#------------------------------------------------------------------------------
#$Date: 2019-11-11 23:27:06 +0200 (Mon, 11 Nov 2019) $
#$Revision: 227440 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/28/1552807.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_1552807
loop_
_publ_author_name
'Sturtz, Benjamin W.'
'Moore, Curtis E.'
'Jenkins, Tyler S.'
'Miller, Jennifer L.'
'Momberger, Carlisle D.'
'Rheingold, Arnold L.'
'Kenney, Malcolm E.'
_publ_section_title
;
 Structural Data Showing the Existence of LDI Bonds between the Rings of
 Dimeric Cofacial Siloxysilicon Phthalocyanines.
;
_journal_issue                   2
_journal_name_full               'The journal of physical chemistry. A'
_journal_page_first              471
_journal_page_last               481
_journal_paper_doi               10.1021/acs.jpca.8b09247
_journal_volume                  123
_journal_year                    2019
_chemical_formula_sum            'C104 H70 Cl4 N16 O3 Si4'
_chemical_formula_weight         1845.92
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 99.368(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.5232(11)
_cell_length_b                   18.3430(10)
_cell_length_c                   25.6005(13)
_cell_measurement_reflns_used    6226
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      68.12
_cell_measurement_theta_min      3.41
_cell_volume                     8582.3(8)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0361
_diffrn_reflns_av_unetI/netI     0.0357
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.981
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            24328
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.981
_diffrn_reflns_theta_full        66.000
_diffrn_reflns_theta_max         68.661
_diffrn_reflns_theta_min         3.414
_exptl_absorpt_coefficient_mu    2.326
_exptl_absorpt_correction_T_max  0.900
_exptl_absorpt_correction_T_min  0.717
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.429
_exptl_crystal_description       rod
_exptl_crystal_F_000             3816
_exptl_crystal_size_max          0.220
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.070
_refine_diff_density_max         0.407
_refine_diff_density_min         -0.316
_refine_diff_density_rms         0.056
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     591
_refine_ls_number_reflns         7783
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.033
_refine_ls_R_factor_all          0.0605
_refine_ls_R_factor_gt           0.0457
_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)+(0.0860P)²+0.8900P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1220
_refine_ls_wR_factor_ref         0.1323
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6091
_reflns_number_total             7783
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            jp8b09247_si_010.cif
_cod_data_source_block           kenney10
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               1552807
_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   0.629
_shelx_estimated_absorpt_t_max   0.854
_shelxl_version_number           2013-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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
Si1 Si 0.42243(3) 0.52940(3) 0.70795(2) 0.03597(15) Uani 1 1 d . . .
Si2 Si 0.28191(3) 0.55762(3) 0.61713(2) 0.03953(15) Uani 1 1 d . . .
Cl1 Cl 0.05164(5) 0.48876(4) 0.86782(3) 0.0704(2) Uani 1 1 d . . .
Cl2 Cl 0.01427(5) 0.39644(5) 0.97455(3) 0.0750(2) Uani 1 1 d . . .
O1 O 0.34192(9) 0.52835(8) 0.66468(6) 0.0391(3) Uani 1 1 d . . .
O2 O 0.5000 0.52631(11) 0.7500 0.0379(5) Uani 1 2 d S T P
N1 N 0.47589(11) 0.69377(10) 0.67050(7) 0.0407(4) Uani 1 1 d . . .
N2 N 0.40398(10) 0.62871(10) 0.72651(7) 0.0385(4) Uani 1 1 d . . .
N3 N 0.32880(11) 0.60996(10) 0.79438(7) 0.0404(4) Uani 1 1 d . . .
N4 N 0.36950(10) 0.49565(10) 0.76177(7) 0.0388(4) Uani 1 1 d . . .
N5 N 0.37615(11) 0.36468(10) 0.74969(7) 0.0425(4) Uani 1 1 d . . .
N6 N 0.43437(10) 0.43000(10) 0.68573(7) 0.0383(4) Uani 1 1 d . . .
N7 N 0.49071(11) 0.45053(10) 0.60815(7) 0.0400(4) Uani 1 1 d . . .
N8 N 0.47323(10) 0.56388(10) 0.65318(7) 0.0377(4) Uani 1 1 d . . .
C1 C 0.43092(13) 0.69047(12) 0.70562(8) 0.0399(5) Uani 1 1 d . . .
C2 C 0.40187(13) 0.75484(13) 0.72783(9) 0.0431(5) Uani 1 1 d . . .
C3 C 0.41131(14) 0.82921(13) 0.71949(10) 0.0476(5) Uani 1 1 d . . .
H3A H 0.4414 0.8461 0.6953 0.057 Uiso 1 1 calc R U .
C4 C 0.37516(16) 0.87721(14) 0.74773(11) 0.0532(6) Uani 1 1 d . . .
H4A H 0.3806 0.9281 0.7429 0.064 Uiso 1 1 calc R U .
C5 C 0.33064(15) 0.85270(14) 0.78333(10) 0.0525(6) Uani 1 1 d . . .
H5A H 0.3069 0.8872 0.8024 0.063 Uiso 1 1 calc R U .
C6 C 0.32056(14) 0.77864(14) 0.79135(10) 0.0477(5) Uani 1 1 d . . .
H6A H 0.2899 0.7618 0.8152 0.057 Uiso 1 1 calc R U .
C7 C 0.35723(13) 0.73016(13) 0.76301(9) 0.0417(5) Uani 1 1 d . . .
C8 C 0.36053(13) 0.65106(13) 0.76222(8) 0.0405(5) Uani 1 1 d . . .
C9 C 0.33496(12) 0.53815(13) 0.79450(8) 0.0389(5) Uani 1 1 d . . .
C10 C 0.30270(13) 0.49211(13) 0.83053(9) 0.0424(5) Uani 1 1 d . . .
C11 C 0.26271(14) 0.50796(15) 0.87045(9) 0.0478(5) Uani 1 1 d . . .
H11A H 0.2517 0.5568 0.8788 0.057 Uiso 1 1 calc R U .
C12 C 0.23966(15) 0.44973(16) 0.89752(10) 0.0540(6) Uani 1 1 d . . .
H12A H 0.2123 0.4588 0.9252 0.065 Uiso 1 1 calc R U .
C13 C 0.25530(16) 0.37765(16) 0.88548(10) 0.0538(6) Uani 1 1 d . . .
H13A H 0.2385 0.3390 0.9051 0.065 Uiso 1 1 calc R U .
C14 C 0.29492(15) 0.36178(14) 0.84542(9) 0.0486(5) Uani 1 1 d . . .
H14A H 0.3053 0.3130 0.8368 0.058 Uiso 1 1 calc R U .
C15 C 0.31871(13) 0.42054(13) 0.81849(9) 0.0430(5) Uani 1 1 d . . .
C16 C 0.35906(13) 0.42385(12) 0.77464(8) 0.0403(5) Uani 1 1 d . . .
C17 C 0.40805(13) 0.36884(12) 0.70706(9) 0.0399(5) Uani 1 1 d . . .
C18 C 0.41394(13) 0.30652(12) 0.67332(9) 0.0421(5) Uani 1 1 d . . .
C19 C 0.38930(15) 0.23505(13) 0.67501(10) 0.0479(5) Uani 1 1 d . . .
H19A H 0.3668 0.2180 0.7035 0.057 Uiso 1 1 calc R U .
C20 C 0.39894(16) 0.18973(13) 0.63334(10) 0.0516(6) Uani 1 1 d . . .
H20A H 0.3827 0.1406 0.6333 0.062 Uiso 1 1 calc R U .
C21 C 0.43207(15) 0.21477(14) 0.59132(10) 0.0502(6) Uani 1 1 d . . .
H21A H 0.4384 0.1822 0.5636 0.060 Uiso 1 1 calc R U .
C22 C 0.45585(14) 0.28637(13) 0.58937(9) 0.0449(5) Uani 1 1 d . . .
H22A H 0.4777 0.3036 0.5606 0.054 Uiso 1 1 calc R U .
C23 C 0.44642(13) 0.33207(13) 0.63135(9) 0.0422(5) Uani 1 1 d . . .
C24 C 0.45948(12) 0.40928(12) 0.64037(8) 0.0391(5) Uani 1 1 d . . .
C25 C 0.49886(12) 0.52160(12) 0.61577(8) 0.0385(5) Uani 1 1 d . . .
C26 C 0.53954(13) 0.56636(13) 0.58456(9) 0.0412(5) Uani 1 1 d . . .
C27 C 0.57548(14) 0.54982(14) 0.54243(9) 0.0448(5) Uani 1 1 d . . .
H27A H 0.5744 0.5020 0.5281 0.054 Uiso 1 1 calc R U .
C28 C 0.61282(15) 0.60535(15) 0.52212(10) 0.0518(6) Uani 1 1 d . . .
H28A H 0.6383 0.5956 0.4935 0.062 Uiso 1 1 calc R U .
C29 C 0.61372(15) 0.67620(15) 0.54317(10) 0.0514(6) Uani 1 1 d . . .
H29A H 0.6409 0.7132 0.5290 0.062 Uiso 1 1 calc R U .
C30 C 0.57604(14) 0.69342(14) 0.58396(9) 0.0476(5) Uani 1 1 d . . .
H30A H 0.5756 0.7417 0.5974 0.057 Uiso 1 1 calc R U .
C31 C 0.53887(13) 0.63733(13) 0.60453(9) 0.0411(5) Uani 1 1 d . . .
C32 C 0.49452(12) 0.63476(12) 0.64636(8) 0.0396(5) Uani 1 1 d . . .
C41 C 0.20636(13) 0.59954(13) 0.64671(10) 0.0463(5) Uani 1 1 d . . .
C42 C 0.16367(16) 0.65661(16) 0.62268(14) 0.0649(8) Uani 1 1 d . . .
H42A H 0.1733 0.6761 0.5901 0.078 Uiso 1 1 calc R U .
C43 C 0.10722(19) 0.6853(2) 0.6459(2) 0.0869(12) Uani 1 1 d . . .
H43A H 0.0791 0.7249 0.6296 0.104 Uiso 1 1 calc R U .
C44 C 0.09162(18) 0.6563(2) 0.69290(18) 0.0849(12) Uani 1 1 d . . .
H44A H 0.0524 0.6756 0.7084 0.102 Uiso 1 1 calc R U .
C45 C 0.13270(16) 0.5997(2) 0.71704(13) 0.0688(9) Uani 1 1 d . . .
H45A H 0.1221 0.5798 0.7492 0.083 Uiso 1 1 calc R U .
C46 C 0.18954(14) 0.57200(15) 0.69438(10) 0.0517(6) Uani 1 1 d . . .
H46A H 0.2180 0.5332 0.7115 0.062 Uiso 1 1 calc R U .
C51 C 0.32004(13) 0.62420(13) 0.57279(9) 0.0447(5) Uani 1 1 d . . .
C52 C 0.34676(14) 0.59980(13) 0.52781(9) 0.0471(5) Uani 1 1 d . . .
H52A H 0.3412 0.5500 0.5179 0.056 Uiso 1 1 calc R U .
C53 C 0.38124(15) 0.64710(15) 0.49749(10) 0.0514(6) Uani 1 1 d . . .
H53A H 0.3992 0.6294 0.4672 0.062 Uiso 1 1 calc R U .
C54 C 0.38962(15) 0.71964(15) 0.51116(10) 0.0516(6) Uani 1 1 d . . .
H54A H 0.4134 0.7519 0.4904 0.062 Uiso 1 1 calc R U .
C55 C 0.36329(15) 0.74540(14) 0.55530(11) 0.0516(6) Uani 1 1 d . . .
H55A H 0.3688 0.7954 0.5647 0.062 Uiso 1 1 calc R U .
C56 C 0.32881(14) 0.69818(14) 0.58581(10) 0.0472(5) Uani 1 1 d . . .
H56A H 0.3109 0.7164 0.6160 0.057 Uiso 1 1 calc R U .
C61 C 0.24642(13) 0.47626(12) 0.57611(9) 0.0412(5) Uani 1 1 d . . .
C62 C 0.20103(14) 0.48334(14) 0.52750(10) 0.0485(6) Uani 1 1 d . . .
H62A H 0.1844 0.5304 0.5156 0.058 Uiso 1 1 calc R U .
C63 C 0.17941(15) 0.42308(15) 0.49583(10) 0.0507(6) Uani 1 1 d . . .
H63A H 0.1487 0.4292 0.4626 0.061 Uiso 1 1 calc R U .
C64 C 0.20273(15) 0.35423(14) 0.51291(10) 0.0496(6) Uani 1 1 d . . .
H64A H 0.1893 0.3131 0.4909 0.060 Uiso 1 1 calc R U .
C65 C 0.24553(14) 0.34512(13) 0.56189(9) 0.0457(5) Uani 1 1 d . . .
H65A H 0.2599 0.2976 0.5742 0.055 Uiso 1 1 calc R U .
C66 C 0.26762(13) 0.40559(13) 0.59313(9) 0.0438(5) Uani 1 1 d . . .
H66A H 0.2976 0.3990 0.6266 0.053 Uiso 1 1 calc R U .
C71 C -0.04509(18) 0.41025(19) 0.91299(12) 0.0669(8) Uani 1 1 d . . .
H71A H -0.0357 0.3720 0.8877 0.080 Uiso 1 1 calc R U .
H71B H -0.0965 0.4055 0.9186 0.080 Uiso 1 1 calc R U .
C72 C -0.03451(18) 0.48281(19) 0.89000(13) 0.0698(8) Uani 1 1 d . . .
H72A H -0.0373 0.5209 0.9170 0.084 Uiso 1 1 calc R U .
H72B H -0.0742 0.4919 0.8598 0.084 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'
Cl Cl 0.3639 0.7018 '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
O2 Si1 O1 177.37(10) .
O2 Si1 N8 90.54(6) .
O1 Si1 N8 90.58(8) .
O2 Si1 N4 90.74(6) .
O1 Si1 N4 88.15(8) .
N8 Si1 N4 178.66(8) .
O2 Si1 N2 92.41(9) .
O1 Si1 N2 89.97(8) .
N8 Si1 N2 89.79(8) .
N4 Si1 N2 89.78(8) .
O2 Si1 N6 91.74(9) .
O1 Si1 N6 85.88(8) .
N8 Si1 N6 90.15(8) .
N4 Si1 N6 90.19(8) .
N2 Si1 N6 175.84(8) .
O1 Si2 C41 107.69(10) .
O1 Si2 C61 107.13(10) .
C41 Si2 C61 109.71(11) .
O1 Si2 C51 113.20(10) .
C41 Si2 C51 110.98(11) .
C61 Si2 C51 108.03(10) .
Si2 O1 Si1 156.12(11) .
Si1 O2 Si1 176.07(15) 2_656
C32 N1 C1 121.5(2) .
C8 N2 C1 107.49(19) .
C8 N2 Si1 126.31(16) .
C1 N2 Si1 126.19(15) .
C9 N3 C8 121.5(2) .
C9 N4 C16 107.35(19) .
C9 N4 Si1 126.65(16) .
C16 N4 Si1 125.99(15) .
C16 N5 C17 121.6(2) .
C17 N6 C24 107.55(18) .
C17 N6 Si1 126.09(15) .
C24 N6 Si1 125.50(15) .
C24 N7 C25 121.6(2) .
C25 N8 C32 107.78(18) .
C25 N8 Si1 126.08(15) .
C32 N8 Si1 126.03(15) .
N1 C1 N2 127.5(2) .
N1 C1 C2 122.9(2) .
N2 C1 C2 109.6(2) .
C7 C2 C3 121.2(2) .
C7 C2 C1 106.6(2) .
C3 C2 C1 132.2(2) .
C4 C3 C2 117.4(2) .
C3 C4 C5 121.6(2) .
C6 C5 C4 121.2(2) .
C5 C6 C7 117.3(2) .
C6 C7 C2 121.4(2) .
C6 C7 C8 132.1(2) .
C2 C7 C8 106.5(2) .
N3 C8 N2 127.7(2) .
N3 C8 C7 122.5(2) .
N2 C8 C7 109.7(2) .
N3 C9 N4 127.7(2) .
N3 C9 C10 122.5(2) .
N4 C9 C10 109.8(2) .
C11 C10 C15 121.3(2) .
C11 C10 C9 132.2(2) .
C15 C10 C9 106.5(2) .
C12 C11 C10 117.0(2) .
C11 C12 C13 122.0(2) .
C14 C13 C12 121.0(2) .
C13 C14 C15 117.0(2) .
C14 C15 C10 121.7(2) .
C14 C15 C16 131.5(2) .
C10 C15 C16 106.7(2) .
N5 C16 N4 127.9(2) .
N5 C16 C15 122.3(2) .
N4 C16 C15 109.6(2) .
N5 C17 N6 127.6(2) .
N5 C17 C18 122.2(2) .
N6 C17 C18 110.0(2) .
C19 C18 C23 121.7(2) .
C19 C18 C17 132.0(2) .
C23 C18 C17 106.1(2) .
C20 C19 C18 117.2(2) .
C19 C20 C21 121.5(2) .
C22 C21 C20 121.3(2) .
C21 C22 C23 117.4(2) .
C18 C23 C22 121.0(2) .
C18 C23 C24 106.7(2) .
C22 C23 C24 132.1(2) .
N7 C24 N6 127.8(2) .
N7 C24 C23 122.6(2) .
N6 C24 C23 109.6(2) .
N7 C25 N8 127.9(2) .
N7 C25 C26 122.5(2) .
N8 C25 C26 109.62(19) .
C27 C26 C31 121.4(2) .
C27 C26 C25 131.7(2) .
C31 C26 C25 106.9(2) .
C28 C27 C26 117.6(2) .
C27 C28 C29 120.9(2) .
C30 C29 C28 121.6(2) .
C29 C30 C31 117.3(2) .
C30 C31 C26 121.1(2) .
C30 C31 C32 132.7(2) .
C26 C31 C32 106.2(2) .
N1 C32 N8 127.8(2) .
N1 C32 C31 122.7(2) .
N8 C32 C31 109.38(19) .
C42 C41 C46 117.7(3) .
C42 C41 Si2 122.7(2) .
C46 C41 Si2 119.56(19) .
C43 C42 C41 120.6(3) .
C42 C43 C44 120.3(3) .
C45 C44 C43 120.1(3) .
C44 C45 C46 119.6(3) .
C45 C46 C41 121.7(3) .
C52 C51 C56 117.6(2) .
C52 C51 Si2 120.45(18) .
C56 C51 Si2 121.72(19) .
C53 C52 C51 121.2(2) .
C54 C53 C52 120.3(2) .
C53 C54 C55 119.8(2) .
C54 C55 C56 120.1(2) .
C55 C56 C51 121.1(2) .
C62 C61 C66 117.5(2) .
C62 C61 Si2 122.09(18) .
C66 C61 Si2 120.33(18) .
C61 C62 C63 121.5(2) .
C64 C63 C62 119.7(2) .
C65 C64 C63 120.1(2) .
C64 C65 C66 119.9(2) .
C65 C66 C61 121.2(2) .
C72 C71 Cl2 112.1(2) .
C71 C72 Cl1 111.4(2) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Si1 O2 1.6501(6) .
Si1 O1 1.7071(16) .
Si1 N8 1.9186(19) .
Si1 N4 1.9189(19) .
Si1 N2 1.9271(19) .
Si1 N6 1.9333(19) .
Si2 O1 1.6016(16) .
Si2 C41 1.862(3) .
Si2 C61 1.881(2) .
Si2 C51 1.882(3) .
Cl1 C72 1.782(3) .
Cl2 C71 1.787(3) .
O2 Si1 1.6501(6) 2_656
N1 C32 1.320(3) .
N1 C1 1.323(3) .
N2 C8 1.375(3) .
N2 C1 1.380(3) .
N3 C9 1.322(3) .
N3 C8 1.323(3) .
N4 C9 1.376(3) .
N4 C16 1.379(3) .
N5 C16 1.324(3) .
N5 C17 1.325(3) .
N6 C17 1.372(3) .
N6 C24 1.373(3) .
N7 C24 1.320(3) .
N7 C25 1.323(3) .
N8 C25 1.376(3) .
N8 C32 1.378(3) .
C1 C2 1.451(3) .
C2 C7 1.394(3) .
C2 C3 1.396(3) .
C3 C4 1.380(4) .
C4 C5 1.399(4) .
C5 C6 1.391(4) .
C6 C7 1.392(3) .
C7 C8 1.453(3) .
C9 C10 1.449(3) .
C10 C11 1.387(3) .
C10 C15 1.392(3) .
C11 C12 1.378(4) .
C12 C13 1.399(4) .
C13 C14 1.386(4) .
C14 C15 1.389(3) .
C15 C16 1.447(3) .
C17 C18 1.448(3) .
C18 C19 1.391(3) .
C18 C23 1.395(3) .
C19 C20 1.387(4) .
C20 C21 1.400(4) .
C21 C22 1.389(4) .
C22 C23 1.396(3) .
C23 C24 1.449(3) .
C25 C26 1.441(3) .
C26 C27 1.390(3) .
C26 C31 1.399(3) .
C27 C28 1.380(4) .
C28 C29 1.406(4) .
C29 C30 1.384(4) .
C30 C31 1.388(3) .
C31 C32 1.453(3) .
C41 C42 1.393(4) .
C41 C46 1.402(4) .
C42 C43 1.388(5) .
C43 C44 1.388(6) .
C44 C45 1.372(6) .
C45 C46 1.379(4) .
C51 C52 1.399(3) .
C51 C56 1.400(3) .
C52 C53 1.387(4) .
C53 C54 1.378(4) .
C54 C55 1.385(4) .
C55 C56 1.389(4) .
C61 C62 1.390(3) .
C61 C66 1.403(3) .
C62 C63 1.391(4) .
C63 C64 1.383(4) .
C64 C65 1.380(4) .
C65 C66 1.390(3) .
C71 C72 1.481(5) .
