#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/39/2013939.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2013939
loop_
_publ_author_name
'Hu, Jing-Hua'
'Tong, Hong-Bo'
'Li, Jian-Feng'
'Huang, Shu-Ping'
'Liu, Dian-Sheng'
_publ_section_title
(1R,2R)-(--)-Bis[μ₄-1-{[1,1-dimethyl-2-(trimethylsilyl)amidino]amino}-2-({1,1-dimethyl-2-[1,1-dimethyl-2-(trimethylsilyl)amidino]amidino}amino)cyclohexane]tetralithium(I)
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m272
_journal_page_last               m274
_journal_paper_doi               10.1107/S0108270104008509
_journal_volume                  60
_journal_year                    2004
_chemical_formula_iupac          '[Li4 (C21 H46 N8 Si2)2]'
_chemical_formula_moiety         'C42 H92 Li4 N14 Si4'
_chemical_formula_sum            'C42 H92 Li4 N14 Si4'
_chemical_formula_weight         961.44
_chemical_name_systematic
;
(1R,2R)-(-)-Bis[μ₄-1-{[1,1-dimethyl-2-(trimethylsilyl)amidino]amino}-
2-({1,1-dimethyl-2-[1,1-dimethyl-2-(trimethylsilyl)amidino]amidino}amino)
cyclohexane]tetralithium(I)
;
_space_group_IT_number           1
_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
_cell_angle_alpha                100.075(2)
_cell_angle_beta                 104.700(2)
_cell_angle_gamma                105.896(2)
_cell_formula_units_Z            1
_cell_length_a                   9.4773(16)
_cell_length_b                   10.8506(19)
_cell_length_c                   15.437(3)
_cell_measurement_reflns_used    3715
_cell_measurement_temperature    190(2)
_cell_measurement_theta_max      25.876
_cell_measurement_theta_min      2.357
_cell_volume                     1424.9(4)
_computing_cell_refinement       'SAINT (Siemens, 1996)'
_computing_data_collection       'SMART (Siemens, 1996)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'SHELXTL (Please provide reference)'
_computing_publication_material  SHELXTL
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      190(2)
_diffrn_measured_fraction_theta_full 0.975
_diffrn_measured_fraction_theta_max 0.975
_diffrn_measurement_device_type  'Siemens SMART CCD area-detector'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            6983
_diffrn_reflns_theta_full        25
_diffrn_reflns_theta_max         25
_diffrn_reflns_theta_min         1.41
_diffrn_standards_decay_%        3.86
_exptl_absorpt_coefficient_mu    0.148
_exptl_absorpt_correction_T_max  0.985
_exptl_absorpt_correction_T_min  0.971
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.12
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             524
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.417
_refine_diff_density_min         -0.395
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.144
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     619
_refine_ls_number_reflns         5898
_refine_ls_number_restraints     3
_refine_ls_restrained_S_all      1.143
_refine_ls_R_factor_all          0.0743
_refine_ls_R_factor_gt           0.0657
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.026P)²+3.2074P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1465
_refine_ls_wR_factor_ref         0.1561
_reflns_number_gt                5429
_reflns_number_total             5017
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            de1235.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'Yes' changed to 'yes' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_geom_bond_publ_flag' value 'Yes' changed to 'yes' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from
2010-06-29.

'_geom_angle_publ_flag' value 'Yes' changed to 'yes'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29 (6
times).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      P1
_cod_database_code               2013939
_cod_database_fobs_code          2013939
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_type_symbol
Li1 0.8975(14) 0.1739(11) 0.6527(8) 0.035(2) Uani d . 1 . . Li
Li2 0.7775(15) 0.0141(11) 0.3398(8) 0.038(3) Uani d . 1 . . Li
Li3 1.0694(15) 0.0399(11) 0.6509(8) 0.037(3) Uani d . 1 . . Li
Li4 1.0339(15) 0.1890(11) 0.3886(8) 0.037(3) Uani d . 1 . . Li
Si1 0.6174(2) -0.1145(2) 0.11560(14) 0.0431(5) Uani d . 1 . . Si
Si2 0.9858(2) 0.33141(17) 0.22419(13) 0.0340(4) Uani d . 1 . . Si
Si3 1.0214(2) 0.33594(18) 0.86761(13) 0.0383(5) Uani d . 1 . . Si
Si4 1.1627(2) -0.06669(19) 0.83854(14) 0.0388(5) Uani d . 1 . . Si
N1 0.7291(7) 0.1323(5) 0.5314(4) 0.0310(12) Uani d . 1 . . N
N2 0.8419(6) -0.0224(5) 0.6387(4) 0.0317(12) Uani d . 1 . . N
N3 0.7749(7) -0.1661(5) 0.7339(4) 0.0359(13) Uani d . 1 . . N
N4 1.0355(6) -0.0624(5) 0.7420(4) 0.0332(13) Uani d . 1 . . N
N5 1.1871(6) 0.1781(5) 0.5021(3) 0.0288(11) Uani d . 1 . . N
N6 0.9811(6) -0.0090(5) 0.3383(4) 0.0292(12) Uani d . 1 . . N
N7 0.9659(7) -0.1532(6) 0.1984(4) 0.0409(14) Uani d . 1 . . N
N8 0.9298(7) 0.3001(5) 0.3164(4) 0.0335(13) Uani d . 1 . . N
N9 0.6907(7) 0.3268(6) 0.3196(4) 0.0375(14) Uani d . 1 . . N
N10 0.8040(6) 0.1973(5) 0.4071(3) 0.0282(12) Uani d . 1 . . N
N11 0.7615(7) 0.3463(5) 0.5258(4) 0.0350(13) Uani d . 1 . . N
N12 1.1432(7) 0.2272(5) 0.6464(4) 0.0305(12) Uani d . 1 . . N
N13 1.3356(7) 0.3775(5) 0.7839(4) 0.0351(13) Uani d . 1 . . N
N14 1.2657(7) 0.3965(5) 0.5823(4) 0.0354(13) Uani d . 1 . . N
N15 1.0679(7) 0.3087(5) 0.7683(4) 0.0326(12) Uani d . 1 . . N
N18 0.7567(7) -0.0882(5) 0.2176(4) 0.0362(13) Uani d . 1 . . N
C1 0.6991(8) -0.0855(6) 0.5604(5) 0.0298(14) Uani d . 1 . . C
H1 0.6111 -0.0837 0.5823 0.036 Uiso calc R 1 . . H
C2 0.6778(8) -0.2309(6) 0.5158(5) 0.0317(14) Uani d . 1 . . C
H2A 0.7677 -0.2336 0.4973 0.038 Uiso calc R 1 . . H
H2B 0.6717 -0.2813 0.5616 0.038 Uiso calc R 1 . . H
C3 0.5325(8) -0.2960(6) 0.4311(5) 0.0363(15) Uani d . 1 . . C
H3A 0.5289 -0.3846 0.403 0.044 Uiso calc R 1 . . H
H3B 0.4417 -0.3046 0.4509 0.044 Uiso calc R 1 . . H
C4 0.5280(8) -0.2170(6) 0.3595(5) 0.0391(16) Uani d . 1 . . C
H4A 0.4287 -0.2552 0.3109 0.047 Uiso calc R 1 . . H
H4B 0.6081 -0.2211 0.3316 0.047 Uiso calc R 1 . . H
C5 0.5533(8) -0.0710(6) 0.4051(4) 0.0319(14) Uani d . 1 . . C
H5A 0.5573 -0.0207 0.3591 0.038 Uiso calc R 1 . . H
H5B 0.4659 -0.0668 0.4258 0.038 Uiso calc R 1 . . H
C6 0.7022(8) -0.0072(6) 0.4876(4) 0.0288(14) Uani d . 1 . . C
H6 0.7894 -0.011 0.4654 0.035 Uiso calc R 1 . . H
C7 0.7657(8) 0.2214(6) 0.4864(4) 0.0305(14) Uani d . 1 . . C
C8 0.6981(10) 0.3606(8) 0.6018(5) 0.047(2) Uani d . 1 . . C
H8A 0.6179 0.2794 0.5943 0.071 Uiso calc R 1 . . H
H8B 0.6558 0.4316 0.6017 0.071 Uiso calc R 1 . . H
H8C 0.7786 0.3805 0.6596 0.071 Uiso calc R 1 . . H
C9 0.8603(10) 0.4698(7) 0.5177(5) 0.0442(18) Uani d . 1 . . C
H9A 0.9285 0.4509 0.4847 0.066 Uiso calc R 1 . . H
H9B 0.9203 0.5269 0.5785 0.066 Uiso calc R 1 . . H
H9C 0.7974 0.5131 0.4845 0.066 Uiso calc R 1 . . H
C10 0.8105(8) 0.2784(6) 0.3476(4) 0.0310(14) Uani d . 1 . . C
C11 0.5407(9) 0.2766(8) 0.3302(6) 0.0456(18) Uani d . 1 . . C
H11A 0.532 0.1967 0.3503 0.068 Uiso calc R 1 . . H
H11B 0.4619 0.2577 0.2719 0.068 Uiso calc R 1 . . H
H11C 0.5282 0.3418 0.3756 0.068 Uiso calc R 1 . . H
C12 0.7127(11) 0.4427(8) 0.2817(6) 0.056(2) Uani d . 1 . . C
H12A 0.8199 0.48 0.2871 0.084 Uiso calc R 1 . . H
H12B 0.6819 0.5079 0.3156 0.084 Uiso calc R 1 . . H
H12C 0.6509 0.4162 0.2175 0.084 Uiso calc R 1 . . H
C13 1.1233(11) 0.5036(7) 0.2526(6) 0.051(2) Uani d . 1 . . C
H13A 1.0717 0.566 0.2656 0.077 Uiso calc R 1 . . H
H13B 1.1591 0.5158 0.2008 0.077 Uiso calc R 1 . . H
H13C 1.2099 0.5176 0.3061 0.077 Uiso calc R 1 . . H
C14 0.8305(10) 0.3054(8) 0.1137(5) 0.053(2) Uani d . 1 . . C
H14A 0.7564 0.2177 0.0975 0.08 Uiso calc R 1 . . H
H14B 0.8754 0.3151 0.0651 0.08 Uiso calc R 1 . . H
H14C 0.7797 0.3699 0.1217 0.08 Uiso calc R 1 . . H
C15 1.0944(11) 0.2177(8) 0.2005(6) 0.053(2) Uani d . 1 . . C
H15A 1.1723 0.2257 0.2569 0.08 Uiso calc R 1 . . H
H15B 1.1428 0.2407 0.1552 0.08 Uiso calc R 1 . . H
H15C 1.0244 0.1279 0.1772 0.08 Uiso calc R 1 . . H
C16 0.9027(8) -0.0828(6) 0.2506(5) 0.0332(15) Uani d . 1 . . C
C17 1.1319(10) -0.1110(8) 0.2109(5) 0.0473(19) Uani d . 1 . . C
H17A 1.178 -0.0179 0.2416 0.071 Uiso calc R 1 . . H
H17B 1.1472 -0.1271 0.1514 0.071 Uiso calc R 1 . . H
H17C 1.1793 -0.1602 0.2478 0.071 Uiso calc R 1 . . H
C18 0.8768(11) -0.2749(8) 0.1268(6) 0.058(2) Uani d . 1 . . C
H18A 0.7759 -0.3087 0.1327 0.087 Uiso calc R 1 . . H
H18B 0.9284 -0.3392 0.1332 0.087 Uiso calc R 1 . . H
H18C 0.8669 -0.2578 0.067 0.087 Uiso calc R 1 . . H
C19 0.4669(12) -0.2824(9) 0.0848(6) 0.072(3) Uani d . 1 . . C
H19A 0.509 -0.3495 0.0654 0.107 Uiso calc R 1 . . H
H19B 0.3787 -0.288 0.0351 0.107 Uiso calc R 1 . . H
H19C 0.436 -0.2958 0.138 0.107 Uiso calc R 1 . . H
C20 0.6840(11) -0.0908(9) 0.0133(6) 0.058(2) Uani d . 1 . . C
H20A 0.7732 -0.0121 0.0321 0.086 Uiso calc R 1 . . H
H20B 0.6024 -0.0819 -0.0342 0.086 Uiso calc R 1 . . H
H20C 0.7103 -0.1663 -0.0105 0.086 Uiso calc R 1 . . H
C21 0.5126(11) 0.0029(10) 0.1363(6) 0.061(2) Uani d . 1 . . C
H21A 0.4507 -0.0248 0.1744 0.091 Uiso calc R 1 . . H
H21B 0.447 0.0042 0.078 0.091 Uiso calc R 1 . . H
H21C 0.5859 0.0903 0.1672 0.091 Uiso calc R 1 . . H
C22 1.0976(7) -0.0478(6) 0.4003(4) 0.0272(13) Uani d . 1 . . C
H22 1.1907 -0.0305 0.3812 0.033 Uiso calc R 1 . . H
C23 1.0378(8) -0.1947(6) 0.3978(4) 0.0310(14) Uani d . 1 . . C
H23A 1.0111 -0.2479 0.3348 0.037 Uiso calc R 1 . . H
H23B 0.9445 -0.2124 0.4154 0.037 Uiso calc R 1 . . H
C24 1.1565(9) -0.2361(7) 0.4625(5) 0.0381(16) Uani d . 1 . . C
H24A 1.1109 -0.3281 0.4618 0.046 Uiso calc R 1 . . H
H24B 1.2449 -0.229 0.4406 0.046 Uiso calc R 1 . . H
C25 1.2100(9) -0.1492(6) 0.5612(5) 0.0369(16) Uani d . 1 . . C
H25A 1.2946 -0.1699 0.599 0.044 Uiso calc R 1 . . H
H25B 1.1257 -0.1685 0.587 0.044 Uiso calc R 1 . . H
C26 1.2638(8) -0.0010(6) 0.5646(5) 0.0323(14) Uani d . 1 . . C
H26A 1.357 0.0207 0.547 0.039 Uiso calc R 1 . . H
H26B 1.2888 0.0512 0.6277 0.039 Uiso calc R 1 . . H
C27 1.1393(7) 0.0364(6) 0.4995(4) 0.0260(13) Uani d . 1 . . C
H27 1.0465 0.0149 0.5187 0.031 Uiso calc R 1 . . H
C28 1.1992(8) 0.2623(6) 0.5783(4) 0.0291(13) Uani d . 1 . . C
C29 1.3336(10) 0.4292(7) 0.5120(5) 0.0455(19) Uani d . 1 . . C
H29A 1.3773 0.3632 0.4929 0.068 Uiso calc R 1 . . H
H29B 1.4134 0.5146 0.5367 0.068 Uiso calc R 1 . . H
H29C 1.2552 0.4316 0.4595 0.068 Uiso calc R 1 . . H
C30 1.2367(10) 0.5055(7) 0.6351(5) 0.0464(19) Uani d . 1 . . C
H30A 1.1524 0.4711 0.6576 0.07 Uiso calc R 1 . . H
H30B 1.2107 0.561 0.596 0.07 Uiso calc R 1 . . H
H30C 1.3279 0.5567 0.6866 0.07 Uiso calc R 1 . . H
C31 1.1844(8) 0.3093(6) 0.7359(4) 0.0283(14) Uani d . 1 . . C
C32 1.4624(9) 0.3520(7) 0.7568(5) 0.0441(18) Uani d . 1 . . C
H32A 1.4253 0.2666 0.7129 0.066 Uiso calc R 1 . . H
H32B 1.5409 0.353 0.8106 0.066 Uiso calc R 1 . . H
H32C 1.5053 0.4194 0.7289 0.066 Uiso calc R 1 . . H
C33 1.3847(10) 0.4885(7) 0.8654(5) 0.0482(19) Uani d . 1 . . C
H33A 1.2991 0.5183 0.8682 0.072 Uiso calc R 1 . . H
H33B 1.4673 0.5599 0.8617 0.072 Uiso calc R 1 . . H
H33C 1.4203 0.4606 0.9202 0.072 Uiso calc R 1 . . H
C34 1.1604(11) 0.3288(9) 0.9768(5) 0.057(2) Uani d . 1 . . C
H34A 1.1716 0.2427 0.9683 0.086 Uiso calc R 1 . . H
H34B 1.1211 0.3449 1.0276 0.086 Uiso calc R 1 . . H
H34C 1.2593 0.3953 0.99 0.086 Uiso calc R 1 . . H
C35 0.9878(12) 0.4983(9) 0.8931(6) 0.061(2) Uani d . 1 . . C
H35A 1.085 0.5694 0.914 0.091 Uiso calc R 1 . . H
H35B 0.9393 0.5015 0.9407 0.091 Uiso calc R 1 . . H
H35C 0.9218 0.5074 0.8379 0.091 Uiso calc R 1 . . H
C36 0.8336(11) 0.2034(8) 0.8443(6) 0.057(2) Uani d . 1 . . C
H36A 0.7634 0.1989 0.7858 0.085 Uiso calc R 1 . . H
H36B 0.7905 0.2231 0.8928 0.085 Uiso calc R 1 . . H
H36C 0.8501 0.1196 0.8421 0.085 Uiso calc R 1 . . H
C37 0.6252(9) -0.1534(7) 0.7273(5) 0.0407(17) Uani d . 1 . . C
H37A 0.6274 -0.0664 0.7212 0.061 Uiso calc R 1 . . H
H37B 0.6001 -0.1663 0.7823 0.061 Uiso calc R 1 . . H
H37C 0.5484 -0.2191 0.674 0.061 Uiso calc R 1 . . H
C38 0.7973(10) -0.2802(7) 0.7648(6) 0.0487(19) Uani d . 1 . . C
H38A 0.8803 -0.3002 0.7471 0.073 Uiso calc R 1 . . H
H38B 0.7039 -0.3553 0.7366 0.073 Uiso calc R 1 . . H
H38C 0.8225 -0.2606 0.8311 0.073 Uiso calc R 1 . . H
C39 1.0953(11) -0.0594(9) 0.9430(6) 0.057(2) Uani d . 1 . . C
H39A 1.0262 -0.0088 0.9399 0.086 Uiso calc R 1 . . H
H39B 1.1829 -0.0178 0.9982 0.086 Uiso calc R 1 . . H
H39C 1.0422 -0.1478 0.9443 0.086 Uiso calc R 1 . . H
C40 1.2242(11) -0.2147(9) 0.8157(6) 0.059(2) Uani d . 1 . . C
H40A 1.1381 -0.2938 0.804 0.088 Uiso calc R 1 . . H
H40B 1.3067 -0.2096 0.8688 0.088 Uiso calc R 1 . . H
H40C 1.2593 -0.2172 0.7625 0.088 Uiso calc R 1 . . H
C41 1.3419(10) 0.0785(8) 0.8645(6) 0.056(2) Uani d . 1 . . C
H41A 1.3869 0.0671 0.8158 0.083 Uiso calc R 1 . . H
H41B 1.4147 0.0844 0.9224 0.083 Uiso calc R 1 . . H
H41C 1.3161 0.1584 0.8687 0.083 Uiso calc R 1 . . H
C42 0.8832(8) -0.0853(6) 0.7045(4) 0.0301(14) Uani d . 1 . . C
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 0 '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'
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_publ_flag
N2 Li1 N1 87.7(5) ?
N2 Li1 N15 121.3(6) ?
N1 Li1 N15 150.9(6) ?
N2 Li1 N12 101.3(5) ?
N1 Li1 N12 116.0(5) ?
N15 Li1 N12 63.7(4) ?
N18 Li2 N10 140.8(7) ?
N18 Li2 N6 69.9(5) ?
N10 Li2 N6 112.3(6) ?
N4 Li3 N12 139.2(6) ?
N4 Li3 N2 70.3(5) ?
N12 Li3 N2 111.8(6) ?
N5 Li4 N6 87.8(5) ?
N5 Li4 N8 149.7(6) ?
N6 Li4 N8 122.5(7) ?
N5 Li4 N10 114.8(5) ?
N6 Li4 N10 100.8(6) ?
N8 Li4 N10 63.6(4) ?
N18 Si1 C21 106.7(3) ?
N18 Si1 C19 110.7(4) ?
C21 Si1 C19 104.2(5) ?
N18 Si1 C20 116.8(4) ?
C21 Si1 C20 107.9(4) ?
C19 Si1 C20 109.6(4) ?
N8 Si2 C15 106.0(3) ?
N8 Si2 C13 111.5(3) ?
C15 Si2 C13 106.6(4) ?
N8 Si2 C14 117.4(4) ?
C15 Si2 C14 107.4(4) ?
C13 Si2 C14 107.3(4) ?
N15 Si3 C36 105.3(3) ?
N15 Si3 C35 111.8(3) ?
C36 Si3 C35 107.1(4) ?
N15 Si3 C34 117.4(4) ?
C36 Si3 C34 107.6(4) ?
C35 Si3 C34 107.2(4) ?
N4 Si4 C40 110.5(4) ?
N4 Si4 C41 106.7(3) ?
C40 Si4 C41 104.7(4) ?
N4 Si4 C39 115.1(4) ?
C40 Si4 C39 110.1(4) ?
C41 Si4 C39 109.2(4) ?
C7 N1 C6 118.8(5) ?
C7 N1 Li1 110.5(6) ?
C6 N1 Li1 104.1(5) ?
C42 N2 C1 121.1(5) ?
C42 N2 Li1 127.8(6) ?
C1 N2 Li1 106.5(5) ?
C42 N2 Li3 85.1(5) ?
C1 N2 Li3 134.3(5) ?
Li1 N2 Li3 75.4(5) ?
C42 N3 C37 123.4(6) ?
C42 N3 C38 121.8(6) ?
C37 N3 C38 114.5(6) ?
C42 N4 Si4 140.6(5) ?
C42 N4 Li3 87.4(5) ?
Si4 N4 Li3 129.6(5) ?
C28 N5 C27 117.2(5) ?
C28 N5 Li4 112.6(5) ?
C27 N5 Li4 104.4(5) ?
C16 N6 C22 121.3(5) ?
C16 N6 Li2 85.0(5) ?
C22 N6 Li2 134.7(5) ?
C16 N6 Li4 127.5(5) ?
C22 N6 Li4 106.4(5) ?
Li2 N6 Li4 75.5(5) ?
C16 N7 C18 123.7(7) ?
C16 N7 C17 122.5(6) ?
C18 N7 C17 113.9(6) ?
C10 N8 Si2 143.0(5) ?
C10 N8 Li4 95.5(5) ?
Si2 N8 Li4 116.3(4) ?
C10 N9 C11 124.5(6) ?
C10 N9 C12 121.0(6) ?
C11 N9 C12 114.4(6) ?
C7 N10 C10 125.1(5) ?
C7 N10 Li2 121.6(5) ?
C10 N10 Li2 109.5(5) ?
C7 N10 Li4 129.7(5) ?
C10 N10 Li4 83.9(5) ?
Li2 N10 Li4 70.2(5) ?
C7 N11 C8 118.9(5) ?
C7 N11 C9 123.1(5) ?
C8 N11 C9 114.9(5) ?
C28 N12 C31 124.9(5) ?
C28 N12 Li3 122.0(5) ?
C31 N12 Li3 108.5(5) ?
C28 N12 Li1 129.9(5) ?
C31 N12 Li1 85.1(5) ?
Li3 N12 Li1 70.5(5) ?
C31 N13 C32 123.7(6) ?
C31 N13 C33 122.5(6) ?
C32 N13 C33 113.7(6) ?
C28 N14 C29 118.7(5) ?
C28 N14 C30 124.8(6) ?
C29 N14 C30 114.2(5) ?
C31 N15 Si3 143.3(5) ?
C31 N15 Li1 96.0(5) ?
Si3 N15 Li1 116.9(4) ?
C16 N18 Si1 140.9(5) ?
C16 N18 Li2 88.5(6) ?
Si1 N18 Li2 127.7(5) ?
N2 C1 C6 109.0(5) ?
N2 C1 C2 112.1(5) ?
C6 C1 C2 109.2(5) ?
N2 C1 H1 108.8 ?
C6 C1 H1 108.8 ?
C2 C1 H1 108.8 ?
C3 C2 C1 112.6(5) ?
C3 C2 H2A 109.1 ?
C1 C2 H2A 109.1 ?
C3 C2 H2B 109.1 ?
C1 C2 H2B 109.1 ?
H2A C2 H2B 107.8 ?
C4 C3 C2 112.1(6) ?
C4 C3 H3A 109.2 ?
C2 C3 H3A 109.2 ?
C4 C3 H3B 109.2 ?
C2 C3 H3B 109.2 ?
H3A C3 H3B 107.9 ?
C3 C4 C5 110.3(6) ?
C3 C4 H4A 109.6 ?
C5 C4 H4A 109.6 ?
C3 C4 H4B 109.6 ?
C5 C4 H4B 109.6 ?
H4A C4 H4B 108.1 ?
C6 C5 C4 112.6(5) ?
C6 C5 H5A 109.1 ?
C4 C5 H5A 109.1 ?
C6 C5 H5B 109.1 ?
C4 C5 H5B 109.1 ?
H5A C5 H5B 107.8 ?
N1 C6 C1 109.0(5) ?
N1 C6 C5 113.4(5) ?
C1 C6 C5 110.0(5) ?
N1 C6 H6 108.1 ?
C1 C6 H6 108.1 ?
C5 C6 H6 108.1 ?
N1 C7 N10 124.0(6) yes
N1 C7 N11 114.5(5) ?
N10 C7 N11 121.5(5) ?
N11 C8 H8A 109.5 ?
N11 C8 H8B 109.5 ?
H8A C8 H8B 109.5 ?
N11 C8 H8C 109.5 ?
H8A C8 H8C 109.5 ?
H8B C8 H8C 109.5 ?
N11 C9 H9A 109.5 ?
N11 C9 H9B 109.5 ?
H9A C9 H9B 109.5 ?
N11 C9 H9C 109.5 ?
H9A C9 H9C 109.5 ?
H9B C9 H9C 109.5 ?
N8 C10 N10 117.0(6) yes
N8 C10 N9 123.1(6) ?
N10 C10 N9 119.8(6) ?
N9 C11 H11A 109.5 ?
N9 C11 H11B 109.5 ?
H11A C11 H11B 109.5 ?
N9 C11 H11C 109.5 ?
H11A C11 H11C 109.5 ?
H11B C11 H11C 109.5 ?
N9 C12 H12A 109.5 ?
N9 C12 H12B 109.5 ?
H12A C12 H12B 109.5 ?
N9 C12 H12C 109.5 ?
H12A C12 H12C 109.5 ?
H12B C12 H12C 109.5 ?
Si2 C13 H13A 109.5 ?
Si2 C13 H13B 109.5 ?
H13A C13 H13B 109.5 ?
Si2 C13 H13C 109.5 ?
H13A C13 H13C 109.5 ?
H13B C13 H13C 109.5 ?
Si2 C14 H14A 109.5 ?
Si2 C14 H14B 109.5 ?
H14A C14 H14B 109.5 ?
Si2 C14 H14C 109.5 ?
H14A C14 H14C 109.5 ?
H14B C14 H14C 109.5 ?
Si2 C15 H15A 109.5 ?
Si2 C15 H15B 109.5 ?
H15A C15 H15B 109.5 ?
Si2 C15 H15C 109.5 ?
H15A C15 H15C 109.5 ?
H15B C15 H15C 109.5 ?
N18 C16 N6 116.3(6) yes
N18 C16 N7 121.0(6) ?
N6 C16 N7 122.6(6) ?
N7 C17 H17A 109.5 ?
N7 C17 H17B 109.5 ?
H17A C17 H17B 109.5 ?
N7 C17 H17C 109.5 ?
H17A C17 H17C 109.5 ?
H17B C17 H17C 109.5 ?
N7 C18 H18A 109.5 ?
N7 C18 H18B 109.5 ?
H18A C18 H18B 109.5 ?
N7 C18 H18C 109.5 ?
H18A C18 H18C 109.5 ?
H18B C18 H18C 109.5 ?
Si1 C19 H19A 109.5 ?
Si1 C19 H19B 109.5 ?
H19A C19 H19B 109.5 ?
Si1 C19 H19C 109.5 ?
H19A C19 H19C 109.5 ?
H19B C19 H19C 109.5 ?
Si1 C20 H20A 109.5 ?
Si1 C20 H20B 109.5 ?
H20A C20 H20B 109.5 ?
Si1 C20 H20C 109.5 ?
H20A C20 H20C 109.5 ?
H20B C20 H20C 109.5 ?
Si1 C21 H21A 109.5 ?
Si1 C21 H21B 109.5 ?
H21A C21 H21B 109.5 ?
Si1 C21 H21C 109.5 ?
H21A C21 H21C 109.5 ?
H21B C21 H21C 109.5 ?
N6 C22 C23 111.8(5) ?
N6 C22 C27 108.6(5) ?
C23 C22 C27 109.2(5) ?
N6 C22 H22 109.1 ?
C23 C22 H22 109.1 ?
C27 C22 H22 109.1 ?
C22 C23 C24 112.5(6) ?
C22 C23 H23A 109.1 ?
C24 C23 H23A 109.1 ?
C22 C23 H23B 109.1 ?
C24 C23 H23B 109.1 ?
H23A C23 H23B 107.8 ?
C25 C24 C23 111.1(5) ?
C25 C24 H24A 109.4 ?
C23 C24 H24A 109.4 ?
C25 C24 H24B 109.4 ?
C23 C24 H24B 109.4 ?
H24A C24 H24B 108 ?
C24 C25 C26 111.6(5) ?
C24 C25 H25A 109.3 ?
C26 C25 H25A 109.3 ?
C24 C25 H25B 109.3 ?
C26 C25 H25B 109.3 ?
H25A C25 H25B 108 ?
C25 C26 C27 112.0(5) ?
C25 C26 H26A 109.2 ?
C27 C26 H26A 109.2 ?
C25 C26 H26B 109.2 ?
C27 C26 H26B 109.2 ?
H26A C26 H26B 107.9 ?
N5 C27 C22 109.9(5) ?
N5 C27 C26 113.2(5) ?
C22 C27 C26 109.1(5) ?
N5 C27 H27 108.2 ?
C22 C27 H27 108.2 ?
C26 C27 H27 108.2 ?
N5 C28 N12 124.5(6) yes
N5 C28 N14 114.8(5) ?
N12 C28 N14 120.6(5) ?
N14 C29 H29A 109.5 ?
N14 C29 H29B 109.5 ?
H29A C29 H29B 109.5 ?
N14 C29 H29C 109.5 ?
H29A C29 H29C 109.5 ?
H29B C29 H29C 109.5 ?
N14 C30 H30A 109.5 ?
N14 C30 H30B 109.5 ?
H30A C30 H30B 109.5 ?
N14 C30 H30C 109.5 ?
H30A C30 H30C 109.5 ?
H30B C30 H30C 109.5 ?
N15 C31 N13 125.0(6) ?
N15 C31 N12 115.1(6) yes
N13 C31 N12 119.8(6) ?
N13 C32 H32A 109.5 ?
N13 C32 H32B 109.5 ?
H32A C32 H32B 109.5 ?
N13 C32 H32C 109.5 ?
H32A C32 H32C 109.5 ?
H32B C32 H32C 109.5 ?
N13 C33 H33A 109.5 ?
N13 C33 H33B 109.5 ?
H33A C33 H33B 109.5 ?
N13 C33 H33C 109.5 ?
H33A C33 H33C 109.5 ?
H33B C33 H33C 109.5 ?
Si3 C34 H34A 109.5 ?
Si3 C34 H34B 109.5 ?
H34A C34 H34B 109.5 ?
Si3 C34 H34C 109.5 ?
H34A C34 H34C 109.5 ?
H34B C34 H34C 109.5 ?
Si3 C35 H35A 109.5 ?
Si3 C35 H35B 109.5 ?
H35A C35 H35B 109.5 ?
Si3 C35 H35C 109.5 ?
H35A C35 H35C 109.5 ?
H35B C35 H35C 109.5 ?
Si3 C36 H36A 109.5 ?
Si3 C36 H36B 109.5 ?
H36A C36 H36B 109.5 ?
Si3 C36 H36C 109.5 ?
H36A C36 H36C 109.5 ?
H36B C36 H36C 109.5 ?
N3 C37 H37A 109.5 ?
N3 C37 H37B 109.5 ?
H37A C37 H37B 109.5 ?
N3 C37 H37C 109.5 ?
H37A C37 H37C 109.5 ?
H37B C37 H37C 109.5 ?
N3 C38 H38A 109.5 ?
N3 C38 H38B 109.5 ?
H38A C38 H38B 109.5 ?
N3 C38 H38C 109.5 ?
H38A C38 H38C 109.5 ?
H38B C38 H38C 109.5 ?
Si4 C39 H39A 109.5 ?
Si4 C39 H39B 109.5 ?
H39A C39 H39B 109.5 ?
Si4 C39 H39C 109.5 ?
H39A C39 H39C 109.5 ?
H39B C39 H39C 109.5 ?
Si4 C40 H40A 109.5 ?
Si4 C40 H40B 109.5 ?
H40A C40 H40B 109.5 ?
Si4 C40 H40C 109.5 ?
H40A C40 H40C 109.5 ?
H40B C40 H40C 109.5 ?
Si4 C41 H41A 109.5 ?
Si4 C41 H41B 109.5 ?
H41A C41 H41B 109.5 ?
Si4 C41 H41C 109.5 ?
H41A C41 H41C 109.5 ?
H41B C41 H41C 109.5 ?
N4 C42 N2 116.8(6) yes
N4 C42 N3 121.3(6) ?
N2 C42 N3 121.9(6) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Li1 N2 . 2.007(12) y
Li1 N1 . 2.013(13) y
Li1 N15 . 2.064(13) y
Li1 N12 . 2.273(13) y
Li2 N18 . 1.947(12) y
Li2 N10 . 1.992(12) y
Li2 N6 . 2.018(14) y
Li3 N4 . 1.973(12) y
Li3 N12 . 1.980(12) y
Li3 N2 . 2.023(14) y
Li4 N5 . 2.017(13) y
Li4 N6 . 2.025(12) y
Li4 N8 . 2.056(13) y
Li4 N10 . 2.292(13) y
Si1 N18 . 1.698(6) ?
Si1 C21 . 1.850(9) ?
Si1 C19 . 1.873(9) ?
Si1 C20 . 1.876(8) ?
Si2 N8 . 1.697(5) ?
Si2 C15 . 1.856(7) ?
Si2 C13 . 1.863(8) ?
Si2 C14 . 1.867(8) ?
Si3 N15 . 1.700(5) ?
Si3 C36 . 1.859(9) ?
Si3 C35 . 1.867(8) ?
Si3 C34 . 1.886(8) ?
Si4 N4 . 1.679(6) ?
Si4 C40 . 1.861(8) ?
Si4 C41 . 1.869(9) ?
Si4 C39 . 1.876(8) ?
N1 C7 . 1.308(8) ?
N1 C6 . 1.468(8) ?
N2 C42 . 1.356(8) ?
N2 C1 . 1.461(8) ?
N3 C42 . 1.383(8) ?
N3 C37 . 1.442(9) ?
N3 C38 . 1.451(8) ?
N4 C42 . 1.345(9) ?
N5 C28 . 1.315(8) ?
N5 C27 . 1.470(7) ?
N6 C16 . 1.346(8) ?
N6 C22 . 1.474(8) ?
N7 C16 . 1.367(8) yes
N7 C18 . 1.444(9) ?
N7 C17 . 1.464(10) ?
N8 C10 . 1.317(8) ?
N9 C10 . 1.382(8) ?
N9 C11 . 1.439(9) ?
N9 C12 . 1.464(8) ?
N10 C7 . 1.366(7) ?
N10 C10 . 1.380(8) ?
N11 C7 . 1.401(7) ?
N11 C8 . 1.451(8) ?
N11 C9 . 1.456(9) ?
N12 C28 . 1.359(8) ?
N12 C31 . 1.399(8) ?
N13 C31 . 1.355(9) ?
N13 C32 . 1.447(9) ?
N13 C33 . 1.456(8) ?
N14 C28 . 1.402(8) ?
N14 C29 . 1.444(8) ?
N14 C30 . 1.446(8) ?
N15 C31 . 1.322(8) ?
N18 C16 . 1.328(9) ?
C1 C6 . 1.524(8) ?
C1 C2 . 1.542(8) ?
C1 H1 . 0.98 ?
C2 C3 . 1.529(9) ?
C2 H2A . 0.97 ?
C2 H2B . 0.97 ?
C3 C4 . 1.511(10) ?
C3 H3A . 0.97 ?
C3 H3B . 0.97 ?
C4 C5 . 1.542(9) ?
C4 H4A . 0.97 ?
C4 H4B . 0.97 ?
C5 C6 . 1.529(9) ?
C5 H5A . 0.97 ?
C5 H5B . 0.97 ?
C6 H6 . 0.98 ?
C8 H8A . 0.96 ?
C8 H8B . 0.96 ?
C8 H8C . 0.96 ?
C9 H9A . 0.96 ?
C9 H9B . 0.96 ?
C9 H9C . 0.96 ?
C11 H11A . 0.96 ?
C11 H11B . 0.96 ?
C11 H11C . 0.96 ?
C12 H12A . 0.96 ?
C12 H12B . 0.96 ?
C12 H12C . 0.96 ?
C13 H13A . 0.96 ?
C13 H13B . 0.96 ?
C13 H13C . 0.96 ?
C14 H14A . 0.96 ?
C14 H14B . 0.96 ?
C14 H14C . 0.96 ?
C15 H15A . 0.96 ?
C15 H15B . 0.96 ?
C15 H15C . 0.96 ?
C17 H17A . 0.96 ?
C17 H17B . 0.96 ?
C17 H17C . 0.96 ?
C18 H18A . 0.96 ?
C18 H18B . 0.96 ?
C18 H18C . 0.96 ?
C19 H19A . 0.96 ?
C19 H19B . 0.96 ?
C19 H19C . 0.96 ?
C20 H20A . 0.96 ?
C20 H20B . 0.96 ?
C20 H20C . 0.96 ?
C21 H21A . 0.96 ?
C21 H21B . 0.96 ?
C21 H21C . 0.96 ?
C22 C23 . 1.528(8) ?
C22 C27 . 1.530(8) ?
C22 H22 . 0.98 ?
C23 C24 . 1.526(9) ?
C23 H23A . 0.97 ?
C23 H23B . 0.97 ?
C24 C25 . 1.520(10) ?
C24 H24A . 0.97 ?
C24 H24B . 0.97 ?
C25 C26 . 1.536(9) ?
C25 H25A . 0.97 ?
C25 H25B . 0.97 ?
C26 C27 . 1.539(8) ?
C26 H26A . 0.97 ?
C26 H26B . 0.97 ?
C27 H27 . 0.98 ?
C29 H29A . 0.96 ?
C29 H29B . 0.96 ?
C29 H29C . 0.96 ?
C30 H30A . 0.96 ?
C30 H30B . 0.96 ?
C30 H30C . 0.96 ?
C32 H32A . 0.96 ?
C32 H32B . 0.96 ?
C32 H32C . 0.96 ?
C33 H33A . 0.96 ?
C33 H33B . 0.96 ?
C33 H33C . 0.96 ?
C34 H34A . 0.96 ?
C34 H34B . 0.96 ?
C34 H34C . 0.96 ?
C35 H35A . 0.96 ?
C35 H35B . 0.96 ?
C35 H35C . 0.96 ?
C36 H36A . 0.96 ?
C36 H36B . 0.96 ?
C36 H36C . 0.96 ?
C37 H37A . 0.96 ?
C37 H37B . 0.96 ?
C37 H37C . 0.96 ?
C38 H38A . 0.96 ?
C38 H38B . 0.96 ?
C38 H38C . 0.96 ?
C39 H39A . 0.96 ?
C39 H39B . 0.96 ?
C39 H39C . 0.96 ?
C40 H40A . 0.96 ?
C40 H40B . 0.96 ?
C40 H40C . 0.96 ?
C41 H41A . 0.96 ?
C41 H41B . 0.96 ?
C41 H41C . 0.96 ?
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_publ_flag
N2 Li1 N1 C7 -147.9(5) ?
N15 Li1 N1 C7 35.8(15) ?
N12 Li1 N1 C7 -46.4(7) ?
N2 Li1 N1 C6 -19.3(5) ?
N15 Li1 N1 C6 164.4(12) ?
N12 Li1 N1 C6 82.2(6) ?
N1 Li1 N2 C42 -164.9(6) ?
N15 Li1 N2 C42 13.0(10) ?
N12 Li1 N2 C42 79.0(7) ?
N1 Li1 N2 C1 -9.2(6) ?
N15 Li1 N2 C1 168.7(6) ?
N12 Li1 N2 C1 -125.3(5) ?
N1 Li1 N2 Li3 123.3(5) ?
N15 Li1 N2 Li3 -58.8(7) ?
N12 Li1 N2 Li3 7.2(5) ?
N4 Li3 N2 C42 -3.6(4) ?
N12 Li3 N2 C42 -139.8(6) ?
N4 Li3 N2 C1 -133.5(6) ?
N12 Li3 N2 C1 90.3(8) ?
N4 Li3 N2 Li1 127.5(5) ?
N12 Li3 N2 Li1 -8.7(6) ?
C40 Si4 N4 C42 104.7(8) ?
C41 Si4 N4 C42 -142.0(8) ?
C39 Si4 N4 C42 -20.7(9) ?
C40 Si4 N4 Li3 -98.8(6) ?
C41 Si4 N4 Li3 14.5(7) ?
C39 Si4 N4 Li3 135.8(6) ?
N12 Li3 N4 C42 104.4(11) ?
N2 Li3 N4 C42 3.6(4) ?
N12 Li3 N4 Si4 -60.9(13) ?
N2 Li3 N4 Si4 -161.7(5) ?
N6 Li4 N5 C28 -146.2(5) ?
N8 Li4 N5 C28 34.2(15) ?
N10 Li4 N5 C28 -45.4(8) ?
N6 Li4 N5 C27 -18.1(5) ?
N8 Li4 N5 C27 162.3(12) ?
N10 Li4 N5 C27 82.8(6) ?
N18 Li2 N6 C16 -2.9(4) ?
N10 Li2 N6 C16 -140.8(6) ?
N18 Li2 N6 C22 -133.2(6) ?
N10 Li2 N6 C22 88.9(8) ?
N18 Li2 N6 Li4 127.9(5) ?
N10 Li2 N6 Li4 -10.0(6) ?
N5 Li4 N6 C16 -165.2(6) ?
N8 Li4 N6 C16 14.6(11) ?
N10 Li4 N6 C16 80.0(7) ?
N5 Li4 N6 C22 -10.0(6) ?
N8 Li4 N6 C22 169.8(6) ?
N10 Li4 N6 C22 -124.8(5) ?
N5 Li4 N6 Li2 122.9(5) ?
N8 Li4 N6 Li2 -57.3(7) ?
N10 Li4 N6 Li2 8.1(5) ?
C15 Si2 N8 C10 -133.3(8) ?
C13 Si2 N8 C10 111.0(8) ?
C14 Si2 N8 C10 -13.4(9) ?
C15 Si2 N8 Li4 13.4(6) ?
C13 Si2 N8 Li4 -102.2(6) ?
C14 Si2 N8 Li4 133.4(6) ?
N5 Li4 N8 C10 -93.7(13) ?
N6 Li4 N8 C10 86.8(7) ?
N10 Li4 N8 C10 0.8(4) ?
N5 Li4 N8 Si2 105.6(12) ?
N6 Li4 N8 Si2 -73.9(8) ?
N10 Li4 N8 Si2 -159.9(4) ?
N18 Li2 N10 C7 158.7(10) ?
N6 Li2 N10 C7 -116.1(7) ?
N18 Li2 N10 C10 -0.5(14) ?
N6 Li2 N10 C10 84.7(7) ?
N18 Li2 N10 Li4 -76.1(12) ?
N6 Li2 N10 Li4 9.1(5) ?
N5 Li4 N10 C7 14.1(9) ?
N6 Li4 N10 C7 106.6(7) ?
N8 Li4 N10 C7 -132.3(6) ?
N5 Li4 N10 C10 145.7(6) ?
N6 Li4 N10 C10 -121.8(5) ?
N8 Li4 N10 C10 -0.7(4) ?
N5 Li4 N10 Li2 -101.0(6) ?
N6 Li4 N10 Li2 -8.5(5) ?
N8 Li4 N10 Li2 112.6(5) ?
N4 Li3 N12 C28 157.9(9) ?
N2 Li3 N12 C28 -117.6(7) ?
N4 Li3 N12 C31 1.0(13) ?
N2 Li3 N12 C31 85.5(7) ?
N4 Li3 N12 Li1 -76.7(11) ?
N2 Li3 N12 Li1 7.9(5) ?
N2 Li1 N12 C28 108.3(6) ?
N1 Li1 N12 C28 15.2(9) ?
N15 Li1 N12 C28 -132.3(6) ?
N2 Li1 N12 C31 -119.2(5) ?
N1 Li1 N12 C31 147.8(6) ?
N15 Li1 N12 C31 0.3(4) ?
N2 Li1 N12 Li3 -7.5(5) ?
N1 Li1 N12 Li3 -100.6(6) ?
N15 Li1 N12 Li3 111.9(5) ?
C36 Si3 N15 C31 -140.1(8) ?
C35 Si3 N15 C31 104.0(8) ?
C34 Si3 N15 C31 -20.5(9) ?
C36 Si3 N15 Li1 11.4(6) ?
C35 Si3 N15 Li1 -104.5(6) ?
C34 Si3 N15 Li1 131.0(5) ?
N2 Li1 N15 C31 87.2(7) ?
N1 Li1 N15 C31 -97.1(13) ?
N12 Li1 N15 C31 -0.3(4) ?
N2 Li1 N15 Si3 -76.2(7) ?
N1 Li1 N15 Si3 99.5(13) ?
N12 Li1 N15 Si3 -163.7(4) ?
C21 Si1 N18 C16 -141.1(8) ?
C19 Si1 N18 C16 106.1(9) ?
C20 Si1 N18 C16 -20.3(9) ?
C21 Si1 N18 Li2 12.6(7) ?
C19 Si1 N18 Li2 -100.2(7) ?
C20 Si1 N18 Li2 133.3(6) ?
N10 Li2 N18 C16 104.0(12) ?
N6 Li2 N18 C16 3.0(4) ?
N10 Li2 N18 Si1 -59.8(14) ?
N6 Li2 N18 Si1 -160.8(5) ?
C42 N2 C1 C6 -166.9(5) ?
Li1 N2 C1 C6 35.4(7) ?
Li3 N2 C1 C6 -50.2(8) ?
C42 N2 C1 C2 -45.9(8) ?
Li1 N2 C1 C2 156.4(5) ?
Li3 N2 C1 C2 70.9(8) ?
N2 C1 C2 C3 -177.4(5) ?
C6 C1 C2 C3 -56.5(7) ?
C1 C2 C3 C4 54.5(7) ?
C2 C3 C4 C5 -52.1(8) ?
C3 C4 C5 C6 54.8(7) ?
C7 N1 C6 C1 166.9(6) ?
Li1 N1 C6 C1 43.5(6) ?
C7 N1 C6 C5 -70.2(8) ?
Li1 N1 C6 C5 166.4(5) ?
N2 C1 C6 N1 -54.8(7) ?
C2 C1 C6 N1 -177.6(5) ?
N2 C1 C6 C5 -179.7(5) ?
C2 C1 C6 C5 57.5(7) ?
C4 C5 C6 N1 179.5(5) ?
C4 C5 C6 C1 -58.2(7) ?
C6 N1 C7 N10 -10.4(10) ?
Li1 N1 C7 N10 109.7(7) ?
C6 N1 C7 N11 169.0(6) ?
Li1 N1 C7 N11 -70.9(7) ?
C10 N10 C7 N1 165.2(7) ?
Li2 N10 C7 N1 9.4(10) ?
Li4 N10 C7 N1 -80.2(9) ?
C10 N10 C7 N11 -14.2(10) ?
Li2 N10 C7 N11 -170.0(7) ?
Li4 N10 C7 N11 100.4(8) ?
C8 N11 C7 N1 -8.5(10) ?
C9 N11 C7 N1 150.3(7) ?
C8 N11 C7 N10 170.9(7) ?
C9 N11 C7 N10 -30.2(10) ?
Si2 N8 C10 N10 149.2(6) ?
Li4 N8 C10 N10 -1.3(7) ?
Si2 N8 C10 N9 -27.3(12) ?
Li4 N8 C10 N9 -177.7(7) ?
C7 N10 C10 N8 136.4(7) ?
Li2 N10 C10 N8 -65.3(8) ?
Li4 N10 C10 N8 1.1(6) ?
C7 N10 C10 N9 -47.0(10) ?
Li2 N10 C10 N9 111.3(7) ?
Li4 N10 C10 N9 177.7(7) ?
C11 N9 C10 N8 161.6(7) ?
C12 N9 C10 N8 -22.9(10) ?
C11 N9 C10 N10 -14.8(10) ?
C12 N9 C10 N10 160.8(6) ?
Si1 N18 C16 N6 154.8(6) ?
Li2 N18 C16 N6 -4.7(7) ?
Si1 N18 C16 N7 -27.6(12) ?
Li2 N18 C16 N7 172.9(7) ?
C22 N6 C16 N18 145.2(6) ?
Li2 N6 C16 N18 4.5(7) ?
Li4 N6 C16 N18 -62.9(9) ?
C22 N6 C16 N7 -32.4(10) ?
Li2 N6 C16 N7 -173.0(7) ?
Li4 N6 C16 N7 119.6(8) ?
C18 N7 C16 N18 -27.4(11) ?
C17 N7 C16 N18 152.9(7) ?
C18 N7 C16 N6 150.1(7) ?
C17 N7 C16 N6 -29.7(11) ?
C16 N6 C22 C23 -47.0(8) ?
Li2 N6 C22 C23 70.3(8) ?
Li4 N6 C22 C23 155.9(5) ?
C16 N6 C22 C27 -167.6(6) ?
Li2 N6 C22 C27 -50.3(9) ?
Li4 N6 C22 C27 35.3(6) ?
N6 C22 C23 C24 -179.3(5) ?
C27 C22 C23 C24 -59.1(7) ?
C22 C23 C24 C25 55.1(7) ?
C23 C24 C25 C26 -51.6(8) ?
C24 C25 C26 C27 54.2(7) ?
C28 N5 C27 C22 167.8(6) ?
Li4 N5 C27 C22 42.5(6) ?
C28 N5 C27 C26 -69.9(7) ?
Li4 N5 C27 C26 164.8(5) ?
N6 C22 C27 N5 -54.0(6) ?
C23 C22 C27 N5 -176.2(5) ?
N6 C22 C27 C26 -178.7(5) ?
C23 C22 C27 C26 59.2(7) ?
C25 C26 C27 N5 179.4(5) ?
C25 C26 C27 C22 -57.8(7) ?
C27 N5 C28 N12 -13.1(10) ?
Li4 N5 C28 N12 108.0(7) ?
C27 N5 C28 N14 171.4(5) ?
Li4 N5 C28 N14 -67.4(8) ?
C31 N12 C28 N5 164.7(6) ?
Li3 N12 C28 N5 11.7(10) ?
Li1 N12 C28 N5 -78.8(8) ?
C31 N12 C28 N14 -20.1(10) ?
Li3 N12 C28 N14 -173.1(7) ?
Li1 N12 C28 N14 96.4(8) ?
C29 N14 C28 N5 -8.7(9) ?
C30 N14 C28 N5 153.4(7) ?
C29 N14 C28 N12 175.7(7) ?
C30 N14 C28 N12 -22.2(10) ?
Si3 N15 C31 N13 -21.9(12) ?
Li1 N15 C31 N13 -176.6(7) ?
Si3 N15 C31 N12 155.2(6) ?
Li1 N15 C31 N12 0.5(6) ?
C32 N13 C31 N15 164.1(6) ?
C33 N13 C31 N15 -19.1(11) ?
C32 N13 C31 N12 -12.9(10) ?
C33 N13 C31 N12 163.9(6) ?
C28 N12 C31 N15 136.0(6) ?
Li3 N12 C31 N15 -68.0(7) ?
Li1 N12 C31 N15 -0.5(6) ?
C28 N12 C31 N13 -46.7(9) ?
Li3 N12 C31 N13 109.3(7) ?
Li1 N12 C31 N13 176.8(6) ?
Si4 N4 C42 N2 156.4(6) ?
Li3 N4 C42 N2 -5.7(7) ?
Si4 N4 C42 N3 -21.7(11) ?
Li3 N4 C42 N3 176.2(7) ?
C1 N2 C42 N4 145.6(6) yes
Li1 N2 C42 N4 -61.8(9) ?
Li3 N2 C42 N4 5.5(6) ?
C1 N2 C42 N3 -36.2(9) ?
Li1 N2 C42 N3 116.3(8) ?
Li3 N2 C42 N3 -176.3(7) ?
C37 N3 C42 N4 153.6(6) ?
C38 N3 C42 N4 -33.3(10) ?
C37 N3 C42 N2 -24.5(10) ?
C38 N3 C42 N2 148.6(7) ?
