# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2022

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_ydkr
_database_code_depnum_ccdc_archive 'CCDC 2191231'
loop_
_audit_author_name
_audit_author_address
'Takuya Kuwabara'
;Ochanomizu University
Japan
;
_audit_update_record             
;
2022-07-19 deposited with the CCDC.	2022-10-13 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C36 H56 Li2 O5 Si'
_chemical_formula_sum            'C36 H56 Li2 O5 Si'
_chemical_formula_weight         610.77

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'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           7
_space_group_name_H-M_alt        'P c'
_space_group_name_Hall           'P -2yc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'x, -y, z+1/2'

_cell_length_a                   9.332(3)
_cell_length_b                   10.610(3)
_cell_length_c                   17.742(5)
_cell_angle_alpha                90
_cell_angle_beta                 95.085(5)
_cell_angle_gamma                90
_cell_volume                     1749.7(8)
_cell_formula_units_Z            2
_cell_measurement_temperature    93(2)
_cell_measurement_reflns_used    5678
_cell_measurement_theta_min      2.2389
_cell_measurement_theta_max      31.1704

_exptl_crystal_description       Prism
_exptl_crystal_colour            Black
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.159
_exptl_crystal_F_000             664
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.210
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.120
_exptl_absorpt_coefficient_mu    0.106
_shelx_estimated_absorpt_T_min   0.978
_shelx_estimated_absorpt_T_max   0.987
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8715
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      93(2)
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'rotating-anode X-ray tube'
_diffrn_radiation_monochromator  Confocal
_diffrn_measurement_device_type  'Rigaku VariMax Saturn'
_diffrn_measurement_method       'omega scans'
_diffrn_detector_area_resol_mean 28.5714
_diffrn_reflns_number            13870
_diffrn_reflns_av_unetI/netI     0.0619
_diffrn_reflns_av_R_equivalents  0.0364
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         3.594
_diffrn_reflns_theta_max         27.483
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.800
_diffrn_reflns_point_group_measured_fraction_full 0.821
_reflns_number_total             6403
_reflns_number_gt                5102
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.603
_reflns_Friedel_fraction_max     0.603
_reflns_Friedel_fraction_full    0.645

_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.
;

_computing_data_collection       'RIGAKU CrystalClear'
_computing_cell_refinement       'RIGAKU CrystalClear'
_computing_data_reduction        'RIGAKU CrystalClear'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Yadokari-XG 2009(Wakita Nemoto et al.)'
_computing_publication_material  'Yadokari-XG 2009(Wakita,Nemoto et al.)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0715P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_extinction_coef       0.059(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_abs_structure_details 
;
 Flack x determined using 1318 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.29(8)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         6403
_refine_ls_number_parameters     400
_refine_ls_number_restraints     2
_refine_ls_R_factor_all          0.0638
_refine_ls_R_factor_gt           0.0515
_refine_ls_wR_factor_ref         0.1280
_refine_ls_wR_factor_gt          0.1180
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_restrained_S_all      1.038
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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 0.74545(10) 0.77765(9) 0.55363(6) 0.0246(2) Uani 1 1 d . . . . .
O3 O 0.3546(3) 0.5764(2) 0.66431(14) 0.0287(6) Uani 1 1 d . . . . .
O1 O 0.5848(3) 0.4059(2) 0.59837(14) 0.0290(6) Uani 1 1 d . . . . .
O5 O 0.6040(3) 0.9471(2) 0.38012(15) 0.0310(6) Uani 1 1 d . . . . .
O4 O 0.3630(3) 0.8016(2) 0.30805(15) 0.0299(6) Uani 1 1 d . . . . .
O2 O 0.2700(3) 0.3940(2) 0.53220(15) 0.0298(6) Uani 1 1 d . . . . .
C6 C 0.5659(4) 0.8463(3) 0.56767(19) 0.0220(7) Uani 1 1 d . . . . .
C14 C 0.5645(4) 0.9448(3) 0.6191(2) 0.0273(8) Uani 1 1 d . . . . .
H14 H 0.6545 0.9738 0.6418 0.033 Uiso 1 1 calc R U . . .
C3 C 0.4957(4) 0.6047(3) 0.4477(2) 0.0240(7) Uani 1 1 d . . . . .
H3 H 0.4456 0.5311 0.4298 0.029 Uiso 1 1 calc R U . . .
C2 C 0.6401(4) 0.6056(3) 0.43143(19) 0.0239(7) Uani 1 1 d . . . . .
C11 C 0.3038(4) 0.8668(3) 0.5528(2) 0.0277(8) Uani 1 1 d . . . . .
H11 H 0.2128 0.8430 0.5288 0.033 Uiso 1 1 calc R U . . .
C5 C 0.4294(4) 0.7981(3) 0.5337(2) 0.0230(7) Uani 1 1 d . . . . .
C15 C 0.7976(4) 0.6697(4) 0.6358(2) 0.0334(9) Uani 1 1 d . . . . .
H15 H 0.7247 0.6037 0.6381 0.050 Uiso 1 1 calc R U . . .
H15A H 0.8044 0.7183 0.6830 0.050 Uiso 1 1 calc R U . . .
H15B H 0.8910 0.6309 0.6292 0.050 Uiso 1 1 calc R U . . .
C4 C 0.4051(4) 0.6921(3) 0.4863(2) 0.0244(7) Uani 1 1 d . . . . .
H4 H 0.3057 0.6727 0.4771 0.029 Uiso 1 1 calc R U . . .
C36 C 0.2827(4) 0.6954(4) 0.2775(2) 0.0308(8) Uani 1 1 d . . . . .
H36 H 0.2410 0.6473 0.3181 0.037 Uiso 1 1 calc R U . . .
H36A H 0.3446 0.6385 0.2503 0.037 Uiso 1 1 calc R U . . .
C16 C 0.8861(4) 0.9059(4) 0.5608(3) 0.0416(11) Uani 1 1 d . . . . .
H16 H 0.9821 0.8678 0.5630 0.062 Uiso 1 1 calc R U . . .
H16A H 0.8772 0.9555 0.6068 0.062 Uiso 1 1 calc R U . . .
H16B H 0.8722 0.9609 0.5164 0.062 Uiso 1 1 calc R U . . .
C20 C 0.6164(4) 0.3481(4) 0.6722(2) 0.0289(8) Uani 1 1 d . . . . .
H20 H 0.5474 0.2795 0.6802 0.035 Uiso 1 1 calc R U . . .
H20A H 0.6123 0.4112 0.7131 0.035 Uiso 1 1 calc R U . . .
C7 C 0.8865(4) 0.6893(4) 0.4313(2) 0.0311(8) Uani 1 1 d . . . . .
H7 H 0.9585 0.7471 0.4505 0.037 Uiso 1 1 calc R U . . .
C13 C 0.4409(4) 1.0043(4) 0.6398(2) 0.0302(8) Uani 1 1 d . . . . .
H13 H 0.4455 1.0693 0.6767 0.036 Uiso 1 1 calc R U . . .
C1 C 0.7549(4) 0.6896(3) 0.4643(2) 0.0271(8) Uani 1 1 d . . . . .
C28 C 0.4299(4) 0.6640(4) 0.7166(2) 0.0297(8) Uani 1 1 d . . . . .
H28 H 0.4506 0.7439 0.6908 0.036 Uiso 1 1 calc R U . . .
H28A H 0.5216 0.6273 0.7389 0.036 Uiso 1 1 calc R U . . .
C12 C 0.3083(4) 0.9637(3) 0.6033(2) 0.0292(8) Uani 1 1 d . . . . .
H12 H 0.2216 1.0042 0.6141 0.035 Uiso 1 1 calc R U . . .
C10 C 0.6842(4) 0.5166(4) 0.3762(2) 0.0307(8) Uani 1 1 d . . . . .
H10 H 0.6187 0.4520 0.3591 0.037 Uiso 1 1 calc R U . . .
C23 C 0.0800(5) 0.3244(4) 0.4448(2) 0.0370(9) Uani 1 1 d . . . . .
H23 H -0.0241 0.3055 0.4434 0.044 Uiso 1 1 calc R U . . .
H23A H 0.1034 0.3510 0.3938 0.044 Uiso 1 1 calc R U . . .
C9 C 0.8153(5) 0.5205(4) 0.3474(2) 0.0353(9) Uani 1 1 d . . . . .
H9 H 0.8369 0.4616 0.3097 0.042 Uiso 1 1 calc R U . . .
C8 C 0.9183(5) 0.6107(4) 0.3728(2) 0.0379(10) Uani 1 1 d . . . . .
H8 H 1.0070 0.6175 0.3507 0.046 Uiso 1 1 calc R U . . .
C32 C 0.5966(5) 1.0712(3) 0.4110(3) 0.0391(10) Uani 1 1 d . . . . .
H32 H 0.6304 1.0717 0.4655 0.047 Uiso 1 1 calc R U . . .
H32A H 0.4970 1.1041 0.4046 0.047 Uiso 1 1 calc R U . . .
C35 C 0.1656(4) 0.7521(4) 0.2238(2) 0.0372(9) Uani 1 1 d . . . . .
H35 H 0.0829 0.6939 0.2146 0.045 Uiso 1 1 calc R U . . .
H35A H 0.2020 0.7748 0.1748 0.045 Uiso 1 1 calc R U . . .
C27 C 0.3275(4) 0.6854(4) 0.7764(2) 0.0347(9) Uani 1 1 d . . . . .
H27 H 0.3491 0.7652 0.8040 0.042 Uiso 1 1 calc R U . . .
H27A H 0.3305 0.6148 0.8130 0.042 Uiso 1 1 calc R U . . .
C17 C 0.6897(5) 0.3628(4) 0.5481(2) 0.0363(9) Uani 1 1 d . . . . .
H17 H 0.7527 0.4333 0.5353 0.044 Uiso 1 1 calc R U . . .
H17A H 0.6405 0.3290 0.5006 0.044 Uiso 1 1 calc R U . . .
C33 C 0.2660(5) 0.9079(4) 0.3112(3) 0.0389(10) Uani 1 1 d . . . . .
H33 H 0.3064 0.9833 0.2878 0.047 Uiso 1 1 calc R U . . .
H33A H 0.2500 0.9279 0.3643 0.047 Uiso 1 1 calc R U . . .
C25 C 0.2020(4) 0.6049(4) 0.6624(2) 0.0333(9) Uani 1 1 d . . . . .
H25 H 0.1458 0.5265 0.6665 0.040 Uiso 1 1 calc R U . . .
H25A H 0.1687 0.6473 0.6143 0.040 Uiso 1 1 calc R U . . .
C21 C 0.3094(5) 0.2733(4) 0.5037(3) 0.0372(10) Uani 1 1 d . . . . .
H21 H 0.3576 0.2212 0.5447 0.045 Uiso 1 1 calc R U . . .
H21A H 0.3751 0.2833 0.4633 0.045 Uiso 1 1 calc R U . . .
C19 C 0.7681(4) 0.2963(4) 0.6705(2) 0.0385(10) Uani 1 1 d . . . . .
H19 H 0.8411 0.3605 0.6872 0.046 Uiso 1 1 calc R U . . .
H19A H 0.7828 0.2207 0.7030 0.046 Uiso 1 1 calc R U . . .
C34 C 0.1255(5) 0.8686(4) 0.2672(3) 0.0411(10) Uani 1 1 d . . . . .
H34 H 0.0514 0.8485 0.3020 0.049 Uiso 1 1 calc R U . . .
H34A H 0.0887 0.9362 0.2322 0.049 Uiso 1 1 calc R U . . .
C29 C 0.7071(5) 0.9440(4) 0.3240(2) 0.0377(10) Uani 1 1 d . . . . .
H29 H 0.6575 0.9364 0.2725 0.045 Uiso 1 1 calc R U . . .
H29A H 0.7736 0.8718 0.3330 0.045 Uiso 1 1 calc R U . . .
C26 C 0.1825(5) 0.6919(5) 0.7296(2) 0.0501(12) Uani 1 1 d . . . . .
H26 H 0.1606 0.7791 0.7124 0.060 Uiso 1 1 calc R U . . .
H26A H 0.1042 0.6614 0.7590 0.060 Uiso 1 1 calc R U . . .
C22 C 0.1696(5) 0.2134(4) 0.4729(3) 0.0490(12) Uani 1 1 d . . . . .
H22 H 0.1849 0.1543 0.4311 0.059 Uiso 1 1 calc R U . . .
H22A H 0.1238 0.1675 0.5130 0.059 Uiso 1 1 calc R U . . .
C18 C 0.7746(5) 0.2638(5) 0.5887(3) 0.0507(12) Uani 1 1 d . . . . .
H18 H 0.8751 0.2643 0.5750 0.061 Uiso 1 1 calc R U . . .
H18A H 0.7322 0.1796 0.5773 0.061 Uiso 1 1 calc R U . . .
C24 C 0.1243(5) 0.4230(4) 0.5036(3) 0.0534(14) Uani 1 1 d . . . . .
H24 H 0.1192 0.5081 0.4807 0.064 Uiso 1 1 calc R U . . .
H24A H 0.0599 0.4205 0.5450 0.064 Uiso 1 1 calc R U . . .
C31 C 0.6946(8) 1.1480(5) 0.3663(5) 0.094(3) Uani 1 1 d . . . . .
H31 H 0.6372 1.1972 0.3269 0.112 Uiso 1 1 calc R U . . .
H31A H 0.7509 1.2077 0.4001 0.112 Uiso 1 1 calc R U . . .
C30 C 0.7873(8) 1.0661(6) 0.3325(4) 0.090(2) Uani 1 1 d . . . . .
H30 H 0.8784 1.0553 0.3649 0.108 Uiso 1 1 calc R U . . .
H30A H 0.8096 1.0986 0.2825 0.108 Uiso 1 1 calc R U . . .
Li1 Li 0.4226(7) 0.5176(5) 0.5662(4) 0.0284(13) Uani 1 1 d . . . . .
Li2 Li 0.5047(7) 0.7905(6) 0.3967(4) 0.0331(15) 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 C1 1.848(4) . ?
Si1 C6 1.864(4) . ?
Si1 C15 1.884(4) . ?
Si1 C16 1.887(4) . ?
O3 C28 1.450(4) . ?
O3 C25 1.453(4) . ?
O3 Li1 2.004(7) . ?
O1 C20 1.454(4) . ?
O1 C17 1.456(5) . ?
O1 Li1 1.967(6) . ?
O5 C32 1.430(4) . ?
O5 C29 1.445(4) . ?
O5 Li2 1.938(7) . ?
O4 C36 1.433(4) . ?
O4 C33 1.450(5) . ?
O4 Li2 1.967(7) . ?
O2 C21 1.437(4) . ?
O2 C24 1.442(5) . ?
O2 Li1 1.989(7) . ?
C6 C14 1.388(5) . ?
C6 C5 1.453(5) . ?
C14 C13 1.393(5) . ?
C14 H14 0.9500 . ?
C3 C2 1.404(5) . ?
C3 C4 1.465(5) . ?
C3 Li2 2.174(7) . ?
C3 Li1 2.448(8) . ?
C3 H3 0.9500 . ?
C2 C10 1.447(5) . ?
C2 C1 1.474(5) . ?
C2 Li2 2.384(7) . ?
C11 C12 1.361(5) . ?
C11 C5 1.446(5) . ?
C11 H11 0.9500 . ?
C5 C4 1.410(5) . ?
C5 Li2 2.590(7) . ?
C15 H15 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C4 Li2 2.177(8) . ?
C4 Li1 2.329(7) . ?
C4 H4 0.9500 . ?
C36 C35 1.509(5) . ?
C36 H36 0.9900 . ?
C36 H36A 0.9900 . ?
C16 H16 0.9800 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C20 C19 1.521(5) . ?
C20 H20 0.9900 . ?
C20 H20A 0.9900 . ?
C7 C8 1.384(6) . ?
C7 C1 1.407(5) . ?
C7 H7 0.9500 . ?
C13 C12 1.412(5) . ?
C13 H13 0.9500 . ?
C1 Li2 2.746(8) . ?
C28 C27 1.507(5) . ?
C28 H28 0.9900 . ?
C28 H28A 0.9900 . ?
C12 H12 0.9500 . ?
C10 C9 1.368(6) . ?
C10 H10 0.9500 . ?
C23 C22 1.504(6) . ?
C23 C24 1.509(6) . ?
C23 H23 0.9900 . ?
C23 H23A 0.9900 . ?
C9 C8 1.402(6) . ?
C9 H9 0.9500 . ?
C8 H8 0.9500 . ?
C32 C31 1.503(7) . ?
C32 H32 0.9900 . ?
C32 H32A 0.9900 . ?
C35 C34 1.522(6) . ?
C35 H35 0.9900 . ?
C35 H35A 0.9900 . ?
C27 C26 1.525(6) . ?
C27 H27 0.9900 . ?
C27 H27A 0.9900 . ?
C17 C18 1.466(6) . ?
C17 H17 0.9900 . ?
C17 H17A 0.9900 . ?
C33 C34 1.523(6) . ?
C33 H33 0.9900 . ?
C33 H33A 0.9900 . ?
C25 C26 1.531(6) . ?
C25 H25 0.9900 . ?
C25 H25A 0.9900 . ?
C21 C22 1.509(6) . ?
C21 H21 0.9900 . ?
C21 H21A 0.9900 . ?
C19 C18 1.498(6) . ?
C19 H19 0.9900 . ?
C19 H19A 0.9900 . ?
C34 H34 0.9900 . ?
C34 H34A 0.9900 . ?
C29 C30 1.497(7) . ?
C29 H29 0.9900 . ?
C29 H29A 0.9900 . ?
C26 H26 0.9900 . ?
C26 H26A 0.9900 . ?
C22 H22 0.9900 . ?
C22 H22A 0.9900 . ?
C18 H18 0.9900 . ?
C18 H18A 0.9900 . ?
C24 H24 0.9900 . ?
C24 H24A 0.9900 . ?
C31 C30 1.399(8) . ?
C31 H31 0.9900 . ?
C31 H31A 0.9900 . ?
C30 H30 0.9900 . ?
C30 H30A 0.9900 . ?

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 C6 115.08(16) . . ?
C1 Si1 C15 109.13(17) . . ?
C6 Si1 C15 107.94(17) . . ?
C1 Si1 C16 109.7(2) . . ?
C6 Si1 C16 109.71(17) . . ?
C15 Si1 C16 104.8(2) . . ?
C28 O3 C25 107.5(3) . . ?
C28 O3 Li1 125.6(3) . . ?
C25 O3 Li1 115.4(3) . . ?
C20 O1 C17 109.0(3) . . ?
C20 O1 Li1 127.3(3) . . ?
C17 O1 Li1 123.6(3) . . ?
C32 O5 C29 110.1(3) . . ?
C32 O5 Li2 133.7(3) . . ?
C29 O5 Li2 116.2(3) . . ?
C36 O4 C33 108.6(3) . . ?
C36 O4 Li2 123.2(3) . . ?
C33 O4 Li2 113.2(3) . . ?
C21 O2 C24 109.2(3) . . ?
C21 O2 Li1 119.7(3) . . ?
C24 O2 Li1 126.4(3) . . ?
C14 C6 C5 118.6(3) . . ?
C14 C6 Si1 116.3(3) . . ?
C5 C6 Si1 124.9(2) . . ?
C6 C14 C13 124.8(3) . . ?
C6 C14 H14 117.6 . . ?
C13 C14 H14 117.6 . . ?
C2 C3 C4 134.1(3) . . ?
C2 C3 Li2 80.5(3) . . ?
C4 C3 Li2 70.5(3) . . ?
C2 C3 Li1 121.7(3) . . ?
C4 C3 Li1 67.8(2) . . ?
Li2 C3 Li1 136.4(3) . . ?
C2 C3 H3 112.9 . . ?
C4 C3 H3 112.9 . . ?
Li2 C3 H3 129.9 . . ?
Li1 C3 H3 79.1 . . ?
C3 C2 C10 118.1(3) . . ?
C3 C2 C1 126.9(3) . . ?
C10 C2 C1 115.0(3) . . ?
C3 C2 Li2 64.0(2) . . ?
C10 C2 Li2 122.6(3) . . ?
C1 C2 Li2 87.4(3) . . ?
C12 C11 C5 123.8(3) . . ?
C12 C11 H11 118.1 . . ?
C5 C11 H11 118.1 . . ?
C4 C5 C11 116.8(3) . . ?
C4 C5 C6 128.1(3) . . ?
C11 C5 C6 115.1(3) . . ?
C4 C5 Li2 57.2(2) . . ?
C11 C5 Li2 121.9(3) . . ?
C6 C5 Li2 95.7(3) . . ?
Si1 C15 H15 109.5 . . ?
Si1 C15 H15A 109.5 . . ?
H15 C15 H15A 109.5 . . ?
Si1 C15 H15B 109.5 . . ?
H15 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C5 C4 C3 135.6(3) . . ?
C5 C4 Li2 89.8(3) . . ?
C3 C4 Li2 70.2(3) . . ?
C5 C4 Li1 105.8(3) . . ?
C3 C4 Li1 76.6(3) . . ?
Li2 C4 Li1 144.5(3) . . ?
C5 C4 H4 112.2 . . ?
C3 C4 H4 112.2 . . ?
Li2 C4 H4 116.9 . . ?
Li1 C4 H4 86.9 . . ?
O4 C36 C35 104.5(3) . . ?
O4 C36 H36 110.8 . . ?
C35 C36 H36 110.8 . . ?
O4 C36 H36A 110.8 . . ?
C35 C36 H36A 110.8 . . ?
H36 C36 H36A 108.9 . . ?
Si1 C16 H16 109.5 . . ?
Si1 C16 H16A 109.5 . . ?
H16 C16 H16A 109.5 . . ?
Si1 C16 H16B 109.5 . . ?
H16 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
O1 C20 C19 104.4(3) . . ?
O1 C20 H20 110.9 . . ?
C19 C20 H20 110.9 . . ?
O1 C20 H20A 110.9 . . ?
C19 C20 H20A 110.9 . . ?
H20 C20 H20A 108.9 . . ?
C8 C7 C1 124.5(4) . . ?
C8 C7 H7 117.7 . . ?
C1 C7 H7 117.7 . . ?
C14 C13 C12 117.0(3) . . ?
C14 C13 H13 121.5 . . ?
C12 C13 H13 121.5 . . ?
C7 C1 C2 117.7(3) . . ?
C7 C1 Si1 117.9(3) . . ?
C2 C1 Si1 123.8(3) . . ?
C7 C1 Li2 124.0(3) . . ?
C2 C1 Li2 60.2(2) . . ?
Si1 C1 Li2 94.3(2) . . ?
O3 C28 C27 104.2(3) . . ?
O3 C28 H28 110.9 . . ?
C27 C28 H28 110.9 . . ?
O3 C28 H28A 110.9 . . ?
C27 C28 H28A 110.9 . . ?
H28 C28 H28A 108.9 . . ?
C11 C12 C13 120.5(3) . . ?
C11 C12 H12 119.8 . . ?
C13 C12 H12 119.8 . . ?
C9 C10 C2 123.4(4) . . ?
C9 C10 H10 118.3 . . ?
C2 C10 H10 118.3 . . ?
C22 C23 C24 101.7(3) . . ?
C22 C23 H23 111.4 . . ?
C24 C23 H23 111.4 . . ?
C22 C23 H23A 111.4 . . ?
C24 C23 H23A 111.4 . . ?
H23 C23 H23A 109.3 . . ?
C10 C9 C8 120.7(4) . . ?
C10 C9 H9 119.6 . . ?
C8 C9 H9 119.6 . . ?
C7 C8 C9 117.8(4) . . ?
C7 C8 H8 121.1 . . ?
C9 C8 H8 121.1 . . ?
O5 C32 C31 104.2(4) . . ?
O5 C32 H32 110.9 . . ?
C31 C32 H32 110.9 . . ?
O5 C32 H32A 110.9 . . ?
C31 C32 H32A 110.9 . . ?
H32 C32 H32A 108.9 . . ?
C36 C35 C34 101.6(3) . . ?
C36 C35 H35 111.5 . . ?
C34 C35 H35 111.5 . . ?
C36 C35 H35A 111.5 . . ?
C34 C35 H35A 111.5 . . ?
H35 C35 H35A 109.3 . . ?
C28 C27 C26 102.2(3) . . ?
C28 C27 H27 111.3 . . ?
C26 C27 H27 111.3 . . ?
C28 C27 H27A 111.3 . . ?
C26 C27 H27A 111.3 . . ?
H27 C27 H27A 109.2 . . ?
O1 C17 C18 106.7(3) . . ?
O1 C17 H17 110.4 . . ?
C18 C17 H17 110.4 . . ?
O1 C17 H17A 110.4 . . ?
C18 C17 H17A 110.4 . . ?
H17 C17 H17A 108.6 . . ?
O4 C33 C34 106.2(3) . . ?
O4 C33 H33 110.5 . . ?
C34 C33 H33 110.5 . . ?
O4 C33 H33A 110.5 . . ?
C34 C33 H33A 110.5 . . ?
H33 C33 H33A 108.7 . . ?
O3 C25 C26 106.9(3) . . ?
O3 C25 H25 110.3 . . ?
C26 C25 H25 110.3 . . ?
O3 C25 H25A 110.3 . . ?
C26 C25 H25A 110.3 . . ?
H25 C25 H25A 108.6 . . ?
O2 C21 C22 105.3(3) . . ?
O2 C21 H21 110.7 . . ?
C22 C21 H21 110.7 . . ?
O2 C21 H21A 110.7 . . ?
C22 C21 H21A 110.7 . . ?
H21 C21 H21A 108.8 . . ?
C18 C19 C20 102.7(3) . . ?
C18 C19 H19 111.2 . . ?
C20 C19 H19 111.2 . . ?
C18 C19 H19A 111.2 . . ?
C20 C19 H19A 111.2 . . ?
H19 C19 H19A 109.1 . . ?
C35 C34 C33 104.0(3) . . ?
C35 C34 H34 111.0 . . ?
C33 C34 H34 111.0 . . ?
C35 C34 H34A 111.0 . . ?
C33 C34 H34A 111.0 . . ?
H34 C34 H34A 109.0 . . ?
O5 C29 C30 105.6(4) . . ?
O5 C29 H29 110.6 . . ?
C30 C29 H29 110.6 . . ?
O5 C29 H29A 110.6 . . ?
C30 C29 H29A 110.6 . . ?
H29 C29 H29A 108.8 . . ?
C27 C26 C25 103.7(3) . . ?
C27 C26 H26 111.0 . . ?
C25 C26 H26 111.0 . . ?
C27 C26 H26A 111.0 . . ?
C25 C26 H26A 111.0 . . ?
H26 C26 H26A 109.0 . . ?
C23 C22 C21 103.1(3) . . ?
C23 C22 H22 111.1 . . ?
C21 C22 H22 111.1 . . ?
C23 C22 H22A 111.1 . . ?
C21 C22 H22A 111.1 . . ?
H22 C22 H22A 109.1 . . ?
C17 C18 C19 104.2(4) . . ?
C17 C18 H18 110.9 . . ?
C19 C18 H18 110.9 . . ?
C17 C18 H18A 110.9 . . ?
C19 C18 H18A 110.9 . . ?
H18 C18 H18A 108.9 . . ?
O2 C24 C23 106.7(4) . . ?
O2 C24 H24 110.4 . . ?
C23 C24 H24 110.4 . . ?
O2 C24 H24A 110.4 . . ?
C23 C24 H24A 110.4 . . ?
H24 C24 H24A 108.6 . . ?
C30 C31 C32 108.5(4) . . ?
C30 C31 H31 110.0 . . ?
C32 C31 H31 110.0 . . ?
C30 C31 H31A 110.0 . . ?
C32 C31 H31A 110.0 . . ?
H31 C31 H31A 108.4 . . ?
C31 C30 C29 105.0(5) . . ?
C31 C30 H30 110.8 . . ?
C29 C30 H30 110.8 . . ?
C31 C30 H30A 110.8 . . ?
C29 C30 H30A 110.8 . . ?
H30 C30 H30A 108.8 . . ?
O1 Li1 O2 101.7(3) . . ?
O1 Li1 O3 103.3(3) . . ?
O2 Li1 O3 101.3(3) . . ?
O1 Li1 C4 131.8(4) . . ?
O2 Li1 C4 109.2(3) . . ?
O3 Li1 C4 105.7(3) . . ?
O1 Li1 C3 102.2(3) . . ?
O2 Li1 C3 103.6(3) . . ?
O3 Li1 C3 139.6(3) . . ?
C4 Li1 C3 35.60(15) . . ?
O5 Li2 O4 97.1(3) . . ?
O5 Li2 C3 151.4(4) . . ?
O4 Li2 C3 109.8(3) . . ?
O5 Li2 C4 139.7(4) . . ?
O4 Li2 C4 108.2(3) . . ?
C3 Li2 C4 39.35(17) . . ?
O5 Li2 C2 119.7(3) . . ?
O4 Li2 C2 124.0(3) . . ?
C3 Li2 C2 35.49(16) . . ?
C4 Li2 C2 70.6(2) . . ?
O5 Li2 C5 106.8(3) . . ?
O4 Li2 C5 122.0(3) . . ?
C3 Li2 C5 67.3(2) . . ?
C4 Li2 C5 32.99(15) . . ?
C2 Li2 C5 88.0(2) . . ?
O5 Li2 C1 90.1(3) . . ?
O4 Li2 C1 149.1(3) . . ?
C3 Li2 C1 61.8(2) . . ?
C4 Li2 C1 84.0(2) . . ?
C2 Li2 C1 32.42(14) . . ?
C5 Li2 C1 83.9(2) . . ?

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
C1 Si1 C6 C14 -159.4(3) . . . . ?
C15 Si1 C6 C14 78.5(3) . . . . ?
C16 Si1 C6 C14 -35.2(3) . . . . ?
C1 Si1 C6 C5 25.7(3) . . . . ?
C15 Si1 C6 C5 -96.4(3) . . . . ?
C16 Si1 C6 C5 149.9(3) . . . . ?
C5 C6 C14 C13 -1.7(5) . . . . ?
Si1 C6 C14 C13 -176.9(3) . . . . ?
C4 C3 C2 C10 -165.3(4) . . . . ?
Li2 C3 C2 C10 -114.8(3) . . . . ?
Li1 C3 C2 C10 105.9(4) . . . . ?
C4 C3 C2 C1 14.1(6) . . . . ?
Li2 C3 C2 C1 64.6(4) . . . . ?
Li1 C3 C2 C1 -74.7(5) . . . . ?
C4 C3 C2 Li2 -50.5(4) . . . . ?
Li1 C3 C2 Li2 -139.4(3) . . . . ?
C12 C11 C5 C4 173.7(4) . . . . ?
C12 C11 C5 C6 -5.0(5) . . . . ?
C12 C11 C5 Li2 -119.9(4) . . . . ?
C14 C6 C5 C4 -173.4(3) . . . . ?
Si1 C6 C5 C4 1.4(5) . . . . ?
C14 C6 C5 C11 5.1(5) . . . . ?
Si1 C6 C5 C11 179.9(3) . . . . ?
C14 C6 C5 Li2 134.4(3) . . . . ?
Si1 C6 C5 Li2 -50.8(3) . . . . ?
C11 C5 C4 C3 173.1(4) . . . . ?
C6 C5 C4 C3 -8.4(7) . . . . ?
Li2 C5 C4 C3 60.8(4) . . . . ?
C11 C5 C4 Li2 112.3(3) . . . . ?
C6 C5 C4 Li2 -69.2(4) . . . . ?
C11 C5 C4 Li1 -100.1(3) . . . . ?
C6 C5 C4 Li1 78.5(4) . . . . ?
Li2 C5 C4 Li1 147.7(3) . . . . ?
C2 C3 C4 C5 -14.2(7) . . . . ?
Li2 C3 C4 C5 -68.1(5) . . . . ?
Li1 C3 C4 C5 99.0(5) . . . . ?
C2 C3 C4 Li2 53.9(4) . . . . ?
Li1 C3 C4 Li2 167.1(3) . . . . ?
C2 C3 C4 Li1 -113.2(4) . . . . ?
Li2 C3 C4 Li1 -167.1(3) . . . . ?
C33 O4 C36 C35 31.2(4) . . . . ?
Li2 O4 C36 C35 167.0(3) . . . . ?
C17 O1 C20 C19 14.9(4) . . . . ?
Li1 O1 C20 C19 -168.2(3) . . . . ?
C6 C14 C13 C12 -2.5(6) . . . . ?
C8 C7 C1 C2 -3.7(5) . . . . ?
C8 C7 C1 Si1 167.9(3) . . . . ?
C8 C7 C1 Li2 -74.8(5) . . . . ?
C3 C2 C1 C7 -169.7(3) . . . . ?
C10 C2 C1 C7 9.7(4) . . . . ?
Li2 C2 C1 C7 -115.3(3) . . . . ?
C3 C2 C1 Si1 19.2(5) . . . . ?
C10 C2 C1 Si1 -161.3(3) . . . . ?
Li2 C2 C1 Si1 73.6(3) . . . . ?
C3 C2 C1 Li2 -54.4(3) . . . . ?
C10 C2 C1 Li2 125.0(3) . . . . ?
C6 Si1 C1 C7 149.1(3) . . . . ?
C15 Si1 C1 C7 -89.5(3) . . . . ?
C16 Si1 C1 C7 24.8(3) . . . . ?
C6 Si1 C1 C2 -39.9(3) . . . . ?
C15 Si1 C1 C2 81.6(3) . . . . ?
C16 Si1 C1 C2 -164.1(3) . . . . ?
C6 Si1 C1 Li2 16.7(2) . . . . ?
C15 Si1 C1 Li2 138.2(2) . . . . ?
C16 Si1 C1 Li2 -107.5(2) . . . . ?
C25 O3 C28 C27 33.7(4) . . . . ?
Li1 O3 C28 C27 174.8(3) . . . . ?
C5 C11 C12 C13 1.0(6) . . . . ?
C14 C13 C12 C11 2.8(6) . . . . ?
C3 C2 C10 C9 170.0(3) . . . . ?
C1 C2 C10 C9 -9.5(5) . . . . ?
Li2 C2 C10 C9 94.3(4) . . . . ?
C2 C10 C9 C8 2.5(6) . . . . ?
C1 C7 C8 C9 -3.6(6) . . . . ?
C10 C9 C8 C7 4.3(6) . . . . ?
C29 O5 C32 C31 3.9(6) . . . . ?
Li2 O5 C32 C31 -174.7(5) . . . . ?
O4 C36 C35 C34 -39.0(4) . . . . ?
O3 C28 C27 C26 -39.8(4) . . . . ?
C20 O1 C17 C18 7.8(5) . . . . ?
Li1 O1 C17 C18 -169.3(4) . . . . ?
C36 O4 C33 C34 -10.2(4) . . . . ?
Li2 O4 C33 C34 -150.7(3) . . . . ?
C28 O3 C25 C26 -13.6(4) . . . . ?
Li1 O3 C25 C26 -159.2(3) . . . . ?
C24 O2 C21 C22 -14.5(5) . . . . ?
Li1 O2 C21 C22 -171.8(3) . . . . ?
O1 C20 C19 C18 -31.1(4) . . . . ?
C36 C35 C34 C33 32.2(4) . . . . ?
O4 C33 C34 C35 -14.6(4) . . . . ?
C32 O5 C29 C30 11.6(5) . . . . ?
Li2 O5 C29 C30 -169.5(5) . . . . ?
C28 C27 C26 C25 30.8(5) . . . . ?
O3 C25 C26 C27 -11.5(5) . . . . ?
C24 C23 C22 C21 -36.8(5) . . . . ?
O2 C21 C22 C23 32.3(5) . . . . ?
O1 C17 C18 C19 -27.6(5) . . . . ?
C20 C19 C18 C17 35.9(5) . . . . ?
C21 O2 C24 C23 -9.2(5) . . . . ?
Li1 O2 C24 C23 146.2(4) . . . . ?
C22 C23 C24 O2 28.8(5) . . . . ?
O5 C32 C31 C30 -19.4(8) . . . . ?
C32 C31 C30 C29 26.4(9) . . . . ?
O5 C29 C30 C31 -23.4(7) . . . . ?

_refine_diff_density_max         0.540
_refine_diff_density_min         -0.314
_refine_diff_density_rms         0.058

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_ydkr_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 2191233'
loop_
_audit_author_name
_audit_author_address
'Takuya Kuwabara'
;Ochanomizu University
Japan
;
_audit_update_record             
;
2022-07-19 deposited with the CCDC.	2022-10-13 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C60 H78 Li10 O5 Si3'
_chemical_formula_sum            'C60 H78 Li10 O5 Si3'
_chemical_formula_weight         1032.89

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'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'

_space_group_crystal_system      trigonal
_space_group_IT_number           161
_space_group_name_H-M_alt        'R 3 c :H'
_space_group_name_Hall           'R 3 -2"c'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x+y, y, z+1/2'
'x, x-y, z+1/2'
'-y, -x, z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'-x+y+2/3, y+1/3, z+5/6'
'x+2/3, x-y+1/3, z+5/6'
'-y+2/3, -x+1/3, z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-x+y+1/3, y+2/3, z+7/6'
'x+1/3, x-y+2/3, z+7/6'
'-y+1/3, -x+2/3, z+7/6'

_cell_length_a                   15.249(4)
_cell_length_b                   15.249(4)
_cell_length_c                   44.207(11)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     8902(5)
_cell_formula_units_Z            6
_cell_measurement_temperature    93(2)
_cell_measurement_reflns_used    8699
_cell_measurement_theta_min      1.7963
_cell_measurement_theta_max      31.2108

_exptl_crystal_description       Prism
_exptl_crystal_colour            Black
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.156
_exptl_crystal_F_000             3300
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.160
_exptl_crystal_size_min          0.130
_exptl_absorpt_coefficient_mu    0.125
_shelx_estimated_absorpt_T_min   0.978
_shelx_estimated_absorpt_T_max   0.984
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8544
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      93(2)
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'rotating-anode X-ray tube'
_diffrn_radiation_monochromator  Confocal
_diffrn_measurement_device_type  'Rigaku VariMax Saturn'
_diffrn_measurement_method       'omega scans'
_diffrn_detector_area_resol_mean 28.5714
_diffrn_reflns_number            22798
_diffrn_reflns_av_unetI/netI     0.0513
_diffrn_reflns_av_R_equivalents  0.0565
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -57
_diffrn_reflns_limit_l_max       45
_diffrn_reflns_theta_min         3.008
_diffrn_reflns_theta_max         27.470
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.921
_diffrn_reflns_point_group_measured_fraction_full 0.931
_reflns_number_total             4195
_reflns_number_gt                3660
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.849
_reflns_Friedel_fraction_max     0.847
_reflns_Friedel_fraction_full    0.869

_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.
;

_computing_data_collection       'RIGAKU CrystalClear'
_computing_cell_refinement       'RIGAKU CrystalClear'
_computing_data_reduction        'RIGAKU CrystalClear'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Yadokari-XG 2009(Wakita Nemoto et al.)'
_computing_publication_material  'Yadokari-XG 2009(Wakita,Nemoto et al.)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0799P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
;
 Flack x determined using 1255 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.02(6)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         4195
_refine_ls_number_parameters     239
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0641
_refine_ls_R_factor_gt           0.0513
_refine_ls_wR_factor_ref         0.1340
_refine_ls_wR_factor_gt          0.1179
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_restrained_S_all      1.065
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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 0.87557(7) 0.66754(7) 0.49772(3) 0.0290(2) Uani 1 1 d . . . . .
O2 O 1.0000 1.0000 0.52936(9) 0.0233(8) Uani 1 3 d S T P . .
O1 O 1.0000 1.0000 0.46640(9) 0.0223(8) Uani 1 3 d S T P . .
O3 O 0.40071(18) 0.58878(19) 0.44727(6) 0.0328(6) Uani 1 1 d . . . . .
C3 C 0.7558(3) 0.7964(3) 0.48809(10) 0.0367(9) Uani 1 1 d . . . . .
H3 H 0.7070 0.8141 0.4819 0.044 Uiso 1 1 calc R U . . .
C6 C 0.8918(3) 0.7378(2) 0.53341(8) 0.0268(7) Uani 1 1 d . . . . .
C12 C 0.8954(3) 0.8074(3) 0.59299(8) 0.0328(8) Uani 1 1 d . . . . .
H12 H 0.8962 0.8304 0.6130 0.039 Uiso 1 1 calc R U . . .
C4 C 0.7636(3) 0.7948(3) 0.52117(9) 0.0337(8) Uani 1 1 d . . . . .
H4 H 0.7182 0.8107 0.5312 0.040 Uiso 1 1 calc R U . . .
C5 C 0.8228(3) 0.7753(2) 0.54144(8) 0.0280(7) Uani 1 1 d . . . . .
C11 C 0.8238(3) 0.8006(3) 0.57320(8) 0.0333(8) Uani 1 1 d . . . . .
H11 H 0.7723 0.8130 0.5805 0.040 Uiso 1 1 calc R U . . .
C2 C 0.8020(3) 0.7785(3) 0.46362(9) 0.0362(9) Uani 1 1 d . . . . .
C13 C 0.9686(3) 0.7810(3) 0.58450(8) 0.0328(8) Uani 1 1 d . . . . .
H13 H 1.0206 0.7890 0.5980 0.039 Uiso 1 1 calc R U . . .
C14 C 0.9608(3) 0.7425(3) 0.55533(8) 0.0274(7) Uani 1 1 d . . . . .
H14 H 1.0050 0.7180 0.5500 0.033 Uiso 1 1 calc R U . . .
C19 C 0.4894(3) 0.6146(3) 0.46524(9) 0.0392(9) Uani 1 1 d . . . . .
H19 H 0.5512 0.6591 0.4535 0.047 Uiso 1 1 calc R U . . .
H19A H 0.4909 0.5524 0.4706 0.047 Uiso 1 1 calc R U . . .
C16 C 0.9793(3) 0.6360(3) 0.49408(10) 0.0455(10) Uani 1 1 d . . . . .
H16 H 1.0448 0.6988 0.4930 0.068 Uiso 1 1 calc R U . . .
H16A H 0.9689 0.5963 0.4756 0.068 Uiso 1 1 calc R U . . .
H16B H 0.9783 0.5966 0.5117 0.068 Uiso 1 1 calc R U . . .
C1 C 0.8758(3) 0.7430(3) 0.46462(9) 0.0335(8) Uani 1 1 d . . . . .
C20 C 0.4869(3) 0.6675(4) 0.49322(10) 0.0529(11) Uani 1 1 d . . . . .
H20 H 0.4913 0.7319 0.4878 0.079 Uiso 1 1 calc R U . . .
H20A H 0.5443 0.6805 0.5062 0.079 Uiso 1 1 calc R U . . .
H20B H 0.4235 0.6249 0.5041 0.079 Uiso 1 1 calc R U . . .
C10 C 0.7786(4) 0.7983(3) 0.43299(11) 0.0520(13) Uani 1 1 d . . . . .
H10 H 0.7202 0.8043 0.4298 0.062 Uiso 1 1 calc R U . . .
C9 C 0.8402(4) 0.8085(3) 0.40876(10) 0.0582(15) Uani 1 1 d . . . . .
H9 H 0.8266 0.8277 0.3897 0.070 Uiso 1 1 calc R U . . .
C15 C 0.7508(3) 0.5468(3) 0.49801(9) 0.0405(9) Uani 1 1 d . . . . .
H15 H 0.7488 0.5045 0.5150 0.061 Uiso 1 1 calc R U . . .
H15A H 0.7422 0.5104 0.4790 0.061 Uiso 1 1 calc R U . . .
H15B H 0.6960 0.5623 0.5002 0.061 Uiso 1 1 calc R U . . .
C17 C 0.2933(4) 0.4858(4) 0.40674(12) 0.0616(14) Uani 1 1 d . . . . .
H17 H 0.2390 0.4513 0.4216 0.092 Uiso 1 1 calc R U . . .
H17A H 0.2862 0.4378 0.3908 0.092 Uiso 1 1 calc R U . . .
H17B H 0.2890 0.5422 0.3978 0.092 Uiso 1 1 calc R U . . .
C7 C 0.9316(4) 0.7507(3) 0.43879(9) 0.0420(10) Uani 1 1 d . . . . .
H7 H 0.9785 0.7271 0.4398 0.050 Uiso 1 1 calc R U . . .
C8 C 0.9224(4) 0.7914(3) 0.41138(10) 0.0532(12) Uani 1 1 d . . . . .
H8 H 0.9693 0.8067 0.3953 0.064 Uiso 1 1 calc R U . . .
C18 C 0.3925(4) 0.5249(3) 0.42180(10) 0.0438(10) Uani 1 1 d . . . . .
H18 H 0.4001 0.4675 0.4290 0.053 Uiso 1 1 calc R U . . .
H18A H 0.4475 0.5644 0.4072 0.053 Uiso 1 1 calc R U . . .
Li2 Li 0.9260(4) 0.9005(4) 0.49813(14) 0.0292(12) Uani 1 1 d . . . . .
Li3 Li 0.8804(5) 0.9590(5) 0.54989(15) 0.0337(13) Uani 1 1 d . . . . .
Li4 Li 0.3333 0.6667 0.4491(3) 0.033(2) Uani 1 3 d S T P . .
Li1 Li 0.8843(5) 0.9638(5) 0.44538(16) 0.0381(14) 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 C6 1.853(4) . ?
Si1 C1 1.861(4) . ?
Si1 C15 1.873(4) . ?
Si1 C16 1.876(4) . ?
O2 Li3 1.844(6) . ?
O2 Li3 1.844(6) 3_675 ?
O2 Li3 1.844(6) 2_765 ?
O2 Li2 1.941(6) . ?
O2 Li2 1.942(6) 3_675 ?
O2 Li2 1.942(6) 2_765 ?
O1 Li1 1.818(7) . ?
O1 Li1 1.819(7) 2_765 ?
O1 Li1 1.819(7) 3_675 ?
O1 Li2 1.957(7) 2_765 ?
O1 Li2 1.957(7) 3_675 ?
O1 Li2 1.957(7) . ?
O3 C19 1.443(5) . ?
O3 C18 1.453(5) . ?
O3 Li4 1.922(2) . ?
C3 C2 1.390(6) . ?
C3 C4 1.468(6) . ?
C3 Li2 2.309(7) . ?
C3 H3 0.9500 . ?
C6 C14 1.406(5) . ?
C6 C5 1.469(5) . ?
C6 Li3 2.680(7) 2_765 ?
C6 Li2 2.751(7) . ?
C12 C11 1.363(6) . ?
C12 C13 1.413(5) . ?
C12 Li3 2.779(7) 2_765 ?
C12 H12 0.9500 . ?
C4 C5 1.406(5) . ?
C4 Li2 2.403(7) . ?
C4 Li3 2.567(8) . ?
C4 H4 0.9500 . ?
C5 C11 1.455(5) . ?
C5 Li3 2.509(7) . ?
C5 Li2 2.605(7) . ?
C11 Li3 2.356(7) . ?
C11 H11 0.9500 . ?
C2 C10 1.470(5) . ?
C2 C1 1.474(6) . ?
C2 Li2 2.418(7) . ?
C2 Li1 2.582(7) . ?
C13 C14 1.397(5) . ?
C13 Li3 2.405(7) 2_765 ?
C13 H13 0.9500 . ?
C14 Li3 2.380(7) 2_765 ?
C14 H14 0.9500 . ?
C19 C20 1.487(6) . ?
C19 H19 0.9900 . ?
C19 H19A 0.9900 . ?
C16 H16 0.9800 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C1 C7 1.394(6) . ?
C1 Li2 2.591(7) . ?
C1 Li1 2.723(8) 2_765 ?
C20 H20 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C10 C9 1.381(8) . ?
C10 Li1 2.280(8) . ?
C10 H10 0.9500 . ?
C9 C8 1.407(8) . ?
C9 Li1 2.663(8) . ?
C9 H9 0.9500 . ?
C15 H15 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C17 C18 1.478(6) . ?
C17 H17 0.9800 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C7 C8 1.400(6) . ?
C7 Li1 2.280(7) 2_765 ?
C7 H7 0.9500 . ?
C8 Li1 2.393(8) 2_765 ?
C8 H8 0.9500 . ?
C18 H18 0.9900 . ?
C18 H18A 0.9900 . ?
Li2 Li2 2.364(10) 2_765 ?
Li2 Li2 2.364(10) 3_675 ?
Li2 Li3 2.671(9) . ?
Li2 Li1 2.718(9) . ?
Li3 C14 2.380(7) 3_675 ?
Li3 C13 2.405(7) 3_675 ?
Li3 C6 2.680(7) 3_675 ?
Li3 C12 2.779(7) 3_675 ?
Li3 Li3 2.780(11) 2_765 ?
Li3 Li3 2.780(11) 3_675 ?
Li3 Li2 2.803(8) 3_675 ?
Li4 O3 1.922(2) 3_565 ?
Li4 O3 1.922(2) 2_665 ?
Li1 C7 2.281(7) 3_675 ?
Li1 C8 2.393(8) 3_675 ?
Li1 Li1 2.707(12) 2_765 ?
Li1 Li1 2.707(12) 3_675 ?
Li1 C1 2.723(8) 3_675 ?
Li1 Li2 2.800(9) 3_675 ?

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
C6 Si1 C1 110.72(16) . . ?
C6 Si1 C15 109.79(18) . . ?
C1 Si1 C15 107.45(17) . . ?
C6 Si1 C16 109.61(18) . . ?
C1 Si1 C16 110.5(2) . . ?
C15 Si1 C16 108.8(2) . . ?
Li3 O2 Li3 97.9(3) . 3_675 ?
Li3 O2 Li3 97.9(3) . 2_765 ?
Li3 O2 Li3 97.9(3) 3_675 2_765 ?
Li3 O2 Li2 89.7(3) . . ?
Li3 O2 Li2 163.6(3) 3_675 . ?
Li3 O2 Li2 95.5(3) 2_765 . ?
Li3 O2 Li2 95.5(3) . 3_675 ?
Li3 O2 Li2 89.7(3) 3_675 3_675 ?
Li3 O2 Li2 163.6(3) 2_765 3_675 ?
Li2 O2 Li2 75.0(3) . 3_675 ?
Li3 O2 Li2 163.6(3) . 2_765 ?
Li3 O2 Li2 95.5(3) 3_675 2_765 ?
Li3 O2 Li2 89.7(3) 2_765 2_765 ?
Li2 O2 Li2 75.0(3) . 2_765 ?
Li2 O2 Li2 75.0(3) 3_675 2_765 ?
Li1 O1 Li1 96.2(3) . 2_765 ?
Li1 O1 Li1 96.2(3) . 3_675 ?
Li1 O1 Li1 96.2(3) 2_765 3_675 ?
Li1 O1 Li2 164.7(3) . 2_765 ?
Li1 O1 Li2 92.0(3) 2_765 2_765 ?
Li1 O1 Li2 95.7(3) 3_675 2_765 ?
Li1 O1 Li2 95.7(3) . 3_675 ?
Li1 O1 Li2 164.7(3) 2_765 3_675 ?
Li1 O1 Li2 92.0(3) 3_675 3_675 ?
Li2 O1 Li2 74.3(3) 2_765 3_675 ?
Li1 O1 Li2 92.0(3) . . ?
Li1 O1 Li2 95.7(3) 2_765 . ?
Li1 O1 Li2 164.7(3) 3_675 . ?
Li2 O1 Li2 74.3(3) 2_765 . ?
Li2 O1 Li2 74.3(3) 3_675 . ?
C19 O3 C18 111.4(3) . . ?
C19 O3 Li4 121.7(3) . . ?
C18 O3 Li4 123.6(4) . . ?
C2 C3 C4 135.9(3) . . ?
C2 C3 Li2 77.2(3) . . ?
C4 C3 Li2 75.4(2) . . ?
C2 C3 H3 112.0 . . ?
C4 C3 H3 112.0 . . ?
Li2 C3 H3 129.1 . . ?
C14 C6 C5 118.5(3) . . ?
C14 C6 Si1 119.8(3) . . ?
C5 C6 Si1 121.1(3) . . ?
C14 C6 Li3 62.4(2) . 2_765 ?
C5 C6 Li3 85.8(2) . 2_765 ?
Si1 C6 Li3 129.3(2) . 2_765 ?
C14 C6 Li2 123.0(3) . . ?
C5 C6 Li2 68.7(2) . . ?
Si1 C6 Li2 87.08(18) . . ?
Li3 C6 Li2 62.12(19) 2_765 . ?
C11 C12 C13 121.7(3) . . ?
C11 C12 Li3 88.1(2) . 2_765 ?
C13 C12 Li3 59.9(2) . 2_765 ?
C11 C12 H12 119.1 . . ?
C13 C12 H12 119.1 . . ?
Li3 C12 H12 123.3 2_765 . ?
C5 C4 C3 134.8(3) . . ?
C5 C4 Li2 81.8(3) . . ?
C3 C4 Li2 68.4(2) . . ?
C5 C4 Li3 71.7(2) . . ?
C3 C4 Li3 119.9(3) . . ?
Li2 C4 Li3 64.9(2) . . ?
C5 C4 H4 112.6 . . ?
C3 C4 H4 112.6 . . ?
Li2 C4 H4 131.7 . . ?
Li3 C4 H4 76.1 . . ?
C4 C5 C11 118.8(3) . . ?
C4 C5 C6 126.1(3) . . ?
C11 C5 C6 115.0(3) . . ?
C4 C5 Li3 76.2(2) . . ?
C11 C5 Li3 66.9(2) . . ?
C6 C5 Li3 123.4(3) . . ?
C4 C5 Li2 65.9(2) . . ?
C11 C5 Li2 126.3(3) . . ?
C6 C5 Li2 79.6(2) . . ?
Li3 C5 Li2 62.9(2) . . ?
C12 C11 C5 122.7(3) . . ?
C12 C11 Li3 109.5(3) . . ?
C5 C11 Li3 78.5(3) . . ?
C12 C11 H11 118.6 . . ?
C5 C11 H11 118.6 . . ?
Li3 C11 H11 81.9 . . ?
C3 C2 C10 118.5(4) . . ?
C3 C2 C1 127.2(3) . . ?
C10 C2 C1 114.3(4) . . ?
C3 C2 Li2 68.7(2) . . ?
C10 C2 Li2 126.9(3) . . ?
C1 C2 Li2 79.4(2) . . ?
C3 C2 Li1 92.6(3) . . ?
C10 C2 Li1 61.5(3) . . ?
C1 C2 Li1 111.7(3) . . ?
Li2 C2 Li1 65.8(2) . . ?
C14 C13 C12 116.8(3) . . ?
C14 C13 Li3 72.0(3) . 2_765 ?
C12 C13 Li3 89.5(3) . 2_765 ?
C14 C13 H13 121.6 . . ?
C12 C13 H13 121.6 . . ?
Li3 C13 H13 107.6 2_765 . ?
C13 C14 C6 124.2(3) . . ?
C13 C14 Li3 74.0(3) . 2_765 ?
C6 C14 Li3 86.1(3) . 2_765 ?
C13 C14 H14 117.9 . . ?
C6 C14 H14 117.9 . . ?
Li3 C14 H14 111.5 2_765 . ?
O3 C19 C20 109.4(3) . . ?
O3 C19 H19 109.8 . . ?
C20 C19 H19 109.8 . . ?
O3 C19 H19A 109.8 . . ?
C20 C19 H19A 109.8 . . ?
H19 C19 H19A 108.3 . . ?
Si1 C16 H16 109.5 . . ?
Si1 C16 H16A 109.5 . . ?
H16 C16 H16A 109.5 . . ?
Si1 C16 H16B 109.5 . . ?
H16 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C7 C1 C2 119.4(4) . . ?
C7 C1 Si1 120.6(3) . . ?
C2 C1 Si1 119.0(3) . . ?
C7 C1 Li2 120.3(3) . . ?
C2 C1 Li2 66.6(2) . . ?
Si1 C1 Li2 91.83(19) . . ?
C7 C1 Li1 56.8(2) . 2_765 ?
C2 C1 Li1 95.5(3) . 2_765 ?
Si1 C1 Li1 125.7(2) . 2_765 ?
Li2 C1 Li1 63.6(2) . 2_765 ?
C19 C20 H20 109.5 . . ?
C19 C20 H20A 109.5 . . ?
H20 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C9 C10 C2 121.1(5) . . ?
C9 C10 Li1 89.9(3) . . ?
C2 C10 Li1 84.1(3) . . ?
C9 C10 H10 119.5 . . ?
C2 C10 H10 119.5 . . ?
Li1 C10 H10 96.2 . . ?
C10 C9 C8 122.3(4) . . ?
C10 C9 Li1 58.9(3) . . ?
C8 C9 Li1 105.2(3) . . ?
C10 C9 H9 118.9 . . ?
C8 C9 H9 118.9 . . ?
Li1 C9 H9 105.3 . . ?
Si1 C15 H15 109.5 . . ?
Si1 C15 H15A 109.5 . . ?
H15 C15 H15A 109.5 . . ?
Si1 C15 H15B 109.5 . . ?
H15 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C18 C17 H17 109.5 . . ?
C18 C17 H17A 109.5 . . ?
H17 C17 H17A 109.5 . . ?
C18 C17 H17B 109.5 . . ?
H17 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C1 C7 C8 123.7(5) . . ?
C1 C7 Li1 92.4(3) . 2_765 ?
C8 C7 Li1 77.0(3) . 2_765 ?
C1 C7 H7 118.2 . . ?
C8 C7 H7 118.2 . . ?
Li1 C7 H7 101.1 2_765 . ?
C7 C8 C9 116.7(4) . . ?
C7 C8 Li1 68.2(3) . 2_765 ?
C9 C8 Li1 104.2(3) . 2_765 ?
C7 C8 H8 121.6 . . ?
C9 C8 H8 121.6 . . ?
Li1 C8 H8 96.8 2_765 . ?
O3 C18 C17 110.3(3) . . ?
O3 C18 H18 109.6 . . ?
C17 C18 H18 109.6 . . ?
O3 C18 H18A 109.6 . . ?
C17 C18 H18A 109.6 . . ?
H18 C18 H18A 108.1 . . ?
O2 Li2 O1 91.1(3) . . ?
O2 Li2 C3 133.5(3) . . ?
O1 Li2 C3 114.2(3) . . ?
O2 Li2 Li2 52.50(15) . 2_765 ?
O1 Li2 Li2 52.85(14) . 2_765 ?
C3 Li2 Li2 167.0(2) . 2_765 ?
O2 Li2 Li2 52.50(15) . 3_675 ?
O1 Li2 Li2 52.85(14) . 3_675 ?
C3 Li2 Li2 112.6(4) . 3_675 ?
Li2 Li2 Li2 60.001(2) 2_765 3_675 ?
O2 Li2 C4 102.9(3) . . ?
O1 Li2 C4 145.6(3) . . ?
C3 Li2 C4 36.24(17) . . ?
Li2 Li2 C4 154.57(17) 2_765 . ?
Li2 Li2 C4 113.0(3) 3_675 . ?
O2 Li2 C2 167.2(3) . . ?
O1 Li2 C2 94.0(3) . . ?
C3 Li2 C2 34.11(16) . . ?
Li2 Li2 C2 138.6(2) 2_765 . ?
Li2 Li2 C2 123.2(3) 3_675 . ?
C4 Li2 C2 66.7(2) . . ?
O2 Li2 C1 156.6(3) . . ?
O1 Li2 C1 95.6(3) . . ?
C3 Li2 C1 62.82(19) . . ?
Li2 Li2 C1 116.1(3) 2_765 . ?
Li2 Li2 C1 145.05(15) 3_675 . ?
C4 Li2 C1 83.8(2) . . ?
C2 Li2 C1 34.00(15) . . ?
O2 Li2 C5 87.3(2) . . ?
O1 Li2 C5 176.4(3) . . ?
C3 Li2 C5 65.03(19) . . ?
Li2 Li2 C5 127.8(2) 2_765 . ?
Li2 Li2 C5 123.8(2) 3_675 . ?
C4 Li2 C5 32.28(14) . . ?
C2 Li2 C5 86.9(2) . . ?
C1 Li2 C5 87.1(2) . . ?
O2 Li2 Li3 43.65(19) . . ?
O1 Li2 Li3 120.1(3) . . ?
C3 Li2 Li3 90.2(3) . . ?
Li2 Li2 Li3 95.98(19) 2_765 . ?
Li2 Li2 Li3 67.3(2) 3_675 . ?
C4 Li2 Li3 60.5(2) . . ?
C2 Li2 Li3 124.3(3) . . ?
C1 Li2 Li3 142.5(3) . . ?
C5 Li2 Li3 56.8(2) . . ?
O2 Li2 Li1 118.7(3) . . ?
O1 Li2 Li1 41.96(19) . . ?
C3 Li2 Li1 72.4(2) . . ?
Li2 Li2 Li1 94.58(19) 2_765 . ?
Li2 Li2 Li1 66.5(2) 3_675 . ?
C4 Li2 Li1 104.9(3) . . ?
C2 Li2 Li1 60.0(2) . . ?
C1 Li2 Li1 80.0(2) . . ?
C5 Li2 Li1 136.7(3) . . ?
Li3 Li2 Li1 118.1(3) . . ?
O2 Li2 C6 94.3(2) . . ?
O1 Li2 C6 151.8(3) . . ?
C3 Li2 C6 81.2(2) . . ?
Li2 Li2 C6 111.0(3) 2_765 . ?
Li2 Li2 C6 145.24(14) 3_675 . ?
C4 Li2 C6 59.17(17) . . ?
C2 Li2 C6 86.6(2) . . ?
C1 Li2 C6 69.69(18) . . ?
C5 Li2 C6 31.70(12) . . ?
Li3 Li2 C6 81.5(2) . . ?
Li1 Li2 C6 146.5(3) . . ?
O2 Li3 C11 110.9(3) . . ?
O2 Li3 C14 130.4(3) . 3_675 ?
C11 Li3 C14 118.7(3) . 3_675 ?
O2 Li3 C13 137.5(4) . 3_675 ?
C11 Li3 C13 99.8(3) . 3_675 ?
C14 Li3 C13 33.95(14) 3_675 3_675 ?
O2 Li3 C5 92.3(3) . . ?
C11 Li3 C5 34.61(15) . . ?
C14 Li3 C5 129.1(3) 3_675 . ?
C13 Li3 C5 128.1(3) 3_675 . ?
O2 Li3 C4 100.0(3) . . ?
C11 Li3 C4 59.8(2) . . ?
C14 Li3 C4 104.0(3) 3_675 . ?
C13 Li3 C4 120.9(3) 3_675 . ?
C5 Li3 C4 32.12(14) . . ?
O2 Li3 Li2 46.6(2) . . ?
C11 Li3 Li2 93.2(3) . . ?
C14 Li3 Li2 126.5(3) 3_675 . ?
C13 Li3 Li2 160.5(3) 3_675 . ?
C5 Li3 Li2 60.3(2) . . ?
C4 Li3 Li2 54.6(2) . . ?
O2 Li3 C6 99.1(3) . 3_675 ?
C11 Li3 C6 149.6(3) . 3_675 ?
C14 Li3 C6 31.55(13) 3_675 3_675 ?
C13 Li3 C6 58.00(17) 3_675 3_675 ?
C5 Li3 C6 143.1(3) . 3_675 ?
C4 Li3 C6 111.0(3) . 3_675 ?
Li2 Li3 C6 104.2(3) . 3_675 ?
O2 Li3 C12 108.6(3) . 3_675 ?
C11 Li3 C12 110.3(3) . 3_675 ?
C14 Li3 C12 54.62(17) 3_675 3_675 ?
C13 Li3 C12 30.55(15) 3_675 3_675 ?
C5 Li3 C12 144.9(3) . 3_675 ?
C4 Li3 C12 151.2(3) . 3_675 ?
Li2 Li3 C12 152.1(3) . 3_675 ?
C6 Li3 C12 62.40(17) 3_675 3_675 ?
O2 Li3 Li3 41.07(15) . 2_765 ?
C11 Li3 Li3 72.5(3) . 2_765 ?
C14 Li3 Li3 162.7(3) 3_675 2_765 ?
C13 Li3 Li3 136.2(2) 3_675 2_765 ?
C5 Li3 Li3 67.9(3) . 2_765 ?
C4 Li3 Li3 93.0(3) . 2_765 ?
Li2 Li3 Li3 61.9(2) . 2_765 ?
C6 Li3 Li3 137.9(3) 3_675 2_765 ?
C12 Li3 Li3 110.3(2) 3_675 2_765 ?
O2 Li3 Li3 41.07(15) . 3_675 ?
C11 Li3 Li3 125.7(3) . 3_675 ?
C14 Li3 Li3 103.6(4) 3_675 3_675 ?
C13 Li3 Li3 97.1(3) 3_675 3_675 ?
C5 Li3 Li3 127.1(3) . 3_675 ?
C4 Li3 Li3 141.0(2) . 3_675 ?
Li2 Li3 Li3 86.82(17) . 3_675 ?
C6 Li3 Li3 80.8(3) 3_675 3_675 ?
C12 Li3 Li3 67.6(2) 3_675 3_675 ?
Li3 Li3 Li3 60.000(2) 2_765 3_675 ?
O2 Li3 Li2 43.59(19) . 3_675 ?
C11 Li3 Li2 144.0(3) . 3_675 ?
C14 Li3 Li2 91.0(2) 3_675 3_675 ?
C13 Li3 Li2 115.8(3) 3_675 3_675 ?
C5 Li3 Li2 111.2(3) . 3_675 ?
C4 Li3 Li2 95.4(3) . 3_675 ?
Li2 Li3 Li2 51.1(3) . 3_675 ?
C6 Li3 Li2 60.19(19) 3_675 3_675 ?
C12 Li3 Li2 103.3(2) 3_675 3_675 ?
Li3 Li3 Li2 84.30(17) 2_765 3_675 ?
Li3 Li3 Li2 57.2(2) 3_675 3_675 ?
O3 Li4 O3 119.82(5) . 3_565 ?
O3 Li4 O3 119.82(5) . 2_665 ?
O3 Li4 O3 119.82(5) 3_565 2_665 ?
O1 Li1 C10 120.0(3) . . ?
O1 Li1 C7 123.3(4) . 3_675 ?
C10 Li1 C7 115.4(3) . 3_675 ?
O1 Li1 C8 122.2(4) . 3_675 ?
C10 Li1 C8 112.3(3) . 3_675 ?
C7 Li1 C8 34.74(18) 3_675 3_675 ?
O1 Li1 C2 92.3(3) . . ?
C10 Li1 C2 34.49(16) . . ?
C7 Li1 C2 131.4(3) 3_675 . ?
C8 Li1 C2 145.0(3) 3_675 . ?
O1 Li1 C9 110.8(3) . . ?
C10 Li1 C9 31.2(2) . . ?
C7 Li1 C9 122.7(3) 3_675 . ?
C8 Li1 C9 101.0(3) 3_675 . ?
C2 Li1 C9 56.49(19) . . ?
O1 Li1 Li1 41.89(17) . 2_765 ?
C10 Li1 Li1 87.0(4) . 2_765 ?
C7 Li1 Li1 153.6(4) 3_675 2_765 ?
C8 Li1 Li1 125.6(2) 3_675 2_765 ?
C2 Li1 Li1 74.9(3) . 2_765 ?
C9 Li1 Li1 69.5(3) . 2_765 ?
O1 Li1 Li1 41.89(17) . 3_675 ?
C10 Li1 Li1 144.4(4) . 3_675 ?
C7 Li1 Li1 94.5(4) 3_675 3_675 ?
C8 Li1 Li1 81.0(3) 3_675 3_675 ?
C2 Li1 Li1 131.4(3) . 3_675 ?
C9 Li1 Li1 116.2(2) . 3_675 ?
Li1 Li1 Li1 60.000(2) 2_765 3_675 ?
O1 Li1 Li2 46.0(2) . . ?
C10 Li1 Li2 88.5(3) . . ?
C7 Li1 Li2 128.2(3) 3_675 . ?
C8 Li1 Li2 157.1(3) 3_675 . ?
C2 Li1 Li2 54.22(19) . . ?
C9 Li1 Li2 101.9(3) . . ?
Li1 Li1 Li2 62.2(2) 2_765 . ?
Li1 Li1 Li2 87.22(18) 3_675 . ?
O1 Li1 C1 94.7(3) . 3_675 ?
C10 Li1 C1 137.5(3) . 3_675 ?
C7 Li1 C1 30.75(17) 3_675 3_675 ?
C8 Li1 C1 57.11(19) 3_675 3_675 ?
C2 Li1 C1 132.3(3) . 3_675 ?
C9 Li1 C1 153.4(3) . 3_675 ?
Li1 Li1 C1 134.2(3) 2_765 3_675 ?
Li1 Li1 C1 77.9(3) 3_675 3_675 ?
Li2 Li1 C1 101.3(3) . 3_675 ?
O1 Li1 Li2 44.1(2) . 3_675 ?
C10 Li1 Li2 136.7(3) . 3_675 ?
C7 Li1 Li2 86.7(3) 3_675 3_675 ?
C8 Li1 Li2 106.5(3) 3_675 3_675 ?
C2 Li1 Li2 102.8(3) . 3_675 ?
C9 Li1 Li2 150.4(3) . 3_675 ?
Li1 Li1 Li2 85.58(18) 2_765 3_675 ?
Li1 Li1 Li2 59.1(2) 3_675 3_675 ?
Li2 Li1 Li2 50.7(3) . 3_675 ?
C1 Li1 Li2 55.93(19) 3_675 3_675 ?

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
C1 Si1 C6 C14 -134.1(3) . . . . ?
C15 Si1 C6 C14 107.4(3) . . . . ?
C16 Si1 C6 C14 -12.0(3) . . . . ?
C1 Si1 C6 C5 55.6(3) . . . . ?
C15 Si1 C6 C5 -62.9(3) . . . . ?
C16 Si1 C6 C5 177.7(3) . . . . ?
C1 Si1 C6 Li3 -57.0(3) . . . 2_765 ?
C15 Si1 C6 Li3 -175.4(3) . . . 2_765 ?
C16 Si1 C6 Li3 65.2(3) . . . 2_765 ?
C1 Si1 C6 Li2 -7.3(2) . . . . ?
C15 Si1 C6 Li2 -125.76(19) . . . . ?
C16 Si1 C6 Li2 114.8(2) . . . . ?
C2 C3 C4 C5 0.9(7) . . . . ?
Li2 C3 C4 C5 -52.4(4) . . . . ?
C2 C3 C4 Li2 53.3(4) . . . . ?
C2 C3 C4 Li3 94.3(5) . . . . ?
Li2 C3 C4 Li3 41.0(3) . . . . ?
C3 C4 C5 C11 167.8(4) . . . . ?
Li2 C4 C5 C11 119.7(3) . . . . ?
Li3 C4 C5 C11 53.5(3) . . . . ?
C3 C4 C5 C6 -7.2(6) . . . . ?
Li2 C4 C5 C6 -55.3(4) . . . . ?
Li3 C4 C5 C6 -121.5(4) . . . . ?
C3 C4 C5 Li3 114.3(4) . . . . ?
Li2 C4 C5 Li3 66.2(2) . . . . ?
C3 C4 C5 Li2 48.1(4) . . . . ?
Li3 C4 C5 Li2 -66.2(2) . . . . ?
C14 C6 C5 C4 166.8(3) . . . . ?
Si1 C6 C5 C4 -22.8(5) . . . . ?
Li3 C6 C5 C4 111.4(4) 2_765 . . . ?
Li2 C6 C5 C4 49.8(3) . . . . ?
C14 C6 C5 C11 -8.4(5) . . . . ?
Si1 C6 C5 C11 162.0(2) . . . . ?
Li3 C6 C5 C11 -63.7(3) 2_765 . . . ?
Li2 C6 C5 C11 -125.4(3) . . . . ?
C14 C6 C5 Li3 69.4(4) . . . . ?
Si1 C6 C5 Li3 -120.1(3) . . . . ?
Li3 C6 C5 Li3 14.1(3) 2_765 . . . ?
Li2 C6 C5 Li3 -47.5(3) . . . . ?
C14 C6 C5 Li2 117.0(3) . . . . ?
Si1 C6 C5 Li2 -72.6(3) . . . . ?
Li3 C6 C5 Li2 61.7(2) 2_765 . . . ?
C13 C12 C11 C5 -5.9(5) . . . . ?
Li3 C12 C11 C5 46.5(4) 2_765 . . . ?
C13 C12 C11 Li3 -94.5(4) . . . . ?
Li3 C12 C11 Li3 -42.1(3) 2_765 . . . ?
C4 C5 C11 C12 -164.0(3) . . . . ?
C6 C5 C11 C12 11.6(5) . . . . ?
Li3 C5 C11 C12 -105.9(4) . . . . ?
Li2 C5 C11 C12 -83.9(4) . . . . ?
C4 C5 C11 Li3 -58.0(3) . . . . ?
C6 C5 C11 Li3 117.5(3) . . . . ?
Li2 C5 C11 Li3 22.0(3) . . . . ?
C4 C3 C2 C10 -174.1(4) . . . . ?
Li2 C3 C2 C10 -121.4(4) . . . . ?
C4 C3 C2 C1 4.4(7) . . . . ?
Li2 C3 C2 C1 57.1(4) . . . . ?
C4 C3 C2 Li2 -52.7(4) . . . . ?
C4 C3 C2 Li1 -115.4(5) . . . . ?
Li2 C3 C2 Li1 -62.7(2) . . . . ?
C11 C12 C13 C14 -3.3(5) . . . . ?
Li3 C12 C13 C14 -69.5(3) 2_765 . . . ?
C11 C12 C13 Li3 66.2(4) . . . 2_765 ?
C12 C13 C14 C6 6.3(5) . . . . ?
Li3 C13 C14 C6 -73.7(4) 2_765 . . . ?
C12 C13 C14 Li3 80.0(3) . . . 2_765 ?
C5 C6 C14 C13 -0.1(5) . . . . ?
Si1 C6 C14 C13 -170.7(3) . . . . ?
Li3 C6 C14 C13 67.7(4) 2_765 . . . ?
Li2 C6 C14 C13 81.7(4) . . . . ?
C5 C6 C14 Li3 -67.8(3) . . . 2_765 ?
Si1 C6 C14 Li3 121.6(3) . . . 2_765 ?
Li2 C6 C14 Li3 14.1(3) . . . 2_765 ?
C18 O3 C19 C20 -172.1(4) . . . . ?
Li4 O3 C19 C20 27.7(5) . . . . ?
C3 C2 C1 C7 -165.5(4) . . . . ?
C10 C2 C1 C7 13.0(5) . . . . ?
Li2 C2 C1 C7 -112.8(4) . . . . ?
Li1 C2 C1 C7 -54.3(4) . . . . ?
C3 C2 C1 Si1 25.7(5) . . . . ?
C10 C2 C1 Si1 -155.8(3) . . . . ?
Li2 C2 C1 Si1 78.4(3) . . . . ?
Li1 C2 C1 Si1 136.9(3) . . . . ?
C3 C2 C1 Li2 -52.7(4) . . . . ?
C10 C2 C1 Li2 125.8(4) . . . . ?
Li1 C2 C1 Li2 58.5(3) . . . . ?
C3 C2 C1 Li1 -110.7(4) . . . 2_765 ?
C10 C2 C1 Li1 67.8(3) . . . 2_765 ?
Li2 C2 C1 Li1 -58.0(2) . . . 2_765 ?
Li1 C2 C1 Li1 0.4(2) . . . 2_765 ?
C6 Si1 C1 C7 135.0(3) . . . . ?
C15 Si1 C1 C7 -105.1(3) . . . . ?
C16 Si1 C1 C7 13.4(4) . . . . ?
C6 Si1 C1 C2 -56.3(3) . . . . ?
C15 Si1 C1 C2 63.6(3) . . . . ?
C16 Si1 C1 C2 -177.9(3) . . . . ?
C6 Si1 C1 Li2 7.7(2) . . . . ?
C15 Si1 C1 Li2 127.6(2) . . . . ?
C16 Si1 C1 Li2 -113.9(2) . . . . ?
C6 Si1 C1 Li1 66.0(3) . . . 2_765 ?
C15 Si1 C1 Li1 -174.1(3) . . . 2_765 ?
C16 Si1 C1 Li1 -55.6(3) . . . 2_765 ?
C3 C2 C10 C9 162.5(4) . . . . ?
C1 C2 C10 C9 -16.2(5) . . . . ?
Li2 C2 C10 C9 78.8(5) . . . . ?
Li1 C2 C10 C9 86.2(4) . . . . ?
C3 C2 C10 Li1 76.3(4) . . . . ?
C1 C2 C10 Li1 -102.4(3) . . . . ?
Li2 C2 C10 Li1 -7.4(5) . . . . ?
C2 C10 C9 C8 6.0(6) . . . . ?
Li1 C10 C9 C8 88.9(4) . . . . ?
C2 C10 C9 Li1 -83.0(4) . . . . ?
C2 C1 C7 C8 0.3(6) . . . . ?
Si1 C1 C7 C8 168.9(3) . . . . ?
Li2 C1 C7 C8 -78.2(5) . . . . ?
Li1 C1 C7 C8 -76.0(4) 2_765 . . . ?
C2 C1 C7 Li1 76.4(4) . . . 2_765 ?
Si1 C1 C7 Li1 -115.0(3) . . . 2_765 ?
Li2 C1 C7 Li1 -2.1(4) . . . 2_765 ?
C1 C7 C8 C9 -11.3(6) . . . . ?
Li1 C7 C8 C9 -95.5(4) 2_765 . . . ?
C1 C7 C8 Li1 84.2(4) . . . 2_765 ?
C10 C9 C8 C7 8.0(6) . . . . ?
Li1 C9 C8 C7 70.6(4) . . . . ?
C10 C9 C8 Li1 -64.4(5) . . . 2_765 ?
Li1 C9 C8 Li1 -1.9(3) . . . 2_765 ?
C19 O3 C18 C17 170.7(4) . . . . ?
Li4 O3 C18 C17 -29.5(5) . . . . ?
Li3 O2 Li3 C11 -120.77(13) 3_675 . . . ?
Li3 O2 Li3 C11 -21.7(5) 2_765 . . . ?
Li2 O2 Li3 C11 73.9(3) . . . . ?
Li2 O2 Li3 C11 148.8(3) 3_675 . . . ?
Li2 O2 Li3 C11 95.1(9) 2_765 . . . ?
Li3 O2 Li3 C14 59.6(7) 3_675 . . 3_675 ?
Li3 O2 Li3 C14 158.7(3) 2_765 . . 3_675 ?
Li2 O2 Li3 C14 -105.8(4) . . . 3_675 ?
Li2 O2 Li3 C14 -30.9(5) 3_675 . . 3_675 ?
Li2 O2 Li3 C14 -84.5(10) 2_765 . . 3_675 ?
Li3 O2 Li3 C13 12.7(6) 3_675 . . 3_675 ?
Li3 O2 Li3 C13 111.9(3) 2_765 . . 3_675 ?
Li2 O2 Li3 C13 -152.6(5) . . . 3_675 ?
Li2 O2 Li3 C13 -77.7(5) 3_675 . . 3_675 ?
Li2 O2 Li3 C13 -131.4(8) 2_765 . . 3_675 ?
Li3 O2 Li3 C5 -150.74(19) 3_675 . . . ?
Li3 O2 Li3 C5 -51.6(4) 2_765 . . . ?
Li2 O2 Li3 C5 43.9(3) . . . . ?
Li2 O2 Li3 C5 118.8(2) 3_675 . . . ?
Li2 O2 Li3 C5 65.1(10) 2_765 . . . ?
Li3 O2 Li3 C4 177.9(3) 3_675 . . . ?
Li3 O2 Li3 C4 -83.0(4) 2_765 . . . ?
Li2 O2 Li3 C4 12.5(3) . . . . ?
Li2 O2 Li3 C4 87.4(3) 3_675 . . . ?
Li2 O2 Li3 C4 33.7(10) 2_765 . . . ?
Li3 O2 Li3 Li2 165.4(3) 3_675 . . . ?
Li3 O2 Li3 Li2 -95.5(3) 2_765 . . . ?
Li2 O2 Li3 Li2 74.9(3) 3_675 . . . ?
Li2 O2 Li3 Li2 21.2(10) 2_765 . . . ?
Li3 O2 Li3 C6 64.5(4) 3_675 . . 3_675 ?
Li3 O2 Li3 C6 163.6(2) 2_765 . . 3_675 ?
Li2 O2 Li3 C6 -100.9(3) . . . 3_675 ?
Li2 O2 Li3 C6 -26.0(3) 3_675 . . 3_675 ?
Li2 O2 Li3 C6 -79.7(9) 2_765 . . 3_675 ?
Li3 O2 Li3 C12 0.6(4) 3_675 . . 3_675 ?
Li3 O2 Li3 C12 99.73(11) 2_765 . . 3_675 ?
Li2 O2 Li3 C12 -164.7(3) . . . 3_675 ?
Li2 O2 Li3 C12 -89.8(3) 3_675 . . 3_675 ?
Li2 O2 Li3 C12 -143.5(8) 2_765 . . 3_675 ?
Li3 O2 Li3 Li3 -99.1(4) 3_675 . . 2_765 ?
Li2 O2 Li3 Li3 95.5(3) . . . 2_765 ?
Li2 O2 Li3 Li3 170.4(3) 3_675 . . 2_765 ?
Li2 O2 Li3 Li3 116.8(8) 2_765 . . 2_765 ?
Li3 O2 Li3 Li3 99.1(4) 2_765 . . 3_675 ?
Li2 O2 Li3 Li3 -165.4(3) . . . 3_675 ?
Li2 O2 Li3 Li3 -90.5(3) 3_675 . . 3_675 ?
Li2 O2 Li3 Li3 -144.1(9) 2_765 . . 3_675 ?
Li3 O2 Li3 Li2 90.5(3) 3_675 . . 3_675 ?
Li3 O2 Li3 Li2 -170.4(3) 2_765 . . 3_675 ?
Li2 O2 Li3 Li2 -74.9(3) . . . 3_675 ?
Li2 O2 Li3 Li2 -53.7(10) 2_765 . . 3_675 ?
Li1 O1 Li1 C10 42.7(6) 2_765 . . . ?
Li1 O1 Li1 C10 139.7(3) 3_675 . . . ?
Li2 O1 Li1 C10 -79.5(11) 2_765 . . . ?
Li2 O1 Li1 C10 -127.7(4) 3_675 . . . ?
Li2 O1 Li1 C10 -53.2(4) . . . . ?
Li1 O1 Li1 C7 -150.8(3) 2_765 . . 3_675 ?
Li1 O1 Li1 C7 -53.8(6) 3_675 . . 3_675 ?
Li2 O1 Li1 C7 87.1(10) 2_765 . . 3_675 ?
Li2 O1 Li1 C7 38.9(5) 3_675 . . 3_675 ?
Li2 O1 Li1 C7 113.3(4) . . . 3_675 ?
Li1 O1 Li1 C8 -109.21(18) 2_765 . . 3_675 ?
Li1 O1 Li1 C8 -12.2(5) 3_675 . . 3_675 ?
Li2 O1 Li1 C8 128.6(9) 2_765 . . 3_675 ?
Li2 O1 Li1 C8 80.4(4) 3_675 . . 3_675 ?
Li2 O1 Li1 C8 154.8(4) . . . 3_675 ?
Li1 O1 Li1 C2 64.3(4) 2_765 . . . ?
Li1 O1 Li1 C2 161.3(2) 3_675 . . . ?
Li2 O1 Li1 C2 -57.9(11) 2_765 . . . ?
Li2 O1 Li1 C2 -106.1(3) 3_675 . . . ?
Li2 O1 Li1 C2 -31.6(3) . . . . ?
Li1 O1 Li1 C9 9.5(4) 2_765 . . . ?
Li1 O1 Li1 C9 106.45(13) 3_675 . . . ?
Li2 O1 Li1 C9 -112.7(10) 2_765 . . . ?
Li2 O1 Li1 C9 -160.9(3) 3_675 . . . ?
Li2 O1 Li1 C9 -86.5(3) . . . . ?
Li1 O1 Li1 Li1 97.0(4) 3_675 . . 2_765 ?
Li2 O1 Li1 Li1 -122.2(9) 2_765 . . 2_765 ?
Li2 O1 Li1 Li1 -170.4(3) 3_675 . . 2_765 ?
Li2 O1 Li1 Li1 -95.9(3) . . . 2_765 ?
Li1 O1 Li1 Li1 -97.0(4) 2_765 . . 3_675 ?
Li2 O1 Li1 Li1 140.9(10) 2_765 . . 3_675 ?
Li2 O1 Li1 Li1 92.7(3) 3_675 . . 3_675 ?
Li2 O1 Li1 Li1 167.1(3) . . . 3_675 ?
Li1 O1 Li1 Li2 95.9(3) 2_765 . . . ?
Li1 O1 Li1 Li2 -167.1(3) 3_675 . . . ?
Li2 O1 Li1 Li2 -26.2(10) 2_765 . . . ?
Li2 O1 Li1 Li2 -74.4(3) 3_675 . . . ?
Li1 O1 Li1 C1 -162.9(2) 2_765 . . 3_675 ?
Li1 O1 Li1 C1 -65.9(4) 3_675 . . 3_675 ?
Li2 O1 Li1 C1 74.9(10) 2_765 . . 3_675 ?
Li2 O1 Li1 C1 26.7(3) 3_675 . . 3_675 ?
Li2 O1 Li1 C1 101.1(3) . . . 3_675 ?
Li1 O1 Li1 Li2 170.4(3) 2_765 . . 3_675 ?
Li1 O1 Li1 Li2 -92.7(3) 3_675 . . 3_675 ?
Li2 O1 Li1 Li2 48.2(11) 2_765 . . 3_675 ?
Li2 O1 Li1 Li2 74.4(3) . . . 3_675 ?

_refine_diff_density_max         0.521
_refine_diff_density_min         -0.613
_refine_diff_density_rms         0.168

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_ydkr_CCDC2
_database_code_depnum_ccdc_archive 'CCDC 2191232'
loop_
_audit_author_name
_audit_author_address
'Takuya Kuwabara'
;Ochanomizu University
Japan
;
_audit_update_record             
;
2022-07-19 deposited with the CCDC.	2022-10-13 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C68 H85 Li10 O6 Si3'
_chemical_formula_sum            'C68 H85 Li10 O6 Si3'
_chemical_formula_weight         1152.02

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'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.117(6)
_cell_length_b                   15.204(8)
_cell_length_c                   19.765(10)
_cell_angle_alpha                85.97(2)
_cell_angle_beta                 79.66(2)
_cell_angle_gamma                79.45(2)
_cell_volume                     3228(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    93(2)
_cell_measurement_reflns_used    9510
_cell_measurement_theta_min      1.8909
_cell_measurement_theta_max      31.0848

_exptl_crystal_description       Prism
_exptl_crystal_colour            Black
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.185
_exptl_crystal_F_000             1226
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.150
_exptl_crystal_size_mid          0.120
_exptl_crystal_size_min          0.050
_exptl_absorpt_coefficient_mu    0.123
_shelx_estimated_absorpt_T_min   0.982
_shelx_estimated_absorpt_T_max   0.994
_exptl_absorpt_correction_type   Multi-scan
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8544
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      93(2)
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'rotating-anode X-ray tube'
_diffrn_radiation_monochromator  Confocal
_diffrn_measurement_device_type  'Rigaku VariMax Saturn'
_diffrn_measurement_method       'omega scans'
_diffrn_detector_area_resol_mean 28.5714
_diffrn_reflns_number            26145
_diffrn_reflns_av_unetI/netI     0.0816
_diffrn_reflns_av_R_equivalents  0.0419
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         3.037
_diffrn_reflns_theta_max         27.370
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.961
_diffrn_measured_fraction_theta_full 0.981
_diffrn_reflns_Laue_measured_fraction_max 0.961
_diffrn_reflns_Laue_measured_fraction_full 0.981
_diffrn_reflns_point_group_measured_fraction_max 0.961
_diffrn_reflns_point_group_measured_fraction_full 0.981
_reflns_number_total             14088
_reflns_number_gt                9201
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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.
;

_computing_data_collection       'RIGAKU CrystalClear'
_computing_cell_refinement       'RIGAKU CrystalClear'
_computing_data_reduction        'RIGAKU CrystalClear'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Yadokari-XG 2009(Wakita Nemoto et al.)'
_computing_publication_material  'Yadokari-XG 2009(Wakita,Nemoto et al.)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1015P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_extinction_coef       0.0250(16)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         14088
_refine_ls_number_parameters     792
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0936
_refine_ls_R_factor_gt           0.0611
_refine_ls_wR_factor_ref         0.1887
_refine_ls_wR_factor_gt          0.1551
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_restrained_S_all      1.025
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
Si2 Si 0.48257(6) 0.18758(4) 0.45592(3) 0.02036(16) Uani 1 1 d . . . . .
Si3 Si 0.26604(6) 0.66562(4) 0.32563(3) 0.02363(17) Uani 1 1 d . . . . .
Si1 Si 0.46437(7) 0.28232(5) 0.07512(3) 0.02704(18) Uani 1 1 d . . . . .
O2 O 0.54864(14) 0.39836(10) 0.27183(8) 0.0207(3) Uani 1 1 d . . . . .
O1 O 0.30280(14) 0.36827(10) 0.29776(8) 0.0212(4) Uani 1 1 d . . . . .
O3 O 0.11077(19) 0.13328(11) 0.73094(9) 0.0357(5) Uani 1 1 d . . . . .
O5 O 0.04470(18) 0.00172(12) 0.85378(10) 0.0399(5) Uani 1 1 d . . . . .
O4 O 0.0468(2) 0.19984(13) 0.88385(11) 0.0456(5) Uani 1 1 d . . . . .
O6 O 0.30316(19) 0.09000(14) 0.83288(12) 0.0490(6) Uani 1 1 d . . . . .
C17 C 0.3278(2) 0.25687(15) 0.44995(11) 0.0200(5) Uani 1 1 d . . . . .
C18 C 0.3041(2) 0.35315(15) 0.46419(11) 0.0194(5) Uani 1 1 d . . . . .
C22 C 0.6101(2) 0.24068(15) 0.40359(11) 0.0205(5) Uani 1 1 d . . . . .
C3 C 0.5176(2) 0.16573(15) 0.21731(12) 0.0248(5) Uani 1 1 d . . . . .
H3 H 0.5262 0.1195 0.2519 0.030 Uiso 1 1 calc R U . . .
C19 C 0.3917(2) 0.40805(14) 0.46387(11) 0.0207(5) Uani 1 1 d . . . . .
H19 H 0.3541 0.4664 0.4786 0.025 Uiso 1 1 calc R U . . .
C21 C 0.6234(2) 0.33185(15) 0.41788(11) 0.0204(5) Uani 1 1 d . . . . .
C20 C 0.5271(2) 0.39870(15) 0.44663(11) 0.0213(5) Uani 1 1 d . . . . .
H20 H 0.5566 0.4499 0.4575 0.026 Uiso 1 1 calc R U . . .
C4 C 0.6357(2) 0.19547(15) 0.19111(12) 0.0245(5) Uani 1 1 d . . . . .
H4 H 0.7043 0.1576 0.2065 0.029 Uiso 1 1 calc R U . . .
C23 C 0.2273(2) 0.21696(15) 0.44130(12) 0.0236(5) Uani 1 1 d . . . . .
H23 H 0.2427 0.1543 0.4348 0.028 Uiso 1 1 calc R U . . .
C2 C 0.3957(2) 0.18707(15) 0.20512(12) 0.0235(5) Uani 1 1 d . . . . .
C30 C 0.7082(2) 0.18845(16) 0.36104(12) 0.0250(5) Uani 1 1 d . . . . .
H30 H 0.6990 0.1297 0.3521 0.030 Uiso 1 1 calc R U . . .
C34 C 0.2026(2) 0.55968(15) 0.22481(13) 0.0258(5) Uani 1 1 d . . . . .
C5 C 0.6703(2) 0.26755(16) 0.14827(12) 0.0244(5) Uani 1 1 d . . . . .
C10 C 0.2984(2) 0.14652(16) 0.25020(13) 0.0273(5) Uani 1 1 d . . . . .
H10 H 0.3225 0.0962 0.2791 0.033 Uiso 1 1 calc R U . . .
C25 C 0.0799(2) 0.35251(16) 0.46484(12) 0.0248(5) Uani 1 1 d . . . . .
H25 H -0.0032 0.3839 0.4712 0.030 Uiso 1 1 calc R U . . .
C24 C 0.1057(2) 0.26341(16) 0.44155(12) 0.0255(5) Uani 1 1 d . . . . .
H24 H 0.0441 0.2368 0.4270 0.031 Uiso 1 1 calc R U . . .
C26 C 0.1719(2) 0.39384(15) 0.47819(12) 0.0238(5) Uani 1 1 d . . . . .
H26 H 0.1496 0.4513 0.4973 0.029 Uiso 1 1 calc R U . . .
C1 C 0.3509(2) 0.24936(15) 0.14999(12) 0.0247(5) Uani 1 1 d . . . . .
C29 C 0.8195(2) 0.21799(17) 0.33085(13) 0.0275(5) Uani 1 1 d . . . . .
H29 H 0.8792 0.1839 0.2978 0.033 Uiso 1 1 calc R U . . .
C27 C 0.7470(2) 0.35412(17) 0.39489(12) 0.0262(5) Uani 1 1 d . . . . .
H27 H 0.7649 0.4075 0.4101 0.031 Uiso 1 1 calc R U . . .
C33 C 0.1730(2) 0.58816(15) 0.29680(12) 0.0233(5) Uani 1 1 d . . . . .
C37 C 0.4923(2) 0.60941(15) 0.23079(13) 0.0252(5) Uani 1 1 d . . . . .
C42 C 0.1051(3) 0.52116(17) 0.20240(14) 0.0323(6) Uani 1 1 d . . . . .
H42 H 0.1093 0.5130 0.1548 0.039 Uiso 1 1 calc R U . . .
C31 C 0.5065(2) 0.17906(16) 0.54844(13) 0.0275(5) Uani 1 1 d . . . . .
H31 H 0.4827 0.2384 0.5681 0.041 Uiso 1 1 calc R U . . .
H31A H 0.5942 0.1561 0.5505 0.041 Uiso 1 1 calc R U . . .
H31B H 0.4552 0.1382 0.5748 0.041 Uiso 1 1 calc R U . . .
C7 C 0.2228(2) 0.27489(16) 0.15282(13) 0.0268(5) Uani 1 1 d . . . . .
H7 H 0.1951 0.3127 0.1164 0.032 Uiso 1 1 calc R U . . .
C6 C 0.5916(2) 0.32595(16) 0.10539(12) 0.0251(5) Uani 1 1 d . . . . .
C48 C 0.2206(2) 0.68172(17) 0.42037(13) 0.0311(6) Uani 1 1 d . . . . .
H48 H 0.2318 0.6234 0.4451 0.047 Uiso 1 1 calc R U . . .
H48A H 0.1333 0.7105 0.4307 0.047 Uiso 1 1 calc R U . . .
H48B H 0.2729 0.7196 0.4350 0.047 Uiso 1 1 calc R U . . .
C28 C 0.8385(2) 0.30083(17) 0.35207(13) 0.0280(6) Uani 1 1 d . . . . .
H28 H 0.9158 0.3199 0.3364 0.034 Uiso 1 1 calc R U . . .
C38 C 0.4357(2) 0.62026(15) 0.30399(13) 0.0243(5) Uani 1 1 d . . . . .
C32 C 0.4889(2) 0.07305(16) 0.42395(13) 0.0289(6) Uani 1 1 d . . . . .
H32 H 0.4228 0.0450 0.4518 0.043 Uiso 1 1 calc R U . . .
H32A H 0.5698 0.0362 0.4277 0.043 Uiso 1 1 calc R U . . .
H32B H 0.4775 0.0782 0.3757 0.043 Uiso 1 1 calc R U . . .
C46 C 0.5141(2) 0.61737(15) 0.35263(13) 0.0256(5) Uani 1 1 d . . . . .
H46 H 0.4769 0.6239 0.3996 0.031 Uiso 1 1 calc R U . . .
C36 C 0.4326(2) 0.58837(16) 0.17890(13) 0.0293(6) Uani 1 1 d . . . . .
H36 H 0.4816 0.5912 0.1344 0.035 Uiso 1 1 calc R U . . .
C11 C 0.7921(2) 0.29109(17) 0.14763(13) 0.0286(6) Uani 1 1 d . . . . .
H11 H 0.8528 0.2493 0.1668 0.034 Uiso 1 1 calc R U . . .
C35 C 0.3125(2) 0.56303(17) 0.17721(13) 0.0304(6) Uani 1 1 d . . . . .
H35 H 0.3073 0.5442 0.1332 0.036 Uiso 1 1 calc R U . . .
C41 C 0.0071(2) 0.49634(17) 0.24896(16) 0.0356(7) Uani 1 1 d . . . . .
H41 H -0.0508 0.4676 0.2328 0.043 Uiso 1 1 calc R U . . .
C12 C 0.8225(2) 0.37173(17) 0.12028(13) 0.0305(6) Uani 1 1 d . . . . .
H12 H 0.9008 0.3860 0.1239 0.037 Uiso 1 1 calc R U . . .
C14 C 0.6290(2) 0.40619(17) 0.07687(13) 0.0289(6) Uani 1 1 d . . . . .
H14 H 0.5774 0.4439 0.0493 0.035 Uiso 1 1 calc R U . . .
C8 C 0.1313(2) 0.24861(17) 0.20594(13) 0.0295(6) Uani 1 1 d . . . . .
H8 H 0.0464 0.2760 0.2105 0.035 Uiso 1 1 calc R U . . .
C45 C 0.6442(2) 0.60545(16) 0.33623(15) 0.0308(6) Uani 1 1 d . . . . .
H45 H 0.6949 0.5956 0.3709 0.037 Uiso 1 1 calc R U . . .
C9 C 0.1743(2) 0.17862(17) 0.25212(13) 0.0307(6) Uani 1 1 d . . . . .
H9 H 0.1155 0.1535 0.2851 0.037 Uiso 1 1 calc R U . . .
C39 C 0.0681(2) 0.56558(16) 0.34024(14) 0.0276(5) Uani 1 1 d . . . . .
H39 H 0.0483 0.5871 0.3856 0.033 Uiso 1 1 calc R U . . .
C44 C 0.6960(2) 0.60884(16) 0.26538(15) 0.0321(6) Uani 1 1 d . . . . .
H44 H 0.7829 0.6075 0.2525 0.039 Uiso 1 1 calc R U . . .
C43 C 0.6248(2) 0.61399(16) 0.21474(14) 0.0325(6) Uani 1 1 d . . . . .
H43 H 0.6625 0.6207 0.1680 0.039 Uiso 1 1 calc R U . . .
C13 C 0.7383(2) 0.43358(18) 0.08690(13) 0.0317(6) Uani 1 1 d . . . . .
H13 H 0.7552 0.4915 0.0718 0.038 Uiso 1 1 calc R U . . .
C47 C 0.2382(3) 0.77564(17) 0.27578(16) 0.0387(7) Uani 1 1 d . . . . .
H47 H 0.2814 0.8184 0.2924 0.058 Uiso 1 1 calc R U . . .
H47A H 0.1490 0.7993 0.2823 0.058 Uiso 1 1 calc R U . . .
H47B H 0.2698 0.7665 0.2268 0.058 Uiso 1 1 calc R U . . .
C40 C -0.0093(2) 0.51255(17) 0.31996(15) 0.0321(6) Uani 1 1 d . . . . .
H40 H -0.0700 0.4886 0.3525 0.039 Uiso 1 1 calc R U . . .
C16 C 0.3808(3) 0.3677(2) 0.01887(14) 0.0418(7) Uani 1 1 d . . . . .
H16 H 0.3164 0.3425 0.0028 0.063 Uiso 1 1 calc R U . . .
H16A H 0.4400 0.3844 -0.0208 0.063 Uiso 1 1 calc R U . . .
H16B H 0.3424 0.4209 0.0452 0.063 Uiso 1 1 calc R U . . .
C60 C 0.0627(3) -0.05994(18) 0.91209(14) 0.0360(6) Uani 1 1 d . . . . .
H60 H 0.0734 -0.0275 0.9517 0.043 Uiso 1 1 calc R U . . .
H60A H 0.1371 -0.1064 0.8999 0.043 Uiso 1 1 calc R U . . .
C59 C -0.0548(3) -0.10268(19) 0.92973(15) 0.0399(7) Uani 1 1 d . . . . .
H59 H -0.0394 -0.1635 0.9117 0.048 Uiso 1 1 calc R U . . .
H59A H -0.0829 -0.1064 0.9801 0.048 Uiso 1 1 calc R U . . .
C52 C 0.1238(3) 0.22050(18) 0.69840(16) 0.0428(7) Uani 1 1 d . . . . .
H52 H 0.2011 0.2384 0.7065 0.051 Uiso 1 1 calc R U . . .
H52A H 0.0524 0.2664 0.7170 0.051 Uiso 1 1 calc R U . . .
C15 C 0.5407(3) 0.1825(2) 0.02274(15) 0.0457(7) Uani 1 1 d . . . . .
H15 H 0.5994 0.1434 0.0479 0.069 Uiso 1 1 calc R U . . .
H15A H 0.5853 0.2027 -0.0213 0.069 Uiso 1 1 calc R U . . .
H15B H 0.4773 0.1495 0.0143 0.069 Uiso 1 1 calc R U . . .
C50 C 0.1701(3) 0.1135(2) 0.61147(17) 0.0541(9) Uani 1 1 d . . . . .
H50 H 0.1327 0.0943 0.5744 0.065 Uiso 1 1 calc R U . . .
H50A H 0.2616 0.0994 0.5991 0.065 Uiso 1 1 calc R U . . .
C51 C 0.1277(3) 0.2105(2) 0.62297(16) 0.0548(9) Uani 1 1 d . . . . .
H51 H 0.0444 0.2306 0.6105 0.066 Uiso 1 1 calc R U . . .
H51A H 0.1863 0.2460 0.5951 0.066 Uiso 1 1 calc R U . . .
C58 C -0.1497(3) -0.0403(2) 0.89483(17) 0.0457(7) Uani 1 1 d . . . . .
H58 H -0.1927 0.0100 0.9243 0.055 Uiso 1 1 calc R U . . .
H58A H -0.2119 -0.0725 0.8825 0.055 Uiso 1 1 calc R U . . .
C57 C -0.0688(3) -0.0079(2) 0.83133(16) 0.0436(7) Uani 1 1 d . . . . .
H57 H -0.0517 -0.0520 0.7947 0.052 Uiso 1 1 calc R U . . .
H57A H -0.1098 0.0502 0.8134 0.052 Uiso 1 1 calc R U . . .
C49 C 0.1268(4) 0.0696(2) 0.67812(16) 0.0605(10) Uani 1 1 d . . . . .
H49 H 0.0471 0.0498 0.6772 0.073 Uiso 1 1 calc R U . . .
H49A H 0.1886 0.0164 0.6874 0.073 Uiso 1 1 calc R U . . .
C54 C 0.0069(3) 0.3246(2) 0.95250(17) 0.0543(9) Uani 1 1 d . . . . .
H54 H 0.0003 0.3904 0.9463 0.065 Uiso 1 1 calc R U . . .
H54A H 0.0347 0.3053 0.9969 0.065 Uiso 1 1 calc R U . . .
C55 C -0.1169(4) 0.2962(2) 0.94992(18) 0.0570(9) Uani 1 1 d . . . . .
H55 H -0.1538 0.2739 0.9958 0.068 Uiso 1 1 calc R U . . .
H55A H -0.1762 0.3471 0.9343 0.068 Uiso 1 1 calc R U . . .
C62 C 0.4885(3) 0.0373(2) 0.8784(2) 0.0566(9) Uani 1 1 d . . . . .
H62 H 0.5234 0.0451 0.9199 0.068 Uiso 1 1 calc R U . . .
H62A H 0.5252 -0.0224 0.8600 0.068 Uiso 1 1 calc R U . . .
C53 C 0.0948(4) 0.2782(2) 0.8939(2) 0.0680(11) Uani 1 1 d . . . . .
H53 H 0.0985 0.3176 0.8517 0.082 Uiso 1 1 calc R U . . .
H53A H 0.1794 0.2616 0.9053 0.082 Uiso 1 1 calc R U . . .
C56 C -0.0864(4) 0.2240(3) 0.8999(2) 0.0782(13) Uani 1 1 d . . . . .
H56 H -0.1231 0.1714 0.9200 0.094 Uiso 1 1 calc R U . . .
H56A H -0.1207 0.2450 0.8576 0.094 Uiso 1 1 calc R U . . .
C66 C -0.0029(7) 0.0524(3) 0.4412(3) 0.096(2) Uani 1 1 d . . . . .
H66 H 0.0010 0.0855 0.3985 0.115 Uiso 1 1 calc R U . . .
C61 C 0.3501(3) 0.0495(4) 0.8938(2) 0.0869(15) Uani 1 1 d . . . . .
H61 H 0.3232 -0.0091 0.9056 0.104 Uiso 1 1 calc R U . . .
H61A H 0.3177 0.0887 0.9333 0.104 Uiso 1 1 calc R U . . .
C64 C 0.4061(4) 0.1133(3) 0.7844(2) 0.0763(13) Uani 1 1 d . . . . .
H64 H 0.3848 0.1744 0.7642 0.092 Uiso 1 1 calc R U . . .
H64A H 0.4311 0.0704 0.7468 0.092 Uiso 1 1 calc R U . . .
Li2 Li 0.4569(4) 0.3221(3) 0.2345(2) 0.0267(9) Uani 1 1 d . . . . .
Li6 Li 0.6051(4) 0.4622(3) 0.1926(2) 0.0326(10) Uani 1 1 d . . . . .
C63 C 0.5091(4) 0.1084(3) 0.8267(3) 0.0998(19) Uani 1 1 d . . . . .
H63 H 0.5917 0.0937 0.7974 0.120 Uiso 1 1 calc R U . . .
H63A H 0.5034 0.1659 0.8485 0.120 Uiso 1 1 calc R U . . .
Li5 Li 0.4371(4) 0.3570(3) 0.3516(2) 0.0263(9) Uani 1 1 d . . . . .
Li3 Li 0.6759(4) 0.3013(3) 0.2686(2) 0.0314(10) Uani 1 1 d . . . . .
Li1 Li 0.2598(4) 0.2613(3) 0.3294(2) 0.0307(9) Uani 1 1 d . . . . .
C65 C -0.0963(8) 0.0752(4) 0.4919(3) 0.111(2) Uani 1 1 d . . . . .
H65 H -0.1620 0.1244 0.4895 0.133 Uiso 1 1 calc R U . . .
C67 C 0.0856(7) -0.0172(4) 0.4500(3) 0.0989(18) Uani 1 1 d . . . . .
Li4 Li 0.2063(4) 0.3828(3) 0.2306(2) 0.0337(10) Uani 1 1 d . . . . .
Li8 Li 0.3866(4) 0.4722(3) 0.2689(2) 0.0267(9) Uani 1 1 d . . . . .
Li7 Li 0.1805(4) 0.4302(3) 0.3616(2) 0.0317(10) Uani 1 1 d . . . . .
Li9 Li 0.6014(4) 0.4608(3) 0.3346(2) 0.0307(10) Uani 1 1 d . . . . .
Li10 Li 0.1310(4) 0.1025(3) 0.8247(2) 0.0347(10) Uani 1 1 d . . . . .
C68 C 0.1769(7) -0.0424(4) 0.4072(6) 0.170(4) Uani 1 1 d . . . . .
H68 H 0.1720 -0.0060 0.3645 0.256 Uiso 1 1 calc R U . . .
H68A H 0.1803 -0.1054 0.3981 0.256 Uiso 1 1 calc R U . . .
H68B H 0.2519 -0.0358 0.4246 0.256 Uiso 1 1 calc R U . . .


_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
Si2 C17 1.865(2) . ?
Si2 C22 1.873(2) . ?
Si2 C32 1.879(3) . ?
Si2 C31 1.887(3) . ?
Si3 C38 1.868(3) . ?
Si3 C48 1.871(3) . ?
Si3 C33 1.880(3) . ?
Si3 C47 1.885(3) . ?
Si1 C1 1.868(3) . ?
Si1 C6 1.871(3) . ?
Si1 C16 1.874(3) . ?
Si1 C15 1.878(3) . ?
O2 Li3 1.844(4) . ?
O2 Li9 1.849(5) . ?
O2 Li6 1.857(5) . ?
O2 Li2 1.937(5) . ?
O2 Li8 1.949(4) . ?
O2 Li5 1.966(4) . ?
O1 Li1 1.817(5) . ?
O1 Li4 1.829(5) . ?
O1 Li7 1.847(5) . ?
O1 Li5 1.960(4) . ?
O1 Li2 1.976(5) . ?
O1 Li8 1.978(4) . ?
O3 C49 1.439(3) . ?
O3 C52 1.453(3) . ?
O3 Li10 1.921(5) . ?
O5 C57 1.445(3) . ?
O5 C60 1.452(3) . ?
O5 Li10 1.953(5) . ?
O4 C53 1.431(4) . ?
O4 C56 1.441(4) . ?
O4 Li10 1.944(5) . ?
O6 C64 1.435(4) . ?
O6 C61 1.451(4) . ?
O6 Li10 1.924(5) . ?
C17 C23 1.406(3) . ?
C17 C18 1.477(3) . ?
C17 Li1 2.619(5) . ?
C17 Li5 2.644(5) . ?
C18 C19 1.393(3) . ?
C18 C26 1.471(3) . ?
C18 Li5 2.444(5) . ?
C18 Li7 2.729(5) . ?
C22 C30 1.406(3) . ?
C22 C21 1.472(3) . ?
C22 Li5 2.663(5) . ?
C22 Li3 2.775(5) . ?
C3 C2 1.395(3) . ?
C3 C4 1.461(3) . ?
C3 Li2 2.381(5) . ?
C3 H3 0.9500 . ?
C19 C20 1.465(3) . ?
C19 Li5 2.341(5) . ?
C19 H19 0.9500 . ?
C21 C20 1.402(3) . ?
C21 C27 1.461(3) . ?
C21 Li9 2.475(5) . ?
C21 Li5 2.601(5) . ?
C20 Li9 2.411(5) . ?
C20 Li5 2.451(5) . ?
C20 H20 0.9500 . ?
C4 C5 1.405(3) . ?
C4 Li3 2.448(5) . ?
C4 Li2 2.571(5) . ?
C4 H4 0.9500 . ?
C23 C24 1.405(3) . ?
C23 Li1 2.252(5) . ?
C23 H23 0.9500 . ?
C2 C10 1.472(3) . ?
C2 C1 1.487(3) . ?
C2 Li2 2.416(5) . ?
C30 C29 1.411(3) . ?
C30 Li3 2.445(5) . ?
C30 H30 0.9500 . ?
C34 C35 1.409(4) . ?
C34 C42 1.468(4) . ?
C34 C33 1.479(3) . ?
C34 Li8 2.488(5) . ?
C34 Li4 2.677(5) . ?
C5 C11 1.461(4) . ?
C5 C6 1.465(3) . ?
C5 Li3 2.483(5) . ?
C5 Li2 2.692(5) . ?
C10 C9 1.371(4) . ?
C10 Li1 2.355(5) . ?
C10 H10 0.9500 . ?
C25 C26 1.367(3) . ?
C25 C24 1.424(3) . ?
C25 Li7 2.477(5) . ?
C25 H25 0.9500 . ?
C24 Li1 2.545(5) . ?
C24 H24 0.9500 . ?
C26 Li7 2.321(5) . ?
C26 H26 0.9500 . ?
C1 C7 1.397(3) . ?
C1 Li2 2.616(5) . ?
C1 Li4 2.752(5) . ?
C29 C28 1.418(4) . ?
C29 Li3 2.326(5) . ?
C29 H29 0.9500 . ?
C27 C28 1.376(3) . ?
C27 Li9 2.475(5) . ?
C27 H27 0.9500 . ?
C33 C39 1.400(3) . ?
C33 Li7 2.636(5) . ?
C33 Li8 2.680(5) . ?
C37 C36 1.401(4) . ?
C37 C43 1.463(4) . ?
C37 C38 1.478(3) . ?
C37 Li6 2.454(5) . ?
C37 Li8 2.581(5) . ?
C42 C41 1.385(4) . ?
C42 Li4 2.279(5) . ?
C42 H42 0.9500 . ?
C31 H31 0.9800 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C7 C8 1.415(4) . ?
C7 Li4 2.287(5) . ?
C7 H7 0.9500 . ?
C6 C14 1.409(3) . ?
C6 Li2 2.719(5) . ?
C48 H48 0.9800 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C28 Li3 2.655(5) . ?
C28 H28 0.9500 . ?
C38 C46 1.402(3) . ?
C38 Li8 2.579(5) . ?
C32 H32 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C46 C45 1.405(3) . ?
C46 Li9 2.426(5) . ?
C46 H46 0.9500 . ?
C36 C35 1.462(4) . ?
C36 Li8 2.471(5) . ?
C36 Li6 2.489(5) . ?
C36 H36 0.9500 . ?
C11 C12 1.379(4) . ?
C11 Li3 2.507(5) . ?
C11 H11 0.9500 . ?
C35 Li8 2.374(5) . ?
C35 H35 0.9500 . ?
C41 C40 1.415(4) . ?
C41 Li4 2.533(5) . ?
C41 H41 0.9500 . ?
C12 C13 1.416(4) . ?
C12 Li6 2.756(5) . ?
C12 H12 0.9500 . ?
C14 C13 1.405(4) . ?
C14 Li6 2.450(5) . ?
C14 H14 0.9500 . ?
C8 C9 1.424(4) . ?
C8 Li4 2.450(5) . ?
C8 H8 0.9500 . ?
C45 C44 1.417(4) . ?
C45 Li9 2.337(5) . ?
C45 H45 0.9500 . ?
C9 Li1 2.458(5) . ?
C9 H9 0.9500 . ?
C39 C40 1.405(4) . ?
C39 Li7 2.259(5) . ?
C39 H39 0.9500 . ?
C44 C43 1.373(4) . ?
C44 H44 0.9500 . ?
C43 Li6 2.434(5) . ?
C43 H43 0.9500 . ?
C13 Li6 2.351(5) . ?
C13 H13 0.9500 . ?
C47 H47 0.9800 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C40 Li7 2.492(5) . ?
C40 H40 0.9500 . ?
C16 H16 0.9800 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C60 C59 1.537(4) . ?
C60 H60 0.9900 . ?
C60 H60A 0.9900 . ?
C59 C58 1.514(4) . ?
C59 H59 0.9900 . ?
C59 H59A 0.9900 . ?
C52 C51 1.501(4) . ?
C52 H52 0.9900 . ?
C52 H52A 0.9900 . ?
C15 H15 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C50 C49 1.476(4) . ?
C50 C51 1.483(5) . ?
C50 H50 0.9900 . ?
C50 H50A 0.9900 . ?
C51 H51 0.9900 . ?
C51 H51A 0.9900 . ?
C58 C57 1.515(4) . ?
C58 H58 0.9900 . ?
C58 H58A 0.9900 . ?
C57 H57 0.9900 . ?
C57 H57A 0.9900 . ?
C49 H49 0.9900 . ?
C49 H49A 0.9900 . ?
C54 C53 1.500(5) . ?
C54 C55 1.527(5) . ?
C54 H54 0.9900 . ?
C54 H54A 0.9900 . ?
C55 C56 1.481(5) . ?
C55 H55 0.9900 . ?
C55 H55A 0.9900 . ?
C62 C63 1.455(5) . ?
C62 C61 1.493(5) . ?
C62 H62 0.9900 . ?
C62 H62A 0.9900 . ?
C53 H53 0.9900 . ?
C53 H53A 0.9900 . ?
C56 H56 0.9900 . ?
C56 H56A 0.9900 . ?
C66 C65 1.322(8) . ?
C66 C67 1.332(8) . ?
C66 H66 0.9500 . ?
C61 H61 0.9900 . ?
C61 H61A 0.9900 . ?
C64 C63 1.522(6) . ?
C64 H64 0.9900 . ?
C64 H64A 0.9900 . ?
Li2 Li5 2.374(6) . ?
Li2 Li8 2.378(6) . ?
Li2 Li3 2.601(6) . ?
Li2 Li4 2.782(6) . ?
Li6 Li8 2.604(6) . ?
Li6 Li9 2.799(7) . ?
Li6 Li3 2.840(6) . ?
C63 H63 0.9900 . ?
C63 H63A 0.9900 . ?
Li5 Li8 2.371(6) . ?
Li5 Li9 2.589(6) . ?
Li5 Li1 2.765(6) . ?
Li3 Li9 2.755(6) . ?
Li1 Li7 2.641(6) . ?
Li1 Li4 2.662(6) . ?
C65 C67 1.406(7) 2_556 ?
C65 H65 0.9500 . ?
C67 C68 1.220(9) . ?
C67 C65 1.406(7) 2_556 ?
Li4 Li7 2.689(7) . ?
Li4 Li8 2.851(6) . ?
Li8 Li7 2.807(6) . ?
C68 H68 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?

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
C17 Si2 C22 110.83(11) . . ?
C17 Si2 C32 109.30(11) . . ?
C22 Si2 C32 109.54(11) . . ?
C17 Si2 C31 109.11(11) . . ?
C22 Si2 C31 107.87(11) . . ?
C32 Si2 C31 110.17(11) . . ?
C38 Si3 C48 110.08(12) . . ?
C38 Si3 C33 110.35(11) . . ?
C48 Si3 C33 110.48(12) . . ?
C38 Si3 C47 106.68(12) . . ?
C48 Si3 C47 110.93(13) . . ?
C33 Si3 C47 108.25(13) . . ?
C1 Si1 C6 110.54(11) . . ?
C1 Si1 C16 109.35(13) . . ?
C6 Si1 C16 111.29(13) . . ?
C1 Si1 C15 110.55(13) . . ?
C6 Si1 C15 106.51(13) . . ?
C16 Si1 C15 108.56(15) . . ?
Li3 O2 Li9 96.5(2) . . ?
Li3 O2 Li6 100.3(2) . . ?
Li9 O2 Li6 98.1(2) . . ?
Li3 O2 Li2 86.9(2) . . ?
Li9 O2 Li2 160.4(2) . . ?
Li6 O2 Li2 100.3(2) . . ?
Li3 O2 Li8 162.0(2) . . ?
Li9 O2 Li8 99.1(2) . . ?
Li6 O2 Li8 86.3(2) . . ?
Li2 O2 Li8 75.46(18) . . ?
Li3 O2 Li5 97.9(2) . . ?
Li9 O2 Li5 85.43(19) . . ?
Li6 O2 Li5 160.9(2) . . ?
Li2 O2 Li5 74.93(18) . . ?
Li8 O2 Li5 74.57(18) . . ?
Li1 O1 Li4 93.8(2) . . ?
Li1 O1 Li7 92.3(2) . . ?
Li4 O1 Li7 94.0(2) . . ?
Li1 O1 Li5 94.1(2) . . ?
Li4 O1 Li5 166.5(2) . . ?
Li7 O1 Li5 96.6(2) . . ?
Li1 O1 Li2 98.0(2) . . ?
Li4 O1 Li2 93.9(2) . . ?
Li7 O1 Li2 166.6(2) . . ?
Li5 O1 Li2 74.20(19) . . ?
Li1 O1 Li8 167.0(2) . . ?
Li4 O1 Li8 96.9(2) . . ?
Li7 O1 Li8 94.4(2) . . ?
Li5 O1 Li8 74.05(18) . . ?
Li2 O1 Li8 73.94(18) . . ?
C49 O3 C52 108.7(2) . . ?
C49 O3 Li10 124.6(2) . . ?
C52 O3 Li10 123.1(2) . . ?
C57 O5 C60 108.8(2) . . ?
C57 O5 Li10 123.2(2) . . ?
C60 O5 Li10 126.2(2) . . ?
C53 O4 C56 106.0(3) . . ?
C53 O4 Li10 125.9(2) . . ?
C56 O4 Li10 123.3(3) . . ?
C64 O6 C61 108.0(3) . . ?
C64 O6 Li10 129.9(3) . . ?
C61 O6 Li10 122.1(2) . . ?
C23 C17 C18 118.5(2) . . ?
C23 C17 Si2 120.94(17) . . ?
C18 C17 Si2 119.99(17) . . ?
C23 C17 Li1 59.25(16) . . ?
C18 C17 Li1 101.16(16) . . ?
Si2 C17 Li1 114.96(14) . . ?
C23 C17 Li5 122.17(18) . . ?
C18 C17 Li5 65.84(15) . . ?
Si2 C17 Li5 89.01(13) . . ?
Li1 C17 Li5 63.40(14) . . ?
C19 C18 C26 118.1(2) . . ?
C19 C18 C17 127.4(2) . . ?
C26 C18 C17 114.5(2) . . ?
C19 C18 Li5 69.04(16) . . ?
C26 C18 Li5 124.48(18) . . ?
C17 C18 Li5 80.70(16) . . ?
C19 C18 Li7 102.48(17) . . ?
C26 C18 Li7 58.24(15) . . ?
C17 C18 Li7 103.21(17) . . ?
Li5 C18 Li7 66.39(15) . . ?
C30 C22 C21 118.5(2) . . ?
C30 C22 Si2 120.20(17) . . ?
C21 C22 Si2 119.99(17) . . ?
C30 C22 Li5 121.64(18) . . ?
C21 C22 Li5 71.46(15) . . ?
Si2 C22 Li5 88.26(13) . . ?
C30 C22 Li3 61.69(15) . . ?
C21 C22 Li3 82.01(16) . . ?
Si2 C22 Li3 137.90(15) . . ?
Li5 C22 Li3 63.79(14) . . ?
C2 C3 C4 137.0(2) . . ?
C2 C3 Li2 74.47(17) . . ?
C4 C3 Li2 80.14(17) . . ?
C2 C3 H3 111.5 . . ?
C4 C3 H3 111.5 . . ?
Li2 C3 H3 126.8 . . ?
C18 C19 C20 136.2(2) . . ?
C18 C19 Li5 77.20(17) . . ?
C20 C19 Li5 76.35(16) . . ?
C18 C19 H19 111.9 . . ?
C20 C19 H19 111.9 . . ?
Li5 C19 H19 127.8 . . ?
C20 C21 C27 118.8(2) . . ?
C20 C21 C22 125.6(2) . . ?
C27 C21 C22 115.4(2) . . ?
C20 C21 Li9 70.81(16) . . ?
C27 C21 Li9 72.83(16) . . ?
C22 C21 Li9 123.86(18) . . ?
C20 C21 Li5 68.06(15) . . ?
C27 C21 Li5 128.21(18) . . ?
C22 C21 Li5 76.08(15) . . ?
Li9 C21 Li5 61.27(15) . . ?
C21 C20 C19 135.0(2) . . ?
C21 C20 Li9 75.86(17) . . ?
C19 C20 Li9 114.32(18) . . ?
C21 C20 Li5 79.89(17) . . ?
C19 C20 Li5 68.15(16) . . ?
Li9 C20 Li5 64.35(16) . . ?
C21 C20 H20 112.5 . . ?
C19 C20 H20 112.5 . . ?
Li9 C20 H20 77.3 . . ?
Li5 C20 H20 135.7 . . ?
C5 C4 C3 134.3(2) . . ?
C5 C4 Li3 74.82(18) . . ?
C3 C4 Li3 110.52(19) . . ?
C5 C4 Li2 79.32(17) . . ?
C3 C4 Li2 65.82(16) . . ?
Li3 C4 Li2 62.36(15) . . ?
C5 C4 H4 112.9 . . ?
C3 C4 H4 112.9 . . ?
Li3 C4 H4 83.4 . . ?
Li2 C4 H4 139.9 . . ?
C24 C23 C17 124.5(2) . . ?
C24 C23 Li1 84.85(18) . . ?
C17 C23 Li1 88.31(18) . . ?
C24 C23 H23 117.8 . . ?
C17 C23 H23 117.8 . . ?
Li1 C23 H23 97.4 . . ?
C3 C2 C10 119.2(2) . . ?
C3 C2 C1 126.3(2) . . ?
C10 C2 C1 114.5(2) . . ?
C3 C2 Li2 71.73(17) . . ?
C10 C2 Li2 121.72(19) . . ?
C1 C2 Li2 80.37(17) . . ?
C22 C30 C29 124.0(2) . . ?
C22 C30 Li3 87.90(17) . . ?
C29 C30 Li3 68.23(17) . . ?
C22 C30 H30 118.0 . . ?
C29 C30 H30 118.0 . . ?
Li3 C30 H30 115.7 . . ?
C35 C34 C42 117.5(2) . . ?
C35 C34 C33 128.0(2) . . ?
C42 C34 C33 114.5(2) . . ?
C35 C34 Li8 68.76(17) . . ?
C42 C34 Li8 125.20(19) . . ?
C33 C34 Li8 80.67(17) . . ?
C35 C34 Li4 99.14(19) . . ?
C42 C34 Li4 58.33(15) . . ?
C33 C34 Li4 106.32(18) . . ?
Li8 C34 Li4 66.88(15) . . ?
C4 C5 C11 118.9(2) . . ?
C4 C5 C6 125.6(2) . . ?
C11 C5 C6 115.4(2) . . ?
C4 C5 Li3 72.09(17) . . ?
C11 C5 Li3 73.87(17) . . ?
C6 C5 Li3 122.45(18) . . ?
C4 C5 Li2 69.83(16) . . ?
C11 C5 Li2 128.09(19) . . ?
C6 C5 Li2 75.32(16) . . ?
Li3 C5 Li2 60.18(15) . . ?
C9 C10 C2 122.6(2) . . ?
C9 C10 Li1 77.62(19) . . ?
C2 C10 Li1 92.57(18) . . ?
C9 C10 H10 118.7 . . ?
C2 C10 H10 118.7 . . ?
Li1 C10 H10 100.2 . . ?
C26 C25 C24 121.5(2) . . ?
C26 C25 Li7 67.26(18) . . ?
C24 C25 Li7 99.75(19) . . ?
C26 C25 H25 119.2 . . ?
C24 C25 H25 119.2 . . ?
Li7 C25 H25 102.8 . . ?
C23 C24 C25 116.3(2) . . ?
C23 C24 Li1 61.78(16) . . ?
C25 C24 Li1 107.42(18) . . ?
C23 C24 H24 121.9 . . ?
C25 C24 H24 121.9 . . ?
Li1 C24 H24 99.5 . . ?
C25 C26 C18 122.8(2) . . ?
C25 C26 Li7 79.85(19) . . ?
C18 C26 Li7 89.15(17) . . ?
C25 C26 H26 118.6 . . ?
C18 C26 H26 118.6 . . ?
Li7 C26 H26 101.5 . . ?
C7 C1 C2 118.2(2) . . ?
C7 C1 Si1 121.74(18) . . ?
C2 C1 Si1 119.79(18) . . ?
C7 C1 Li2 118.14(19) . . ?
C2 C1 Li2 65.56(15) . . ?
Si1 C1 Li2 90.66(14) . . ?
C7 C1 Li4 56.01(16) . . ?
C2 C1 Li4 99.08(17) . . ?
Si1 C1 Li4 118.00(15) . . ?
Li2 C1 Li4 62.38(14) . . ?
C30 C29 C28 117.1(2) . . ?
C30 C29 Li3 77.48(18) . . ?
C28 C29 Li3 86.77(18) . . ?
C30 C29 H29 121.5 . . ?
C28 C29 H29 121.5 . . ?
Li3 C29 H29 105.2 . . ?
C28 C27 C21 122.5(2) . . ?
C28 C27 Li9 114.5(2) . . ?
C21 C27 Li9 72.84(16) . . ?
C28 C27 H27 118.7 . . ?
C21 C27 H27 118.7 . . ?
Li9 C27 H27 82.9 . . ?
C39 C33 C34 119.8(2) . . ?
C39 C33 Si3 120.62(19) . . ?
C34 C33 Si3 119.20(18) . . ?
C39 C33 Li7 58.95(16) . . ?
C34 C33 Li7 99.62(17) . . ?
Si3 C33 Li7 116.27(15) . . ?
C39 C33 Li8 122.61(18) . . ?
C34 C33 Li8 66.34(15) . . ?
Si3 C33 Li8 86.95(13) . . ?
Li7 C33 Li8 63.75(14) . . ?
C36 C37 C43 119.2(2) . . ?
C36 C37 C38 125.5(2) . . ?
C43 C37 C38 115.1(2) . . ?
C36 C37 Li6 74.93(18) . . ?
C43 C37 Li6 71.85(17) . . ?
C38 C37 Li6 119.40(18) . . ?
C36 C37 Li8 69.63(17) . . ?
C43 C37 Li8 129.01(18) . . ?
C38 C37 Li8 73.28(16) . . ?
Li6 C37 Li8 62.24(15) . . ?
C41 C42 C34 121.7(2) . . ?
C41 C42 Li4 83.7(2) . . ?
C34 C42 Li4 88.42(19) . . ?
C41 C42 H42 119.2 . . ?
C34 C42 H42 119.2 . . ?
Li4 C42 H42 98.1 . . ?
Si2 C31 H31 109.5 . . ?
Si2 C31 H31A 109.5 . . ?
H31 C31 H31A 109.5 . . ?
Si2 C31 H31B 109.5 . . ?
H31 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C1 C7 C8 124.9(2) . . ?
C1 C7 Li4 93.54(19) . . ?
C8 C7 Li4 79.05(19) . . ?
C1 C7 H7 117.5 . . ?
C8 C7 H7 117.5 . . ?
Li4 C7 H7 98.0 . . ?
C14 C6 C5 118.6(2) . . ?
C14 C6 Si1 120.90(19) . . ?
C5 C6 Si1 119.31(18) . . ?
C14 C6 Li2 119.89(18) . . ?
C5 C6 Li2 73.26(16) . . ?
Si1 C6 Li2 87.48(13) . . ?
Si3 C48 H48 109.5 . . ?
Si3 C48 H48A 109.5 . . ?
H48 C48 H48A 109.5 . . ?
Si3 C48 H48B 109.5 . . ?
H48 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C27 C28 C29 121.3(2) . . ?
C27 C28 Li3 88.24(18) . . ?
C29 C28 Li3 61.01(16) . . ?
C27 C28 H28 119.4 . . ?
C29 C28 H28 119.4 . . ?
Li3 C28 H28 121.7 . . ?
C46 C38 C37 118.5(2) . . ?
C46 C38 Si3 121.03(19) . . ?
C37 C38 Si3 118.59(18) . . ?
C46 C38 Li8 118.96(18) . . ?
C37 C38 Li8 73.42(16) . . ?
Si3 C38 Li8 90.25(13) . . ?
Si2 C32 H32 109.5 . . ?
Si2 C32 H32A 109.5 . . ?
H32 C32 H32A 109.5 . . ?
Si2 C32 H32B 109.5 . . ?
H32 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C38 C46 C45 124.1(2) . . ?
C38 C46 Li9 92.93(18) . . ?
C45 C46 Li9 69.41(17) . . ?
C38 C46 H46 118.0 . . ?
C45 C46 H46 118.0 . . ?
Li9 C46 H46 108.7 . . ?
C37 C36 C35 134.9(2) . . ?
C37 C36 Li8 78.25(18) . . ?
C35 C36 Li8 68.83(17) . . ?
C37 C36 Li6 72.14(18) . . ?
C35 C36 Li6 115.7(2) . . ?
Li8 C36 Li6 63.33(15) . . ?
C37 C36 H36 112.5 . . ?
C35 C36 H36 112.5 . . ?
Li8 C36 H36 137.5 . . ?
Li6 C36 H36 80.5 . . ?
C12 C11 C5 122.5(2) . . ?
C12 C11 Li3 113.0(2) . . ?
C5 C11 Li3 72.08(17) . . ?
C12 C11 H11 118.8 . . ?
C5 C11 H11 118.8 . . ?
Li3 C11 H11 85.1 . . ?
C34 C35 C36 135.7(2) . . ?
C34 C35 Li8 77.67(18) . . ?
C36 C35 Li8 76.11(17) . . ?
C34 C35 H35 112.1 . . ?
C36 C35 H35 112.1 . . ?
Li8 C35 H35 127.0 . . ?
C42 C41 C40 121.9(3) . . ?
C42 C41 Li4 63.41(18) . . ?
C40 C41 Li4 102.72(19) . . ?
C42 C41 H41 119.1 . . ?
C40 C41 H41 119.1 . . ?
Li4 C41 H41 103.5 . . ?
C11 C12 C13 120.8(3) . . ?
C11 C12 Li6 90.50(18) . . ?
C13 C12 Li6 58.57(16) . . ?
C11 C12 H12 119.6 . . ?
C13 C12 H12 119.6 . . ?
Li6 C12 H12 121.3 . . ?
C13 C14 C6 123.7(2) . . ?
C13 C14 Li6 69.19(18) . . ?
C6 C14 Li6 90.08(18) . . ?
C13 C14 H14 118.2 . . ?
C6 C14 H14 118.2 . . ?
Li6 C14 H14 112.0 . . ?
C7 C8 C9 115.9(2) . . ?
C7 C8 Li4 66.39(18) . . ?
C9 C8 Li4 107.32(19) . . ?
C7 C8 H8 122.1 . . ?
C9 C8 H8 122.1 . . ?
Li4 C8 H8 95.6 . . ?
C46 C45 C44 116.6(2) . . ?
C46 C45 Li9 76.33(18) . . ?
C44 C45 Li9 94.28(19) . . ?
C46 C45 H45 121.7 . . ?
C44 C45 H45 121.7 . . ?
Li9 C45 H45 98.8 . . ?
C10 C9 C8 121.7(2) . . ?
C10 C9 Li1 69.36(18) . . ?
C8 C9 Li1 101.35(19) . . ?
C10 C9 H9 119.1 . . ?
C8 C9 H9 119.1 . . ?
Li1 C9 H9 99.2 . . ?
C33 C39 C40 123.1(3) . . ?
C33 C39 Li7 88.96(18) . . ?
C40 C39 Li7 82.14(19) . . ?
C33 C39 H39 118.4 . . ?
C40 C39 H39 118.4 . . ?
Li7 C39 H39 99.4 . . ?
C43 C44 C45 122.1(2) . . ?
C43 C44 H44 118.9 . . ?
C45 C44 H44 118.9 . . ?
C44 C43 C37 121.8(2) . . ?
C44 C43 Li6 107.8(2) . . ?
C37 C43 Li6 73.33(18) . . ?
C44 C43 H43 119.1 . . ?
C37 C43 H43 119.1 . . ?
Li6 C43 H43 88.9 . . ?
C14 C13 C12 117.6(2) . . ?
C14 C13 Li6 76.87(19) . . ?
C12 C13 Li6 90.50(19) . . ?
C14 C13 H13 121.2 . . ?
C12 C13 H13 121.2 . . ?
Li6 C13 H13 102.2 . . ?
Si3 C47 H47 109.5 . . ?
Si3 C47 H47A 109.5 . . ?
H47 C47 H47A 109.5 . . ?
Si3 C47 H47B 109.5 . . ?
H47 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C39 C40 C41 117.1(2) . . ?
C39 C40 Li7 63.90(17) . . ?
C41 C40 Li7 106.4(2) . . ?
C39 C40 H40 121.5 . . ?
C41 C40 H40 121.5 . . ?
Li7 C40 H40 98.7 . . ?
Si1 C16 H16 109.5 . . ?
Si1 C16 H16A 109.5 . . ?
H16 C16 H16A 109.5 . . ?
Si1 C16 H16B 109.5 . . ?
H16 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
O5 C60 C59 106.1(2) . . ?
O5 C60 H60 110.5 . . ?
C59 C60 H60 110.5 . . ?
O5 C60 H60A 110.5 . . ?
C59 C60 H60A 110.5 . . ?
H60 C60 H60A 108.7 . . ?
C58 C59 C60 104.1(2) . . ?
C58 C59 H59 110.9 . . ?
C60 C59 H59 110.9 . . ?
C58 C59 H59A 110.9 . . ?
C60 C59 H59A 110.9 . . ?
H59 C59 H59A 108.9 . . ?
O3 C52 C51 105.8(2) . . ?
O3 C52 H52 110.6 . . ?
C51 C52 H52 110.6 . . ?
O3 C52 H52A 110.6 . . ?
C51 C52 H52A 110.6 . . ?
H52 C52 H52A 108.7 . . ?
Si1 C15 H15 109.5 . . ?
Si1 C15 H15A 109.5 . . ?
H15 C15 H15A 109.5 . . ?
Si1 C15 H15B 109.5 . . ?
H15 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C49 C50 C51 104.2(3) . . ?
C49 C50 H50 110.9 . . ?
C51 C50 H50 110.9 . . ?
C49 C50 H50A 110.9 . . ?
C51 C50 H50A 110.9 . . ?
H50 C50 H50A 108.9 . . ?
C50 C51 C52 105.3(2) . . ?
C50 C51 H51 110.7 . . ?
C52 C51 H51 110.7 . . ?
C50 C51 H51A 110.7 . . ?
C52 C51 H51A 110.7 . . ?
H51 C51 H51A 108.8 . . ?
C59 C58 C57 101.7(2) . . ?
C59 C58 H58 111.4 . . ?
C57 C58 H58 111.4 . . ?
C59 C58 H58A 111.4 . . ?
C57 C58 H58A 111.4 . . ?
H58 C58 H58A 109.3 . . ?
O5 C57 C58 105.3(2) . . ?
O5 C57 H57 110.7 . . ?
C58 C57 H57 110.7 . . ?
O5 C57 H57A 110.7 . . ?
C58 C57 H57A 110.7 . . ?
H57 C57 H57A 108.8 . . ?
O3 C49 C50 108.1(3) . . ?
O3 C49 H49 110.1 . . ?
C50 C49 H49 110.1 . . ?
O3 C49 H49A 110.1 . . ?
C50 C49 H49A 110.1 . . ?
H49 C49 H49A 108.4 . . ?
C53 C54 C55 104.3(3) . . ?
C53 C54 H54 110.9 . . ?
C55 C54 H54 110.9 . . ?
C53 C54 H54A 110.9 . . ?
C55 C54 H54A 110.9 . . ?
H54 C54 H54A 108.9 . . ?
C56 C55 C54 104.9(3) . . ?
C56 C55 H55 110.8 . . ?
C54 C55 H55 110.8 . . ?
C56 C55 H55A 110.8 . . ?
C54 C55 H55A 110.8 . . ?
H55 C55 H55A 108.8 . . ?
C63 C62 C61 102.1(3) . . ?
C63 C62 H62 111.4 . . ?
C61 C62 H62 111.4 . . ?
C63 C62 H62A 111.4 . . ?
C61 C62 H62A 111.4 . . ?
H62 C62 H62A 109.2 . . ?
O4 C53 C54 105.9(3) . . ?
O4 C53 H53 110.6 . . ?
C54 C53 H53 110.6 . . ?
O4 C53 H53A 110.6 . . ?
C54 C53 H53A 110.6 . . ?
H53 C53 H53A 108.7 . . ?
O4 C56 C55 108.3(3) . . ?
O4 C56 H56 110.0 . . ?
C55 C56 H56 110.0 . . ?
O4 C56 H56A 110.0 . . ?
C55 C56 H56A 110.0 . . ?
H56 C56 H56A 108.4 . . ?
C65 C66 C67 119.8(6) . . ?
C65 C66 H66 120.1 . . ?
C67 C66 H66 120.1 . . ?
O6 C61 C62 107.8(3) . . ?
O6 C61 H61 110.2 . . ?
C62 C61 H61 110.2 . . ?
O6 C61 H61A 110.2 . . ?
C62 C61 H61A 110.2 . . ?
H61 C61 H61A 108.5 . . ?
O6 C64 C63 104.4(3) . . ?
O6 C64 H64 110.9 . . ?
C63 C64 H64 110.9 . . ?
O6 C64 H64A 110.9 . . ?
C63 C64 H64A 110.9 . . ?
H64 C64 H64A 108.9 . . ?
O2 Li2 O1 91.53(18) . . ?
O2 Li2 Li5 53.07(15) . . ?
O1 Li2 Li5 52.58(15) . . ?
O2 Li2 Li8 52.48(15) . . ?
O1 Li2 Li8 53.06(15) . . ?
Li5 Li2 Li8 59.86(17) . . ?
O2 Li2 C3 126.5(2) . . ?
O1 Li2 C3 120.5(2) . . ?
Li5 Li2 C3 112.23(19) . . ?
Li8 Li2 C3 171.5(2) . . ?
O2 Li2 C2 159.4(2) . . ?
O1 Li2 C2 97.56(19) . . ?
Li5 Li2 C2 120.1(2) . . ?
Li8 Li2 C2 145.5(2) . . ?
C3 Li2 C2 33.80(10) . . ?
O2 Li2 C4 99.69(19) . . ?
O1 Li2 C4 151.6(2) . . ?
Li5 Li2 C4 115.81(19) . . ?
Li8 Li2 C4 149.9(2) . . ?
C3 Li2 C4 34.05(10) . . ?
C2 Li2 C4 64.32(13) . . ?
O2 Li2 Li3 45.07(14) . . ?
O1 Li2 Li3 122.9(2) . . ?
Li5 Li2 Li3 70.43(18) . . ?
Li8 Li2 Li3 97.5(2) . . ?
C3 Li2 Li3 81.67(17) . . ?
C2 Li2 Li3 115.39(19) . . ?
C4 Li2 Li3 56.50(14) . . ?
O2 Li2 C1 162.4(2) . . ?
O1 Li2 C1 96.46(18) . . ?
Li5 Li2 C1 142.5(2) . . ?
Li8 Li2 C1 122.1(2) . . ?
C3 Li2 C1 61.71(13) . . ?
C2 Li2 C1 34.08(9) . . ?
C4 Li2 C1 80.51(14) . . ?
Li3 Li2 C1 136.8(2) . . ?
O2 Li2 C5 85.94(17) . . ?
O1 Li2 C5 177.1(2) . . ?
Li5 Li2 C5 126.4(2) . . ?
Li8 Li2 C5 124.0(2) . . ?
C3 Li2 C5 62.39(13) . . ?
C2 Li2 C5 85.32(15) . . ?
C4 Li2 C5 30.85(9) . . ?
Li3 Li2 C5 55.93(14) . . ?
C1 Li2 C5 85.57(15) . . ?
O2 Li2 C6 94.72(18) . . ?
O1 Li2 C6 147.7(2) . . ?
Li5 Li2 C6 147.2(2) . . ?
Li8 Li2 C6 108.21(19) . . ?
C3 Li2 C6 80.06(14) . . ?
C2 Li2 C6 87.45(15) . . ?
C4 Li2 C6 57.62(11) . . ?
Li3 Li2 C6 82.12(17) . . ?
C1 Li2 C6 70.32(13) . . ?
C5 Li2 C6 31.42(9) . . ?
O2 Li2 Li4 118.7(2) . . ?
O1 Li2 Li4 41.00(13) . . ?
Li5 Li2 Li4 93.39(19) . . ?
Li8 Li2 Li4 66.53(17) . . ?
C3 Li2 Li4 112.8(2) . . ?
C2 Li2 Li4 79.28(17) . . ?
C4 Li2 Li4 141.2(2) . . ?
Li3 Li2 Li4 161.9(2) . . ?
C1 Li2 Li4 61.21(15) . . ?
C5 Li2 Li4 139.6(2) . . ?
C6 Li2 Li4 110.17(18) . . ?
O2 Li6 C13 138.0(2) . . ?
O2 Li6 C43 112.9(2) . . ?
C13 Li6 C43 103.19(19) . . ?
O2 Li6 C14 123.0(2) . . ?
C13 Li6 C14 33.95(11) . . ?
C43 Li6 C14 123.6(2) . . ?
O2 Li6 C37 96.0(2) . . ?
C13 Li6 C37 125.9(2) . . ?
C43 Li6 C37 34.82(11) . . ?
C14 Li6 C37 125.8(2) . . ?
O2 Li6 C36 105.6(2) . . ?
C13 Li6 C36 110.64(19) . . ?
C43 Li6 C36 60.23(14) . . ?
C14 Li6 C36 96.12(18) . . ?
C37 Li6 C36 32.93(10) . . ?
O2 Li6 Li8 48.31(14) . . ?
C13 Li6 Li8 150.6(2) . . ?
C43 Li6 Li8 93.82(18) . . ?
C14 Li6 Li8 116.9(2) . . ?
C37 Li6 Li8 61.27(15) . . ?
C36 Li6 Li8 57.99(14) . . ?
O2 Li6 C12 111.9(2) . . ?
C13 Li6 C12 30.93(10) . . ?
C43 Li6 C12 111.40(19) . . ?
C14 Li6 C12 54.85(13) . . ?
C37 Li6 C12 144.9(2) . . ?
C36 Li6 C12 141.2(2) . . ?
Li8 Li6 C12 153.8(2) . . ?
O2 Li6 Li9 40.83(14) . . ?
C13 Li6 Li9 142.8(2) . . ?
C43 Li6 Li9 75.44(17) . . ?
C14 Li6 Li9 159.5(2) . . ?
C37 Li6 Li9 73.82(16) . . ?
C36 Li6 Li9 100.88(19) . . ?
Li8 Li6 Li9 64.56(17) . . ?
C12 Li6 Li9 113.89(19) . . ?
O2 Li6 Li3 39.70(13) . . ?
C13 Li6 Li3 100.51(19) . . ?
C43 Li6 Li3 128.4(2) . . ?
C14 Li6 Li3 101.06(19) . . ?
C37 Li6 Li3 130.9(2) . . ?
C36 Li6 Li3 144.8(2) . . ?
Li8 Li6 Li3 86.84(18) . . ?
C12 Li6 Li3 72.23(15) . . ?
Li9 Li6 Li3 58.48(15) . . ?
O2 Li6 Li2 40.86(14) . . ?
C13 Li6 Li2 112.0(2) . . ?
C43 Li6 Li2 143.8(2) . . ?
C14 Li6 Li2 84.81(17) . . ?
C37 Li6 Li2 111.80(19) . . ?
C36 Li6 Li2 98.18(18) . . ?
Li8 Li6 Li2 50.69(14) . . ?
C12 Li6 Li2 103.29(17) . . ?
Li9 Li6 Li2 81.52(16) . . ?
Li3 Li6 Li2 53.73(15) . . ?
C62 C63 C64 104.6(3) . . ?
C62 C63 H63 110.8 . . ?
C64 C63 H63 110.8 . . ?
C62 C63 H63A 110.8 . . ?
C64 C63 H63A 110.8 . . ?
H63 C63 H63A 108.9 . . ?
O1 Li5 O2 91.19(18) . . ?
O1 Li5 C19 119.1(2) . . ?
O2 Li5 C19 128.6(2) . . ?
O1 Li5 Li8 53.33(15) . . ?
O2 Li5 Li8 52.39(15) . . ?
C19 Li5 Li8 112.4(2) . . ?
O1 Li5 Li2 53.22(15) . . ?
O2 Li5 Li2 51.99(15) . . ?
C19 Li5 Li2 171.2(2) . . ?
Li8 Li5 Li2 60.15(17) . . ?
O1 Li5 C18 95.81(18) . . ?
O2 Li5 C18 161.1(2) . . ?
C19 Li5 C18 33.76(10) . . ?
Li8 Li5 C18 119.9(2) . . ?
Li2 Li5 C18 143.7(2) . . ?
O1 Li5 C20 152.1(2) . . ?
O2 Li5 C20 100.96(19) . . ?
C19 Li5 C20 35.51(10) . . ?
Li8 Li5 C20 116.5(2) . . ?
Li2 Li5 C20 150.2(2) . . ?
C18 Li5 C20 65.59(13) . . ?
O1 Li5 Li9 124.3(2) . . ?
O2 Li5 Li9 45.39(14) . . ?
C19 Li5 Li9 83.76(17) . . ?
Li8 Li5 Li9 71.13(18) . . ?
Li2 Li5 Li9 97.4(2) . . ?
C18 Li5 Li9 117.5(2) . . ?
C20 Li5 Li9 57.07(15) . . ?
O1 Li5 C21 175.8(2) . . ?
O2 Li5 C21 87.54(17) . . ?
C19 Li5 C21 64.57(13) . . ?
Li8 Li5 C21 128.1(2) . . ?
Li2 Li5 C21 123.3(2) . . ?
C18 Li5 C21 86.64(15) . . ?
C20 Li5 C21 32.06(9) . . ?
Li9 Li5 C21 56.97(14) . . ?
O1 Li5 C17 93.19(17) . . ?
O2 Li5 C17 163.6(2) . . ?
C19 Li5 C17 61.81(13) . . ?
Li8 Li5 C17 140.3(2) . . ?
Li2 Li5 C17 120.1(2) . . ?
C18 Li5 C17 33.46(9) . . ?
C20 Li5 C17 82.23(15) . . ?
Li9 Li5 C17 139.1(2) . . ?
C21 Li5 C17 86.96(14) . . ?
O1 Li5 C22 144.0(2) . . ?
O2 Li5 C22 96.60(17) . . ?
C19 Li5 C22 82.36(14) . . ?
Li8 Li5 C22 148.7(2) . . ?
Li2 Li5 C22 106.40(18) . . ?
C18 Li5 C22 88.05(15) . . ?
C20 Li5 C22 59.85(12) . . ?
Li9 Li5 C22 84.01(16) . . ?
C21 Li5 C22 32.46(9) . . ?
C17 Li5 C22 70.87(13) . . ?
O1 Li5 Li1 40.94(13) . . ?
O2 Li5 Li1 118.9(2) . . ?
C19 Li5 Li1 110.35(19) . . ?
Li8 Li5 Li1 94.13(19) . . ?
Li2 Li5 Li1 67.22(17) . . ?
C18 Li5 Li1 76.82(16) . . ?
C20 Li5 Li1 139.7(2) . . ?
Li9 Li5 Li1 163.0(2) . . ?
C21 Li5 Li1 137.03(19) . . ?
C17 Li5 Li1 57.87(14) . . ?
C22 Li5 Li1 106.63(17) . . ?
O2 Li3 C29 143.9(2) . . ?
O2 Li3 C30 126.2(2) . . ?
C29 Li3 C30 34.29(10) . . ?
O2 Li3 C4 107.0(2) . . ?
C29 Li3 C4 104.93(18) . . ?
C30 Li3 C4 94.13(17) . . ?
O2 Li3 C5 94.35(19) . . ?
C29 Li3 C5 121.7(2) . . ?
C30 Li3 C5 124.7(2) . . ?
C4 Li3 C5 33.09(10) . . ?
O2 Li3 C11 108.2(2) . . ?
C29 Li3 C11 102.15(18) . . ?
C30 Li3 C11 125.02(19) . . ?
C4 Li3 C11 59.74(13) . . ?
C5 Li3 C11 34.05(10) . . ?
O2 Li3 Li2 48.06(14) . . ?
C29 Li3 Li2 147.6(2) . . ?
C30 Li3 Li2 114.0(2) . . ?
C4 Li3 Li2 61.14(15) . . ?
C5 Li3 Li2 63.89(15) . . ?
C11 Li3 Li2 95.21(18) . . ?
O2 Li3 C28 116.7(2) . . ?
C29 Li3 C28 32.22(10) . . ?
C30 Li3 C28 56.29(12) . . ?
C4 Li3 C28 135.95(19) . . ?
C5 Li3 C28 140.0(2) . . ?
C11 Li3 C28 108.13(18) . . ?
Li2 Li3 C28 156.1(2) . . ?
O2 Li3 Li9 41.82(14) . . ?
C29 Li3 Li9 104.5(2) . . ?
C30 Li3 Li9 104.53(19) . . ?
C4 Li3 Li9 148.8(2) . . ?
C5 Li3 Li9 129.6(2) . . ?
C11 Li3 Li9 122.7(2) . . ?
Li2 Li3 Li9 88.26(18) . . ?
C28 Li3 Li9 74.95(16) . . ?
O2 Li3 C22 95.93(19) . . ?
C29 Li3 C22 57.54(12) . . ?
C30 Li3 C22 30.41(9) . . ?
C4 Li3 C22 108.90(18) . . ?
C5 Li3 C22 141.7(2) . . ?
C11 Li3 C22 155.33(19) . . ?
Li2 Li3 C22 97.30(18) . . ?
C28 Li3 C22 63.23(12) . . ?
Li9 Li3 C22 78.93(16) . . ?
O2 Li3 Li6 40.03(14) . . ?
C29 Li3 Li6 147.4(2) . . ?
C30 Li3 Li6 164.1(2) . . ?
C4 Li3 Li6 98.32(18) . . ?
C5 Li3 Li6 69.98(16) . . ?
C11 Li3 Li6 70.34(15) . . ?
Li2 Li3 Li6 64.57(16) . . ?
C28 Li3 Li6 118.0(2) . . ?
Li9 Li3 Li6 60.01(16) . . ?
C22 Li3 Li6 134.32(19) . . ?
O2 Li3 Li5 42.62(14) . . ?
C29 Li3 Li5 113.1(2) . . ?
C30 Li3 Li5 84.91(17) . . ?
C4 Li3 Li5 103.58(19) . . ?
C5 Li3 Li5 114.98(19) . . ?
C11 Li3 Li5 144.2(2) . . ?
Li2 Li3 Li5 51.09(15) . . ?
C28 Li3 Li5 104.99(18) . . ?
Li9 Li3 Li5 54.71(15) . . ?
C22 Li3 Li5 56.21(13) . . ?
Li6 Li3 Li5 82.52(17) . . ?
O1 Li1 C23 124.3(2) . . ?
O1 Li1 C10 117.3(2) . . ?
C23 Li1 C10 115.75(19) . . ?
O1 Li1 C9 117.8(2) . . ?
C23 Li1 C9 115.6(2) . . ?
C10 Li1 C9 33.01(11) . . ?
O1 Li1 C24 116.0(2) . . ?
C23 Li1 C24 33.36(10) . . ?
C10 Li1 C24 123.81(19) . . ?
C9 Li1 C24 104.04(18) . . ?
O1 Li1 C17 97.5(2) . . ?
C23 Li1 C17 32.44(10) . . ?
C10 Li1 C17 128.59(19) . . ?
C9 Li1 C17 144.65(19) . . ?
C24 Li1 C17 57.57(13) . . ?
O1 Li1 Li7 44.31(14) . . ?
C23 Li1 Li7 90.83(19) . . ?
C10 Li1 Li7 150.9(2) . . ?
C9 Li1 Li7 125.9(2) . . ?
C24 Li1 Li7 72.25(16) . . ?
C17 Li1 Li7 80.16(17) . . ?
O1 Li1 Li4 43.29(15) . . ?
C23 Li1 Li4 148.8(2) . . ?
C10 Li1 Li4 90.31(19) . . ?
C9 Li1 Li4 76.65(17) . . ?
C24 Li1 Li4 118.1(2) . . ?
C17 Li1 Li4 137.8(2) . . ?
Li7 Li1 Li4 60.93(17) . . ?
O1 Li1 Li5 44.98(14) . . ?
C23 Li1 Li5 90.93(18) . . ?
C10 Li1 Li5 123.9(2) . . ?
C9 Li1 Li5 150.0(2) . . ?
C24 Li1 Li5 105.86(19) . . ?
C17 Li1 Li5 58.73(14) . . ?
Li7 Li1 Li5 63.38(17) . . ?
Li4 Li1 Li5 87.76(18) . . ?
O1 Li1 Li2 43.12(14) . . ?
C23 Li1 Li2 136.4(2) . . ?
C10 Li1 Li2 81.44(17) . . ?
C9 Li1 Li2 100.31(18) . . ?
C24 Li1 Li2 154.4(2) . . ?
C17 Li1 Li2 104.91(18) . . ?
Li7 Li1 Li2 87.12(18) . . ?
Li4 Li1 Li2 60.34(16) . . ?
Li5 Li1 Li2 49.86(14) . . ?
C66 C65 C67 111.1(7) . 2_556 ?
C66 C65 H65 124.4 . . ?
C67 C65 H65 124.4 2_556 . ?
C68 C67 C66 124.9(8) . . ?
C68 C67 C65 106.0(9) . 2_556 ?
C66 C67 C65 129.0(7) . 2_556 ?
O1 Li4 C42 120.6(2) . . ?
O1 Li4 C7 121.6(2) . . ?
C42 Li4 C7 115.8(2) . . ?
O1 Li4 C8 115.5(2) . . ?
C42 Li4 C8 120.0(2) . . ?
C7 Li4 C8 34.56(11) . . ?
O1 Li4 C41 117.6(2) . . ?
C42 Li4 C41 32.92(11) . . ?
C7 Li4 C41 117.6(2) . . ?
C8 Li4 C41 101.72(19) . . ?
O1 Li4 Li1 42.91(14) . . ?
C42 Li4 Li1 147.6(2) . . ?
C7 Li4 Li1 92.14(19) . . ?
C8 Li4 Li1 73.78(17) . . ?
C41 Li4 Li1 120.3(2) . . ?
O1 Li4 C34 90.44(19) . . ?
C42 Li4 C34 33.25(10) . . ?
C7 Li4 C34 136.1(2) . . ?
C8 Li4 C34 153.1(2) . . ?
C41 Li4 C34 57.07(13) . . ?
Li1 Li4 C34 129.7(2) . . ?
O1 Li4 Li7 43.24(15) . . ?
C42 Li4 Li7 90.01(19) . . ?
C7 Li4 Li7 149.8(2) . . ?
C8 Li4 Li7 119.6(2) . . ?
C41 Li4 Li7 75.34(17) . . ?
Li1 Li4 Li7 59.15(16) . . ?
C34 Li4 Li7 74.04(16) . . ?
O1 Li4 C1 95.65(19) . . ?
C42 Li4 C1 131.4(2) . . ?
C7 Li4 C1 30.45(10) . . ?
C8 Li4 C1 56.94(13) . . ?
C41 Li4 C1 146.5(2) . . ?
Li1 Li4 C1 80.98(16) . . ?
C34 Li4 C1 131.1(2) . . ?
Li7 Li4 C1 136.30(19) . . ?
O1 Li4 Li2 45.13(14) . . ?
C42 Li4 Li2 130.3(2) . . ?
C7 Li4 Li2 86.73(18) . . ?
C8 Li4 Li2 103.69(19) . . ?
C41 Li4 Li2 154.1(2) . . ?
Li1 Li4 Li2 63.42(16) . . ?
C34 Li4 Li2 99.74(18) . . ?
Li7 Li4 Li2 87.87(18) . . ?
C1 Li4 Li2 56.41(14) . . ?
O1 Li4 Li8 43.54(14) . . ?
C42 Li4 Li8 86.63(18) . . ?
C7 Li4 Li8 131.8(2) . . ?
C8 Li4 Li8 152.8(2) . . ?
C41 Li4 Li8 104.24(19) . . ?
Li1 Li4 Li8 86.22(18) . . ?
C34 Li4 Li8 53.39(13) . . ?
Li7 Li4 Li8 60.82(17) . . ?
C1 Li4 Li8 102.53(18) . . ?
Li2 Li4 Li8 49.93(14) . . ?
O2 Li8 O1 91.14(18) . . ?
O2 Li8 Li5 53.04(15) . . ?
O1 Li8 Li5 52.62(15) . . ?
O2 Li8 C35 129.8(2) . . ?
O1 Li8 C35 114.8(2) . . ?
Li5 Li8 C35 166.8(2) . . ?
O2 Li8 Li2 52.05(15) . . ?
O1 Li8 Li2 53.00(15) . . ?
Li5 Li8 Li2 59.99(17) . . ?
C35 Li8 Li2 110.2(2) . . ?
O2 Li8 C36 103.33(19) . . ?
O1 Li8 C36 147.3(2) . . ?
Li5 Li8 C36 154.8(2) . . ?
C35 Li8 C36 35.06(11) . . ?
Li2 Li8 C36 115.1(2) . . ?
O2 Li8 C34 161.5(2) . . ?
O1 Li8 C34 92.83(18) . . ?
Li5 Li8 C34 140.3(2) . . ?
C35 Li8 C34 33.58(10) . . ?
Li2 Li8 C34 118.2(2) . . ?
C36 Li8 C34 64.85(13) . . ?
O2 Li8 C38 97.88(19) . . ?
O1 Li8 C38 146.6(2) . . ?
Li5 Li8 C38 109.5(2) . . ?
C35 Li8 C38 83.43(15) . . ?
Li2 Li8 C38 149.4(2) . . ?
C36 Li8 C38 60.87(13) . . ?
C34 Li8 C38 88.66(15) . . ?
O2 Li8 C37 89.83(17) . . ?
O1 Li8 C37 179.0(2) . . ?
Li5 Li8 C37 128.2(2) . . ?
C35 Li8 C37 64.38(13) . . ?
Li2 Li8 C37 127.7(2) . . ?
C36 Li8 C37 32.12(10) . . ?
C34 Li8 C37 86.21(15) . . ?
C38 Li8 C37 33.30(9) . . ?
O2 Li8 Li6 45.35(14) . . ?
O1 Li8 Li6 124.2(2) . . ?
Li5 Li8 Li6 98.4(2) . . ?
C35 Li8 Li6 85.69(18) . . ?
Li2 Li8 Li6 71.40(18) . . ?
C36 Li8 Li6 58.67(14) . . ?
C34 Li8 Li6 119.3(2) . . ?
C38 Li8 Li6 82.88(17) . . ?
C37 Li8 Li6 56.49(14) . . ?
O2 Li8 C33 164.7(2) . . ?
O1 Li8 C33 92.15(17) . . ?
Li5 Li8 C33 119.0(2) . . ?
C35 Li8 C33 61.43(12) . . ?
Li2 Li8 C33 139.1(2) . . ?
C36 Li8 C33 81.57(14) . . ?
C34 Li8 C33 32.99(9) . . ?
C38 Li8 C33 71.58(13) . . ?
C37 Li8 C33 86.96(14) . . ?
Li6 Li8 C33 139.77(19) . . ?
O2 Li8 Li7 118.6(2) . . ?
O1 Li8 Li7 40.98(13) . . ?
Li5 Li8 Li7 65.96(17) . . ?
C35 Li8 Li7 108.06(19) . . ?
Li2 Li8 Li7 93.78(19) . . ?
C36 Li8 Li7 137.98(19) . . ?
C34 Li8 Li7 74.92(16) . . ?
C38 Li8 Li7 108.29(18) . . ?
C37 Li8 Li7 138.4(2) . . ?
Li6 Li8 Li7 162.9(2) . . ?
C33 Li8 Li7 57.36(13) . . ?
O1 Li7 C39 124.3(2) . . ?
O1 Li7 C26 120.2(2) . . ?
C39 Li7 C26 113.2(2) . . ?
O1 Li7 C25 121.1(2) . . ?
C39 Li7 C25 111.93(19) . . ?
C26 Li7 C25 32.89(10) . . ?
O1 Li7 C40 117.3(2) . . ?
C39 Li7 C40 33.96(10) . . ?
C26 Li7 C40 119.2(2) . . ?
C25 Li7 C40 98.93(18) . . ?
O1 Li7 C33 96.70(18) . . ?
C39 Li7 C33 32.08(10) . . ?
C26 Li7 C33 129.3(2) . . ?
C25 Li7 C33 142.1(2) . . ?
C40 Li7 C33 57.43(12) . . ?
O1 Li7 Li1 43.41(14) . . ?
C39 Li7 Li1 149.5(2) . . ?
C26 Li7 Li1 91.80(18) . . ?
C25 Li7 Li1 79.27(17) . . ?
C40 Li7 Li1 118.6(2) . . ?
C33 Li7 Li1 136.7(2) . . ?
O1 Li7 Li4 42.74(15) . . ?
C39 Li7 Li4 92.55(18) . . ?
C26 Li7 Li4 151.2(2) . . ?
C25 Li7 Li4 126.2(2) . . ?
C40 Li7 Li4 75.13(17) . . ?
C33 Li7 Li4 79.43(16) . . ?
Li1 Li7 Li4 59.92(16) . . ?
O1 Li7 C18 89.57(17) . . ?
C39 Li7 C18 135.9(2) . . ?
C26 Li7 C18 32.61(9) . . ?
C25 Li7 C18 56.95(12) . . ?
C40 Li7 C18 151.8(2) . . ?
C33 Li7 C18 131.9(2) . . ?
Li1 Li7 C18 74.37(15) . . ?
Li4 Li7 C18 129.62(19) . . ?
O1 Li7 Li8 44.63(14) . . ?
C39 Li7 Li8 90.93(18) . . ?
C26 Li7 Li8 126.6(2) . . ?
C25 Li7 Li8 153.7(2) . . ?
C40 Li7 Li8 107.39(18) . . ?
C33 Li7 Li8 58.90(13) . . ?
Li1 Li7 Li8 87.51(18) . . ?
Li4 Li7 Li8 62.44(17) . . ?
C18 Li7 Li8 97.67(18) . . ?
O1 Li7 Li5 43.23(14) . . ?
C39 Li7 Li5 135.9(2) . . ?
C26 Li7 Li5 84.53(17) . . ?
C25 Li7 Li5 104.20(17) . . ?
C40 Li7 Li5 155.9(2) . . ?
C33 Li7 Li5 105.25(18) . . ?
Li1 Li7 Li5 60.44(16) . . ?
Li4 Li7 Li5 85.68(18) . . ?
C18 Li7 Li5 51.99(12) . . ?
Li8 Li7 Li5 49.63(14) . . ?
O2 Li9 C45 134.5(2) . . ?
O2 Li9 C20 106.1(2) . . ?
C45 Li9 C20 114.0(2) . . ?
O2 Li9 C46 120.4(2) . . ?
C45 Li9 C46 34.25(10) . . ?
C20 Li9 C46 99.27(18) . . ?
O2 Li9 C27 108.1(2) . . ?
C45 Li9 C27 109.8(2) . . ?
C20 Li9 C27 60.58(13) . . ?
C46 Li9 C27 131.3(2) . . ?
O2 Li9 C21 94.04(18) . . ?
C45 Li9 C21 131.4(2) . . ?
C20 Li9 C21 33.33(9) . . ?
C46 Li9 C21 130.6(2) . . ?
C27 Li9 C21 34.33(10) . . ?
O2 Li9 Li5 49.18(14) . . ?
C45 Li9 Li5 148.1(2) . . ?
C20 Li9 Li5 58.57(14) . . ?
C46 Li9 Li5 113.8(2) . . ?
C27 Li9 Li5 93.46(17) . . ?
C21 Li9 Li5 61.76(14) . . ?
O2 Li9 Li3 41.69(13) . . ?
C45 Li9 Li3 143.4(2) . . ?
C20 Li9 Li3 97.15(18) . . ?
C46 Li9 Li3 159.2(2) . . ?
C27 Li9 Li3 68.50(15) . . ?
C21 Li9 Li3 68.57(15) . . ?
Li5 Li9 Li3 65.00(16) . . ?
O2 Li9 Li6 41.04(14) . . ?
C45 Li9 Li6 95.93(18) . . ?
C20 Li9 Li6 147.0(2) . . ?
C46 Li9 Li6 98.04(18) . . ?
C27 Li9 Li6 123.3(2) . . ?
C21 Li9 Li6 129.3(2) . . ?
Li5 Li9 Li6 88.69(19) . . ?
Li3 Li9 Li6 61.51(16) . . ?
O2 Li9 Li8 41.73(13) . . ?
C45 Li9 Li8 107.81(18) . . ?
C20 Li9 Li8 100.94(18) . . ?
C46 Li9 Li8 81.30(16) . . ?
C27 Li9 Li8 142.27(19) . . ?
C21 Li9 Li8 112.68(18) . . ?
Li5 Li9 Li8 50.92(14) . . ?
Li3 Li9 Li8 83.11(17) . . ?
Li6 Li9 Li8 54.45(15) . . ?
O3 Li10 O6 109.9(2) . . ?
O3 Li10 O4 110.3(2) . . ?
O6 Li10 O4 104.8(2) . . ?
O3 Li10 O5 106.6(2) . . ?
O6 Li10 O5 118.8(2) . . ?
O4 Li10 O5 106.2(2) . . ?
C67 C68 H68 109.5 . . ?
C67 C68 H68A 109.5 . . ?
H68 C68 H68A 109.5 . . ?
C67 C68 H68B 109.5 . . ?
H68 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?

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
C22 Si2 C17 C23 136.84(19) . . . . ?
C32 Si2 C17 C23 16.0(2) . . . . ?
C31 Si2 C17 C23 -104.5(2) . . . . ?
C22 Si2 C17 C18 -51.9(2) . . . . ?
C32 Si2 C17 C18 -172.75(17) . . . . ?
C31 Si2 C17 C18 66.7(2) . . . . ?
C22 Si2 C17 Li1 69.09(17) . . . . ?
C32 Si2 C17 Li1 -51.74(17) . . . . ?
C31 Si2 C17 Li1 -172.27(14) . . . . ?
C22 Si2 C17 Li5 9.23(14) . . . . ?
C32 Si2 C17 Li5 -111.60(14) . . . . ?
C31 Si2 C17 Li5 127.86(13) . . . . ?
C23 C17 C18 C19 -169.3(2) . . . . ?
Si2 C17 C18 C19 19.3(3) . . . . ?
Li1 C17 C18 C19 -108.4(2) . . . . ?
Li5 C17 C18 C19 -54.4(2) . . . . ?
C23 C17 C18 C26 8.9(3) . . . . ?
Si2 C17 C18 C26 -162.55(16) . . . . ?
Li1 C17 C18 C26 69.8(2) . . . . ?
Li5 C17 C18 C26 123.8(2) . . . . ?
C23 C17 C18 Li5 -114.9(2) . . . . ?
Si2 C17 C18 Li5 73.70(18) . . . . ?
Li1 C17 C18 Li5 -53.93(16) . . . . ?
C23 C17 C18 Li7 -51.9(2) . . . . ?
Si2 C17 C18 Li7 136.61(16) . . . . ?
Li1 C17 C18 Li7 8.98(19) . . . . ?
Li5 C17 C18 Li7 62.91(16) . . . . ?
C17 Si2 C22 C30 -135.29(19) . . . . ?
C32 Si2 C22 C30 -14.6(2) . . . . ?
C31 Si2 C22 C30 105.3(2) . . . . ?
C17 Si2 C22 C21 58.2(2) . . . . ?
C32 Si2 C22 C21 178.89(17) . . . . ?
C31 Si2 C22 C21 -61.2(2) . . . . ?
C17 Si2 C22 Li5 -9.16(14) . . . . ?
C32 Si2 C22 Li5 111.52(13) . . . . ?
C31 Si2 C22 Li5 -128.55(13) . . . . ?
C17 Si2 C22 Li3 -55.3(2) . . . . ?
C32 Si2 C22 Li3 65.4(2) . . . . ?
C31 Si2 C22 Li3 -174.71(19) . . . . ?
C26 C18 C19 C20 -172.9(2) . . . . ?
C17 C18 C19 C20 5.2(4) . . . . ?
Li5 C18 C19 C20 -54.1(3) . . . . ?
Li7 C18 C19 C20 -112.5(3) . . . . ?
C26 C18 C19 Li5 -118.9(2) . . . . ?
C17 C18 C19 Li5 59.3(2) . . . . ?
Li7 C18 C19 Li5 -58.40(16) . . . . ?
C30 C22 C21 C20 165.9(2) . . . . ?
Si2 C22 C21 C20 -27.3(3) . . . . ?
Li5 C22 C21 C20 49.4(2) . . . . ?
Li3 C22 C21 C20 114.3(2) . . . . ?
C30 C22 C21 C27 -9.4(3) . . . . ?
Si2 C22 C21 C27 157.32(16) . . . . ?
Li5 C22 C21 C27 -126.0(2) . . . . ?
Li3 C22 C21 C27 -61.0(2) . . . . ?
C30 C22 C21 Li9 76.3(3) . . . . ?
Si2 C22 C21 Li9 -117.0(2) . . . . ?
Li5 C22 C21 Li9 -40.3(2) . . . . ?
Li3 C22 C21 Li9 24.6(2) . . . . ?
C30 C22 C21 Li5 116.6(2) . . . . ?
Si2 C22 C21 Li5 -76.67(17) . . . . ?
Li3 C22 C21 Li5 64.96(14) . . . . ?
C27 C21 C20 C19 167.2(2) . . . . ?
C22 C21 C20 C19 -8.0(4) . . . . ?
Li9 C21 C20 C19 110.4(3) . . . . ?
Li5 C21 C20 C19 44.5(3) . . . . ?
C27 C21 C20 Li9 56.8(2) . . . . ?
C22 C21 C20 Li9 -118.5(2) . . . . ?
Li5 C21 C20 Li9 -65.89(15) . . . . ?
C27 C21 C20 Li5 122.7(2) . . . . ?
C22 C21 C20 Li5 -52.6(2) . . . . ?
Li9 C21 C20 Li5 65.89(15) . . . . ?
C18 C19 C20 C21 6.3(5) . . . . ?
Li5 C19 C20 C21 -48.0(3) . . . . ?
C18 C19 C20 Li9 100.5(3) . . . . ?
Li5 C19 C20 Li9 46.13(19) . . . . ?
C18 C19 C20 Li5 54.4(3) . . . . ?
C2 C3 C4 C5 10.3(5) . . . . ?
Li2 C3 C4 C5 -43.9(3) . . . . ?
C2 C3 C4 Li3 98.8(3) . . . . ?
Li2 C3 C4 Li3 44.67(18) . . . . ?
C2 C3 C4 Li2 54.2(3) . . . . ?
C18 C17 C23 C24 3.6(3) . . . . ?
Si2 C17 C23 C24 174.96(18) . . . . ?
Li1 C17 C23 C24 -82.6(2) . . . . ?
Li5 C17 C23 C24 -74.4(3) . . . . ?
C18 C17 C23 Li1 86.2(2) . . . . ?
Si2 C17 C23 Li1 -102.46(19) . . . . ?
Li5 C17 C23 Li1 8.2(2) . . . . ?
C4 C3 C2 C10 -172.7(3) . . . . ?
Li2 C3 C2 C10 -116.7(2) . . . . ?
C4 C3 C2 C1 6.6(5) . . . . ?
Li2 C3 C2 C1 62.6(2) . . . . ?
C4 C3 C2 Li2 -56.0(3) . . . . ?
C21 C22 C30 C29 0.0(3) . . . . ?
Si2 C22 C30 C29 -166.76(19) . . . . ?
Li5 C22 C30 C29 84.7(3) . . . . ?
Li3 C22 C30 C29 61.8(2) . . . . ?
C21 C22 C30 Li3 -61.9(2) . . . . ?
Si2 C22 C30 Li3 131.42(18) . . . . ?
Li5 C22 C30 Li3 22.9(2) . . . . ?
C3 C4 C5 C11 163.3(3) . . . . ?
Li3 C4 C5 C11 59.2(2) . . . . ?
Li2 C4 C5 C11 123.2(2) . . . . ?
C3 C4 C5 C6 -13.5(4) . . . . ?
Li3 C4 C5 C6 -117.5(2) . . . . ?
Li2 C4 C5 C6 -53.5(2) . . . . ?
C3 C4 C5 Li3 104.1(3) . . . . ?
Li2 C4 C5 Li3 64.02(15) . . . . ?
C3 C4 C5 Li2 40.0(3) . . . . ?
Li3 C4 C5 Li2 -64.02(15) . . . . ?
C3 C2 C10 C9 164.6(2) . . . . ?
C1 C2 C10 C9 -14.7(3) . . . . ?
Li2 C2 C10 C9 79.0(3) . . . . ?
C3 C2 C10 Li1 87.7(2) . . . . ?
C1 C2 C10 Li1 -91.7(2) . . . . ?
Li2 C2 C10 Li1 2.1(2) . . . . ?
C17 C23 C24 C25 -12.2(3) . . . . ?
Li1 C23 C24 C25 -96.6(2) . . . . ?
C17 C23 C24 Li1 84.4(2) . . . . ?
C26 C25 C24 C23 7.6(3) . . . . ?
Li7 C25 C24 C23 76.8(2) . . . . ?
C26 C25 C24 Li1 -59.0(3) . . . . ?
Li7 C25 C24 Li1 10.3(2) . . . . ?
C24 C25 C26 C18 5.3(4) . . . . ?
Li7 C25 C26 C18 -82.3(2) . . . . ?
C24 C25 C26 Li7 87.6(2) . . . . ?
C19 C18 C26 C25 164.9(2) . . . . ?
C17 C18 C26 C25 -13.5(3) . . . . ?
Li5 C18 C26 C25 82.1(3) . . . . ?
Li7 C18 C26 C25 77.3(2) . . . . ?
C19 C18 C26 Li7 87.6(2) . . . . ?
C17 C18 C26 Li7 -90.8(2) . . . . ?
Li5 C18 C26 Li7 4.8(2) . . . . ?
C3 C2 C1 C7 -168.9(2) . . . . ?
C10 C2 C1 C7 10.4(3) . . . . ?
Li2 C2 C1 C7 -110.1(2) . . . . ?
C3 C2 C1 Si1 17.0(3) . . . . ?
C10 C2 C1 Si1 -163.64(17) . . . . ?
Li2 C2 C1 Si1 75.78(18) . . . . ?
C3 C2 C1 Li2 -58.7(2) . . . . ?
C10 C2 C1 Li2 120.6(2) . . . . ?
C3 C2 C1 Li4 -112.7(2) . . . . ?
C10 C2 C1 Li4 66.6(2) . . . . ?
Li2 C2 C1 Li4 -53.96(17) . . . . ?
C6 Si1 C1 C7 133.4(2) . . . . ?
C16 Si1 C1 C7 10.6(2) . . . . ?
C15 Si1 C1 C7 -108.9(2) . . . . ?
C6 Si1 C1 C2 -52.7(2) . . . . ?
C16 Si1 C1 C2 -175.54(19) . . . . ?
C15 Si1 C1 C2 65.0(2) . . . . ?
C6 Si1 C1 Li2 9.26(14) . . . . ?
C16 Si1 C1 Li2 -113.59(15) . . . . ?
C15 Si1 C1 Li2 126.94(15) . . . . ?
C6 Si1 C1 Li4 67.99(17) . . . . ?
C16 Si1 C1 Li4 -54.86(19) . . . . ?
C15 Si1 C1 Li4 -174.32(16) . . . . ?
C22 C30 C29 C28 8.2(3) . . . . ?
Li3 C30 C29 C28 79.7(2) . . . . ?
C22 C30 C29 Li3 -71.5(2) . . . . ?
C20 C21 C27 C28 -164.3(2) . . . . ?
C22 C21 C27 C28 11.4(3) . . . . ?
Li9 C21 C27 C28 -108.5(3) . . . . ?
Li5 C21 C27 C28 -80.6(3) . . . . ?
C20 C21 C27 Li9 -55.8(2) . . . . ?
C22 C21 C27 Li9 119.9(2) . . . . ?
Li5 C21 C27 Li9 27.9(2) . . . . ?
C35 C34 C33 C39 -168.9(2) . . . . ?
C42 C34 C33 C39 9.3(3) . . . . ?
Li8 C34 C33 C39 -115.3(2) . . . . ?
Li4 C34 C33 C39 -52.9(3) . . . . ?
C35 C34 C33 Si3 18.3(3) . . . . ?
C42 C34 C33 Si3 -163.60(16) . . . . ?
Li8 C34 C33 Si3 71.85(17) . . . . ?
Li4 C34 C33 Si3 134.29(16) . . . . ?
C35 C34 C33 Li7 -109.2(3) . . . . ?
C42 C34 C33 Li7 68.9(2) . . . . ?
Li8 C34 C33 Li7 -55.66(16) . . . . ?
Li4 C34 C33 Li7 6.8(2) . . . . ?
C35 C34 C33 Li8 -53.6(2) . . . . ?
C42 C34 C33 Li8 124.6(2) . . . . ?
Li4 C34 C33 Li8 62.44(16) . . . . ?
C38 Si3 C33 C39 134.86(19) . . . . ?
C48 Si3 C33 C39 12.9(2) . . . . ?
C47 Si3 C33 C39 -108.7(2) . . . . ?
C38 Si3 C33 C34 -52.3(2) . . . . ?
C48 Si3 C33 C34 -174.30(17) . . . . ?
C47 Si3 C33 C34 64.1(2) . . . . ?
C38 Si3 C33 Li7 66.95(17) . . . . ?
C48 Si3 C33 Li7 -55.01(18) . . . . ?
C47 Si3 C33 Li7 -176.65(16) . . . . ?
C38 Si3 C33 Li8 8.31(14) . . . . ?
C48 Si3 C33 Li8 -113.65(13) . . . . ?
C47 Si3 C33 Li8 124.71(14) . . . . ?
C35 C34 C42 C41 165.2(2) . . . . ?
C33 C34 C42 C41 -13.1(3) . . . . ?
Li8 C34 C42 C41 82.8(3) . . . . ?
Li4 C34 C42 C41 81.6(3) . . . . ?
C35 C34 C42 Li4 83.6(2) . . . . ?
C33 C34 C42 Li4 -94.7(2) . . . . ?
Li8 C34 C42 Li4 1.2(3) . . . . ?
C2 C1 C7 C8 2.5(4) . . . . ?
Si1 C1 C7 C8 176.5(2) . . . . ?
Li2 C1 C7 C8 -73.2(3) . . . . ?
Li4 C1 C7 C8 -79.1(3) . . . . ?
C2 C1 C7 Li4 81.6(2) . . . . ?
Si1 C1 C7 Li4 -104.4(2) . . . . ?
Li2 C1 C7 Li4 5.9(2) . . . . ?
C4 C5 C6 C14 166.7(2) . . . . ?
C11 C5 C6 C14 -10.2(3) . . . . ?
Li3 C5 C6 C14 76.3(3) . . . . ?
Li2 C5 C6 C14 115.4(2) . . . . ?
C4 C5 C6 Si1 -25.9(3) . . . . ?
C11 C5 C6 Si1 157.24(18) . . . . ?
Li3 C5 C6 Si1 -116.3(2) . . . . ?
Li2 C5 C6 Si1 -77.20(17) . . . . ?
C4 C5 C6 Li2 51.3(2) . . . . ?
C11 C5 C6 Li2 -125.6(2) . . . . ?
Li3 C5 C6 Li2 -39.1(2) . . . . ?
C1 Si1 C6 C14 -132.6(2) . . . . ?
C16 Si1 C6 C14 -10.9(2) . . . . ?
C15 Si1 C6 C14 107.2(2) . . . . ?
C1 Si1 C6 C5 60.3(2) . . . . ?
C16 Si1 C6 C5 -178.02(18) . . . . ?
C15 Si1 C6 C5 -59.9(2) . . . . ?
C1 Si1 C6 Li2 -8.91(14) . . . . ?
C16 Si1 C6 Li2 112.80(14) . . . . ?
C15 Si1 C6 Li2 -129.05(14) . . . . ?
C21 C27 C28 C29 -3.6(4) . . . . ?
Li9 C27 C28 C29 -88.2(3) . . . . ?
C21 C27 C28 Li3 50.5(2) . . . . ?
Li9 C27 C28 Li3 -34.0(2) . . . . ?
C30 C29 C28 C27 -6.4(3) . . . . ?
Li3 C29 C28 C27 67.8(3) . . . . ?
C30 C29 C28 Li3 -74.2(2) . . . . ?
C36 C37 C38 C46 163.1(2) . . . . ?
C43 C37 C38 C46 -11.4(3) . . . . ?
Li6 C37 C38 C46 71.1(3) . . . . ?
Li8 C37 C38 C46 114.4(2) . . . . ?
C36 C37 C38 Si3 -32.3(3) . . . . ?
C43 C37 C38 Si3 153.23(18) . . . . ?
Li6 C37 C38 Si3 -124.28(19) . . . . ?
Li8 C37 C38 Si3 -80.96(17) . . . . ?
C36 C37 C38 Li8 48.7(2) . . . . ?
C43 C37 C38 Li8 -125.8(2) . . . . ?
Li6 C37 C38 Li8 -43.3(2) . . . . ?
C48 Si3 C38 C46 -11.0(2) . . . . ?
C33 Si3 C38 C46 -133.21(19) . . . . ?
C47 Si3 C38 C46 109.4(2) . . . . ?
C48 Si3 C38 C37 -175.26(17) . . . . ?
C33 Si3 C38 C37 62.6(2) . . . . ?
C47 Si3 C38 C37 -54.8(2) . . . . ?
C48 Si3 C38 Li8 113.57(14) . . . . ?
C33 Si3 C38 Li8 -8.62(15) . . . . ?
C47 Si3 C38 Li8 -126.00(15) . . . . ?
C37 C38 C46 C45 0.5(3) . . . . ?
Si3 C38 C46 C45 -163.71(18) . . . . ?
Li8 C38 C46 C45 86.5(3) . . . . ?
C37 C38 C46 Li9 -66.5(2) . . . . ?
Si3 C38 C46 Li9 129.28(18) . . . . ?
Li8 C38 C46 Li9 19.5(2) . . . . ?
C43 C37 C36 C35 167.4(3) . . . . ?
C38 C37 C36 C35 -6.9(4) . . . . ?
Li6 C37 C36 C35 108.7(3) . . . . ?
Li8 C37 C36 C35 43.2(3) . . . . ?
C43 C37 C36 Li8 124.2(2) . . . . ?
C38 C37 C36 Li8 -50.1(2) . . . . ?
Li6 C37 C36 Li8 65.51(15) . . . . ?
C43 C37 C36 Li6 58.7(2) . . . . ?
C38 C37 C36 Li6 -115.6(2) . . . . ?
Li8 C37 C36 Li6 -65.51(15) . . . . ?
C4 C5 C11 C12 -164.6(2) . . . . ?
C6 C5 C11 C12 12.5(3) . . . . ?
Li3 C5 C11 C12 -106.3(3) . . . . ?
Li2 C5 C11 C12 -78.5(3) . . . . ?
C4 C5 C11 Li3 -58.3(2) . . . . ?
C6 C5 C11 Li3 118.7(2) . . . . ?
Li2 C5 C11 Li3 27.8(2) . . . . ?
C42 C34 C35 C36 -174.5(3) . . . . ?
C33 C34 C35 C36 3.6(5) . . . . ?
Li8 C34 C35 C36 -54.8(3) . . . . ?
Li4 C34 C35 C36 -115.5(3) . . . . ?
C42 C34 C35 Li8 -119.7(2) . . . . ?
C33 C34 C35 Li8 58.4(3) . . . . ?
Li4 C34 C35 Li8 -60.71(16) . . . . ?
C37 C36 C35 C34 9.4(5) . . . . ?
Li8 C36 C35 C34 55.3(3) . . . . ?
Li6 C36 C35 C34 99.3(3) . . . . ?
C37 C36 C35 Li8 -46.0(3) . . . . ?
Li6 C36 C35 Li8 43.9(2) . . . . ?
C34 C42 C41 C40 4.6(4) . . . . ?
Li4 C42 C41 C40 88.8(3) . . . . ?
C34 C42 C41 Li4 -84.2(2) . . . . ?
C5 C11 C12 C13 -4.4(4) . . . . ?
Li3 C11 C12 C13 -87.2(3) . . . . ?
C5 C11 C12 Li6 48.6(3) . . . . ?
Li3 C11 C12 Li6 -34.2(2) . . . . ?
C5 C6 C14 C13 0.3(4) . . . . ?
Si1 C6 C14 C13 -166.9(2) . . . . ?
Li2 C6 C14 C13 86.5(3) . . . . ?
C5 C6 C14 Li6 -64.5(2) . . . . ?
Si1 C6 C14 Li6 128.30(18) . . . . ?
Li2 C6 C14 Li6 21.8(2) . . . . ?
C1 C7 C8 C9 -11.9(4) . . . . ?
Li4 C7 C8 C9 -98.6(2) . . . . ?
C1 C7 C8 Li4 86.6(3) . . . . ?
C38 C46 C45 C44 8.8(4) . . . . ?
Li9 C46 C45 C44 87.9(2) . . . . ?
C38 C46 C45 Li9 -79.2(3) . . . . ?
C2 C10 C9 C8 5.7(4) . . . . ?
Li1 C10 C9 C8 90.8(3) . . . . ?
C2 C10 C9 Li1 -85.1(2) . . . . ?
C7 C8 C9 C10 7.6(4) . . . . ?
Li4 C8 C9 C10 -64.0(3) . . . . ?
C7 C8 C9 Li1 80.3(3) . . . . ?
Li4 C8 C9 Li1 8.6(2) . . . . ?
C34 C33 C39 C40 3.2(3) . . . . ?
Si3 C33 C39 C40 175.95(18) . . . . ?
Li7 C33 C39 C40 -79.9(2) . . . . ?
Li8 C33 C39 C40 -76.3(3) . . . . ?
C34 C33 C39 Li7 83.1(2) . . . . ?
Si3 C33 C39 Li7 -104.1(2) . . . . ?
Li8 C33 C39 Li7 3.6(2) . . . . ?
C46 C45 C44 C43 -6.7(4) . . . . ?
Li9 C45 C44 C43 70.2(3) . . . . ?
C45 C44 C43 C37 -4.7(4) . . . . ?
C45 C44 C43 Li6 -85.8(3) . . . . ?
C36 C37 C43 C44 -161.2(2) . . . . ?
C38 C37 C43 C44 13.7(3) . . . . ?
Li6 C37 C43 C44 -101.0(3) . . . . ?
Li8 C37 C43 C44 -74.7(3) . . . . ?
C36 C37 C43 Li6 -60.2(2) . . . . ?
C38 C37 C43 Li6 114.6(2) . . . . ?
Li8 C37 C43 Li6 26.3(2) . . . . ?
C6 C14 C13 C12 8.2(4) . . . . ?
Li6 C14 C13 C12 83.6(2) . . . . ?
C6 C14 C13 Li6 -75.4(3) . . . . ?
C11 C12 C13 C14 -6.1(4) . . . . ?
Li6 C12 C13 C14 -75.4(2) . . . . ?
C11 C12 C13 Li6 69.4(3) . . . . ?
C33 C39 C40 C41 -12.3(3) . . . . ?
Li7 C39 C40 C41 -95.8(2) . . . . ?
C33 C39 C40 Li7 83.6(2) . . . . ?
C42 C41 C40 C39 8.3(4) . . . . ?
Li4 C41 C40 C39 74.7(3) . . . . ?
C42 C41 C40 Li7 -60.3(3) . . . . ?
Li4 C41 C40 Li7 6.1(2) . . . . ?
C57 O5 C60 C59 -5.6(3) . . . . ?
Li10 O5 C60 C59 159.4(2) . . . . ?
O5 C60 C59 C58 -18.0(3) . . . . ?
C49 O3 C52 C51 9.1(4) . . . . ?
Li10 O3 C52 C51 168.4(3) . . . . ?
C49 C50 C51 C52 28.4(4) . . . . ?
O3 C52 C51 C50 -23.4(4) . . . . ?
C60 C59 C58 C57 33.2(3) . . . . ?
C60 O5 C57 C58 27.2(3) . . . . ?
Li10 O5 C57 C58 -138.4(3) . . . . ?
C59 C58 C57 O5 -37.4(3) . . . . ?
C52 O3 C49 C50 8.9(4) . . . . ?
Li10 O3 C49 C50 -150.0(3) . . . . ?
C51 C50 C49 O3 -23.3(4) . . . . ?
C53 C54 C55 C56 10.3(4) . . . . ?
C56 O4 C53 C54 33.8(4) . . . . ?
Li10 O4 C53 C54 -170.4(3) . . . . ?
C55 C54 C53 O4 -27.0(4) . . . . ?
C53 O4 C56 C55 -27.3(4) . . . . ?
Li10 O4 C56 C55 176.0(3) . . . . ?
C54 C55 C56 O4 9.8(4) . . . . ?
C64 O6 C61 C62 -7.2(5) . . . . ?
Li10 O6 C61 C62 171.1(3) . . . . ?
C63 C62 C61 O6 27.4(5) . . . . ?
C61 O6 C64 C63 -15.1(5) . . . . ?
Li10 O6 C64 C63 166.8(3) . . . . ?
Li3 O2 Li6 C13 24.1(4) . . . . ?
Li9 O2 Li6 C13 122.3(4) . . . . ?
Li2 O2 Li6 C13 -64.5(4) . . . . ?
Li8 O2 Li6 C13 -139.0(4) . . . . ?
Li5 O2 Li6 C13 -138.1(5) . . . . ?
Li3 O2 Li6 C43 -123.1(2) . . . . ?
Li9 O2 Li6 C43 -24.9(3) . . . . ?
Li2 O2 Li6 C43 148.3(2) . . . . ?
Li8 O2 Li6 C43 73.8(2) . . . . ?
Li5 O2 Li6 C43 74.7(7) . . . . ?
Li3 O2 Li6 C14 64.9(3) . . . . ?
Li9 O2 Li6 C14 163.1(3) . . . . ?
Li2 O2 Li6 C14 -23.7(3) . . . . ?
Li8 O2 Li6 C14 -98.2(3) . . . . ?
Li5 O2 Li6 C14 -97.3(6) . . . . ?
Li3 O2 Li6 C37 -154.71(19) . . . . ?
Li9 O2 Li6 C37 -56.5(2) . . . . ?
Li2 O2 Li6 C37 116.63(19) . . . . ?
Li8 O2 Li6 C37 42.13(19) . . . . ?
Li5 O2 Li6 C37 43.0(7) . . . . ?
Li3 O2 Li6 C36 173.1(2) . . . . ?
Li9 O2 Li6 C36 -88.7(2) . . . . ?
Li2 O2 Li6 C36 84.5(2) . . . . ?
Li8 O2 Li6 C36 10.0(2) . . . . ?
Li5 O2 Li6 C36 10.9(8) . . . . ?
Li3 O2 Li6 Li8 163.2(2) . . . . ?
Li9 O2 Li6 Li8 -98.7(2) . . . . ?
Li2 O2 Li6 Li8 74.50(19) . . . . ?
Li5 O2 Li6 Li8 0.9(6) . . . . ?
Li3 O2 Li6 C12 3.5(3) . . . . ?
Li9 O2 Li6 C12 101.7(2) . . . . ?
Li2 O2 Li6 C12 -85.1(2) . . . . ?
Li8 O2 Li6 C12 -159.6(2) . . . . ?
Li5 O2 Li6 C12 -158.7(5) . . . . ?
Li3 O2 Li6 Li9 -98.2(2) . . . . ?
Li2 O2 Li6 Li9 173.2(2) . . . . ?
Li8 O2 Li6 Li9 98.7(2) . . . . ?
Li5 O2 Li6 Li9 99.6(7) . . . . ?
Li9 O2 Li6 Li3 98.2(2) . . . . ?
Li2 O2 Li6 Li3 -88.7(2) . . . . ?
Li8 O2 Li6 Li3 -163.2(2) . . . . ?
Li5 O2 Li6 Li3 -162.3(7) . . . . ?
Li3 O2 Li6 Li2 88.7(2) . . . . ?
Li9 O2 Li6 Li2 -173.2(2) . . . . ?
Li8 O2 Li6 Li2 -74.50(19) . . . . ?
Li5 O2 Li6 Li2 -73.6(6) . . . . ?
C61 C62 C63 C64 -36.0(5) . . . . ?
O6 C64 C63 C62 32.6(5) . . . . ?
Li9 O2 Li3 C29 26.7(4) . . . . ?
Li6 O2 Li3 C29 126.2(4) . . . . ?
Li2 O2 Li3 C29 -133.9(4) . . . . ?
Li8 O2 Li3 C29 -123.4(6) . . . . ?
Li5 O2 Li3 C29 -59.6(4) . . . . ?
Li9 O2 Li3 C30 69.4(3) . . . . ?
Li6 O2 Li3 C30 168.9(3) . . . . ?
Li2 O2 Li3 C30 -91.1(3) . . . . ?
Li8 O2 Li3 C30 -80.7(7) . . . . ?
Li5 O2 Li3 C30 -16.8(3) . . . . ?
Li9 O2 Li3 C4 178.0(2) . . . . ?
Li6 O2 Li3 C4 -82.5(2) . . . . ?
Li2 O2 Li3 C4 17.4(2) . . . . ?
Li8 O2 Li3 C4 27.9(8) . . . . ?
Li5 O2 Li3 C4 91.7(2) . . . . ?
Li9 O2 Li3 C5 -150.86(18) . . . . ?
Li6 O2 Li3 C5 -51.4(2) . . . . ?
Li2 O2 Li3 C5 48.56(18) . . . . ?
Li8 O2 Li3 C5 59.0(7) . . . . ?
Li5 O2 Li3 C5 122.87(18) . . . . ?
Li9 O2 Li3 C11 -119.0(2) . . . . ?
Li6 O2 Li3 C11 -19.5(3) . . . . ?
Li2 O2 Li3 C11 80.4(2) . . . . ?
Li8 O2 Li3 C11 90.9(7) . . . . ?
Li5 O2 Li3 C11 154.7(2) . . . . ?
Li9 O2 Li3 Li2 160.6(2) . . . . ?
Li6 O2 Li3 Li2 -99.9(2) . . . . ?
Li8 O2 Li3 Li2 10.5(7) . . . . ?
Li5 O2 Li3 Li2 74.31(19) . . . . ?
Li9 O2 Li3 C28 3.1(3) . . . . ?
Li6 O2 Li3 C28 102.6(2) . . . . ?
Li2 O2 Li3 C28 -157.5(2) . . . . ?
Li8 O2 Li3 C28 -147.0(6) . . . . ?
Li5 O2 Li3 C28 -83.1(2) . . . . ?
Li6 O2 Li3 Li9 99.5(2) . . . . ?
Li2 O2 Li3 Li9 -160.6(2) . . . . ?
Li8 O2 Li3 Li9 -150.1(7) . . . . ?
Li5 O2 Li3 Li9 -86.3(2) . . . . ?
Li9 O2 Li3 C22 66.08(19) . . . . ?
Li6 O2 Li3 C22 165.59(19) . . . . ?
Li2 O2 Li3 C22 -94.49(18) . . . . ?
Li8 O2 Li3 C22 -84.0(7) . . . . ?
Li5 O2 Li3 C22 -20.19(19) . . . . ?
Li9 O2 Li3 Li6 -99.5(2) . . . . ?
Li2 O2 Li3 Li6 99.9(2) . . . . ?
Li8 O2 Li3 Li6 110.4(7) . . . . ?
Li5 O2 Li3 Li6 174.2(2) . . . . ?
Li9 O2 Li3 Li5 86.3(2) . . . . ?
Li6 O2 Li3 Li5 -174.2(2) . . . . ?
Li2 O2 Li3 Li5 -74.31(19) . . . . ?
Li8 O2 Li3 Li5 -63.8(7) . . . . ?
Li4 O1 Li1 C23 -141.8(3) . . . . ?
Li7 O1 Li1 C23 -47.7(3) . . . . ?
Li5 O1 Li1 C23 49.1(3) . . . . ?
Li2 O1 Li1 C23 123.7(3) . . . . ?
Li8 O1 Li1 C23 73.1(10) . . . . ?
Li4 O1 Li1 C10 57.3(3) . . . . ?
Li7 O1 Li1 C10 151.5(3) . . . . ?
Li5 O1 Li1 C10 -111.7(2) . . . . ?
Li2 O1 Li1 C10 -37.1(3) . . . . ?
Li8 O1 Li1 C10 -87.7(10) . . . . ?
Li4 O1 Li1 C9 19.9(3) . . . . ?
Li7 O1 Li1 C9 114.1(3) . . . . ?
Li5 O1 Li1 C9 -149.1(2) . . . . ?
Li2 O1 Li1 C9 -74.5(3) . . . . ?
Li8 O1 Li1 C9 -125.1(9) . . . . ?
Li4 O1 Li1 C24 -104.2(2) . . . . ?
Li7 O1 Li1 C24 -10.1(3) . . . . ?
Li5 O1 Li1 C24 86.7(2) . . . . ?
Li2 O1 Li1 C24 161.3(2) . . . . ?
Li8 O1 Li1 C24 110.7(9) . . . . ?
Li4 O1 Li1 C17 -161.7(2) . . . . ?
Li7 O1 Li1 C17 -67.5(2) . . . . ?
Li5 O1 Li1 C17 29.22(19) . . . . ?
Li2 O1 Li1 C17 103.81(19) . . . . ?
Li8 O1 Li1 C17 53.2(10) . . . . ?
Li4 O1 Li1 Li7 -94.2(2) . . . . ?
Li5 O1 Li1 Li7 96.8(2) . . . . ?
Li2 O1 Li1 Li7 171.4(2) . . . . ?
Li8 O1 Li1 Li7 120.8(10) . . . . ?
Li7 O1 Li1 Li4 94.2(2) . . . . ?
Li5 O1 Li1 Li4 -169.1(2) . . . . ?
Li2 O1 Li1 Li4 -94.5(2) . . . . ?
Li8 O1 Li1 Li4 -145.0(10) . . . . ?
Li4 O1 Li1 Li5 169.1(2) . . . . ?
Li7 O1 Li1 Li5 -96.8(2) . . . . ?
Li2 O1 Li1 Li5 74.59(19) . . . . ?
Li8 O1 Li1 Li5 24.0(9) . . . . ?
Li4 O1 Li1 Li2 94.5(2) . . . . ?
Li7 O1 Li1 Li2 -171.4(2) . . . . ?
Li5 O1 Li1 Li2 -74.59(19) . . . . ?
Li8 O1 Li1 Li2 -50.6(9) . . . . ?
C67 C66 C65 C67 -0.8(7) . . . 2_556 ?
C65 C66 C67 C68 -178.1(6) . . . . ?
C65 C66 C67 C65 1.0(9) . . . 2_556 ?
Li1 O1 Li4 C42 143.6(3) . . . . ?
Li7 O1 Li4 C42 51.1(3) . . . . ?
Li5 O1 Li4 C42 -90.7(9) . . . . ?
Li2 O1 Li4 C42 -118.1(3) . . . . ?
Li8 O1 Li4 C42 -43.9(3) . . . . ?
Li1 O1 Li4 C7 -53.3(3) . . . . ?
Li7 O1 Li4 C7 -145.8(3) . . . . ?
Li5 O1 Li4 C7 72.4(10) . . . . ?
Li2 O1 Li4 C7 45.0(3) . . . . ?
Li8 O1 Li4 C7 119.2(3) . . . . ?
Li1 O1 Li4 C8 -14.3(3) . . . . ?
Li7 O1 Li4 C8 -106.9(3) . . . . ?
Li5 O1 Li4 C8 111.4(9) . . . . ?
Li2 O1 Li4 C8 83.9(3) . . . . ?
Li8 O1 Li4 C8 158.2(2) . . . . ?
Li1 O1 Li4 C41 105.9(3) . . . . ?
Li7 O1 Li4 C41 13.4(3) . . . . ?
Li5 O1 Li4 C41 -128.4(8) . . . . ?
Li2 O1 Li4 C41 -155.8(2) . . . . ?
Li8 O1 Li4 C41 -81.5(3) . . . . ?
Li7 O1 Li4 Li1 -92.6(2) . . . . ?
Li5 O1 Li4 Li1 125.7(9) . . . . ?
Li2 O1 Li4 Li1 98.3(2) . . . . ?
Li8 O1 Li4 Li1 172.5(2) . . . . ?
Li1 O1 Li4 C34 158.38(19) . . . . ?
Li7 O1 Li4 C34 65.82(19) . . . . ?
Li5 O1 Li4 C34 -75.9(9) . . . . ?
Li2 O1 Li4 C34 -103.36(17) . . . . ?
Li8 O1 Li4 C34 -29.10(19) . . . . ?
Li1 O1 Li4 Li7 92.6(2) . . . . ?
Li5 O1 Li4 Li7 -141.8(9) . . . . ?
Li2 O1 Li4 Li7 -169.2(2) . . . . ?
Li8 O1 Li4 Li7 -94.9(2) . . . . ?
Li1 O1 Li4 C1 -70.3(2) . . . . ?
Li7 O1 Li4 C1 -162.82(19) . . . . ?
Li5 O1 Li4 C1 55.4(9) . . . . ?
Li2 O1 Li4 C1 28.00(18) . . . . ?
Li8 O1 Li4 C1 102.27(18) . . . . ?
Li1 O1 Li4 Li2 -98.3(2) . . . . ?
Li7 O1 Li4 Li2 169.2(2) . . . . ?
Li5 O1 Li4 Li2 27.4(9) . . . . ?
Li8 O1 Li4 Li2 74.27(18) . . . . ?
Li1 O1 Li4 Li8 -172.5(2) . . . . ?
Li7 O1 Li4 Li8 94.9(2) . . . . ?
Li5 O1 Li4 Li8 -46.8(9) . . . . ?
Li2 O1 Li4 Li8 -74.27(18) . . . . ?
Li1 O1 Li7 C39 -142.7(3) . . . . ?
Li4 O1 Li7 C39 -48.8(3) . . . . ?
Li5 O1 Li7 C39 122.9(3) . . . . ?
Li2 O1 Li7 C39 77.3(9) . . . . ?
Li8 O1 Li7 C39 48.5(3) . . . . ?
Li1 O1 Li7 C26 55.7(3) . . . . ?
Li4 O1 Li7 C26 149.7(3) . . . . ?
Li5 O1 Li7 C26 -38.6(3) . . . . ?
Li2 O1 Li7 C26 -84.3(9) . . . . ?
Li8 O1 Li7 C26 -113.1(3) . . . . ?
Li1 O1 Li7 C25 17.3(3) . . . . ?
Li4 O1 Li7 C25 111.3(3) . . . . ?
Li5 O1 Li7 C25 -77.1(3) . . . . ?
Li2 O1 Li7 C25 -122.7(8) . . . . ?
Li8 O1 Li7 C25 -151.5(3) . . . . ?
Li1 O1 Li7 C40 -103.8(3) . . . . ?
Li4 O1 Li7 C40 -9.8(3) . . . . ?
Li5 O1 Li7 C40 161.8(2) . . . . ?
Li2 O1 Li7 C40 116.2(8) . . . . ?
Li8 O1 Li7 C40 87.4(2) . . . . ?
Li1 O1 Li7 C33 -160.4(2) . . . . ?
Li4 O1 Li7 C33 -66.5(2) . . . . ?
Li5 O1 Li7 C33 105.17(19) . . . . ?
Li2 O1 Li7 C33 59.5(9) . . . . ?
Li8 O1 Li7 C33 30.75(19) . . . . ?
Li4 O1 Li7 Li1 94.0(2) . . . . ?
Li5 O1 Li7 Li1 -94.4(2) . . . . ?
Li2 O1 Li7 Li1 -140.0(9) . . . . ?
Li8 O1 Li7 Li1 -168.8(2) . . . . ?
Li1 O1 Li7 Li4 -94.0(2) . . . . ?
Li5 O1 Li7 Li4 171.6(2) . . . . ?
Li2 O1 Li7 Li4 126.0(9) . . . . ?
Li8 O1 Li7 Li4 97.2(2) . . . . ?
Li1 O1 Li7 C18 67.40(19) . . . . ?
Li4 O1 Li7 C18 161.38(19) . . . . ?
Li5 O1 Li7 C18 -26.98(18) . . . . ?
Li2 O1 Li7 C18 -72.6(9) . . . . ?
Li8 O1 Li7 C18 -101.40(17) . . . . ?
Li1 O1 Li7 Li8 168.8(2) . . . . ?
Li4 O1 Li7 Li8 -97.2(2) . . . . ?
Li5 O1 Li7 Li8 74.42(19) . . . . ?
Li2 O1 Li7 Li8 28.8(8) . . . . ?
Li1 O1 Li7 Li5 94.4(2) . . . . ?
Li4 O1 Li7 Li5 -171.6(2) . . . . ?
Li2 O1 Li7 Li5 -45.6(8) . . . . ?
Li8 O1 Li7 Li5 -74.42(19) . . . . ?
Li3 O2 Li9 C45 126.2(3) . . . . ?
Li6 O2 Li9 C45 24.8(4) . . . . ?
Li2 O2 Li9 C45 -134.9(5) . . . . ?
Li8 O2 Li9 C45 -62.8(3) . . . . ?
Li5 O2 Li9 C45 -136.3(3) . . . . ?
Li3 O2 Li9 C20 -82.6(2) . . . . ?
Li6 O2 Li9 C20 176.0(2) . . . . ?
Li2 O2 Li9 C20 16.4(7) . . . . ?
Li8 O2 Li9 C20 88.5(2) . . . . ?
Li5 O2 Li9 C20 14.91(19) . . . . ?
Li3 O2 Li9 C46 166.1(2) . . . . ?
Li6 O2 Li9 C46 64.7(3) . . . . ?
Li2 O2 Li9 C46 -95.0(6) . . . . ?
Li8 O2 Li9 C46 -22.9(3) . . . . ?
Li5 O2 Li9 C46 -96.4(2) . . . . ?
Li3 O2 Li9 C27 -18.9(2) . . . . ?
Li6 O2 Li9 C27 -120.3(2) . . . . ?
Li2 O2 Li9 C27 80.0(6) . . . . ?
Li8 O2 Li9 C27 152.14(19) . . . . ?
Li5 O2 Li9 C27 78.6(2) . . . . ?
Li3 O2 Li9 C21 -50.9(2) . . . . ?
Li6 O2 Li9 C21 -152.34(18) . . . . ?
Li2 O2 Li9 C21 48.0(6) . . . . ?
Li8 O2 Li9 C21 120.10(18) . . . . ?
Li5 O2 Li9 C21 46.55(17) . . . . ?
Li3 O2 Li9 Li5 -97.5(2) . . . . ?
Li6 O2 Li9 Li5 161.1(2) . . . . ?
Li2 O2 Li9 Li5 1.5(6) . . . . ?
Li8 O2 Li9 Li5 73.55(18) . . . . ?
Li6 O2 Li9 Li3 -101.4(2) . . . . ?
Li2 O2 Li9 Li3 99.0(6) . . . . ?
Li8 O2 Li9 Li3 171.0(2) . . . . ?
Li5 O2 Li9 Li3 97.5(2) . . . . ?
Li3 O2 Li9 Li6 101.4(2) . . . . ?
Li2 O2 Li9 Li6 -159.7(6) . . . . ?
Li8 O2 Li9 Li6 -87.6(2) . . . . ?
Li5 O2 Li9 Li6 -161.1(2) . . . . ?
Li3 O2 Li9 Li8 -171.0(2) . . . . ?
Li6 O2 Li9 Li8 87.6(2) . . . . ?
Li2 O2 Li9 Li8 -72.1(6) . . . . ?
Li5 O2 Li9 Li8 -73.55(18) . . . . ?

_refine_diff_density_max         0.803
_refine_diff_density_min         -0.601
_refine_diff_density_rms         0.108

