#------------------------------------------------------------------------------
#$Date: 2016-03-25 17:00:32 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179999 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/93/7029361.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_7029361
loop_
_publ_author_name
'Liu, Peng'
'Chen, Hongxia'
'Zhang, Yong'
'Xue, Mingqiang'
'Yao, Yingming'
'Shen, Qi'
_publ_section_title
;
 Synthesis of γ-amidine-functionalized dianionic β-diketiminato
 lanthanide amides and trianionic β-diketiminato Na/Sm heterobimetallic
 complexes and their reactivity in polymerization of l-lactide.
;
_journal_issue                   14
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5586
_journal_page_last               5594
_journal_paper_doi               10.1039/c3dt52706a
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety         'C48 H80 N5 Si2 Yb, 0.5(C6 H14)'
_chemical_formula_sum            'C51 H87 N5 Si2 Yb'
_chemical_formula_weight         999.48
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                99.150(2)
_cell_angle_beta                 101.425(2)
_cell_angle_gamma                92.695(2)
_cell_formula_units_Z            2
_cell_length_a                   11.4354(3)
_cell_length_b                   12.4814(3)
_cell_length_c                   19.2857(5)
_cell_measurement_reflns_used    12511
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      29.4346
_cell_measurement_theta_min      3.1490
_cell_volume                     2654.98(12)
_computing_cell_refinement       'CrysAlisPro, Agilent Technologies'
_computing_data_collection       'CrysAlisPro, Agilent Technologies'
_computing_data_reduction        'CrysAlisPro, Agilent Technologies'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      223(2)
_diffrn_detector_area_resol_mean 10.4692
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Xcalibur, Atlas, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0625
_diffrn_reflns_av_sigmaI/netI    0.0603
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            25731
_diffrn_reflns_theta_full        25.50
_diffrn_reflns_theta_max         25.50
_diffrn_reflns_theta_min         3.16
_exptl_absorpt_coefficient_mu    1.842
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.25144
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.250
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       chip
_exptl_crystal_F_000             1052
_exptl_crystal_size_max          0.80
_exptl_crystal_size_mid          0.60
_exptl_crystal_size_min          0.20
_refine_diff_density_max         2.144
_refine_diff_density_min         -1.142
_refine_diff_density_rms         0.104
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.041
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     494
_refine_ls_number_reflns         9854
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.043
_refine_ls_R_factor_all          0.0416
_refine_ls_R_factor_gt           0.0374
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0418P)²+2.2078P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0878
_refine_ls_wR_factor_ref         0.0904
_reflns_number_gt                9090
_reflns_number_total             9854
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3dt52706a.txt
_cod_data_source_block           complex2
_cod_original_cell_volume        2654.97(13)
_cod_database_code               7029361
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Yb1 Yb 0.729661(12) 0.831188(11) 0.744614(7) 0.02086(7) Uani 1 1 d .
Si1 Si 0.57611(11) 1.04151(10) 0.80774(7) 0.0393(3) Uani 1 1 d .
Si2 Si 0.64303(10) 0.87565(9) 0.90143(6) 0.0320(2) Uani 1 1 d .
N1 N 0.8401(3) 0.9244(2) 0.69119(15) 0.0228(6) Uani 1 1 d .
N2 N 0.8316(2) 0.6852(2) 0.73759(15) 0.0210(6) Uani 1 1 d .
N3 N 0.6261(2) 0.7489(2) 0.63167(15) 0.0229(6) Uani 1 1 d .
N4 N 0.6684(3) 0.7493(3) 0.51801(16) 0.0291(7) Uani 1 1 d D
H4 H 0.5948(14) 0.752(3) 0.4988(19) 0.031(11) Uiso 1 1 d D
N5 N 0.6441(3) 0.9261(2) 0.82365(16) 0.0275(7) Uani 1 1 d .
C1 C 0.9983(3) 0.8807(3) 0.6254(2) 0.0311(9) Uani 1 1 d .
H1A H 1.0377 0.9509 0.6404 0.037 Uiso 1 1 calc R
H1B H 1.0296 0.8279 0.5953 0.037 Uiso 1 1 calc R
C2 C 0.8975(3) 0.8561(3) 0.64705(18) 0.0216(7) Uani 1 1 d .
C3 C 0.8348(3) 0.7412(3) 0.61904(18) 0.0207(7) Uani 1 1 d .
H3 H 0.8690 0.7123 0.5772 0.025 Uiso 1 1 calc R
C4 C 0.8575(3) 0.6568(3) 0.66996(19) 0.0237(8) Uani 1 1 d .
C5 C 0.9006(4) 0.5643(3) 0.6444(2) 0.0336(9) Uani 1 1 d .
H5A H 0.9163 0.5105 0.6733 0.040 Uiso 1 1 calc R
H5B H 0.9151 0.5530 0.5976 0.040 Uiso 1 1 calc R
C6 C 0.8758(3) 1.0378(3) 0.70535(19) 0.0235(7) Uani 1 1 d .
C7 C 0.9379(3) 1.0876(3) 0.7746(2) 0.0293(8) Uani 1 1 d .
C8 C 0.9606(4) 1.2001(3) 0.7897(2) 0.0399(10) Uani 1 1 d .
H8 H 1.0000 1.2335 0.8361 0.048 Uiso 1 1 calc R
C9 C 0.9263(4) 1.2642(3) 0.7379(2) 0.0427(11) Uani 1 1 d .
H9 H 0.9417 1.3403 0.7491 0.051 Uiso 1 1 calc R
C10 C 0.8695(4) 1.2148(3) 0.6696(2) 0.0340(9) Uani 1 1 d .
H10 H 0.8478 1.2580 0.6341 0.041 Uiso 1 1 calc R
C11 C 0.8434(3) 1.1027(3) 0.65203(19) 0.0260(8) Uani 1 1 d .
C12 C 0.9877(5) 1.0197(5) 0.8306(3) 0.0581(8) Uani 1 1 d .
H12 H 0.9402 0.9484 0.8180 0.070 Uiso 1 1 calc R
C13 C 1.1152(4) 0.9987(5) 0.8254(3) 0.0581(8) Uani 1 1 d .
H13A H 1.1162 0.9592 0.7780 0.087 Uiso 1 1 calc R
H13B H 1.1482 0.9559 0.8613 0.087 Uiso 1 1 calc R
H13C H 1.1630 1.0675 0.8336 0.087 Uiso 1 1 calc R
C14 C 0.9809(5) 1.0672(5) 0.9068(2) 0.0581(8) Uani 1 1 d .
H14A H 1.0314 1.1348 0.9222 0.087 Uiso 1 1 calc R
H14B H 1.0080 1.0160 0.9383 0.087 Uiso 1 1 calc R
H14C H 0.8988 1.0812 0.9088 0.087 Uiso 1 1 calc R
C15 C 0.7820(4) 1.0546(4) 0.5750(2) 0.0383(6) Uani 1 1 d .
H15 H 0.7713 0.9746 0.5714 0.046 Uiso 1 1 calc R
C16 C 0.8607(4) 1.0787(4) 0.5233(2) 0.0383(6) Uani 1 1 d .
H16A H 0.8736 1.1569 0.5264 0.057 Uiso 1 1 calc R
H16B H 0.8215 1.0462 0.4746 0.057 Uiso 1 1 calc R
H16C H 0.9371 1.0485 0.5358 0.057 Uiso 1 1 calc R
C17 C 0.6581(4) 1.0959(3) 0.5525(2) 0.0383(6) Uani 1 1 d .
H17A H 0.6045 1.0707 0.5808 0.057 Uiso 1 1 calc R
H17B H 0.6264 1.0683 0.5020 0.057 Uiso 1 1 calc R
H17C H 0.6652 1.1749 0.5605 0.057 Uiso 1 1 calc R
C18 C 0.8520(3) 0.6049(3) 0.78376(18) 0.0245(8) Uani 1 1 d .
C19 C 0.7585(4) 0.5261(3) 0.7825(2) 0.0316(9) Uani 1 1 d .
C20 C 0.7751(4) 0.4565(3) 0.8331(2) 0.0443(11) Uani 1 1 d .
H20 H 0.7125 0.4052 0.8334 0.053 Uiso 1 1 calc R
C21 C 0.8801(5) 0.4612(4) 0.8819(2) 0.0481(12) Uani 1 1 d .
H21 H 0.8894 0.4140 0.9157 0.058 Uiso 1 1 calc R
C22 C 0.9718(5) 0.5353(3) 0.8813(2) 0.0442(11) Uani 1 1 d .
H22 H 1.0446 0.5369 0.9143 0.053 Uiso 1 1 calc R
C23 C 0.9606(4) 0.6088(3) 0.8330(2) 0.0355(9) Uani 1 1 d .
C24 C 0.6397(4) 0.5141(4) 0.7281(3) 0.0525(7) Uani 1 1 d .
H24 H 0.6379 0.5775 0.7031 0.063 Uiso 1 1 calc R
C25 C 0.6298(4) 0.4121(4) 0.6715(3) 0.0525(7) Uani 1 1 d .
H25A H 0.6948 0.4159 0.6462 0.079 Uiso 1 1 calc R
H25B H 0.5538 0.4071 0.6377 0.079 Uiso 1 1 calc R
H25C H 0.6344 0.3484 0.6946 0.079 Uiso 1 1 calc R
C26 C 0.5320(4) 0.5148(4) 0.7634(3) 0.0525(7) Uani 1 1 d .
H26A H 0.5276 0.4503 0.7852 0.079 Uiso 1 1 calc R
H26B H 0.4596 0.5152 0.7274 0.079 Uiso 1 1 calc R
H26C H 0.5401 0.5793 0.8000 0.079 Uiso 1 1 calc R
C27 C 1.0648(5) 0.6890(5) 0.8347(3) 0.0688(9) Uani 1 1 d .
H27 H 1.0338 0.7471 0.8084 0.083 Uiso 1 1 calc R
C28 C 1.1584(5) 0.6347(5) 0.7972(3) 0.0688(9) Uani 1 1 d .
H28A H 1.1893 0.5765 0.8217 0.103 Uiso 1 1 calc R
H28B H 1.2235 0.6882 0.7985 0.103 Uiso 1 1 calc R
H28C H 1.1216 0.6049 0.7477 0.103 Uiso 1 1 calc R
C29 C 1.1257(5) 0.7425(5) 0.9112(3) 0.0688(9) Uani 1 1 d .
H29A H 1.0665 0.7756 0.9356 0.103 Uiso 1 1 calc R
H29B H 1.1868 0.7980 0.9094 0.103 Uiso 1 1 calc R
H29C H 1.1622 0.6878 0.9370 0.103 Uiso 1 1 calc R
C30 C 0.7001(3) 0.7459(3) 0.58845(18) 0.0232(7) Uani 1 1 d .
C31 C 0.4952(3) 0.7433(3) 0.60343(19) 0.0268(8) Uani 1 1 d .
H31 H 0.4782 0.7995 0.5727 0.032 Uiso 1 1 calc R
C32 C 0.4462(4) 0.6320(3) 0.5589(2) 0.0355(9) Uani 1 1 d .
H32A H 0.4650 0.5753 0.5882 0.043 Uiso 1 1 calc R
H32B H 0.4846 0.6174 0.5176 0.043 Uiso 1 1 calc R
C33 C 0.3099(4) 0.6287(4) 0.5324(2) 0.0458(11) Uani 1 1 d .
H33A H 0.2918 0.6809 0.4996 0.055 Uiso 1 1 calc R
H33B H 0.2798 0.5559 0.5058 0.055 Uiso 1 1 calc R
C34 C 0.2468(4) 0.6560(4) 0.5944(3) 0.0526(12) Uani 1 1 d .
H34A H 0.2568 0.5990 0.6242 0.063 Uiso 1 1 calc R
H34B H 0.1609 0.6581 0.5755 0.063 Uiso 1 1 calc R
C35 C 0.2963(4) 0.7651(4) 0.6404(3) 0.0464(11) Uani 1 1 d .
H35A H 0.2587 0.7779 0.6821 0.056 Uiso 1 1 calc R
H35B H 0.2774 0.8234 0.6124 0.056 Uiso 1 1 calc R
C36 C 0.4322(3) 0.7672(4) 0.6658(2) 0.0364(9) Uani 1 1 d .
H36A H 0.4628 0.8390 0.6939 0.044 Uiso 1 1 calc R
H36B H 0.4503 0.7130 0.6972 0.044 Uiso 1 1 calc R
C37 C 0.7440(3) 0.7577(3) 0.46589(19) 0.0287(8) Uani 1 1 d .
H37 H 0.8206 0.7992 0.4911 0.034 Uiso 1 1 calc R
C38 C 0.6808(4) 0.8203(4) 0.4096(2) 0.0405(10) Uani 1 1 d .
H38A H 0.6679 0.8931 0.4330 0.049 Uiso 1 1 calc R
H38B H 0.6025 0.7824 0.3865 0.049 Uiso 1 1 calc R
C39 C 0.7550(5) 0.8303(5) 0.3530(2) 0.0552(13) Uani 1 1 d .
H39A H 0.7113 0.8684 0.3165 0.066 Uiso 1 1 calc R
H39B H 0.8305 0.8735 0.3756 0.066 Uiso 1 1 calc R
C40 C 0.7811(5) 0.7196(5) 0.3174(2) 0.0646(16) Uani 1 1 d .
H40A H 0.8322 0.7286 0.2832 0.078 Uiso 1 1 calc R
H40B H 0.7060 0.6789 0.2907 0.078 Uiso 1 1 calc R
C41 C 0.8433(5) 0.6556(4) 0.3730(3) 0.0602(14) Uani 1 1 d .
H41A H 0.9225 0.6922 0.3958 0.072 Uiso 1 1 calc R
H41B H 0.8548 0.5827 0.3490 0.072 Uiso 1 1 calc R
C42 C 0.7708(4) 0.6457(3) 0.4303(2) 0.0402(10) Uani 1 1 d .
H42A H 0.8156 0.6083 0.4668 0.048 Uiso 1 1 calc R
H42B H 0.6954 0.6018 0.4084 0.048 Uiso 1 1 calc R
C43 C 0.5677(5) 1.0566(5) 0.7122(3) 0.0665(16) Uani 1 1 d .
H43A H 0.6434 1.0410 0.6990 0.100 Uiso 1 1 calc R
H43B H 0.5508 1.1304 0.7065 0.100 Uiso 1 1 calc R
H43C H 0.5044 1.0060 0.6815 0.100 Uiso 1 1 calc R
C44 C 0.4196(5) 1.0387(5) 0.8227(3) 0.0628(15) Uani 1 1 d .
H44A H 0.3738 0.9739 0.7937 0.094 Uiso 1 1 calc R
H44B H 0.3830 1.1028 0.8090 0.094 Uiso 1 1 calc R
H44C H 0.4208 1.0378 0.8730 0.094 Uiso 1 1 calc R
C45 C 0.6579(6) 1.1701(4) 0.8630(4) 0.0777(19) Uani 1 1 d .
H45A H 0.6656 1.1667 0.9135 0.117 Uiso 1 1 calc R
H45B H 0.6137 1.2317 0.8516 0.117 Uiso 1 1 calc R
H45C H 0.7369 1.1786 0.8523 0.117 Uiso 1 1 calc R
C46 C 0.7652(5) 0.7809(4) 0.9119(3) 0.0586(14) Uani 1 1 d .
H46A H 0.7465 0.7187 0.8733 0.088 Uiso 1 1 calc R
H46B H 0.7720 0.7561 0.9577 0.088 Uiso 1 1 calc R
H46C H 0.8404 0.8187 0.9103 0.088 Uiso 1 1 calc R
C47 C 0.4980(5) 0.7986(4) 0.8995(3) 0.0585(14) Uani 1 1 d .
H47A H 0.4355 0.8485 0.8999 0.088 Uiso 1 1 calc R
H47B H 0.5056 0.7634 0.9414 0.088 Uiso 1 1 calc R
H47C H 0.4775 0.7440 0.8564 0.088 Uiso 1 1 calc R
C48 C 0.6731(5) 0.9813(4) 0.9838(2) 0.0501(12) Uani 1 1 d .
H48A H 0.7502 1.0206 0.9883 0.075 Uiso 1 1 calc R
H48B H 0.6739 0.9467 1.0255 0.075 Uiso 1 1 calc R
H48C H 0.6110 1.0317 0.9806 0.075 Uiso 1 1 calc R
C49 C 0.301(2) 0.352(2) -0.0941(16) 0.158(4) Uiso 0.50 1 d PD
C50 C 0.339(2) 0.432(2) -0.0262(13) 0.158(4) Uiso 0.50 1 d PD
C51 C 0.461(2) 0.443(3) -0.0405(15) 0.158(4) Uiso 0.50 1 d PD
C52 C 0.525(2) 0.535(3) 0.0184(17) 0.158(4) Uiso 0.50 1 d PD
C53 C 0.658(2) 0.543(2) 0.0581(13) 0.158(4) Uiso 0.50 1 d PD
C54 C 0.743(2) 0.642(2) 0.0948(17) 0.158(4) Uiso 0.50 1 d PD
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'
N N 0.0061 0.0033 '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'
Yb Yb -0.3850 5.5486 '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
N1 Yb1 N5 116.20(11) . .
N1 Yb1 N2 95.54(11) . .
N5 Yb1 N2 137.37(11) . .
N1 Yb1 N3 87.53(10) . .
N5 Yb1 N3 123.03(11) . .
N2 Yb1 N3 83.72(10) . .
N1 Yb1 C30 66.55(10) . .
N5 Yb1 C30 142.92(10) . .
N2 Yb1 C30 74.35(10) . .
N3 Yb1 C30 24.55(10) . .
N1 Yb1 C2 25.74(10) . .
N5 Yb1 C2 141.80(10) . .
N2 Yb1 C2 72.13(10) . .
N3 Yb1 C2 74.83(10) . .
C30 Yb1 C2 50.54(9) . .
N1 Yb1 C3 54.28(10) . .
N5 Yb1 C3 167.60(11) . .
N2 Yb1 C3 54.92(10) . .
N3 Yb1 C3 53.08(9) . .
C30 Yb1 C3 29.95(9) . .
C2 Yb1 C3 29.82(9) . .
N1 Yb1 C4 77.59(10) . .
N5 Yb1 C4 162.56(11) . .
N2 Yb1 C4 25.36(10) . .
N3 Yb1 C4 65.48(9) . .
C30 Yb1 C4 50.66(9) . .
C2 Yb1 C4 52.03(9) . .
C3 Yb1 C4 29.83(9) . .
N1 Yb1 Si1 97.19(8) . .
N5 Yb1 Si1 25.05(8) . .
N2 Yb1 Si1 162.36(8) . .
N3 Yb1 Si1 108.95(7) . .
C30 Yb1 Si1 122.11(7) . .
C2 Yb1 Si1 122.28(7) . .
C3 Yb1 Si1 142.60(7) . .
C4 Yb1 Si1 172.27(7) . .
N5 Si1 C43 109.5(2) . .
N5 Si1 C44 112.8(2) . .
C43 Si1 C44 106.9(2) . .
N5 Si1 C45 114.1(2) . .
C43 Si1 C45 105.8(3) . .
C44 Si1 C45 107.2(3) . .
N5 Si1 Yb1 32.86(10) . .
C43 Si1 Yb1 76.99(17) . .
C44 Si1 Yb1 129.1(2) . .
C45 Si1 Yb1 120.7(2) . .
N5 Si2 C48 114.1(2) . .
N5 Si2 C47 112.7(2) . .
C48 Si2 C47 106.8(2) . .
N5 Si2 C46 107.3(2) . .
C48 Si2 C46 107.1(2) . .
C47 Si2 C46 108.6(3) . .
C2 N1 C6 118.3(3) . .
C2 N1 Yb1 111.1(2) . .
C6 N1 Yb1 129.4(2) . .
C4 N2 C18 115.8(3) . .
C4 N2 Yb1 111.7(2) . .
C18 N2 Yb1 131.0(2) . .
C30 N3 C31 120.6(3) . .
C30 N3 Yb1 107.7(2) . .
C31 N3 Yb1 127.1(2) . .
C30 N4 C37 129.4(3) . .
C30 N4 H4 120(3) . .
C37 N4 H4 111(3) . .
Si1 N5 Si2 121.20(18) . .
Si1 N5 Yb1 122.09(17) . .
Si2 N5 Yb1 116.65(16) . .
C2 C1 H1A 120.0 . .
C2 C1 H1B 120.0 . .
H1A C1 H1B 120.0 . .
C1 C2 N1 127.0(3) . .
C1 C2 C3 117.7(3) . .
N1 C2 C3 115.2(3) . .
C1 C2 Yb1 159.9(3) . .
N1 C2 Yb1 43.11(16) . .
C3 C2 Yb1 75.75(18) . .
C2 C3 C30 111.2(3) . .
C2 C3 C4 116.9(3) . .
C30 C3 C4 112.0(3) . .
C2 C3 Yb1 74.43(17) . .
C30 C3 Yb1 74.27(18) . .
C4 C3 Yb1 75.66(18) . .
C2 C3 H3 105.2 . .
C30 C3 H3 105.2 . .
C4 C3 H3 105.2 . .
Yb1 C3 H3 179.1 . .
C5 C4 N2 126.7(3) . .
C5 C4 C3 116.6(3) . .
N2 C4 C3 116.7(3) . .
C5 C4 Yb1 166.7(3) . .
N2 C4 Yb1 42.93(15) . .
C3 C4 Yb1 74.51(18) . .
C4 C5 H5A 120.0 . .
C4 C5 H5B 120.0 . .
H5A C5 H5B 120.0 . .
C7 C6 C11 119.3(3) . .
C7 C6 N1 119.9(3) . .
C11 C6 N1 120.6(3) . .
C8 C7 C6 119.2(4) . .
C8 C7 C12 119.7(4) . .
C6 C7 C12 121.0(4) . .
C9 C8 C7 121.5(4) . .
C9 C8 H8 119.2 . .
C7 C8 H8 119.2 . .
C10 C9 C8 119.1(4) . .
C10 C9 H9 120.4 . .
C8 C9 H9 120.4 . .
C9 C10 C11 121.6(4) . .
C9 C10 H10 119.2 . .
C11 C10 H10 119.2 . .
C10 C11 C6 119.2(3) . .
C10 C11 C15 118.2(3) . .
C6 C11 C15 122.6(3) . .
C13 C12 C14 110.8(4) . .
C13 C12 C7 108.8(4) . .
C14 C12 C7 115.0(4) . .
C13 C12 H12 107.3 . .
C14 C12 H12 107.3 . .
C7 C12 H12 107.3 . .
C12 C13 H13A 109.5 . .
C12 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C12 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C12 C14 H14A 109.5 . .
C12 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C12 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C11 C15 C16 110.3(3) . .
C11 C15 C17 112.9(3) . .
C16 C15 C17 109.6(3) . .
C11 C15 H15 107.9 . .
C16 C15 H15 107.9 . .
C17 C15 H15 107.9 . .
C15 C16 H16A 109.5 . .
C15 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C15 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C15 C17 H17A 109.5 . .
C15 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C15 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C23 C18 C19 119.8(4) . .
C23 C18 N2 120.6(3) . .
C19 C18 N2 119.5(3) . .
C20 C19 C18 118.8(4) . .
C20 C19 C24 118.7(4) . .
C18 C19 C24 122.5(4) . .
C21 C20 C19 121.6(4) . .
C21 C20 H20 119.2 . .
C19 C20 H20 119.2 . .
C20 C21 C22 119.4(4) . .
C20 C21 H21 120.3 . .
C22 C21 H21 120.3 . .
C21 C22 C23 122.1(4) . .
C21 C22 H22 119.0 . .
C23 C22 H22 119.0 . .
C22 C23 C18 118.4(4) . .
C22 C23 C27 119.9(4) . .
C18 C23 C27 121.8(4) . .
C26 C24 C25 110.2(4) . .
C26 C24 C19 112.7(4) . .
C25 C24 C19 111.5(4) . .
C26 C24 H24 107.4 . .
C25 C24 H24 107.4 . .
C19 C24 H24 107.4 . .
C24 C25 H25A 109.5 . .
C24 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
C24 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
C24 C26 H26A 109.5 . .
C24 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
C24 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
C23 C27 C29 112.5(5) . .
C23 C27 C28 111.3(5) . .
C29 C27 C28 109.0(4) . .
C23 C27 H27 108.0 . .
C29 C27 H27 108.0 . .
C28 C27 H27 108.0 . .
C27 C28 H28A 109.5 . .
C27 C28 H28B 109.5 . .
H28A C28 H28B 109.5 . .
C27 C28 H28C 109.5 . .
H28A C28 H28C 109.5 . .
H28B C28 H28C 109.5 . .
C27 C29 H29A 109.5 . .
C27 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
C27 C29 H29C 109.5 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
N3 C30 N4 124.5(3) . .
N3 C30 C3 118.9(3) . .
N4 C30 C3 116.6(3) . .
N3 C30 Yb1 47.78(17) . .
N4 C30 Yb1 155.4(2) . .
C3 C30 Yb1 75.79(18) . .
N3 C31 C36 109.2(3) . .
N3 C31 C32 112.2(3) . .
C36 C31 C32 109.2(3) . .
N3 C31 H31 108.7 . .
C36 C31 H31 108.7 . .
C32 C31 H31 108.7 . .
C31 C32 C33 110.6(3) . .
C31 C32 H32A 109.5 . .
C33 C32 H32A 109.5 . .
C31 C32 H32B 109.5 . .
C33 C32 H32B 109.5 . .
H32A C32 H32B 108.1 . .
C34 C33 C32 111.5(4) . .
C34 C33 H33A 109.3 . .
C32 C33 H33A 109.3 . .
C34 C33 H33B 109.3 . .
C32 C33 H33B 109.3 . .
H33A C33 H33B 108.0 . .
C33 C34 C35 111.3(4) . .
C33 C34 H34A 109.4 . .
C35 C34 H34A 109.4 . .
C33 C34 H34B 109.4 . .
C35 C34 H34B 109.4 . .
H34A C34 H34B 108.0 . .
C34 C35 C36 110.5(4) . .
C34 C35 H35A 109.6 . .
C36 C35 H35A 109.6 . .
C34 C35 H35B 109.6 . .
C36 C35 H35B 109.6 . .
H35A C35 H35B 108.1 . .
C31 C36 C35 112.0(3) . .
C31 C36 H36A 109.2 . .
C35 C36 H36A 109.2 . .
C31 C36 H36B 109.2 . .
C35 C36 H36B 109.2 . .
H36A C36 H36B 107.9 . .
N4 C37 C38 108.4(3) . .
N4 C37 C42 111.7(3) . .
C38 C37 C42 110.5(3) . .
N4 C37 H37 108.7 . .
C38 C37 H37 108.7 . .
C42 C37 H37 108.7 . .
C37 C38 C39 110.8(4) . .
C37 C38 H38A 109.5 . .
C39 C38 H38A 109.5 . .
C37 C38 H38B 109.5 . .
C39 C38 H38B 109.5 . .
H38A C38 H38B 108.1 . .
C40 C39 C38 111.3(4) . .
C40 C39 H39A 109.4 . .
C38 C39 H39A 109.4 . .
C40 C39 H39B 109.4 . .
C38 C39 H39B 109.4 . .
H39A C39 H39B 108.0 . .
C39 C40 C41 110.9(4) . .
C39 C40 H40A 109.5 . .
C41 C40 H40A 109.5 . .
C39 C40 H40B 109.5 . .
C41 C40 H40B 109.5 . .
H40A C40 H40B 108.1 . .
C40 C41 C42 111.5(4) . .
C40 C41 H41A 109.3 . .
C42 C41 H41A 109.3 . .
C40 C41 H41B 109.3 . .
C42 C41 H41B 109.3 . .
H41A C41 H41B 108.0 . .
C41 C42 C37 111.1(4) . .
C41 C42 H42A 109.4 . .
C37 C42 H42A 109.4 . .
C41 C42 H42B 109.4 . .
C37 C42 H42B 109.4 . .
H42A C42 H42B 108.0 . .
Si1 C43 H43A 109.5 . .
Si1 C43 H43B 109.5 . .
H43A C43 H43B 109.5 . .
Si1 C43 H43C 109.5 . .
H43A C43 H43C 109.5 . .
H43B C43 H43C 109.5 . .
Si1 C44 H44A 109.5 . .
Si1 C44 H44B 109.5 . .
H44A C44 H44B 109.5 . .
Si1 C44 H44C 109.5 . .
H44A C44 H44C 109.5 . .
H44B C44 H44C 109.5 . .
Si1 C45 H45A 109.5 . .
Si1 C45 H45B 109.5 . .
H45A C45 H45B 109.5 . .
Si1 C45 H45C 109.5 . .
H45A C45 H45C 109.5 . .
H45B C45 H45C 109.5 . .
Si2 C46 H46A 109.5 . .
Si2 C46 H46B 109.5 . .
H46A C46 H46B 109.5 . .
Si2 C46 H46C 109.5 . .
H46A C46 H46C 109.5 . .
H46B C46 H46C 109.5 . .
Si2 C47 H47A 109.5 . .
Si2 C47 H47B 109.5 . .
H47A C47 H47B 109.5 . .
Si2 C47 H47C 109.5 . .
H47A C47 H47C 109.5 . .
H47B C47 H47C 109.5 . .
Si2 C48 H48A 109.5 . .
Si2 C48 H48B 109.5 . .
H48A C48 H48B 109.5 . .
Si2 C48 H48C 109.5 . .
H48A C48 H48C 109.5 . .
H48B C48 H48C 109.5 . .
C54 C49 C53 94(5) 2_665 2_665
C54 C49 C50 91(5) 2_665 .
C53 C49 C50 29.1(15) 2_665 .
C53 C50 C51 66(3) 2_665 .
C53 C50 C49 68(3) 2_665 .
C51 C50 C49 90(2) . .
C53 C50 C52 76(3) 2_665 2_665
C51 C50 C52 17(2) . 2_665
C49 C50 C52 107(2) . 2_665
C53 C50 C54 71(3) 2_665 2_665
C51 C50 C54 107(2) . 2_665
C49 C50 C54 18.7(17) . 2_665
C52 C50 C54 125(3) 2_665 2_665
C52 C51 C53 106(7) 2_665 2_665
C52 C51 C50 92(7) 2_665 .
C53 C51 C50 29.8(15) 2_665 .
C52 C51 C52 17(9) 2_665 .
C53 C51 C52 111(2) 2_665 .
C50 C51 C52 103.8(18) . .
C52 C51 C51 13(7) 2_665 2_665
C53 C51 C51 110(3) 2_665 2_665
C50 C51 C51 101(2) . 2_665
C52 C51 C51 4(2) . 2_665
C51 C52 C52 155(10) 2_665 2_665
C51 C52 C51 163(9) 2_665 .
C52 C52 C51 7(4) 2_665 .
C51 C52 C53 57(6) 2_665 .
C52 C52 C53 127(4) 2_665 .
C51 C52 C53 127(2) . .
C51 C52 C50 71(6) 2_665 2_665
C52 C52 C50 125(4) 2_665 2_665
C51 C52 C50 121(2) . 2_665
C53 C52 C50 27.3(13) . 2_665
C50 C53 C51 84(3) 2_665 2_665
C50 C53 C49 83(3) 2_665 2_665
C51 C53 C49 99(2) 2_665 2_665
C50 C53 C54 82(4) 2_665 .
C51 C53 C54 118(2) 2_665 .
C49 C53 C54 19.6(18) 2_665 .
C50 C53 C52 77(4) 2_665 .
C51 C53 C52 17(2) 2_665 .
C49 C53 C52 113(2) 2_665 .
C54 C53 C52 131(2) . .
C49 C54 C53 67(5) 2_665 .
C49 C54 C50 70(5) 2_665 2_665
C53 C54 C50 27.2(14) . 2_665
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Yb1 N1 2.183(3) .
Yb1 N5 2.192(3) .
Yb1 N2 2.210(3) .
Yb1 N3 2.314(3) .
Yb1 C30 2.977(3) .
Yb1 C2 2.980(4) .
Yb1 C3 2.998(3) .
Yb1 C4 3.014(3) .
Yb1 Si1 3.4235(11) .
Si1 N5 1.711(3) .
Si1 C43 1.865(5) .
Si1 C44 1.868(5) .
Si1 C45 1.873(6) .
Si2 N5 1.719(3) .
Si2 C48 1.859(4) .
Si2 C47 1.869(5) .
Si2 C46 1.874(5) .
N1 C2 1.388(4) .
N1 C6 1.422(4) .
N2 C4 1.389(4) .
N2 C18 1.440(4) .
N3 C30 1.298(5) .
N3 C31 1.483(4) .
N4 C30 1.343(5) .
N4 C37 1.463(5) .
N4 H4 0.854(10) .
C1 C2 1.340(5) .
C1 H1A 0.9400 .
C1 H1B 0.9400 .
C2 C3 1.538(5) .
C3 C30 1.544(5) .
C3 C4 1.547(5) .
C3 H3 0.9900 .
C4 C5 1.336(5) .
C5 H5A 0.9400 .
C5 H5B 0.9400 .
C6 C7 1.411(5) .
C6 C11 1.412(5) .
C7 C8 1.389(6) .
C7 C12 1.518(6) .
C8 C9 1.386(6) .
C8 H8 0.9400 .
C9 C10 1.379(6) .
C9 H9 0.9400 .
C10 C11 1.390(5) .
C10 H10 0.9400 .
C11 C15 1.524(5) .
C12 C13 1.513(7) .
C12 C14 1.513(7) .
C12 H12 0.9900 .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C13 H13C 0.9700 .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
C14 H14C 0.9700 .
C15 C16 1.524(6) .
C15 C17 1.536(6) .
C15 H15 0.9900 .
C16 H16A 0.9700 .
C16 H16B 0.9700 .
C16 H16C 0.9700 .
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C17 H17C 0.9700 .
C18 C23 1.400(5) .
C18 C19 1.412(6) .
C19 C20 1.397(6) .
C19 C24 1.528(6) .
C20 C21 1.364(7) .
C20 H20 0.9400 .
C21 C22 1.368(7) .
C21 H21 0.9400 .
C22 C23 1.400(6) .
C22 H22 0.9400 .
C23 C27 1.512(7) .
C24 C26 1.520(7) .
C24 C25 1.523(6) .
C24 H24 0.9900 .
C25 H25A 0.9700 .
C25 H25B 0.9700 .
C25 H25C 0.9700 .
C26 H26A 0.9700 .
C26 H26B 0.9700 .
C26 H26C 0.9700 .
C27 C29 1.530(7) .
C27 C28 1.532(8) .
C27 H27 0.9900 .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C28 H28C 0.9700 .
C29 H29A 0.9700 .
C29 H29B 0.9700 .
C29 H29C 0.9700 .
C31 C36 1.518(5) .
C31 C32 1.529(5) .
C31 H31 0.9900 .
C32 C33 1.538(6) .
C32 H32A 0.9800 .
C32 H32B 0.9800 .
C33 C34 1.517(7) .
C33 H33A 0.9800 .
C33 H33B 0.9800 .
C34 C35 1.518(6) .
C34 H34A 0.9800 .
C34 H34B 0.9800 .
C35 C36 1.532(5) .
C35 H35A 0.9800 .
C35 H35B 0.9800 .
C36 H36A 0.9800 .
C36 H36B 0.9800 .
C37 C38 1.523(5) .
C37 C42 1.530(5) .
C37 H37 0.9900 .
C38 C39 1.526(6) .
C38 H38A 0.9800 .
C38 H38B 0.9800 .
C39 C40 1.513(8) .
C39 H39A 0.9800 .
C39 H39B 0.9800 .
C40 C41 1.522(8) .
C40 H40A 0.9800 .
C40 H40B 0.9800 .
C41 C42 1.524(7) .
C41 H41A 0.9800 .
C41 H41B 0.9800 .
C42 H42A 0.9800 .
C42 H42B 0.9800 .
C43 H43A 0.9700 .
C43 H43B 0.9700 .
C43 H43C 0.9700 .
C44 H44A 0.9700 .
C44 H44B 0.9700 .
C44 H44C 0.9700 .
C45 H45A 0.9700 .
C45 H45B 0.9700 .
C45 H45C 0.9700 .
C46 H46A 0.9700 .
C46 H46B 0.9700 .
C46 H46C 0.9700 .
C47 H47A 0.9700 .
C47 H47B 0.9700 .
C47 H47C 0.9700 .
C48 H48A 0.9700 .
C48 H48B 0.9700 .
C48 H48C 0.9700 .
C49 C54 0.51(4) 2_665
C49 C53 1.39(4) 2_665
C49 C50 1.495(18) .
C50 C53 0.73(4) 2_665
C50 C51 1.469(18) .
C50 C52 1.55(5) 2_665
C50 C54 1.59(4) 2_665
C51 C52 0.46(5) 2_665
C51 C53 1.35(4) 2_665
C51 C52 1.528(15) .
C51 C51 1.97(5) 2_665
C52 C51 0.46(5) 2_665
C52 C52 1.09(5) 2_665
C52 C53 1.550(18) .
C52 C50 1.55(5) 2_665
C53 C50 0.73(4) 2_665
C53 C51 1.35(4) 2_665
C53 C49 1.39(4) 2_665
C53 C54 1.516(18) .
C54 C49 0.51(4) 2_665
C54 C50 1.59(4) 2_665
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_4
N1 Yb1 Si1 N5 -141.4(2) . .
N2 Yb1 Si1 N5 -5.5(3) . .
N3 Yb1 Si1 N5 128.8(2) . .
C30 Yb1 Si1 N5 151.9(2) . .
C2 Yb1 Si1 N5 -147.5(2) . .
C3 Yb1 Si1 N5 -177.8(2) . .
C4 Yb1 Si1 N5 171.6(5) . .
N1 Yb1 Si1 C43 47.0(2) . .
N5 Yb1 Si1 C43 -171.7(3) . .
N2 Yb1 Si1 C43 -177.1(3) . .
N3 Yb1 Si1 C43 -42.9(2) . .
C30 Yb1 Si1 C43 -19.8(2) . .
C2 Yb1 Si1 C43 40.8(2) . .
C3 Yb1 Si1 C43 10.5(2) . .
C4 Yb1 Si1 C43 0.0(6) . .
N1 Yb1 Si1 C44 148.4(2) . .
N5 Yb1 Si1 C44 -70.3(3) . .
N2 Yb1 Si1 C44 -75.8(3) . .
N3 Yb1 Si1 C44 58.5(2) . .
C30 Yb1 Si1 C44 81.6(2) . .
C2 Yb1 Si1 C44 142.2(2) . .
C3 Yb1 Si1 C44 111.9(2) . .
C4 Yb1 Si1 C44 101.3(5) . .
N1 Yb1 Si1 C45 -53.9(3) . .
N5 Yb1 Si1 C45 87.5(3) . .
N2 Yb1 Si1 C45 82.0(4) . .
N3 Yb1 Si1 C45 -143.7(3) . .
C30 Yb1 Si1 C45 -120.6(3) . .
C2 Yb1 Si1 C45 -60.1(3) . .
C3 Yb1 Si1 C45 -90.4(3) . .
C4 Yb1 Si1 C45 -100.9(6) . .
N5 Yb1 N1 C2 175.0(2) . .
N2 Yb1 N1 C2 24.3(2) . .
N3 Yb1 N1 C2 -59.1(2) . .
C30 Yb1 N1 C2 -45.9(2) . .
C3 Yb1 N1 C2 -14.31(19) . .
C4 Yb1 N1 C2 6.3(2) . .
Si1 Yb1 N1 C2 -167.9(2) . .
N5 Yb1 N1 C6 7.6(3) . .
N2 Yb1 N1 C6 -143.1(3) . .
N3 Yb1 N1 C6 133.5(3) . .
C30 Yb1 N1 C6 146.6(3) . .
C2 Yb1 N1 C6 -167.4(4) . .
C3 Yb1 N1 C6 178.3(3) . .
C4 Yb1 N1 C6 -161.1(3) . .
Si1 Yb1 N1 C6 24.7(3) . .
N1 Yb1 N2 C4 -44.9(2) . .
N5 Yb1 N2 C4 175.7(2) . .
N3 Yb1 N2 C4 42.0(2) . .
C30 Yb1 N2 C4 18.9(2) . .
C2 Yb1 N2 C4 -34.0(2) . .
C3 Yb1 N2 C4 -6.6(2) . .
Si1 Yb1 N2 C4 179.09(18) . .
N1 Yb1 N2 C18 150.1(3) . .
N5 Yb1 N2 C18 10.6(4) . .
N3 Yb1 N2 C18 -123.0(3) . .
C30 Yb1 N2 C18 -146.2(3) . .
C2 Yb1 N2 C18 160.9(3) . .
C3 Yb1 N2 C18 -171.6(3) . .
C4 Yb1 N2 C18 -165.1(4) . .
Si1 Yb1 N2 C18 14.0(5) . .
N1 Yb1 N3 C30 30.2(2) . .
N5 Yb1 N3 C30 150.1(2) . .
N2 Yb1 N3 C30 -65.7(2) . .
C2 Yb1 N3 C30 7.5(2) . .
C3 Yb1 N3 C30 -15.5(2) . .
C4 Yb1 N3 C30 -47.3(2) . .
Si1 Yb1 N3 C30 126.9(2) . .
N1 Yb1 N3 C31 -125.2(3) . .
N5 Yb1 N3 C31 -5.3(3) . .
N2 Yb1 N3 C31 138.9(3) . .
C30 Yb1 N3 C31 -155.4(4) . .
C2 Yb1 N3 C31 -147.9(3) . .
C3 Yb1 N3 C31 -170.9(3) . .
C4 Yb1 N3 C31 157.3(3) . .
Si1 Yb1 N3 C31 -28.4(3) . .
C43 Si1 N5 Si2 -168.6(3) . .
C44 Si1 N5 Si2 -49.6(3) . .
C45 Si1 N5 Si2 73.0(3) . .
Yb1 Si1 N5 Si2 -177.2(3) . .
C43 Si1 N5 Yb1 8.6(3) . .
C44 Si1 N5 Yb1 127.6(2) . .
C45 Si1 N5 Yb1 -109.8(3) . .
C48 Si2 N5 Si1 -43.2(3) . .
C47 Si2 N5 Si1 78.8(3) . .
C46 Si2 N5 Si1 -161.7(2) . .
C48 Si2 N5 Yb1 139.4(2) . .
C47 Si2 N5 Yb1 -98.5(2) . .
C46 Si2 N5 Yb1 21.0(3) . .
N1 Yb1 N5 Si1 43.7(2) . .
N2 Yb1 N5 Si1 177.56(14) . .
N3 Yb1 N5 Si1 -61.6(2) . .
C30 Yb1 N5 Si1 -41.5(3) . .
C2 Yb1 N5 Si1 47.2(3) . .
C3 Yb1 N5 Si1 6.1(6) . .
C4 Yb1 N5 Si1 -176.3(2) . .
N1 Yb1 N5 Si2 -139.00(16) . .
N2 Yb1 N5 Si2 -5.1(3) . .
N3 Yb1 N5 Si2 115.78(17) . .
C30 Yb1 N5 Si2 135.85(16) . .
C2 Yb1 N5 Si2 -135.47(15) . .
C3 Yb1 N5 Si2 -176.5(4) . .
C4 Yb1 N5 Si2 1.1(5) . .
Si1 Yb1 N5 Si2 177.3(3) . .
C6 N1 C2 C1 12.8(5) . .
Yb1 N1 C2 C1 -156.2(3) . .
C6 N1 C2 C3 -165.4(3) . .
Yb1 N1 C2 C3 25.6(3) . .
C6 N1 C2 Yb1 169.0(4) . .
N1 Yb1 C2 C1 69.3(8) . .
N5 Yb1 C2 C1 62.0(8) . .
N2 Yb1 C2 C1 -85.2(8) . .
N3 Yb1 C2 C1 -173.3(8) . .
C30 Yb1 C2 C1 -169.3(8) . .
C3 Yb1 C2 C1 -134.5(8) . .
C4 Yb1 C2 C1 -102.8(8) . .
Si1 Yb1 C2 C1 83.6(8) . .
N5 Yb1 C2 N1 -7.3(3) . .
N2 Yb1 C2 N1 -154.5(2) . .
N3 Yb1 C2 N1 117.3(2) . .
C30 Yb1 C2 N1 121.4(2) . .
C3 Yb1 C2 N1 156.2(3) . .
C4 Yb1 C2 N1 -172.2(3) . .
Si1 Yb1 C2 N1 14.2(2) . .
N1 Yb1 C2 C3 -156.2(3) . .
N5 Yb1 C2 C3 -163.52(18) . .
N2 Yb1 C2 C3 49.32(17) . .
N3 Yb1 C2 C3 -38.86(17) . .
C30 Yb1 C2 C3 -34.84(17) . .
C4 Yb1 C2 C3 31.63(17) . .
Si1 Yb1 C2 C3 -141.96(15) . .
C1 C2 C3 C30 -130.3(3) . .
N1 C2 C3 C30 48.1(4) . .
Yb1 C2 C3 C30 65.8(2) . .
C1 C2 C3 C4 99.3(4) . .
N1 C2 C3 C4 -82.3(4) . .
Yb1 C2 C3 C4 -64.6(3) . .
C1 C2 C3 Yb1 163.9(3) . .
N1 C2 C3 Yb1 -17.7(2) . .
N1 Yb1 C3 C2 12.46(17) . .
N5 Yb1 C3 C2 54.8(5) . .
N2 Yb1 C3 C2 -118.1(2) . .
N3 Yb1 C3 C2 130.8(2) . .
C30 Yb1 C3 C2 117.9(3) . .
C4 Yb1 C3 C2 -123.8(3) . .
Si1 Yb1 C3 C2 59.1(2) . .
N1 Yb1 C3 C30 -105.5(2) . .
N5 Yb1 C3 C30 -63.1(5) . .
N2 Yb1 C3 C30 124.0(2) . .
N3 Yb1 C3 C30 12.84(18) . .
C2 Yb1 C3 C30 -117.9(3) . .
C4 Yb1 C3 C30 118.3(3) . .
Si1 Yb1 C3 C30 -58.8(2) . .
N1 Yb1 C3 C4 136.2(2) . .
N5 Yb1 C3 C4 178.6(4) . .
N2 Yb1 C3 C4 5.65(17) . .
N3 Yb1 C3 C4 -105.5(2) . .
C30 Yb1 C3 C4 -118.3(3) . .
C2 Yb1 C3 C4 123.8(3) . .
Si1 Yb1 C3 C4 -177.17(14) . .
C18 N2 C4 C5 -1.1(5) . .
Yb1 N2 C4 C5 -168.6(3) . .
C18 N2 C4 C3 179.2(3) . .
Yb1 N2 C4 C3 11.7(4) . .
C18 N2 C4 Yb1 167.5(4) . .
C2 C3 C4 C5 -124.1(4) . .
C30 C3 C4 C5 106.0(4) . .
Yb1 C3 C4 C5 172.1(3) . .
C2 C3 C4 N2 55.6(4) . .
C30 C3 C4 N2 -74.3(4) . .
Yb1 C3 C4 N2 -8.2(2) . .
C2 C3 C4 Yb1 63.9(3) . .
C30 C3 C4 Yb1 -66.1(2) . .
N1 Yb1 C4 C5 177.3(12) . .
N5 Yb1 C4 C5 33.4(13) . .
N2 Yb1 C4 C5 43.2(11) . .
N3 Yb1 C4 C5 -89.8(11) . .
C30 Yb1 C4 C5 -113.0(12) . .
C2 Yb1 C4 C5 -179.2(12) . .
C3 Yb1 C4 C5 -147.6(12) . .
Si1 Yb1 C4 C5 -134.7(10) . .
N1 Yb1 C4 N2 134.0(2) . .
N5 Yb1 C4 N2 -9.8(5) . .
N3 Yb1 C4 N2 -133.0(2) . .
C30 Yb1 C4 N2 -156.2(3) . .
C2 Yb1 C4 N2 137.5(3) . .
C3 Yb1 C4 N2 169.2(3) . .
Si1 Yb1 C4 N2 -177.9(4) . .
N1 Yb1 C4 C3 -35.11(18) . .
N5 Yb1 C4 C3 -179.0(3) . .
N2 Yb1 C4 C3 -169.2(3) . .
N3 Yb1 C4 C3 57.87(18) . .
C30 Yb1 C4 C3 34.63(17) . .
C2 Yb1 C4 C3 -31.63(17) . .
Si1 Yb1 C4 C3 12.9(6) . .
C2 N1 C6 C7 -110.2(4) . .
Yb1 N1 C6 C7 56.5(4) . .
C2 N1 C6 C11 73.7(4) . .
Yb1 N1 C6 C11 -119.7(3) . .
C11 C6 C7 C8 3.2(5) . .
N1 C6 C7 C8 -173.0(3) . .
C11 C6 C7 C12 -172.4(4) . .
N1 C6 C7 C12 11.4(5) . .
C6 C7 C8 C9 -1.7(6) . .
C12 C7 C8 C9 173.9(4) . .
C7 C8 C9 C10 -0.6(7) . .
C8 C9 C10 C11 1.4(6) . .
C9 C10 C11 C6 0.1(6) . .
C9 C10 C11 C15 -179.1(4) . .
C7 C6 C11 C10 -2.4(5) . .
N1 C6 C11 C10 173.8(3) . .
C7 C6 C11 C15 176.8(3) . .
N1 C6 C11 C15 -7.1(5) . .
C8 C7 C12 C13 -84.1(5) . .
C6 C7 C12 C13 91.4(5) . .
C8 C7 C12 C14 40.9(6) . .
C6 C7 C12 C14 -143.6(4) . .
C10 C11 C15 C16 61.3(5) . .
C6 C11 C15 C16 -117.8(4) . .
C10 C11 C15 C17 -61.7(5) . .
C6 C11 C15 C17 119.1(4) . .
C4 N2 C18 C23 94.2(4) . .
Yb1 N2 C18 C23 -101.2(4) . .
C4 N2 C18 C19 -90.1(4) . .
Yb1 N2 C18 C19 74.5(4) . .
C23 C18 C19 C20 2.8(6) . .
N2 C18 C19 C20 -173.0(3) . .
C23 C18 C19 C24 -177.3(4) . .
N2 C18 C19 C24 6.9(5) . .
C18 C19 C20 C21 -1.7(6) . .
C24 C19 C20 C21 178.3(4) . .
C19 C20 C21 C22 -0.4(7) . .
C20 C21 C22 C23 1.6(7) . .
C21 C22 C23 C18 -0.5(6) . .
C21 C22 C23 C27 180.0(5) . .
C19 C18 C23 C22 -1.7(6) . .
N2 C18 C23 C22 174.1(3) . .
C19 C18 C23 C27 177.8(4) . .
N2 C18 C23 C27 -6.4(6) . .
C20 C19 C24 C26 51.6(5) . .
C18 C19 C24 C26 -128.3(4) . .
C20 C19 C24 C25 -72.9(6) . .
C18 C19 C24 C25 107.2(5) . .
C22 C23 C27 C29 -44.1(7) . .
C18 C23 C27 C29 136.5(5) . .
C22 C23 C27 C28 78.6(6) . .
C18 C23 C27 C28 -100.8(5) . .
C31 N3 C30 N4 7.3(5) . .
Yb1 N3 C30 N4 -150.0(3) . .
C31 N3 C30 C3 -174.4(3) . .
Yb1 N3 C30 C3 28.3(4) . .
C31 N3 C30 Yb1 157.3(4) . .
C37 N4 C30 N3 173.0(4) . .
C37 N4 C30 C3 -5.4(5) . .
C37 N4 C30 Yb1 110.2(6) . .
C2 C3 C30 N3 -87.1(4) . .
C4 C3 C30 N3 45.7(4) . .
Yb1 C3 C30 N3 -21.2(3) . .
C2 C3 C30 N4 91.3(4) . .
C4 C3 C30 N4 -135.9(3) . .
Yb1 C3 C30 N4 157.2(3) . .
C2 C3 C30 Yb1 -65.9(2) . .
C4 C3 C30 Yb1 66.9(2) . .
N1 Yb1 C30 N3 -146.8(3) . .
N5 Yb1 C30 N3 -43.8(3) . .
N2 Yb1 C30 N3 109.9(2) . .
C2 Yb1 C30 N3 -170.6(3) . .
C3 Yb1 C30 N3 154.7(3) . .
C4 Yb1 C30 N3 120.2(3) . .
Si1 Yb1 C30 N3 -63.2(2) . .
N1 Yb1 C30 N4 -65.1(6) . .
N5 Yb1 C30 N4 37.8(7) . .
N2 Yb1 C30 N4 -168.5(6) . .
N3 Yb1 C30 N4 81.7(6) . .
C2 Yb1 C30 N4 -89.0(6) . .
C3 Yb1 C30 N4 -123.7(7) . .
C4 Yb1 C30 N4 -158.2(7) . .
Si1 Yb1 C30 N4 18.5(6) . .
N1 Yb1 C30 C3 58.53(19) . .
N5 Yb1 C30 C3 161.48(19) . .
N2 Yb1 C30 C3 -44.81(18) . .
N3 Yb1 C30 C3 -154.7(3) . .
C2 Yb1 C30 C3 34.69(17) . .
C4 Yb1 C30 C3 -34.48(18) . .
Si1 Yb1 C30 C3 142.15(16) . .
C30 N3 C31 C36 -170.7(3) . .
Yb1 N3 C31 C36 -18.1(4) . .
C30 N3 C31 C32 68.0(4) . .
Yb1 N3 C31 C32 -139.4(3) . .
N3 C31 C32 C33 178.4(3) . .
C36 C31 C32 C33 57.2(4) . .
C31 C32 C33 C34 -56.6(5) . .
C32 C33 C34 C35 55.2(5) . .
C33 C34 C35 C36 -54.6(5) . .
N3 C31 C36 C35 178.8(3) . .
C32 C31 C36 C35 -58.1(4) . .
C34 C35 C36 C31 57.0(5) . .
C30 N4 C37 C38 -148.3(4) . .
C30 N4 C37 C42 89.6(5) . .
N4 C37 C38 C39 -179.2(4) . .
C42 C37 C38 C39 -56.4(5) . .
C37 C38 C39 C40 57.0(5) . .
C38 C39 C40 C41 -56.2(6) . .
C39 C40 C41 C42 55.5(6) . .
C40 C41 C42 C37 -55.4(5) . .
N4 C37 C42 C41 176.6(4) . .
C38 C37 C42 C41 55.7(5) . .
C54 C49 C50 C53 -95(8) 2_665 2_665
C54 C49 C50 C51 -160(7) 2_665 .
C53 C49 C50 C51 -64(3) 2_665 .
C54 C49 C50 C52 -162(7) 2_665 2_665
C53 C49 C50 C52 -66(3) 2_665 2_665
C53 C49 C50 C54 95(8) 2_665 2_665
C53 C50 C51 C52 121(10) 2_665 2_665
C49 C50 C51 C52 -174(9) . 2_665
C54 C50 C51 C52 180(9) 2_665 2_665
C49 C50 C51 C53 66(3) . 2_665
C52 C50 C51 C53 -121(10) 2_665 2_665
C54 C50 C51 C53 59(3) 2_665 2_665
C53 C50 C51 C52 108(3) 2_665 .
C49 C50 C51 C52 173.5(19) . .
C52 C50 C51 C52 -13(9) 2_665 .
C54 C50 C51 C52 167(2) 2_665 .
C53 C50 C51 C51 111(4) 2_665 2_665
C49 C50 C51 C51 176(3) . 2_665
C52 C50 C51 C51 -10(7) 2_665 2_665
C54 C50 C51 C51 170(3) 2_665 2_665
C52 C51 C52 C51 0.00(16) 2_665 2_665
C53 C51 C52 C51 78(24) 2_665 2_665
C50 C51 C52 C51 48(23) . 2_665
C53 C51 C52 C52 78(23) 2_665 2_665
C50 C51 C52 C52 48(23) . 2_665
C51 C51 C52 C52 0.0(2) 2_665 2_665
C52 C51 C52 C53 95(25) 2_665 .
C53 C51 C52 C53 174(3) 2_665 .
C50 C51 C52 C53 143(4) . .
C51 C51 C52 C53 95(25) 2_665 .
C52 C51 C52 C50 128(25) 2_665 2_665
C53 C51 C52 C50 -154(4) 2_665 2_665
C50 C51 C52 C50 176(3) . 2_665
C51 C51 C52 C50 128(25) 2_665 2_665
C51 C52 C53 C50 -114(10) 2_665 2_665
C52 C52 C53 C50 96(8) 2_665 2_665
C51 C52 C53 C50 87(4) . 2_665
C52 C52 C53 C51 -150(16) 2_665 2_665
C51 C52 C53 C51 -159(11) . 2_665
C50 C52 C53 C51 114(10) 2_665 2_665
C51 C52 C53 C49 -37(11) 2_665 2_665
C52 C52 C53 C49 173(6) 2_665 2_665
C51 C52 C53 C49 164(3) . 2_665
C50 C52 C53 C49 76(3) 2_665 2_665
C51 C52 C53 C54 -47(11) 2_665 .
C52 C52 C53 C54 163(6) 2_665 .
C51 C52 C53 C54 154(3) . .
C50 C52 C53 C54 67(4) 2_665 .
C50 C53 C54 C49 91(8) 2_665 2_665
C51 C53 C54 C49 13(8) 2_665 2_665
C52 C53 C54 C49 27(9) . 2_665
C51 C53 C54 C50 -79(4) 2_665 2_665
C49 C53 C54 C50 -91(8) 2_665 2_665
C52 C53 C54 C50 -65(4) . 2_665
