref           0.1493
_refine_special_details            ?
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All Si(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 Si1(H1), C1(H1A)
2.b Secondary CH2 refined with riding coordinates:
 C3(H3A,H3B)
2.c Aromatic/amide H refined with riding coordinates:
 C7(H7), C8(H8), C10(H10), C11(H11), C19(H19), C20(H20), C21(H21), C22(H22),
 C23(H23), C25(H25), C26(H26), C27(H27), C28(H28), C29(H29)
2.d Idealised Me refined as rotating group:
 C5(H5A,H5B,H5C), C14(H14A,H14B,H14C), C15(H15A,H15B,H15C), C16(H16A,H16B,
 H16C), C17(H17A,H17B,H17C)
;
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary       dual
_atom_sites_solution_secondary     ?
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
 Si1 Si 0.12787(15) 0.64542(11) 0.26845(9) 0.0244(3) Uani 1 1 d . . . . .
 H1 H -0.0298 0.6540 0.2581 0.029 Uiso 1 1 calc R . . . .
 O1 O -0.0849(5) 0.6770(3) 0.4930(3) 0.0352(8) Uani 1 1 d . . . . .
 O2 O 0.2046(5) 0.6829(3) 0.6278(3) 0.0344(8) Uani 1 1 d . . . . .
 O3 O 0.8091(5) 0.2472(3) 0.9028(3) 0.0337(7) Uani 1 1 d . . . . .
 O4 O 0.5159(5) 0.0614(3) 0.8817(2) 0.0298(7) Uani 1 1 d . . . . .
 C1 C 0.1566(7) 0.4906(4) 0.3623(3) 0.0236(8) Uani 1 1 d . . . . .
 H1A H 0.2675 0.4348 0.3409 0.028 Uiso 1 1 calc R . . . .
 C2 C 0.1188(7) 0.4868(4) 0.4916(3) 0.0242(8) Uani 1 1 d . . . . .
 C3 C -0.0489(8) 0.4017(5) 0.4001(4) 0.0305(9) Uani 1 1 d . . . . .
 H3A H -0.1889 0.4349 0.3812 0.037 Uiso 1 1 calc R . . . .
 H3B H -0.0611 0.2976 0.3969 0.037 Uiso 1 1 calc R . . . .
 C4 C 0.0651(7) 0.6215(4) 0.5365(3) 0.0251(9) Uani 1 1 d . . . . .
 C5 C 0.1802(10) 0.8252(5) 0.6655(4) 0.0447(13) Uani 1 1 d . . . . .
 H5A H 0.2249 0.8922 0.6068 0.067 Uiso 1 1 calc GR . . . .
 H5B H 0.2724 0.8535 0.7390 0.067 Uiso 1 1 calc GR . . . .
 H5C H 0.0270 0.8248 0.6759 0.067 Uiso 1 1 calc GR . . . .
 C6 C 0.2525(7) 0.4061(4) 0.5743(3) 0.0240(8) Uani 1 1 d . . . . .
 C7 C 0.4812(7) 0.4520(4) 0.6040(3) 0.0249(8) Uani 1 1 d . . . . .
 H7 H 0.5567 0.5302 0.5675 0.030 Uiso 1 1 calc R . . . .
 C8 C 0.5945(7) 0.3817(4) 0.6872(3) 0.0264(8) Uani 1 1 d . . . . .
 H8 H 0.7471 0.4141 0.7072 0.032 Uiso 1 1 calc R . . . .
 C9 C 0.4887(7) 0.2637(4) 0.7426(3) 0.0250(8) Uani 1 1 d . . . . .
 C10 C 0.2642(7) 0.2171(4) 0.7094(3) 0.0273(9) Uani 1 1 d . . . . .
 H10 H 0.1904 0.1355 0.7426 0.033 Uiso 1 1 calc R . . . .
 C11 C 0.1457(7) 0.2888(4) 0.6277(3) 0.0255(8) Uani 1 1 d . . . . .
 H11 H -0.0073 0.2574 0.6089 0.031 Uiso 1 1 calc R . . . .
 C12 C 0.8372(7) 0.1591(5) 1.0041(4) 0.0328(10) Uani 1 1 d . . . . .
 C13 C 0.6882(7) 0.0152(5) 0.9622(4) 0.0297(9) Uani 1 1 d . . . . .
 C14 C 0.7595(9) 0.2331(5) 1.1048(4) 0.0413(12) Uani 1 1 d . . . . .
 H14A H 0.8401 0.3308 1.1155 0.062 Uiso 1 1 calc GR . . . .
 H14B H 0.7859 0.1827 1.1756 0.062 Uiso 1 1 calc GR . . . .
 H14C H 0.6028 0.2335 1.0879 0.062 Uiso 1 1 calc GR . . . .
 C15 C 1.0817(8) 0.1559(6) 1.0316(5) 0.0453(13) Uani 1 1 d . . . . .
 H15A H 1.1343 0.1156 0.9644 0.068 Uiso 1 1 calc GR . . . .
 H15B H 1.1039 0.0977 1.0983 0.068 Uiso 1 1 calc GR . . . .
 H15C H 1.1630 0.2524 1.0497 0.068 Uiso 1 1 calc GR . . . .
 C16 C 0.5800(8) -0.0687(5) 1.0568(4) 0.0385(11) Uani 1 1 d . . . . .
 H16A H 0.6924 -0.0989 1.1109 0.058 Uiso 1 1 calc GR . . . .
 H16B H 0.4778 -0.1521 1.0215 0.058 Uiso 1 1 calc GR . . . .
 H16C H 0.5004 -0.0089 1.0985 0.058 Uiso 1 1 calc GR . . . .
 C17 C 0.7989(10) -0.0791(6) 0.8897(5) 0.0459(13) Uani 1 1 d . . . . .
 H17A H 0.6890 -0.1575 0.8523 0.069 Uiso 1 1 calc GR . . . .
 H17B H 0.9090 -0.1170 0.9399 0.069 Uiso 1 1 calc GR . . . .
 H17C H 0.8696 -0.0234 0.8304 0.069 Uiso 1 1 calc GR . . . .
 C18 C 0.2917(7) 0.8179(4) 0.3357(3) 0.0277(9) Uani 1 1 d . . . . .
 C19 C 0.1968(8) 0.9406(5) 0.3319(4) 0.0376(11) Uani 1 1 d . . . . .
 H19 H 0.0526 0.9352 0.2943 0.045 Uiso 1 1 calc R . . . .
 C20 C 0.3111(10) 1.0688(5) 0.3821(5) 0.0455(13) Uani 1 1 d . . . . .
 H20 H 0.2460 1.1507 0.3783 0.055 Uiso 1 1 calc R . . . .
 C21 C 0.5222(10) 1.0769(6) 0.4384(5) 0.0463(13) Uani 1 1 d . . . . .
 H21 H 0.5994 1.1643 0.4739 0.056 Uiso 1 1 calc R . . . .
 C22 C 0.6191(9) 0.9602(7) 0.4430(5) 0.0503(13) Uani 1 1 d . . . . .
 H22 H 0.7632 0.9669 0.4810 0.060 Uiso 1 1 calc R . . . .
 C23 C 0.5049(8) 0.8313(5) 0.3916(4) 0.0361(11) Uani 1 1 d . . . . .
 H23 H 0.5735 0.7509 0.3946 0.043 Uiso 1 1 calc R . . . .
 C24 C 0.2072(7) 0.6027(4) 0.1222(3) 0.0249(8) Uani 1 1 d . . . . .
 C25 C 0.3969(7) 0.5498(4) 0.1034(4) 0.0276(9) Uani 1 1 d . . . . .
 H25 H 0.4940 0.5327 0.1681 0.033 Uiso 1 1 calc R . . . .
 C26 C 0.4449(8) 0.5221(5) -0.0088(4) 0.0312(9) Uani 1 1 d . . . . .
 H26 H 0.5725 0.4854 -0.0195 0.037 Uiso 1 1 calc R . . . .
 C27 C 0.3046(8) 0.5487(5) -0.1051(4) 0.0333(10) Uani 1 1 d . . . . .
 H27 H 0.3384 0.5316 -0.1811 0.040 Uiso 1 1 calc R . . . .
 C28 C 0.1162(8) 0.6001(5) -0.0892(4) 0.0337(10) Uani 1 1 d . . . . .
 H28 H 0.0207 0.6176 -0.1544 0.040 Uiso 1 1 calc R . . . .
 C29 C 0.0668(7) 0.6260(4) 0.0225(3) 0.0271(9) Uani 1 1 d . . . . .
 H29 H -0.0636 0.6601 0.0321 0.032 Uiso 1 1 calc R . . . .
 B1 B 0.6079(8) 0.1879(5) 0.8430(4) 0.0253(10) Uani 1 1 d . . . . .


_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
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
 Si1 H1 1.0000 . ?
 Si1 C1 1.891(4) . ?
 Si1 C18 1.887(5) . ?
 Si1 C24 1.883(4) . ?
 O1 C4 1.230(5) . ?
 O2 C4 1.347(5) . ?
 O2 C5 1.467(6) . ?
 O3 C12 1.481(5) . ?
 O3 B1 1.386(6) . ?
 O4 C13 1.485(5) . ?
 O4 B1 1.360(6) . ?
 C1 H1A 1.0000 . ?
 C1 C2 1.551(5) . ?
 C1 C3 1.526(6) . ?
 C2 C3 1.517(6) . ?
 C2 C4 1.494(6) . ?
 C2 C6 1.523(5) . ?
 C3 H3A 0.9900 . ?
 C3 H3B 0.9900 . ?
 C5 H5A 0.9800 . ?
 C5 H5B 0.9800 . ?
 C5 H5C 0.9800 . ?
 C6 C7 1.421(6) . ?
 C6 C11 1.401(6) . ?
 C7 H7 0.9500 . ?
 C7 C8 1.396(5) . ?
 C8 H8 0.9500 . ?
 C8 C9 1.415(6) . ?
 C9 C10 1.403(6) . ?
 C9 B1 1.579(5) . ?
 C10 H10 0.9500 . ?
 C10 C11 1.410(5) . ?
 C11 H11 0.9500 . ?
 C12 C13 1.556(7) . ?
 C12 C14 1.527(7) . ?
 C12 C15 1.535(6) . ?
 C13 C16 1.528(6) . ?
 C13 C17 1.530(7) . ?
 C14 H14A 0.9800 . ?
 C14 H14B 0.9800 . ?
 C14 H14C 0.9800 . ?
 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 H17A 0.9800 . ?
 C17 H17B 0.9800 . ?
 C17 H17C 0.9800 . ?
 C18 C19 1.414(6) . ?
 C18 C23 1.400(6) . ?
 C19 H19 0.9500 . ?
 C19 C20 1.388(8) . ?
 C20 H20 0.9500 . ?
 C20 C21 1.396(9) . ?
 C21 H21 0.9500 . ?
 C21 C22 1.369(8) . ?
 C22 H22 0.9500 . ?
 C22 C23 1.398(8) . ?
 C23 H23 0.9500 . ?
 C24 C25 1.411(6) . ?
 C24 C29 1.423(5) . ?
 C25 H25 0.9500 . ?
 C25 C26 1.403(6) . ?
 C26 H26 0.9500 . ?
 C26 C27 1.403(6) . ?
 C27 H27 0.9500 . ?
 C27 C28 1.388(7) . ?
 C28 H28 0.9500 . ?
 C28 C29 1.397(6) . ?
 C29 H29 0.9500 . ?

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 Si1 H1 108.0 . . ?
 C18 Si1 H1 108.0 . . ?
 C18 Si1 C1 112.54(18) . . ?
 C24 Si1 H1 108.0 . . ?
 C24 Si1 C1 107.77(17) . . ?
 C24 Si1 C18 112.33(19) . . ?
 C4 O2 C5 116.3(3) . . ?
 B1 O3 C12 105.6(3) . . ?
 B1 O4 C13 106.4(3) . . ?
 Si1 C1 H1A 114.5 . . ?
 C2 C1 Si1 124.2(3) . . ?
 C2 C1 H1A 114.5 . . ?
 C3 C1 Si1 118.8(3) . . ?
 C3 C1 H1A 114.5 . . ?
 C3 C1 C2 59.1(3) . . ?
 C3 C2 C1 59.6(3) . . ?
 C3 C2 C6 117.9(3) . . ?
 C4 C2 C1 112.8(3) . . ?
 C4 C2 C3 116.3(3) . . ?
 C4 C2 C6 117.8(3) . . ?
 C6 C2 C1 119.5(3) . . ?
 C1 C3 H3A 117.6 . . ?
 C1 C3 H3B 117.6 . . ?
 C2 C3 C1 61.3(3) . . ?
 C2 C3 H3A 117.6 . . ?
 C2 C3 H3B 117.6 . . ?
 H3A C3 H3B 114.7 . . ?
 O1 C4 O2 121.8(4) . . ?
 O1 C4 C2 124.5(4) . . ?
 O2 C4 C2 113.6(3) . . ?
 O2 C5 H5A 109.5 . . ?
 O2 C5 H5B 109.5 . . ?
 O2 C5 H5C 109.5 . . ?
 H5A C5 H5B 109.5 . . ?
 H5A C5 H5C 109.5 . . ?
 H5B C5 H5C 109.5 . . ?
 C7 C6 C2 121.6(4) . . ?
 C11 C6 C2 119.3(4) . . ?
 C11 C6 C7 119.0(3) . . ?
 C6 C7 H7 120.1 . . ?
 C8 C7 C6 119.7(4) . . ?
 C8 C7 H7 120.1 . . ?
 C7 C8 H8 119.0 . . ?
 C7 C8 C9 121.9(4) . . ?
 C9 C8 H8 119.0 . . ?
 C8 C9 B1 123.3(4) . . ?
 C10 C9 C8 117.5(3) . . ?
 C10 C9 B1 119.1(4) . . ?
 C9 C10 H10 119.3 . . ?
 C9 C10 C11 121.4(4) . . ?
 C11 C10 H10 119.3 . . ?
 C6 C11 C10 120.3(4) . . ?
 C6 C11 H11 119.8 . . ?
 C10 C11 H11 119.8 . . ?
 O3 C12 C13 102.5(3) . . ?
 O3 C12 C14 106.5(3) . . ?
 O3 C12 C15 108.1(3) . . ?
 C14 C12 C13 113.9(4) . . ?
 C14 C12 C15 109.5(4) . . ?
 C15 C12 C13 115.6(4) . . ?
 O4 C13 C12 101.7(3) . . ?
 O4 C13 C16 108.7(3) . . ?
 O4 C13 C17 106.2(3) . . ?
 C16 C13 C12 115.2(4) . . ?
 C16 C13 C17 110.5(4) . . ?
 C17 C13 C12 113.6(4) . . ?
 C12 C14 H14A 109.5 . . ?
 C12 C14 H14B 109.5 . . ?
 C12 C14 H14C 109.5 . . ?
 H14A C14 H14B 109.5 . . ?
 H14A C14 H14C 109.5 . . ?
 H14B C14 H14C 109.5 . . ?
 C12 C15 H15A 109.5 . . ?
 C12 C15 H15B 109.5 . . ?
 C12 C15 H15C 109.5 . . ?
 H15A C15 H15B 109.5 . . ?
 H15A C15 H15C 109.5 . . ?
 H15B C15 H15C 109.5 . . ?
 C13 C16 H16A 109.5 . . ?
 C13 C16 H16B 109.5 . . ?
 C13 C16 H16C 109.5 . . ?
 H16A C16 H16B 109.5 . . ?
 H16A C16 H16C 109.5 . . ?
 H16B C16 H16C 109.5 . . ?
 C13 C17 H17A 109.5 . . ?
 C13 C17 H17B 109.5 . . ?
 C13 C17 H17C 109.5 . . ?
 H17A C17 H17B 109.5 . . ?
 H17A C17 H17C 109.5 . . ?
 H17B C17 H17C 109.5 . . ?
 C19 C18 Si1 119.4(3) . . ?
 C23 C18 Si1 123.1(3) . . ?
 C23 C18 C19 117.4(4) . . ?
 C18 C19 H19 119.5 . . ?
 C20 C19 C18 121.0(5) . . ?
 C20 C19 H19 119.5 . . ?
 C19 C20 H20 120.2 . . ?
 C19 C20 C21 119.7(5) . . ?
 C21 C20 H20 120.2 . . ?
 C20 C21 H21 119.6 . . ?
 C22 C21 C20 120.7(6) . . ?
 C22 C21 H21 119.6 . . ?
 C21 C22 H22 120.2 . . ?
 C21 C22 C23 119.7(5) . . ?
 C23 C22 H22 120.2 . . ?
 C18 C23 H23 119.3 . . ?
 C22 C23 C18 121.5(4) . . ?
 C22 C23 H23 119.3 . . ?
 C25 C24 Si1 125.0(3) . . ?
 C25 C24 C29 117.1(4) . . ?
 C29 C24 Si1 117.9(3) . . ?
 C24 C25 H25 119.4 . . ?
 C26 C25 C24 121.3(4) . . ?
 C26 C25 H25 119.4 . . ?
 C25 C26 H26 120.0 . . ?
 C25 C26 C27 120.0(4) . . ?
 C27 C26 H26 120.0 . . ?
 C26 C27 H27 120.0 . . ?
 C28 C27 C26 119.9(4) . . ?
 C28 C27 H27 120.0 . . ?
 C27 C28 H28 119.9 . . ?
 C27 C28 C29 120.1(4) . . ?
 C29 C28 H28 119.9 . . ?
 C24 C29 H29 119.2 . . ?
 C28 C29 C24 121.5(4) . . ?
 C28 C29 H29 119.2 . . ?
 O3 B1 C9 123.3(4) . . ?
 O4 B1 O3 114.2(3) . . ?
 O4 B1 C9 122.5(4) . . ?

_olex2_submission_special_instructions  'No special instructions were received'
