#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:46:09 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179423 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/20/4332037.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_4332037
loop_
_publ_author_name
'Li, Hong-Xi'
'Cheng, Mei-Ling'
'Ren, Zhi-Gang'
'Zhang, Wen-Hua'
'Lang, Jian-Ping'
'Shen, Qi'
_publ_section_title
;
 Unique Formation of a Pentanuclear Lanthanum(III) Thiolate Oxide Cluster
 via Control of Hydrolysis
;
_journal_issue                   5
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1885
_journal_page_last               1887
_journal_paper_doi               10.1021/ic052073v
_journal_volume                  45
_journal_year                    2006
_chemical_formula_moiety         'C32 H62 La Li N2 O2 S2 Si4'
_chemical_formula_sum            'C32 H62 La Li N2 O2 S2 Si4'
_chemical_formula_weight         829.17
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                103.077(11)
_cell_angle_beta                 96.329(12)
_cell_angle_gamma                90.864(7)
_cell_formula_units_Z            2
_cell_length_a                   8.718(3)
_cell_length_b                   11.384(4)
_cell_length_c                   22.573(8)
_cell_measurement_reflns_used    7435
_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      25.3
_cell_measurement_theta_min      3.0
_cell_volume                     2167.0(13)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_molecular_graphics    'SHELXL-97 (Sheldrick, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      193(2)
_diffrn_measured_fraction_theta_full 0.976
_diffrn_measured_fraction_theta_max 0.974
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0722
_diffrn_reflns_av_sigmaI/netI    0.1001
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            17997
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         3.03
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.220
_exptl_absorpt_correction_T_max  0.8195
_exptl_absorpt_correction_T_min  0.7752
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'Jacobson, R. (1998) Private communication to Rigaku Company.'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.271
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             864
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.17
_refine_diff_density_max         1.225
_refine_diff_density_min         -1.016
_refine_diff_density_rms         0.154
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     385
_refine_ls_number_reflns         7744
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.037
_refine_ls_R_factor_all          0.0937
_refine_ls_R_factor_gt           0.0695
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1023P)²+1.4923P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1708
_refine_ls_wR_factor_ref         0.1912
_reflns_number_gt                5800
_reflns_number_total             7744
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic052073vsup3.cif
_cod_data_source_block           4
_cod_original_cell_volume        2167.1(12)
_cod_database_code               4332037
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
La1 La 0.74230(5) -0.07856(4) 0.740032(17) 0.02687(16) Uani 1 1 d .
S1 S 0.9984(2) 0.08724(19) 0.74735(9) 0.0381(5) Uani 1 1 d .
S2 S 0.5025(2) 0.08658(19) 0.77249(8) 0.0372(5) Uani 1 1 d .
Si1 Si 0.8639(2) -0.2992(2) 0.62643(9) 0.0342(5) Uani 1 1 d .
Si2 Si 0.5728(2) -0.18613(18) 0.58463(9) 0.0308(5) Uani 1 1 d .
Si3 Si 0.5985(3) -0.2952(2) 0.80598(10) 0.0362(5) Uani 1 1 d .
Si4 Si 0.9044(3) -0.1832(2) 0.87141(10) 0.0398(5) Uani 1 1 d .
O1 O 0.2484(7) 0.3023(5) 0.8507(3) 0.0524(16) Uani 1 1 d .
O2 O 0.2781(6) 0.3014(5) 0.7144(3) 0.0461(14) Uani 1 1 d .
N1 N 0.7198(7) -0.1997(5) 0.6396(2) 0.0293(13) Uani 1 1 d .
N2 N 0.7519(8) -0.1965(6) 0.8144(3) 0.0355(15) Uani 1 1 d .
C1 C 1.0110(10) -0.2653(10) 0.6963(4) 0.061(3) Uani 1 1 d .
H1A H 1.0545 -0.1830 0.7025 0.091 Uiso 1 1 calc R
H1B H 1.0938 -0.3227 0.6906 0.091 Uiso 1 1 calc R
H1C H 0.9612 -0.2727 0.7322 0.091 Uiso 1 1 calc R
C2 C 0.7965(11) -0.4589(8) 0.6131(5) 0.066(3) Uani 1 1 d .
H2A H 0.7301 -0.4678 0.6442 0.098 Uiso 1 1 calc R
H2B H 0.8858 -0.5096 0.6155 0.098 Uiso 1 1 calc R
H2C H 0.7379 -0.4839 0.5724 0.098 Uiso 1 1 calc R
C3 C 0.9693(13) -0.2844(12) 0.5603(5) 0.086(4) Uani 1 1 d .
H3A H 0.9022 -0.3149 0.5219 0.129 Uiso 1 1 calc R
H3B H 1.0627 -0.3312 0.5605 0.129 Uiso 1 1 calc R
H3C H 0.9981 -0.1993 0.5640 0.129 Uiso 1 1 calc R
C4 C 0.4554(10) -0.3286(9) 0.5528(4) 0.0548(15) Uani 1 1 d .
H4A H 0.5179 -0.3882 0.5289 0.082 Uiso 1 1 calc R
H4B H 0.3649 -0.3127 0.5264 0.082 Uiso 1 1 calc R
H4C H 0.4215 -0.3600 0.5865 0.082 Uiso 1 1 calc R
C5 C 0.4406(10) -0.0687(9) 0.6180(4) 0.0548(15) Uani 1 1 d .
H5A H 0.3912 -0.0947 0.6501 0.082 Uiso 1 1 calc R
H5B H 0.3613 -0.0569 0.5858 0.082 Uiso 1 1 calc R
H5C H 0.4998 0.0074 0.6356 0.082 Uiso 1 1 calc R
C6 C 0.6388(10) -0.1190(9) 0.5154(4) 0.0548(15) Uani 1 1 d .
H6A H 0.6748 -0.0345 0.5312 0.082 Uiso 1 1 calc R
H6B H 0.5510 -0.1238 0.4838 0.082 Uiso 1 1 calc R
H6C H 0.7228 -0.1661 0.4978 0.082 Uiso 1 1 calc R
C7 C 0.6475(11) -0.4592(8) 0.7882(5) 0.056(2) Uani 1 1 d .
H7A H 0.7051 -0.4762 0.7525 0.084 Uiso 1 1 calc R
H7B H 0.5520 -0.5098 0.7794 0.084 Uiso 1 1 calc R
H7C H 0.7108 -0.4770 0.8235 0.084 Uiso 1 1 calc R
C8 C 0.4880(12) -0.2672(10) 0.8748(5) 0.065(3) Uani 1 1 d .
H8A H 0.5492 -0.2916 0.9088 0.097 Uiso 1 1 calc R
H8B H 0.3899 -0.3144 0.8645 0.097 Uiso 1 1 calc R
H8C H 0.4676 -0.1812 0.8868 0.097 Uiso 1 1 calc R
C9 C 0.4584(10) -0.2728(8) 0.7403(4) 0.050(2) Uani 1 1 d .
H9A H 0.4193 -0.1912 0.7502 0.074 Uiso 1 1 calc R
H9B H 0.3720 -0.3323 0.7332 0.074 Uiso 1 1 calc R
H9C H 0.5109 -0.2831 0.7034 0.074 Uiso 1 1 calc R
C10 C 1.0065(9) -0.3202(9) 0.8677(4) 0.0555(15) Uani 1 1 d .
H10A H 0.9357 -0.3847 0.8719 0.083 Uiso 1 1 calc R
H10B H 1.0918 -0.3074 0.9009 0.083 Uiso 1 1 calc R
H10C H 1.0478 -0.3433 0.8282 0.083 Uiso 1 1 calc R
C11 C 1.0477(9) -0.0663(10) 0.8658(5) 0.0555(15) Uani 1 1 d .
H11A H 1.0887 -0.0891 0.8262 0.083 Uiso 1 1 calc R
H11B H 1.1324 -0.0592 0.8989 0.083 Uiso 1 1 calc R
H11C H 0.9982 0.0112 0.8692 0.083 Uiso 1 1 calc R
C12 C 0.8517(9) -0.1120(10) 0.9622(4) 0.0555(15) Uani 1 1 d .
H12A H 0.7961 -0.0375 0.9635 0.083 Uiso 1 1 calc R
H12B H 0.9477 -0.0947 0.9901 0.083 Uiso 1 1 calc R
H12C H 0.7870 -0.1712 0.9747 0.083 Uiso 1 1 calc R
C13 C 0.9369(9) 0.1199(7) 0.6749(3) 0.0324(17) Uani 1 1 d .
C14 C 1.0265(9) 0.0844(7) 0.6263(4) 0.0389(18) Uani 1 1 d .
H14 H 1.1155 0.0390 0.6316 0.047 Uiso 1 1 calc R
C15 C 0.9864(11) 0.1149(9) 0.5710(4) 0.050(2) Uani 1 1 d .
H15 H 1.0500 0.0940 0.5389 0.061 Uiso 1 1 calc R
C16 C 0.8534(11) 0.1758(9) 0.5627(4) 0.058(3) Uani 1 1 d .
H16 H 0.8226 0.1937 0.5241 0.069 Uiso 1 1 calc R
C17 C 0.7655(10) 0.2107(9) 0.6096(4) 0.052(2) Uani 1 1 d .
H17 H 0.6756 0.2548 0.6039 0.063 Uiso 1 1 calc R
C18 C 0.8071(9) 0.1820(8) 0.6663(4) 0.0415(19) Uani 1 1 d .
H18 H 0.7450 0.2058 0.6986 0.050 Uiso 1 1 calc R
C19 C 0.5719(9) 0.1255(8) 0.8516(3) 0.0373(18) Uani 1 1 d .
C20 C 0.4830(10) 0.0891(8) 0.8931(4) 0.046(2) Uani 1 1 d .
H20 H 0.3901 0.0421 0.8781 0.055 Uiso 1 1 calc R
C21 C 0.5282(13) 0.1205(10) 0.9554(4) 0.061(3) Uani 1 1 d .
H21 H 0.4666 0.0967 0.9832 0.074 Uiso 1 1 calc R
C22 C 0.6676(13) 0.1886(12) 0.9770(4) 0.077(4) Uani 1 1 d .
H22 H 0.7011 0.2104 1.0196 0.093 Uiso 1 1 calc R
C23 C 0.7528(12) 0.2226(12) 0.9377(5) 0.081(4) Uani 1 1 d .
H23 H 0.8454 0.2701 0.9526 0.097 Uiso 1 1 calc R
C24 C 0.7057(11) 0.1882(10) 0.8737(4) 0.063(3) Uani 1 1 d .
H24 H 0.7697 0.2098 0.8461 0.075 Uiso 1 1 calc R
C25 C 0.1463(14) 0.2932(12) 0.8944(5) 0.088(4) Uani 1 1 d .
H25A H 0.1651 0.2189 0.9095 0.105 Uiso 1 1 calc R
H25B H 0.0379 0.2889 0.8753 0.105 Uiso 1 1 calc R
C26 C 0.1732(16) 0.4013(12) 0.9465(5) 0.085(4) Uani 1 1 d .
H26A H 0.1000 0.4649 0.9413 0.102 Uiso 1 1 calc R
H26B H 0.1643 0.3800 0.9861 0.102 Uiso 1 1 calc R
C27 C 0.3294(19) 0.4387(15) 0.9420(6) 0.118(6) Uani 1 1 d .
H27A H 0.4030 0.4012 0.9681 0.142 Uiso 1 1 calc R
H27B H 0.3435 0.5275 0.9560 0.142 Uiso 1 1 calc R
C28 C 0.3579(13) 0.4010(10) 0.8786(6) 0.080(3) Uani 1 1 d U
H28A H 0.3427 0.4684 0.8578 0.096 Uiso 1 1 calc R
H28B H 0.4650 0.3743 0.8759 0.096 Uiso 1 1 calc R
C29 C 0.1765(11) 0.3943(9) 0.7037(5) 0.064(3) Uani 1 1 d .
H29A H 0.1990 0.4688 0.7363 0.077 Uiso 1 1 calc R
H29B H 0.0674 0.3677 0.7026 0.077 Uiso 1 1 calc R
C30 C 0.2068(12) 0.4161(10) 0.6427(5) 0.065(3) Uani 1 1 d .
H30A H 0.1398 0.3622 0.6089 0.078 Uiso 1 1 calc R
H30B H 0.1893 0.5010 0.6409 0.078 Uiso 1 1 calc R
C31 C 0.3705(12) 0.3883(8) 0.6395(4) 0.055(2) Uani 1 1 d .
H31A H 0.4395 0.4575 0.6621 0.066 Uiso 1 1 calc R
H31B H 0.3939 0.3651 0.5966 0.066 Uiso 1 1 calc R
C32 C 0.3847(11) 0.2833(9) 0.6700(4) 0.054(2) Uani 1 1 d .
H32A H 0.3594 0.2062 0.6394 0.065 Uiso 1 1 calc R
H32B H 0.4913 0.2810 0.6899 0.065 Uiso 1 1 calc R
Li1 Li 0.2541(15) 0.1956(13) 0.7706(6) 0.043(3) Uani 1 1 d .
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'
La La -0.2871 2.4523 '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'
N N 0.0061 0.0033 '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'
S S 0.1246 0.1234 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
N1 La1 N2 111.9(2) . .
N1 La1 S1 105.28(15) . .
N2 La1 S1 117.19(16) . .
N1 La1 S2 118.11(15) . .
N2 La1 S2 103.78(17) . .
S1 La1 S2 100.67(7) . .
N1 La1 Si1 27.04(15) . .
N2 La1 Si1 95.78(16) . .
S1 La1 Si1 95.49(6) . .
S2 La1 Si1 145.10(5) . .
N1 La1 Si3 95.97(15) . .
N2 La1 Si3 26.72(15) . .
S1 La1 Si3 143.90(6) . .
S2 La1 Si3 94.32(6) . .
Si1 La1 Si3 90.36(6) . .
C13 S1 Li1 99.8(4) . 1_655
C13 S1 La1 93.7(2) . .
Li1 S1 La1 164.6(4) 1_655 .
C19 S2 Li1 101.7(4) . .
C19 S2 La1 94.5(3) . .
Li1 S2 La1 162.8(3) . .
N1 Si1 C2 113.5(4) . .
N1 Si1 C3 113.7(4) . .
C2 Si1 C3 107.4(6) . .
N1 Si1 C1 107.6(4) . .
C2 Si1 C1 107.9(5) . .
C3 Si1 C1 106.4(5) . .
C2 Si1 La1 122.0(4) . .
C3 Si1 La1 129.6(4) . .
C1 Si1 La1 69.0(3) . .
N1 Si2 C4 113.1(4) . .
N1 Si2 C5 109.7(3) . .
C4 Si2 C5 107.7(4) . .
N1 Si2 C6 114.9(3) . .
C4 Si2 C6 109.6(4) . .
C5 Si2 C6 101.0(4) . .
N2 Si3 C9 108.3(3) . .
N2 Si3 C7 114.7(4) . .
C9 Si3 C7 106.8(4) . .
N2 Si3 C8 112.8(4) . .
C9 Si3 C8 105.8(5) . .
C7 Si3 C8 107.8(5) . .
C9 Si3 La1 69.6(3) . .
C7 Si3 La1 125.1(3) . .
C8 Si3 La1 126.2(4) . .
N2 Si4 C10 113.0(4) . .
N2 Si4 C11 110.7(3) . .
C10 Si4 C11 106.4(4) . .
N2 Si4 C12 115.7(3) . .
C10 Si4 C12 110.4(4) . .
C11 Si4 C12 99.4(4) . .
C25 O1 C28 107.2(7) . .
C25 O1 Li1 127.3(7) . .
C28 O1 Li1 125.3(7) . .
C32 O2 C29 108.9(7) . .
C32 O2 Li1 124.2(7) . .
C29 O2 Li1 126.1(7) . .
Si1 N1 Si2 123.4(3) . .
Si1 N1 La1 114.1(3) . .
Si2 N1 La1 122.4(3) . .
Si3 N2 Si4 123.4(4) . .
Si3 N2 La1 114.5(3) . .
Si4 N2 La1 122.1(3) . .
Si1 C1 H1A 109.5 . .
Si1 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
Si1 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
Si1 C2 H2A 109.5 . .
Si1 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
Si1 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
Si1 C3 H3A 109.5 . .
Si1 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
Si1 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
Si2 C4 H4A 109.5 . .
Si2 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
Si2 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
Si2 C5 H5A 109.5 . .
Si2 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
Si2 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
Si2 C6 H6A 109.5 . .
Si2 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
Si2 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
Si3 C7 H7A 109.5 . .
Si3 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
Si3 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
Si3 C8 H8A 109.5 . .
Si3 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
Si3 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
Si3 C9 H9A 109.5 . .
Si3 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
Si3 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
Si4 C10 H10A 109.5 . .
Si4 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
Si4 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
Si4 C11 H11A 109.5 . .
Si4 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
Si4 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
Si4 C12 H12A 109.5 . .
Si4 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
Si4 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C18 C13 C14 119.3(7) . .
C18 C13 S1 121.2(6) . .
C14 C13 S1 119.5(6) . .
C15 C14 C13 120.5(8) . .
C15 C14 H14 119.7 . .
C13 C14 H14 119.7 . .
C16 C15 C14 119.4(8) . .
C16 C15 H15 120.3 . .
C14 C15 H15 120.3 . .
C17 C16 C15 120.3(9) . .
C17 C16 H16 119.8 . .
C15 C16 H16 119.8 . .
C16 C17 C18 120.5(9) . .
C16 C17 H17 119.8 . .
C18 C17 H17 119.8 . .
C13 C18 C17 119.8(8) . .
C13 C18 H18 120.1 . .
C17 C18 H18 120.1 . .
C24 C19 C20 118.4(7) . .
C24 C19 S2 123.0(6) . .
C20 C19 S2 118.6(6) . .
C21 C20 C19 121.2(9) . .
C21 C20 H20 119.4 . .
C19 C20 H20 119.4 . .
C20 C21 C22 118.7(8) . .
C20 C21 H21 120.7 . .
C22 C21 H21 120.7 . .
C23 C22 C21 120.2(9) . .
C23 C22 H22 119.9 . .
C21 C22 H22 119.9 . .
C22 C23 C24 120.4(10) . .
C22 C23 H23 119.8 . .
C24 C23 H23 119.8 . .
C19 C24 C23 121.0(9) . .
C19 C24 H24 119.5 . .
C23 C24 H24 119.5 . .
O1 C25 C26 108.8(9) . .
O1 C25 H25A 109.9 . .
C26 C25 H25A 109.9 . .
O1 C25 H25B 109.9 . .
C26 C25 H25B 109.9 . .
H25A C25 H25B 108.3 . .
C27 C26 C25 101.8(10) . .
C27 C26 H26A 111.4 . .
C25 C26 H26A 111.4 . .
C27 C26 H26B 111.4 . .
C25 C26 H26B 111.4 . .
H26A C26 H26B 109.3 . .
C26 C27 C28 108.2(10) . .
C26 C27 H27A 110.1 . .
C28 C27 H27A 110.1 . .
C26 C27 H27B 110.1 . .
C28 C27 H27B 110.1 . .
H27A C27 H27B 108.4 . .
O1 C28 C27 106.3(9) . .
O1 C28 H28A 110.5 . .
C27 C28 H28A 110.5 . .
O1 C28 H28B 110.5 . .
C27 C28 H28B 110.5 . .
H28A C28 H28B 108.7 . .
O2 C29 C30 105.4(7) . .
O2 C29 H29A 110.7 . .
C30 C29 H29A 110.7 . .
O2 C29 H29B 110.7 . .
C30 C29 H29B 110.7 . .
H29A C29 H29B 108.8 . .
C31 C30 C29 103.6(8) . .
C31 C30 H30A 111.0 . .
C29 C30 H30A 111.0 . .
C31 C30 H30B 111.0 . .
C29 C30 H30B 111.0 . .
H30A C30 H30B 109.0 . .
C30 C31 C32 101.8(8) . .
C30 C31 H31A 111.4 . .
C32 C31 H31A 111.4 . .
C30 C31 H31B 111.4 . .
C32 C31 H31B 111.4 . .
H31A C31 H31B 109.3 . .
O2 C32 C31 106.4(7) . .
O2 C32 H32A 110.5 . .
C31 C32 H32A 110.5 . .
O2 C32 H32B 110.5 . .
C31 C32 H32B 110.5 . .
H32A C32 H32B 108.6 . .
O1 Li1 O2 105.8(7) . .
O1 Li1 S1 104.6(6) . 1_455
O2 Li1 S1 111.1(6) . 1_455
O1 Li1 S2 108.1(6) . .
O2 Li1 S2 104.0(6) . .
S1 Li1 S2 122.2(6) 1_455 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
La1 N1 2.357(5) .
La1 N2 2.371(6) .
La1 S1 2.868(2) .
La1 S2 2.877(2) .
La1 Si1 3.431(2) .
La1 Si3 3.442(2) .
S1 C13 1.787(7) .
S1 Li1 2.476(13) 1_655
S2 C19 1.774(7) .
S2 Li1 2.513(14) .
Si1 N1 1.709(6) .
Si1 C2 1.850(10) .
Si1 C3 1.874(10) .
Si1 C1 1.883(9) .
Si2 N1 1.718(6) .
Si2 C4 1.858(10) .
Si2 C5 1.861(9) .
Si2 C6 2.020(10) .
Si3 N2 1.700(7) .
Si3 C9 1.880(9) .
Si3 C7 1.885(10) .
Si3 C8 1.886(9) .
Si4 N2 1.724(6) .
Si4 C10 1.798(10) .
Si4 C11 1.847(9) .
Si4 C12 2.129(10) .
O1 C25 1.420(11) .
O1 C28 1.444(11) .
O1 Li1 1.942(15) .
O2 C32 1.425(10) .
O2 C29 1.435(10) .
O2 Li1 1.962(16) .
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C1 H1C 0.9800 .
C2 H2A 0.9800 .
C2 H2B 0.9800 .
C2 H2C 0.9800 .
C3 H3A 0.9800 .
C3 H3B 0.9800 .
C3 H3C 0.9800 .
C4 H4A 0.9800 .
C4 H4B 0.9800 .
C4 H4C 0.9800 .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C6 H6A 0.9800 .
C6 H6B 0.9800 .
C6 H6C 0.9800 .
C7 H7A 0.9800 .
C7 H7B 0.9800 .
C7 H7C 0.9800 .
C8 H8A 0.9800 .
C8 H8B 0.9800 .
C8 H8C 0.9800 .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C10 H10A 0.9800 .
C10 H10B 0.9800 .
C10 H10C 0.9800 .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 C18 1.362(11) .
C13 C14 1.404(11) .
C14 C15 1.381(12) .
C14 H14 0.9500 .
C15 C16 1.377(13) .
C15 H15 0.9500 .
C16 C17 1.366(13) .
C16 H16 0.9500 .
C17 C18 1.401(12) .
C17 H17 0.9500 .
C18 H18 0.9500 .
C19 C24 1.342(12) .
C19 C20 1.407(11) .
C20 C21 1.380(13) .
C20 H20 0.9500 .
C21 C22 1.409(16) .
C21 H21 0.9500 .
C22 C23 1.334(15) .
C22 H22 0.9500 .
C23 C24 1.420(13) .
C23 H23 0.9500 .
C24 H24 0.9500 .
C25 C26 1.492(15) .
C25 H25A 0.9900 .
C25 H25B 0.9900 .
C26 C27 1.442(19) .
C26 H26A 0.9900 .
C26 H26B 0.9900 .
C27 C28 1.448(17) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C28 H28A 0.9900 .
C28 H28B 0.9900 .
C29 C30 1.503(14) .
C29 H29A 0.9900 .
C29 H29B 0.9900 .
C30 C31 1.472(14) .
C30 H30A 0.9900 .
C30 H30B 0.9900 .
C31 C32 1.508(12) .
C31 H31A 0.9900 .
C31 H31B 0.9900 .
C32 H32A 0.9900 .
C32 H32B 0.9900 .
Li1 S1 2.476(13) 1_455
