#------------------------------------------------------------------------------
#$Date: 2024-07-05 19:31:55 +0300 (Fri, 05 Jul 2024) $
#$Revision: 293079 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/62/7716218.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_7716218
loop_
_publ_author_name
'Liu, Chenghuan'
'Schmidtmann, Marc'
'Müller, Thomas'
_publ_section_title
;
 A Bis(silylene)silole - synthesis, properties and reactivity.
;
_journal_issue                   25
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10446
_journal_page_last               10452
_journal_paper_doi               10.1039/d4dt01112k
_journal_volume                  53
_journal_year                    2024
_chemical_absolute_configuration ad
_chemical_formula_structural
'SiC4(C6H5)2(Si(CH3)3)2(SiTe(C15H23N2))2 *O(C2H5)2'
_chemical_formula_sum            'C56 H84 N4 O Si5 Te2'
_chemical_formula_weight         1224.92
_space_group_crystal_system      orthorhombic
_space_group_IT_number           19
_space_group_name_Hall           'P 2ac 2ab'
_space_group_name_H-M_alt        'P 21 21 21'
_atom_sites_solution_hydrogens   difmap
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2019/3
_audit_update_record
;
2024-04-30 deposited with the CCDC.	2024-05-27 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.3105(6)
_cell_length_b                   15.4573(6)
_cell_length_c                   30.3266(12)
_cell_measurement_reflns_used    9648
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      74.55
_cell_measurement_theta_min      4.08
_cell_volume                     6239.5(4)
_computing_cell_refinement       'Bruker SAINT V8.40B'
_computing_data_collection       'Bruker APEX3'
_computing_data_reduction        'Bruker SAINT V8.40B'
_computing_structure_refinement  'SHELXL-2019/2 (Sheldrick, 2019)'
_computing_structure_solution    'SHELXS-2013/1 (Sheldrick, 2013)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker Photon III CPAD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0605
_diffrn_reflns_av_unetI/netI     0.0328
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            103794
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         74.489
_diffrn_reflns_theta_min         2.914
_diffrn_source                   'I\mS microfocus'
_exptl_absorpt_coefficient_mu    8.586
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.7981
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS-2016/2 (Sheldrick)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.304
_exptl_crystal_description       plate
_exptl_crystal_F_000             2520
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.030
_exptl_crystal_size_min          0.010
_refine_diff_density_max         1.089
_refine_diff_density_min         -0.300
_refine_diff_density_rms         0.081
_refine_ls_abs_structure_details
;
 Flack x determined using 5324 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.0136(15)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     633
_refine_ls_number_reflns         12768
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.056
_refine_ls_R_factor_all          0.0281
_refine_ls_R_factor_gt           0.0269
_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)+(0.0400P)²+1.1000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0653
_refine_ls_wR_factor_ref         0.0660
_reflns_Friedel_coverage         0.816
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.998
_reflns_number_gt                12347
_reflns_number_total             12768
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d4dt01112k3.cif
_cod_data_source_block           lch_1017si2te
_cod_depositor_comments
'Adding full bibliography for 7716218--7716222.cif.'
_cod_database_code               7716218
_shelx_shelxl_version_number     2019/3
_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   0.426
_shelx_estimated_absorpt_t_max   0.919
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -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
Te1 Te 0.49260(2) 0.36905(2) 0.27108(2) 0.02976(7) Uani 1 1 d . . . . .
Te2 Te 0.40426(2) 0.47060(2) 0.48825(2) 0.03074(7) Uani 1 1 d . . . . .
Si1 Si 0.61161(6) 0.46214(5) 0.38720(3) 0.01682(16) Uani 1 1 d . . . . .
Si2 Si 0.71170(7) 0.35880(5) 0.47789(3) 0.02008(17) Uani 1 1 d . . . . .
Si3 Si 0.66889(7) 0.60660(6) 0.30426(3) 0.02005(18) Uani 1 1 d . . . . .
Si4 Si 0.57454(7) 0.34204(5) 0.33913(3) 0.02012(18) Uani 1 1 d . . . . .
Si5 Si 0.47485(7) 0.53452(6) 0.42438(3) 0.02154(18) Uani 1 1 d . . . . .
N1 N 0.6828(2) 0.26807(19) 0.33692(10) 0.0256(6) Uani 1 1 d . . . . .
N2 N 0.5383(2) 0.23828(18) 0.36385(10) 0.0231(6) Uani 1 1 d . . . . .
N3 N 0.3850(2) 0.59499(19) 0.39031(10) 0.0249(6) Uani 1 1 d . . . . .
N4 N 0.5038(3) 0.65085(17) 0.42869(9) 0.0251(6) Uani 1 1 d . . . . .
C1 C 0.7115(3) 0.4366(2) 0.42976(11) 0.0198(6) Uani 1 1 d . . . . .
C2 C 0.7924(3) 0.4855(2) 0.41803(11) 0.0218(6) Uani 1 1 d . . . . .
C3 C 0.7822(3) 0.5425(2) 0.37831(11) 0.0213(6) Uani 1 1 d . . . . .
C4 C 0.6939(3) 0.5407(2) 0.35571(10) 0.0197(6) Uani 1 1 d . . . . .
C5 C 0.8909(3) 0.4835(2) 0.44172(12) 0.0285(8) Uani 1 1 d . . . . .
C6 C 0.9020(4) 0.5235(2) 0.48253(14) 0.0365(9) Uani 1 1 d . . . . .
H6 H 0.847464 0.554777 0.494964 0.044 Uiso 1 1 calc R U . . .
C7 C 0.9934(4) 0.5179(3) 0.50536(16) 0.0512(14) Uani 1 1 d . . . . .
H7 H 1.000788 0.545493 0.533158 0.061 Uiso 1 1 calc R U . . .
C8 C 1.0720(4) 0.4725(4) 0.48749(19) 0.0567(16) Uani 1 1 d . . . . .
H8 H 1.133449 0.467932 0.503257 0.068 Uiso 1 1 calc R U . . .
C9 C 1.0626(4) 0.4333(4) 0.4468(2) 0.0546(15) Uani 1 1 d . . . . .
H9 H 1.117373 0.401949 0.434648 0.065 Uiso 1 1 calc R U . . .
C10 C 0.9727(3) 0.4397(3) 0.42364(15) 0.0373(9) Uani 1 1 d . . . . .
H10 H 0.966982 0.414039 0.395283 0.045 Uiso 1 1 calc R U . . .
C11 C 0.8680(3) 0.6009(2) 0.36600(12) 0.0260(7) Uani 1 1 d . . . . .
C12 C 0.8883(3) 0.6749(3) 0.39057(14) 0.0346(9) Uani 1 1 d . . . . .
H12 H 0.852991 0.685289 0.417277 0.042 Uiso 1 1 calc R U . . .
C13 C 0.9607(4) 0.7339(3) 0.37593(18) 0.0464(12) Uani 1 1 d . . . . .
H13 H 0.973473 0.784764 0.392562 0.056 Uiso 1 1 calc R U . . .
C14 C 1.0135(3) 0.7189(3) 0.33766(18) 0.0482(12) Uani 1 1 d . . . . .
H14 H 1.061497 0.759975 0.327623 0.058 Uiso 1 1 calc R U . . .
C15 C 0.9965(3) 0.6436(3) 0.31376(16) 0.0432(10) Uani 1 1 d . . . . .
H15 H 1.033474 0.632606 0.287566 0.052 Uiso 1 1 calc R U . . .
C16 C 0.9251(3) 0.5845(3) 0.32833(14) 0.0329(9) Uani 1 1 d . . . . .
H16 H 0.915016 0.532248 0.312422 0.039 Uiso 1 1 calc R U . . .
C17 C 0.6064(3) 0.2804(2) 0.47175(12) 0.0261(7) Uani 1 1 d . . . . .
H17A H 0.542215 0.311006 0.474329 0.039 Uiso 1 1 calc R U . . .
H17B H 0.611020 0.236311 0.494901 0.039 Uiso 1 1 calc R U . . .
H17C H 0.610558 0.252489 0.442780 0.039 Uiso 1 1 calc R U . . .
C18 C 0.6930(3) 0.4167(2) 0.53157(12) 0.0285(8) Uani 1 1 d . . . . .
H18A H 0.749174 0.456462 0.536602 0.043 Uiso 1 1 calc R U . . .
H18B H 0.689965 0.374437 0.555613 0.043 Uiso 1 1 calc R U . . .
H18C H 0.630011 0.449502 0.530545 0.043 Uiso 1 1 calc R U . . .
C19 C 0.8305(3) 0.2938(2) 0.48057(12) 0.0270(7) Uani 1 1 d . . . . .
H19A H 0.844862 0.269217 0.451456 0.040 Uiso 1 1 calc R U . . .
H19B H 0.822534 0.246958 0.502051 0.040 Uiso 1 1 calc R U . . .
H19C H 0.886211 0.331303 0.489586 0.040 Uiso 1 1 calc R U . . .
C20 C 0.5312(3) 0.6157(2) 0.29511(12) 0.0249(7) Uani 1 1 d . . . . .
H20A H 0.504450 0.559370 0.285987 0.037 Uiso 1 1 calc R U . . .
H20B H 0.518080 0.658503 0.271992 0.037 Uiso 1 1 calc R U . . .
H20C H 0.498460 0.633898 0.322521 0.037 Uiso 1 1 calc R U . . .
C21 C 0.7166(3) 0.7207(2) 0.30821(13) 0.0300(8) Uani 1 1 d . . . . .
H21A H 0.689098 0.748224 0.334714 0.045 Uiso 1 1 calc R U . . .
H21B H 0.695425 0.753276 0.282080 0.045 Uiso 1 1 calc R U . . .
H21C H 0.790107 0.720230 0.309902 0.045 Uiso 1 1 calc R U . . .
C22 C 0.7261(3) 0.5544(3) 0.25423(12) 0.0299(8) Uani 1 1 d . . . . .
H22A H 0.796960 0.541539 0.259983 0.045 Uiso 1 1 calc R U . . .
H22B H 0.720832 0.593850 0.229042 0.045 Uiso 1 1 calc R U . . .
H22C H 0.690213 0.500576 0.247586 0.045 Uiso 1 1 calc R U . . .
C23 C 0.6269(3) 0.2042(2) 0.35313(11) 0.0230(7) Uani 1 1 d . . . . .
C24 C 0.6590(3) 0.1117(2) 0.35827(12) 0.0249(7) Uani 1 1 d . . . . .
C25 C 0.7093(3) 0.0857(2) 0.39599(13) 0.0299(8) Uani 1 1 d . . . . .
H25 H 0.722014 0.126183 0.418907 0.036 Uiso 1 1 calc R U . . .
C26 C 0.7410(4) 0.0005(3) 0.40036(14) 0.0363(9) Uani 1 1 d . . . . .
H26 H 0.775401 -0.017495 0.426233 0.044 Uiso 1 1 calc R U . . .
C27 C 0.7222(4) -0.0582(2) 0.36664(15) 0.0354(9) Uani 1 1 d . . . . .
H27 H 0.744840 -0.116214 0.369302 0.042 Uiso 1 1 calc R U . . .
C28 C 0.6707(3) -0.0325(3) 0.32919(14) 0.0351(8) Uani 1 1 d . . . . .
H28 H 0.657087 -0.073071 0.306436 0.042 Uiso 1 1 calc R U . . .
C29 C 0.6389(3) 0.0529(2) 0.32495(13) 0.0303(8) Uani 1 1 d . . . . .
H29 H 0.603599 0.070834 0.299304 0.036 Uiso 1 1 calc R U . . .
C30 C 0.7840(3) 0.2666(2) 0.31583(13) 0.0288(8) Uani 1 1 d . . . . .
C31 C 0.8099(4) 0.3585(3) 0.3056(2) 0.0587(16) Uani 1 1 d . . . . .
H31A H 0.816063 0.391229 0.333186 0.088 Uiso 1 1 calc R U . . .
H31B H 0.756759 0.384085 0.287427 0.088 Uiso 1 1 calc R U . . .
H31C H 0.873743 0.360572 0.289602 0.088 Uiso 1 1 calc R U . . .
C32 C 0.7787(6) 0.2155(5) 0.2738(2) 0.079(2) Uani 1 1 d . . . . .
H32A H 0.726084 0.239453 0.254809 0.118 Uiso 1 1 calc R U . . .
H32B H 0.763169 0.154983 0.280618 0.118 Uiso 1 1 calc R U . . .
H32C H 0.843555 0.218666 0.258567 0.118 Uiso 1 1 calc R U . . .
C33 C 0.8626(4) 0.2280(6) 0.3462(2) 0.076(2) Uani 1 1 d . . . . .
H33A H 0.928785 0.231920 0.332255 0.114 Uiso 1 1 calc R U . . .
H33B H 0.846374 0.167185 0.351944 0.114 Uiso 1 1 calc R U . . .
H33C H 0.863288 0.259985 0.374132 0.114 Uiso 1 1 calc R U . . .
C34 C 0.4420(3) 0.1954(2) 0.37601(12) 0.0252(7) Uani 1 1 d . . . . .
C35 C 0.3749(3) 0.2676(3) 0.39338(14) 0.0323(8) Uani 1 1 d . . . . .
H35A H 0.365691 0.311379 0.370381 0.048 Uiso 1 1 calc R U . . .
H35B H 0.406389 0.294146 0.419252 0.048 Uiso 1 1 calc R U . . .
H35C H 0.309422 0.243562 0.401684 0.048 Uiso 1 1 calc R U . . .
C36 C 0.4561(3) 0.1257(3) 0.41132(13) 0.0307(8) Uani 1 1 d . . . . .
H36A H 0.390422 0.102760 0.420017 0.046 Uiso 1 1 calc R U . . .
H36B H 0.489420 0.151002 0.437108 0.046 Uiso 1 1 calc R U . . .
H36C H 0.497599 0.078807 0.399455 0.046 Uiso 1 1 calc R U . . .
C37 C 0.3942(3) 0.1547(2) 0.33500(13) 0.0320(8) Uani 1 1 d . . . . .
H37A H 0.384612 0.199265 0.312401 0.048 Uiso 1 1 calc R U . . .
H37B H 0.329083 0.129510 0.342841 0.048 Uiso 1 1 calc R U . . .
H37C H 0.438483 0.109317 0.323524 0.048 Uiso 1 1 calc R U . . .
C38 C 0.4233(3) 0.6702(2) 0.40425(11) 0.0252(7) Uani 1 1 d . . . . .
C39 C 0.3837(3) 0.7586(2) 0.39448(12) 0.0283(8) Uani 1 1 d . . . . .
C40 C 0.4181(4) 0.8048(3) 0.35780(13) 0.0350(9) Uani 1 1 d . . . . .
H40 H 0.468738 0.780913 0.339402 0.042 Uiso 1 1 calc R U . . .
C41 C 0.3783(4) 0.8855(3) 0.34834(14) 0.0404(10) Uani 1 1 d . . . . .
H41 H 0.402195 0.917325 0.323666 0.048 Uiso 1 1 calc R U . . .
C42 C 0.3031(4) 0.9200(3) 0.37514(15) 0.0394(10) Uani 1 1 d . . . . .
H42 H 0.275419 0.975112 0.368502 0.047 Uiso 1 1 calc R U . . .
C43 C 0.2685(4) 0.8742(3) 0.41137(15) 0.0390(9) Uani 1 1 d . . . . .
H43 H 0.217151 0.897851 0.429506 0.047 Uiso 1 1 calc R U . . .
C44 C 0.3093(4) 0.7933(3) 0.42112(14) 0.0355(9) Uani 1 1 d . . . . .
H44 H 0.286135 0.761985 0.446070 0.043 Uiso 1 1 calc R U . . .
C45 C 0.2863(3) 0.5757(2) 0.36955(13) 0.0278(8) Uani 1 1 d . . . . .
C46 C 0.2848(3) 0.4786(3) 0.36186(15) 0.0376(9) Uani 1 1 d . . . . .
H46A H 0.220144 0.461840 0.349019 0.056 Uiso 1 1 calc R U . . .
H46B H 0.294262 0.448500 0.390009 0.056 Uiso 1 1 calc R U . . .
H46C H 0.339176 0.462742 0.341601 0.056 Uiso 1 1 calc R U . . .
C47 C 0.2734(3) 0.6227(3) 0.32554(14) 0.0390(9) Uani 1 1 d . . . . .
H47A H 0.328130 0.606403 0.305576 0.058 Uiso 1 1 calc R U . . .
H47B H 0.274908 0.685339 0.330481 0.058 Uiso 1 1 calc R U . . .
H47C H 0.208893 0.606465 0.312344 0.058 Uiso 1 1 calc R U . . .
C48 C 0.2007(3) 0.6006(3) 0.40109(14) 0.0347(9) Uani 1 1 d . . . . .
H48A H 0.194274 0.663750 0.402101 0.052 Uiso 1 1 calc R U . . .
H48B H 0.215562 0.578691 0.430698 0.052 Uiso 1 1 calc R U . . .
H48C H 0.137566 0.575301 0.390576 0.052 Uiso 1 1 calc R U . . .
C49 C 0.5659(3) 0.7057(2) 0.45851(12) 0.0306(8) Uani 1 1 d . . . . .
C50 C 0.6482(4) 0.6472(3) 0.47576(16) 0.0425(10) Uani 1 1 d . . . . .
H50A H 0.692852 0.680325 0.495094 0.064 Uiso 1 1 calc R U . . .
H50B H 0.686765 0.623883 0.450936 0.064 Uiso 1 1 calc R U . . .
H50C H 0.618115 0.599395 0.492421 0.064 Uiso 1 1 calc R U . . .
C51 C 0.5013(5) 0.7382(3) 0.49707(13) 0.0435(10) Uani 1 1 d . . . . .
H51A H 0.468131 0.689002 0.511324 0.065 Uiso 1 1 calc R U . . .
H51B H 0.450305 0.778480 0.485957 0.065 Uiso 1 1 calc R U . . .
H51C H 0.544100 0.767991 0.518535 0.065 Uiso 1 1 calc R U . . .
C52 C 0.6128(4) 0.7812(3) 0.43351(15) 0.0379(9) Uani 1 1 d . . . . .
H52A H 0.559586 0.819702 0.422849 0.057 Uiso 1 1 calc R U . . .
H52B H 0.651242 0.759012 0.408376 0.057 Uiso 1 1 calc R U . . .
H52C H 0.657611 0.813279 0.453229 0.057 Uiso 1 1 calc R U . . .
O1 O 0.9647(6) 0.9304(7) 0.2661(3) 0.132(3) Uani 1 1 d . . . . .
C53 C 0.8752(7) 0.9013(7) 0.2473(4) 0.098(3) Uani 1 1 d . . . . .
H53A H 0.838279 0.951537 0.235120 0.118 Uiso 1 1 calc R U . . .
H53B H 0.832945 0.875117 0.270589 0.118 Uiso 1 1 calc R U . . .
C54 C 0.8903(9) 0.8384(8) 0.2125(5) 0.132(4) Uani 1 1 d . . . . .
H54A H 0.917618 0.867420 0.186395 0.197 Uiso 1 1 calc R U . . .
H54B H 0.825990 0.811305 0.205084 0.197 Uiso 1 1 calc R U . . .
H54C H 0.937645 0.794034 0.222565 0.197 Uiso 1 1 calc R U . . .
C55 C 0.9655(9) 0.9859(9) 0.2987(5) 0.137(5) Uani 1 1 d . . . . .
H55A H 0.912336 0.966322 0.319238 0.165 Uiso 1 1 calc R U . . .
H55B H 0.941477 1.041110 0.285991 0.165 Uiso 1 1 calc R U . . .
C56 C 1.0466(12) 1.0076(18) 0.3251(6) 0.239(13) Uani 1 1 d . . . . .
H56A H 1.104318 0.971342 0.317302 0.359 Uiso 1 1 calc R U . . .
H56B H 1.029063 0.998219 0.356109 0.359 Uiso 1 1 calc R U . . .
H56C H 1.063745 1.068596 0.320525 0.359 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 0.0181 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'
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'
Si Si 0.2541 0.3302 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Te Te -0.1759 6.3531 '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
C4 Si1 C1 94.08(15) . . ?
C4 Si1 Si4 107.89(10) . . ?
C1 Si1 Si4 113.26(11) . . ?
C4 Si1 Si5 111.98(11) . . ?
C1 Si1 Si5 107.91(11) . . ?
Si4 Si1 Si5 118.98(5) . . ?
C17 Si2 C18 107.32(18) . . ?
C17 Si2 C19 106.87(17) . . ?
C18 Si2 C19 109.30(17) . . ?
C17 Si2 C1 109.61(15) . . ?
C18 Si2 C1 111.51(16) . . ?
C19 Si2 C1 112.02(16) . . ?
C20 Si3 C21 105.78(17) . . ?
C20 Si3 C22 108.12(18) . . ?
C21 Si3 C22 108.53(19) . . ?
C20 Si3 C4 109.70(16) . . ?
C21 Si3 C4 113.16(16) . . ?
C22 Si3 C4 111.29(16) . . ?
N2 Si4 N1 71.20(14) . . ?
N2 Si4 C23 35.70(14) . . ?
N1 Si4 C23 35.68(14) . . ?
N2 Si4 Te1 112.87(10) . . ?
N1 Si4 Te1 115.96(11) . . ?
C23 Si4 Te1 117.83(9) . . ?
N2 Si4 Si1 118.66(10) . . ?
N1 Si4 Si1 109.87(11) . . ?
C23 Si4 Si1 122.95(9) . . ?
Te1 Si4 Si1 119.00(4) . . ?
N3 Si5 N4 71.30(14) . . ?
N3 Si5 C38 35.75(14) . . ?
N4 Si5 C38 35.72(14) . . ?
N3 Si5 Te2 114.48(11) . . ?
N4 Si5 Te2 115.59(10) . . ?
C38 Si5 Te2 118.78(9) . . ?
N3 Si5 Si1 117.62(11) . . ?
N4 Si5 Si1 109.10(11) . . ?
C38 Si5 Si1 121.70(10) . . ?
Te2 Si5 Si1 119.16(4) . . ?
C23 N1 C30 130.8(3) . . ?
C23 N1 Si4 90.5(2) . . ?
C30 N1 Si4 137.1(2) . . ?
C23 N2 C34 130.3(3) . . ?
C23 N2 Si4 90.8(2) . . ?
C34 N2 Si4 135.7(2) . . ?
C38 N3 C45 130.1(3) . . ?
C38 N3 Si5 91.0(2) . . ?
C45 N3 Si5 135.4(2) . . ?
C38 N4 C49 130.8(3) . . ?
C38 N4 Si5 90.7(2) . . ?
C49 N4 Si5 135.6(2) . . ?
C2 C1 Si2 123.6(3) . . ?
C2 C1 Si1 105.1(2) . . ?
Si2 C1 Si1 131.24(19) . . ?
C1 C2 C5 123.8(3) . . ?
C1 C2 C3 117.7(3) . . ?
C5 C2 C3 118.5(3) . . ?
C4 C3 C2 118.1(3) . . ?
C4 C3 C11 122.9(3) . . ?
C2 C3 C11 119.0(3) . . ?
C3 C4 Si3 123.8(2) . . ?
C3 C4 Si1 105.0(2) . . ?
Si3 C4 Si1 131.22(19) . . ?
C6 C5 C10 118.9(4) . . ?
C6 C5 C2 120.7(4) . . ?
C10 C5 C2 120.4(4) . . ?
C5 C6 C7 120.2(5) . . ?
C5 C6 H6 119.9 . . ?
C7 C6 H6 119.9 . . ?
C8 C7 C6 119.9(5) . . ?
C8 C7 H7 120.1 . . ?
C6 C7 H7 120.1 . . ?
C7 C8 C9 120.5(4) . . ?
C7 C8 H8 119.7 . . ?
C9 C8 H8 119.7 . . ?
C8 C9 C10 119.9(5) . . ?
C8 C9 H9 120.1 . . ?
C10 C9 H9 120.1 . . ?
C9 C10 C5 120.5(5) . . ?
C9 C10 H10 119.8 . . ?
C5 C10 H10 119.8 . . ?
C12 C11 C16 118.8(4) . . ?
C12 C11 C3 120.5(4) . . ?
C16 C11 C3 120.5(3) . . ?
C11 C12 C13 120.0(4) . . ?
C11 C12 H12 120.0 . . ?
C13 C12 H12 120.0 . . ?
C14 C13 C12 120.7(5) . . ?
C14 C13 H13 119.7 . . ?
C12 C13 H13 119.7 . . ?
C13 C14 C15 119.8(4) . . ?
C13 C14 H14 120.1 . . ?
C15 C14 H14 120.1 . . ?
C14 C15 C16 119.8(5) . . ?
C14 C15 H15 120.1 . . ?
C16 C15 H15 120.1 . . ?
C15 C16 C11 120.8(4) . . ?
C15 C16 H16 119.6 . . ?
C11 C16 H16 119.6 . . ?
Si2 C17 H17A 109.5 . . ?
Si2 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
Si2 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
Si2 C18 H18A 109.5 . . ?
Si2 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
Si2 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
Si2 C19 H19A 109.5 . . ?
Si2 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
Si2 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
Si3 C20 H20A 109.5 . . ?
Si3 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
Si3 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
Si3 C21 H21A 109.5 . . ?
Si3 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
Si3 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
Si3 C22 H22A 109.5 . . ?
Si3 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
Si3 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
N1 C23 N2 107.0(3) . . ?
N1 C23 C24 125.8(3) . . ?
N2 C23 C24 127.2(3) . . ?
N1 C23 Si4 53.81(18) . . ?
N2 C23 Si4 53.54(17) . . ?
C24 C23 Si4 175.0(2) . . ?
C25 C24 C29 120.4(3) . . ?
C25 C24 C23 120.0(3) . . ?
C29 C24 C23 119.6(3) . . ?
C24 C25 C26 120.1(4) . . ?
C24 C25 H25 120.0 . . ?
C26 C25 H25 120.0 . . ?
C27 C26 C25 119.6(4) . . ?
C27 C26 H26 120.2 . . ?
C25 C26 H26 120.2 . . ?
C28 C27 C26 120.4(4) . . ?
C28 C27 H27 119.8 . . ?
C26 C27 H27 119.8 . . ?
C27 C28 C29 119.9(4) . . ?
C27 C28 H28 120.1 . . ?
C29 C28 H28 120.1 . . ?
C24 C29 C28 119.8(4) . . ?
C24 C29 H29 120.1 . . ?
C28 C29 H29 120.1 . . ?
N1 C30 C31 106.4(3) . . ?
N1 C30 C32 109.3(4) . . ?
C31 C30 C32 109.6(5) . . ?
N1 C30 C33 111.6(4) . . ?
C31 C30 C33 109.9(5) . . ?
C32 C30 C33 109.9(6) . . ?
C30 C31 H31A 109.5 . . ?
C30 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C30 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C30 C32 H32A 109.5 . . ?
C30 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C30 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C30 C33 H33A 109.5 . . ?
C30 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C30 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
N2 C34 C35 105.4(3) . . ?
N2 C34 C36 112.3(3) . . ?
C35 C34 C36 110.2(3) . . ?
N2 C34 C37 109.8(3) . . ?
C35 C34 C37 109.8(3) . . ?
C36 C34 C37 109.3(3) . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C34 C37 H37A 109.5 . . ?
C34 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
C34 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
N4 C38 N3 106.6(3) . . ?
N4 C38 C39 126.7(3) . . ?
N3 C38 C39 126.7(3) . . ?
N4 C38 Si5 53.63(17) . . ?
N3 C38 Si5 53.29(17) . . ?
C39 C38 Si5 175.0(3) . . ?
C44 C39 C40 119.9(3) . . ?
C44 C39 C38 119.4(3) . . ?
C40 C39 C38 120.6(3) . . ?
C41 C40 C39 120.0(4) . . ?
C41 C40 H40 120.0 . . ?
C39 C40 H40 120.0 . . ?
C40 C41 C42 119.8(4) . . ?
C40 C41 H41 120.1 . . ?
C42 C41 H41 120.1 . . ?
C43 C42 C41 120.4(4) . . ?
C43 C42 H42 119.8 . . ?
C41 C42 H42 119.8 . . ?
C42 C43 C44 119.7(4) . . ?
C42 C43 H43 120.1 . . ?
C44 C43 H43 120.1 . . ?
C39 C44 C43 120.1(4) . . ?
C39 C44 H44 119.9 . . ?
C43 C44 H44 119.9 . . ?
N3 C45 C46 105.9(3) . . ?
N3 C45 C47 111.9(3) . . ?
C46 C45 C47 109.5(4) . . ?
N3 C45 C48 110.0(3) . . ?
C46 C45 C48 109.5(3) . . ?
C47 C45 C48 109.9(3) . . ?
C45 C46 H46A 109.5 . . ?
C45 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
C45 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
C45 C47 H47A 109.5 . . ?
C45 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C45 C47 H47C 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
C45 C48 H48A 109.5 . . ?
C45 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C45 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
N4 C49 C50 105.7(3) . . ?
N4 C49 C52 111.1(3) . . ?
C50 C49 C52 109.4(4) . . ?
N4 C49 C51 109.7(4) . . ?
C50 C49 C51 109.7(4) . . ?
C52 C49 C51 110.9(3) . . ?
C49 C50 H50A 109.5 . . ?
C49 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
C49 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
C49 C51 H51A 109.5 . . ?
C49 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
C49 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
C49 C52 H52A 109.5 . . ?
C49 C52 H52B 109.5 . . ?
H52A C52 H52B 109.5 . . ?
C49 C52 H52C 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
C55 O1 C53 121.8(9) . . ?
O1 C53 C54 113.3(8) . . ?
O1 C53 H53A 108.9 . . ?
C54 C53 H53A 108.9 . . ?
O1 C53 H53B 108.9 . . ?
C54 C53 H53B 108.9 . . ?
H53A C53 H53B 107.7 . . ?
C53 C54 H54A 109.5 . . ?
C53 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C53 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
O1 C55 C56 127.0(13) . . ?
O1 C55 H55A 105.6 . . ?
C56 C55 H55A 105.6 . . ?
O1 C55 H55B 105.6 . . ?
C56 C55 H55B 105.6 . . ?
H55A C55 H55B 106.1 . . ?
C55 C56 H56A 109.5 . . ?
C55 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
C55 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 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
Te1 Si4 2.3714(9) . ?
Te2 Si5 2.3686(9) . ?
Si1 C4 1.894(3) . ?
Si1 C1 1.895(3) . ?
Si1 Si4 2.4114(12) . ?
Si1 Si5 2.4161(12) . ?
Si2 C17 1.863(4) . ?
Si2 C18 1.874(4) . ?
Si2 C19 1.875(4) . ?
Si2 C1 1.891(3) . ?
Si3 C20 1.859(4) . ?
Si3 C21 1.879(4) . ?
Si3 C22 1.879(4) . ?
Si3 C4 1.893(3) . ?
Si4 N2 1.835(3) . ?
Si4 N1 1.841(3) . ?
Si4 C23 2.281(4) . ?
Si5 N3 1.836(3) . ?
Si5 N4 1.844(3) . ?
Si5 C38 2.290(4) . ?
N1 C23 1.331(5) . ?
N1 C30 1.491(5) . ?
N2 C23 1.331(5) . ?
N2 C34 1.490(5) . ?
N3 C38 1.338(5) . ?
N3 C45 1.487(5) . ?
N4 C38 1.337(5) . ?
N4 C49 1.490(5) . ?
C1 C2 1.362(5) . ?
C2 C5 1.496(5) . ?
C2 C3 1.499(4) . ?
C3 C4 1.361(5) . ?
C3 C11 1.503(5) . ?
C5 C6 1.391(6) . ?
C5 C10 1.394(6) . ?
C6 C7 1.402(6) . ?
C6 H6 0.9500 . ?
C7 C8 1.372(9) . ?
C7 H7 0.9500 . ?
C8 C9 1.380(9) . ?
C8 H8 0.9500 . ?
C9 C10 1.391(6) . ?
C9 H9 0.9500 . ?
C10 H10 0.9500 . ?
C11 C12 1.391(6) . ?
C11 C16 1.395(6) . ?
C12 C13 1.399(6) . ?
C12 H12 0.9500 . ?
C13 C14 1.377(8) . ?
C13 H13 0.9500 . ?
C14 C15 1.390(8) . ?
C14 H14 0.9500 . ?
C15 C16 1.391(6) . ?
C15 H15 0.9500 . ?
C16 H16 0.9500 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
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 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 C24 1.500(5) . ?
C24 C25 1.385(5) . ?
C24 C29 1.385(5) . ?
C25 C26 1.390(6) . ?
C25 H25 0.9500 . ?
C26 C27 1.390(6) . ?
C26 H26 0.9500 . ?
C27 C28 1.385(6) . ?
C27 H27 0.9500 . ?
C28 C29 1.393(6) . ?
C28 H28 0.9500 . ?
C29 H29 0.9500 . ?
C30 C31 1.494(6) . ?
C30 C32 1.501(7) . ?
C30 C33 1.517(7) . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 C35 1.522(6) . ?
C34 C36 1.531(5) . ?
C34 C37 1.532(5) . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 C39 1.494(5) . ?
C39 C44 1.386(6) . ?
C39 C40 1.399(5) . ?
C40 C41 1.385(6) . ?
C40 H40 0.9500 . ?
C41 C42 1.395(7) . ?
C41 H41 0.9500 . ?
C42 C43 1.385(6) . ?
C42 H42 0.9500 . ?
C43 C44 1.395(6) . ?
C43 H43 0.9500 . ?
C44 H44 0.9500 . ?
C45 C46 1.520(6) . ?
C45 C47 1.530(5) . ?
C45 C48 1.537(5) . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C46 H46C 0.9800 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C47 H47C 0.9800 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
C49 C50 1.514(6) . ?
C49 C52 1.525(6) . ?
C49 C51 1.536(6) . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C51 H51A 0.9800 . ?
C51 H51B 0.9800 . ?
C51 H51C 0.9800 . ?
C52 H52A 0.9800 . ?
C52 H52B 0.9800 . ?
C52 H52C 0.9800 . ?
O1 C55 1.309(15) . ?
O1 C53 1.396(13) . ?
C53 C54 1.448(16) . ?
C53 H53A 0.9900 . ?
C53 H53B 0.9900 . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
C55 C56 1.38(2) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C56 H56A 0.9800 . ?
C56 H56B 0.9800 . ?
C56 H56C 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
N2 Si4 N1 C23 4.7(2) . . . . ?
Te1 Si4 N1 C23 -102.2(2) . . . . ?
Si1 Si4 N1 C23 119.23(19) . . . . ?
N2 Si4 N1 C30 170.1(4) . . . . ?
C23 Si4 N1 C30 165.5(5) . . . . ?
Te1 Si4 N1 C30 63.2(4) . . . . ?
Si1 Si4 N1 C30 -75.3(4) . . . . ?
N1 Si4 N2 C23 -4.7(2) . . . . ?
Te1 Si4 N2 C23 106.33(19) . . . . ?
Si1 Si4 N2 C23 -107.55(19) . . . . ?
N1 Si4 N2 C34 -164.7(4) . . . . ?
C23 Si4 N2 C34 -160.1(4) . . . . ?
Te1 Si4 N2 C34 -53.7(3) . . . . ?
Si1 Si4 N2 C34 92.4(3) . . . . ?
N4 Si5 N3 C38 -4.5(2) . . . . ?
Te2 Si5 N3 C38 105.8(2) . . . . ?
Si1 Si5 N3 C38 -106.8(2) . . . . ?
N4 Si5 N3 C45 -163.5(4) . . . . ?
C38 Si5 N3 C45 -159.1(5) . . . . ?
Te2 Si5 N3 C45 -53.2(4) . . . . ?
Si1 Si5 N3 C45 94.2(3) . . . . ?
N3 Si5 N4 C38 4.5(2) . . . . ?
Te2 Si5 N4 C38 -104.37(19) . . . . ?
Si1 Si5 N4 C38 118.10(19) . . . . ?
N3 Si5 N4 C49 165.5(4) . . . . ?
C38 Si5 N4 C49 161.0(5) . . . . ?
Te2 Si5 N4 C49 56.6(4) . . . . ?
Si1 Si5 N4 C49 -80.9(4) . . . . ?
C17 Si2 C1 C2 -161.4(3) . . . . ?
C18 Si2 C1 C2 79.9(3) . . . . ?
C19 Si2 C1 C2 -43.0(3) . . . . ?
C17 Si2 C1 Si1 15.7(3) . . . . ?
C18 Si2 C1 Si1 -103.0(3) . . . . ?
C19 Si2 C1 Si1 134.2(2) . . . . ?
C4 Si1 C1 C2 0.2(3) . . . . ?
Si4 Si1 C1 C2 111.7(2) . . . . ?
Si5 Si1 C1 C2 -114.4(2) . . . . ?
C4 Si1 C1 Si2 -177.3(2) . . . . ?
Si4 Si1 C1 Si2 -65.8(3) . . . . ?
Si5 Si1 C1 Si2 68.0(2) . . . . ?
Si2 C1 C2 C5 0.1(5) . . . . ?
Si1 C1 C2 C5 -177.7(3) . . . . ?
Si2 C1 C2 C3 178.3(2) . . . . ?
Si1 C1 C2 C3 0.5(4) . . . . ?
C1 C2 C3 C4 -1.5(5) . . . . ?
C5 C2 C3 C4 176.9(3) . . . . ?
C1 C2 C3 C11 176.6(3) . . . . ?
C5 C2 C3 C11 -5.0(5) . . . . ?
C2 C3 C4 Si3 -178.7(2) . . . . ?
C11 C3 C4 Si3 3.2(5) . . . . ?
C2 C3 C4 Si1 1.5(4) . . . . ?
C11 C3 C4 Si1 -176.5(3) . . . . ?
C20 Si3 C4 C3 -160.5(3) . . . . ?
C21 Si3 C4 C3 -42.7(3) . . . . ?
C22 Si3 C4 C3 79.9(3) . . . . ?
C20 Si3 C4 Si1 19.2(3) . . . . ?
C21 Si3 C4 Si1 137.0(2) . . . . ?
C22 Si3 C4 Si1 -100.4(3) . . . . ?
C1 Si1 C4 C3 -1.0(2) . . . . ?
Si4 Si1 C4 C3 -117.0(2) . . . . ?
Si5 Si1 C4 C3 110.2(2) . . . . ?
C1 Si1 C4 Si3 179.3(2) . . . . ?
Si4 Si1 C4 Si3 63.2(2) . . . . ?
Si5 Si1 C4 Si3 -69.5(2) . . . . ?
C1 C2 C5 C6 -74.9(5) . . . . ?
C3 C2 C5 C6 106.9(4) . . . . ?
C1 C2 C5 C10 103.6(4) . . . . ?
C3 C2 C5 C10 -74.6(4) . . . . ?
C10 C5 C6 C7 -1.5(5) . . . . ?
C2 C5 C6 C7 177.0(3) . . . . ?
C5 C6 C7 C8 -0.3(6) . . . . ?
C6 C7 C8 C9 1.0(6) . . . . ?
C7 C8 C9 C10 0.0(7) . . . . ?
C8 C9 C10 C5 -1.7(6) . . . . ?
C6 C5 C10 C9 2.5(6) . . . . ?
C2 C5 C10 C9 -176.0(4) . . . . ?
C4 C3 C11 C12 104.2(4) . . . . ?
C2 C3 C11 C12 -73.8(4) . . . . ?
C4 C3 C11 C16 -72.1(5) . . . . ?
C2 C3 C11 C16 109.9(4) . . . . ?
C16 C11 C12 C13 3.8(6) . . . . ?
C3 C11 C12 C13 -172.6(4) . . . . ?
C11 C12 C13 C14 -1.0(7) . . . . ?
C12 C13 C14 C15 -1.4(7) . . . . ?
C13 C14 C15 C16 0.9(7) . . . . ?
C14 C15 C16 C11 1.9(6) . . . . ?
C12 C11 C16 C15 -4.3(6) . . . . ?
C3 C11 C16 C15 172.2(3) . . . . ?
C30 N1 C23 N2 -173.3(3) . . . . ?
Si4 N1 C23 N2 -6.4(3) . . . . ?
C30 N1 C23 C24 6.9(6) . . . . ?
Si4 N1 C23 C24 173.9(3) . . . . ?
C30 N1 C23 Si4 -167.0(4) . . . . ?
C34 N2 C23 N1 168.2(3) . . . . ?
Si4 N2 C23 N1 6.4(3) . . . . ?
C34 N2 C23 C24 -12.0(6) . . . . ?
Si4 N2 C23 C24 -173.9(3) . . . . ?
C34 N2 C23 Si4 161.8(4) . . . . ?
N1 C23 C24 C25 86.5(5) . . . . ?
N2 C23 C24 C25 -93.2(5) . . . . ?
N1 C23 C24 C29 -92.9(5) . . . . ?
N2 C23 C24 C29 87.4(5) . . . . ?
C29 C24 C25 C26 0.8(6) . . . . ?
C23 C24 C25 C26 -178.6(4) . . . . ?
C24 C25 C26 C27 0.1(7) . . . . ?
C25 C26 C27 C28 -1.1(7) . . . . ?
C26 C27 C28 C29 1.0(7) . . . . ?
C25 C24 C29 C28 -0.9(6) . . . . ?
C23 C24 C29 C28 178.5(4) . . . . ?
C27 C28 C29 C24 0.0(7) . . . . ?
C23 N1 C30 C31 -178.2(4) . . . . ?
Si4 N1 C30 C31 21.2(6) . . . . ?
C23 N1 C30 C32 63.5(6) . . . . ?
Si4 N1 C30 C32 -97.1(5) . . . . ?
C23 N1 C30 C33 -58.3(6) . . . . ?
Si4 N1 C30 C33 141.1(5) . . . . ?
C23 N2 C34 C35 169.1(3) . . . . ?
Si4 N2 C34 C35 -37.5(4) . . . . ?
C23 N2 C34 C36 49.0(5) . . . . ?
Si4 N2 C34 C36 -157.5(3) . . . . ?
C23 N2 C34 C37 -72.8(5) . . . . ?
Si4 N2 C34 C37 80.7(4) . . . . ?
C49 N4 C38 N3 -168.5(4) . . . . ?
Si5 N4 C38 N3 -6.1(3) . . . . ?
C49 N4 C38 C39 11.4(6) . . . . ?
Si5 N4 C38 C39 173.8(3) . . . . ?
C49 N4 C38 Si5 -162.5(4) . . . . ?
C45 N3 C38 N4 166.9(3) . . . . ?
Si5 N3 C38 N4 6.1(3) . . . . ?
C45 N3 C38 C39 -13.0(6) . . . . ?
Si5 N3 C38 C39 -173.8(3) . . . . ?
C45 N3 C38 Si5 160.8(4) . . . . ?
N4 C38 C39 C44 -93.5(5) . . . . ?
N3 C38 C39 C44 86.4(5) . . . . ?
N4 C38 C39 C40 89.0(5) . . . . ?
N3 C38 C39 C40 -91.1(5) . . . . ?
C44 C39 C40 C41 0.4(7) . . . . ?
C38 C39 C40 C41 177.9(4) . . . . ?
C39 C40 C41 C42 -0.8(7) . . . . ?
C40 C41 C42 C43 0.5(8) . . . . ?
C41 C42 C43 C44 0.1(8) . . . . ?
C40 C39 C44 C43 0.2(7) . . . . ?
C38 C39 C44 C43 -177.3(4) . . . . ?
C42 C43 C44 C39 -0.5(7) . . . . ?
C38 N3 C45 C46 -178.9(4) . . . . ?
Si5 N3 C45 C46 -26.7(5) . . . . ?
C38 N3 C45 C47 61.8(5) . . . . ?
Si5 N3 C45 C47 -146.0(3) . . . . ?
C38 N3 C45 C48 -60.7(5) . . . . ?
Si5 N3 C45 C48 91.5(4) . . . . ?
C38 N4 C49 C50 -178.5(4) . . . . ?
Si5 N4 C49 C50 27.0(5) . . . . ?
C38 N4 C49 C52 -59.9(5) . . . . ?
Si5 N4 C49 C52 145.6(3) . . . . ?
C38 N4 C49 C51 63.2(5) . . . . ?
Si5 N4 C49 C51 -91.3(4) . . . . ?
C55 O1 C53 C54 -178.4(12) . . . . ?
C53 O1 C55 C56 167.5(18) . . . . ?
