#------------------------------------------------------------------------------
#$Date: 2025-08-21 14:03:24 +0200 (Thu 21 de Aug de 2025) $
#$Revision: 301848 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/24/7022475.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7022475
loop_
_publ_author_name
'Roşca, Sorin-Claudiu'
'Roşca, Dragoş-Adrian'
'Dorcet, Vincent'
'Kozak, Christopher M.'
'Kerton, Francesca M.'
'Carpentier, Jean-François'
'Sarazin, Yann'
_publ_section_title
;
 Alkali aminoether-phenolate complexes: synthesis, structural
 characterization and evidence for an activated monomer ROP mechanism.
;
_journal_issue                   25
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9361
_journal_page_last               9375
_journal_paper_doi               10.1039/c2dt32726k
_journal_volume                  42
_journal_year                    2013
_chemical_compound_source        'synthesis as described'
_chemical_formula_moiety         '2(C23 H38 Li N O3)'
_chemical_formula_sum            'C46 H76 Li2 N2 O6'
_chemical_formula_weight         766.97
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.4
_audit_creation_date             2012-02-29T10:08:16-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                91.944(12)
_cell_angle_beta                 100.525(12)
_cell_angle_gamma                95.069(13)
_cell_formula_units_Z            2
_cell_length_a                   10.740(3)
_cell_length_b                   11.668(3)
_cell_length_c                   18.746(5)
_cell_measurement_reflns_used    4022
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      23.08
_cell_measurement_theta_min      2.74
_cell_measurement_wavelength     0.71073
_cell_volume                     2297.6(11)
_computing_cell_refinement       'Bruker APEX2 (Bruker, 2006)'
_computing_data_collection       'Bruker APEX2 (Bruker, 2006)'
_computing_data_reduction        'Bruker APEX2 (Bruker, 2006)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material
;
WinGX publication routines (Farrugia, 1999),
CRYSCAL (T. Roisnel, local program)
;
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR97 (Altomare et al., 1999)'
_diffrn_ambient_temperature      150(2)
_diffrn_detector                 'CCD plate'
_diffrn_measured_fraction_theta_full 0.977
_diffrn_measured_fraction_theta_max 0.968
_diffrn_measurement_device_type  'APEXII, Bruker-AXS'
_diffrn_measurement_method       'CCD rotation images, thin slices'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0556
_diffrn_reflns_av_unetI/netI     0.0847
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            28356
_diffrn_reflns_theta_full        25
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.12
_exptl_absorpt_coefficient_mu    0.071
_exptl_absorpt_correction_T_max  0.996
_exptl_absorpt_correction_T_min  0.911
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
[Sheldrick, G.M. (2002). SADABS Bruker AXS Inc., Madison, Wisconsin, USA]
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.109
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             840
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.371
_refine_diff_density_min         -0.442
_refine_diff_density_rms         0.049
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.022
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     523
_refine_ls_number_reflns         10200
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.022
_refine_ls_R_factor_all          0.1245
_refine_ls_R_factor_gt           0.06
_refine_ls_shift/su_max          0
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0667P)²+0.6046P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1356
_refine_ls_wR_factor_ref         0.1673
_reflns_number_gt                5702
_reflns_number_total             10200
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2dt32726k.txt
_cod_data_source_block           SR8
_cod_database_code               7022475
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Li1 Li -0.0051(3) -0.1108(3) -0.00419(19) 0.0269(8) Uani 1 1 d . . .
O2 O 0.05360(13) -0.00030(12) 0.07566(7) 0.0243(3) Uani 1 1 d . . .
C3 C 0.1501(2) 0.02882(17) 0.13047(11) 0.0230(5) Uani 1 1 d . . .
C4 C 0.1460(2) 0.00368(17) 0.20413(11) 0.0224(5) Uani 1 1 d . . .
C5 C 0.2550(2) 0.03598(18) 0.25730(11) 0.0247(5) Uani 1 1 d . . .
H5 H 0.2515 0.0188 0.3061 0.03 Uiso 1 1 calc R . .
C6 C 0.3675(2) 0.09131(18) 0.24350(11) 0.0255(5) Uani 1 1 d . . .
C7 C 0.3681(2) 0.11728(19) 0.17217(12) 0.0278(5) Uani 1 1 d . . .
H7 H 0.4426 0.1564 0.1605 0.033 Uiso 1 1 calc R . .
C8 C 0.2637(2) 0.08810(18) 0.11707(11) 0.0255(5) Uani 1 1 d . . .
C9 C 0.0282(2) -0.06260(18) 0.22451(11) 0.0272(5) Uani 1 1 d . . .
C10 C -0.0952(2) -0.0095(2) 0.19357(12) 0.0324(5) Uani 1 1 d . . .
H10A H -0.091 0.0695 0.2139 0.049 Uiso 1 1 calc R . .
H10B H -0.168 -0.0555 0.2065 0.049 Uiso 1 1 calc R . .
H10C H -0.1054 -0.0087 0.1406 0.049 Uiso 1 1 calc R . .
C11 C 0.0348(3) -0.0640(2) 0.30734(12) 0.0414(6) Uani 1 1 d . . .
H11A H 0.107 -0.1051 0.3292 0.062 Uiso 1 1 calc R . .
H11B H -0.0442 -0.1032 0.3174 0.062 Uiso 1 1 calc R . .
H11C H 0.0459 0.0153 0.3281 0.062 Uiso 1 1 calc R . .
C12 C 0.0229(2) -0.18738(19) 0.19560(13) 0.0357(6) Uani 1 1 d . . .
H12A H 0.0212 -0.1891 0.1431 0.054 Uiso 1 1 calc R . .
H12B H -0.0541 -0.2309 0.2053 0.054 Uiso 1 1 calc R . .
H12C H 0.0981 -0.2221 0.2199 0.054 Uiso 1 1 calc R . .
C13 C 0.4821(2) 0.13241(19) 0.30445(12) 0.0289(5) Uani 1 1 d . . .
C14 C 0.4808(2) 0.2626(2) 0.31956(14) 0.0389(6) Uani 1 1 d . . .
H14A H 0.4019 0.2775 0.3359 0.058 Uiso 1 1 calc R . .
H14B H 0.4859 0.3029 0.275 0.058 Uiso 1 1 calc R . .
H14C H 0.5539 0.2906 0.3574 0.058 Uiso 1 1 calc R . .
C15 C 0.4765(2) 0.0710(2) 0.37449(12) 0.0363(6) Uani 1 1 d . . .
H15A H 0.4002 0.0889 0.3928 0.054 Uiso 1 1 calc R . .
H15B H 0.5523 0.097 0.4109 0.054 Uiso 1 1 calc R . .
H15C H 0.4733 -0.0124 0.3648 0.054 Uiso 1 1 calc R . .
C16 C 0.6091(2) 0.1109(2) 0.28157(14) 0.0433(7) Uani 1 1 d . . .
H16A H 0.6796 0.1352 0.3218 0.065 Uiso 1 1 calc R . .
H16B H 0.619 0.1552 0.2391 0.065 Uiso 1 1 calc R . .
H16C H 0.6096 0.0287 0.2693 0.065 Uiso 1 1 calc R . .
C17 C 0.2693(2) 0.12658(19) 0.04162(12) 0.0278(5) Uani 1 1 d . . .
H17A H 0.3588 0.151 0.0387 0.033 Uiso 1 1 calc R . .
H17B H 0.2395 0.0605 0.0062 0.033 Uiso 1 1 calc R . .
N18 N 0.19027(17) 0.22371(15) 0.02114(9) 0.0251(4) Uani 1 1 d . . .
C19 C 0.2252(2) 0.2712(2) -0.04478(12) 0.0314(5) Uani 1 1 d . . .
H19A H 0.2032 0.2119 -0.0852 0.038 Uiso 1 1 calc R . .
H19B H 0.3182 0.2924 -0.0365 0.038 Uiso 1 1 calc R . .
C20 C 0.1561(3) 0.3765(2) -0.06536(13) 0.0392(6) Uani 1 1 d . . .
H20A H 0.1794 0.4058 -0.1106 0.047 Uiso 1 1 calc R . .
H20B H 0.0631 0.3548 -0.0748 0.047 Uiso 1 1 calc R . .
O21 O 0.18746(17) 0.46531(13) -0.00906(9) 0.0412(4) Uani 1 1 d . . .
C22 C 0.1519(3) 0.4215(2) 0.05499(13) 0.0387(6) Uani 1 1 d . . .
H22A H 0.0589 0.4002 0.0459 0.046 Uiso 1 1 calc R . .
H22B H 0.1723 0.4824 0.0945 0.046 Uiso 1 1 calc R . .
C23 C 0.2197(2) 0.31746(19) 0.07869(12) 0.0328(6) Uani 1 1 d . . .
H23A H 0.3126 0.3392 0.0898 0.039 Uiso 1 1 calc R . .
H23B H 0.1931 0.2899 0.1235 0.039 Uiso 1 1 calc R . .
Li51 Li 0.0513(4) 0.4937(3) 0.4435(2) 0.0300(9) Uani 1 1 d . . .
O52 O -0.08307(14) 0.57864(12) 0.46724(8) 0.0267(4) Uani 1 1 d . . .
C53 C -0.1776(2) 0.60560(18) 0.41586(11) 0.0232(5) Uani 1 1 d . . .
C54 C -0.2290(2) 0.71455(18) 0.41415(11) 0.0231(5) Uani 1 1 d . B .
C55 C -0.3257(2) 0.73421(18) 0.35648(11) 0.0258(5) Uani 1 1 d . . .
H55 H -0.3574 0.8078 0.3555 0.031 Uiso 1 1 calc R B .
C56 C -0.3793(2) 0.65316(19) 0.30010(12) 0.0285(5) Uani 1 1 d . A .
C57 C -0.3294(2) 0.54763(19) 0.30356(12) 0.0289(5) Uani 1 1 d . . .
H57 H -0.3638 0.4895 0.2668 0.035 Uiso 1 1 calc R B .
C58 C -0.2312(2) 0.52316(18) 0.35856(12) 0.0255(5) Uani 1 1 d . B .
C59 C -0.1835(2) 0.80598(19) 0.47734(12) 0.0270(5) Uani 1 1 d . . .
C60 C -0.2240(2) 0.7578(2) 0.54516(12) 0.0318(5) Uani 1 1 d . B .
H60A H -0.317 0.7438 0.5369 0.048 Uiso 1 1 calc R . .
H60B H -0.1947 0.8133 0.5865 0.048 Uiso 1 1 calc R . .
H60C H -0.1865 0.6852 0.5556 0.048 Uiso 1 1 calc R . .
C61 C -0.0389(2) 0.8346(2) 0.49161(12) 0.0306(5) Uani 1 1 d . B .
H61A H -0.0135 0.8895 0.5336 0.046 Uiso 1 1 calc R . .
H61B H -0.0134 0.8686 0.4488 0.046 Uiso 1 1 calc R . .
H61C H 0.0028 0.7639 0.5016 0.046 Uiso 1 1 calc R . .
C62 C -0.2451(2) 0.9189(2) 0.46375(13) 0.0383(6) Uani 1 1 d . B .
H62A H -0.3375 0.9041 0.4591 0.057 Uiso 1 1 calc R . .
H62B H -0.2251 0.9504 0.4189 0.057 Uiso 1 1 calc R . .
H62C H -0.2119 0.9745 0.5046 0.057 Uiso 1 1 calc R . .
C63A C -0.4831(2) 0.6802(2) 0.23689(13) 0.0345(6) Uani 0.5 1 d P A 1
C64A C -0.4212(5) 0.7781(5) 0.1931(3) 0.0459(8) Uani 0.5 1 d P A 1
H64A H -0.3498 0.7494 0.1743 0.069 Uiso 0.5 1 calc PR A 1
H64B H -0.3904 0.8462 0.2257 0.069 Uiso 0.5 1 calc PR A 1
H64C H -0.4853 0.7988 0.1526 0.069 Uiso 0.5 1 calc PR A 1
C65A C -0.5936(5) 0.7233(6) 0.2602(3) 0.0459(8) Uani 0.5 1 d P A 1
H65A H -0.6529 0.7447 0.2177 0.069 Uiso 0.5 1 calc PR A 1
H65B H -0.5659 0.791 0.2935 0.069 Uiso 0.5 1 calc PR A 1
H65C H -0.6361 0.6631 0.2849 0.069 Uiso 0.5 1 calc PR A 1
C66A C -0.5252(5) 0.5803(5) 0.1794(3) 0.0459(8) Uani 0.5 1 d P A 1
H66A H -0.5937 0.6024 0.1419 0.069 Uiso 0.5 1 calc PR A 1
H66B H -0.5558 0.512 0.2026 0.069 Uiso 0.5 1 calc PR A 1
H66C H -0.4528 0.5628 0.1572 0.069 Uiso 0.5 1 calc PR A 1
C63B C -0.4831(2) 0.6802(2) 0.23689(13) 0.0345(6) Uani 0.5 1 d P A 2
C64B C -0.5497(7) 0.7871(7) 0.2518(4) 0.0711(12) Uani 0.5 1 d P A 2
H64D H -0.492 0.8565 0.2502 0.107 Uiso 0.5 1 calc PR A 2
H64E H -0.5729 0.7838 0.2999 0.107 Uiso 0.5 1 calc PR A 2
H64F H -0.6266 0.7892 0.2147 0.107 Uiso 0.5 1 calc PR A 2
C65B C -0.5954(6) 0.5804(6) 0.2321(4) 0.0711(12) Uani 0.5 1 d P A 2
H65D H -0.6683 0.5981 0.1958 0.107 Uiso 0.5 1 calc PR A 2
H65E H -0.6207 0.5745 0.2795 0.107 Uiso 0.5 1 calc PR A 2
H65F H -0.5665 0.5072 0.2178 0.107 Uiso 0.5 1 calc PR A 2
C66B C -0.4391(6) 0.6800(7) 0.1721(4) 0.0711(12) Uani 0.5 1 d P A 2
H66D H -0.51 0.6871 0.1319 0.107 Uiso 0.5 1 calc PR A 2
H66E H -0.4017 0.6078 0.1651 0.107 Uiso 0.5 1 calc PR A 2
H66F H -0.3744 0.7451 0.1733 0.107 Uiso 0.5 1 calc PR A 2
C67 C -0.1749(2) 0.41025(18) 0.35364(12) 0.0285(5) Uani 1 1 d . B 2
H67A H -0.1674 0.3748 0.4013 0.034 Uiso 1 1 calc R B 2
H67B H -0.2334 0.3576 0.3175 0.034 Uiso 1 1 calc R B 2
N68 N -0.04748(17) 0.42239(15) 0.33263(9) 0.0265(4) Uani 1 1 d . B .
C73 C -0.0176(2) 0.30769(19) 0.30946(13) 0.0314(5) Uani 1 1 d . . .
H73A H -0.0876 0.2729 0.2709 0.038 Uiso 1 1 calc R B .
H73B H -0.0109 0.2572 0.3511 0.038 Uiso 1 1 calc R . .
C72 C 0.1062(2) 0.3150(2) 0.28106(13) 0.0373(6) Uani 1 1 d . B .
H72A H 0.1768 0.3472 0.3201 0.045 Uiso 1 1 calc R . .
H72B H 0.1242 0.2367 0.2664 0.045 Uiso 1 1 calc R . .
O71 O 0.09889(17) 0.38584(14) 0.22043(8) 0.0413(4) Uani 1 1 d . . .
C70 C 0.0730(3) 0.4974(2) 0.24223(14) 0.0392(6) Uani 1 1 d . B .
H70A H 0.069 0.5474 0.2004 0.047 Uiso 1 1 calc R . .
H70B H 0.1435 0.5309 0.2809 0.047 Uiso 1 1 calc R . .
C69 C -0.0499(2) 0.4957(2) 0.26980(12) 0.0330(6) Uani 1 1 d . . .
H69A H -0.0641 0.5752 0.2844 0.04 Uiso 1 1 calc R B .
H69B H -0.1212 0.466 0.2305 0.04 Uiso 1 1 calc R . .
O101 O 0.20640(15) 0.57914(14) 0.42480(9) 0.0396(4) Uani 1 1 d . B .
C102 C 0.1984(3) 0.6957(2) 0.40376(15) 0.0445(7) Uani 1 1 d . . .
H10D H 0.1139 0.721 0.4068 0.053 Uiso 1 1 calc R B .
H10E H 0.2134 0.7035 0.3535 0.053 Uiso 1 1 calc R . .
C103 C 0.2997(3) 0.7634(3) 0.45637(17) 0.0599(8) Uani 1 1 d . B .
H10F H 0.2711 0.7796 0.5027 0.072 Uiso 1 1 calc R . .
H10G H 0.3268 0.8371 0.4365 0.072 Uiso 1 1 calc R . .
C104 C 0.4059(3) 0.6844(3) 0.46671(16) 0.0600(9) Uani 1 1 d . . .
H10H H 0.4603 0.6984 0.5154 0.072 Uiso 1 1 calc R B .
H10I H 0.4595 0.6953 0.4293 0.072 Uiso 1 1 calc R . .
C105 C 0.3350(2) 0.5638(3) 0.45851(16) 0.0498(7) Uani 1 1 d . B .
H10J H 0.3736 0.5121 0.4276 0.06 Uiso 1 1 calc R . .
H10K H 0.3372 0.5305 0.5065 0.06 Uiso 1 1 calc R . .
C111 C 0.3515(3) -0.2165(4) -0.00570(19) 0.0907(13) Uani 1 1 d . . .
H11D H 0.4018 -0.2831 0.0053 0.109 Uiso 1 1 calc R . .
H11E H 0.4086 -0.1446 0.0069 0.109 Uiso 1 1 calc R . .
C112 C 0.2887(3) -0.2222(3) -0.08498(17) 0.0694(10) Uani 1 1 d . . .
H11F H 0.3008 -0.1465 -0.1064 0.083 Uiso 1 1 calc R . .
H11G H 0.3239 -0.2807 -0.113 0.083 Uiso 1 1 calc R . .
C113 C 0.1509(3) -0.2550(2) -0.08441(14) 0.0435(7) Uani 1 1 d . . .
H11I H 0.0962 -0.2223 -0.1256 0.052 Uiso 1 1 calc R . .
H11J H 0.132 -0.3398 -0.0876 0.052 Uiso 1 1 calc R . .
O114 O 0.13141(15) -0.20736(14) -0.01671(8) 0.0354(4) Uani 1 1 d . . .
C115 C 0.2446(2) -0.2196(2) 0.03551(14) 0.0413(6) Uani 1 1 d . . .
H11K H 0.2366 -0.2935 0.0594 0.05 Uiso 1 1 calc R . .
H11L H 0.2596 -0.1559 0.0732 0.05 Uiso 1 1 calc R . .
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'
O O 0.0106 0.006 '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
O2 Li1 O2 95.98(17) . 2
O2 Li1 O114 109.98(19) . .
O2 Li1 O114 118.85(19) 2 .
O2 Li1 N18 124.83(19) . 2
O2 Li1 N18 98.48(16) 2 2
O114 Li1 N18 108.51(17) . 2
O2 Li1 Li1 48.20(13) . 2
O2 Li1 Li1 47.78(12) 2 2
O114 Li1 Li1 128.0(2) . 2
N18 Li1 Li1 122.4(2) 2 2
O2 Li1 C17 110.22(16) . 2
O2 Li1 C17 70.92(12) 2 2
O114 Li1 C17 137.02(18) . 2
N18 Li1 C17 32.38(8) 2 2
Li1 Li1 C17 90.71(18) 2 2
C3 O2 Li1 142.63(17) . .
C3 O2 Li1 119.30(16) . 2
Li1 O2 Li1 84.02(17) . 2
O2 C3 C8 119.88(18) . .
O2 C3 C4 123.29(19) . .
C8 C3 C4 116.84(19) . .
C5 C4 C3 118.3(2) . .
C5 C4 C9 120.55(18) . .
C3 C4 C9 121.09(19) . .
C6 C5 C4 124.60(19) . .
C6 C5 H5 117.7 . .
C4 C5 H5 117.7 . .
C7 C6 C5 116.1(2) . .
C7 C6 C13 120.9(2) . .
C5 C6 C13 122.79(19) . .
C6 C7 C8 122.2(2) . .
C6 C7 H7 118.9 . .
C8 C7 H7 118.9 . .
C7 C8 C3 121.92(19) . .
C7 C8 C17 118.8(2) . .
C3 C8 C17 119.23(19) . .
C12 C9 C10 110.78(19) . .
C12 C9 C4 107.49(18) . .
C10 C9 C4 112.10(17) . .
C12 C9 C11 107.60(19) . .
C10 C9 C11 106.19(19) . .
C4 C9 C11 112.63(19) . .
C9 C10 H10A 109.5 . .
C9 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C9 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C9 C11 H11A 109.5 . .
C9 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
C9 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
C9 C12 H12A 109.5 . .
C9 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C9 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C15 C13 C14 108.99(19) . .
C15 C13 C16 107.62(19) . .
C14 C13 C16 108.5(2) . .
C15 C13 C6 112.07(19) . .
C14 C13 C6 108.29(18) . .
C16 C13 C6 111.31(19) . .
C13 C14 H14A 109.5 . .
C13 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C13 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C13 C15 H15A 109.5 . .
C13 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C13 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
C13 C16 H16A 109.5 . .
C13 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C13 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
N18 C17 C8 112.79(17) . .
N18 C17 Li1 53.80(12) . 2
C8 C17 Li1 91.74(15) . 2
N18 C17 H17A 109 . .
C8 C17 H17A 109 . .
Li1 C17 H17A 157.9 2 .
N18 C17 H17B 109 . .
C8 C17 H17B 109 . .
Li1 C17 H17B 70.7 2 .
H17A C17 H17B 107.8 . .
C19 N18 C23 107.05(17) . .
C19 N18 C17 107.99(17) . .
C23 N18 C17 110.36(17) . .
C19 N18 Li1 115.41(16) . 2
C23 N18 Li1 120.90(17) . 2
C17 N18 Li1 93.82(15) . 2
N18 C19 C20 110.89(19) . .
N18 C19 H19A 109.5 . .
C20 C19 H19A 109.5 . .
N18 C19 H19B 109.5 . .
C20 C19 H19B 109.5 . .
H19A C19 H19B 108.1 . .
O21 C20 C19 111.25(19) . .
O21 C20 H20A 109.4 . .
C19 C20 H20A 109.4 . .
O21 C20 H20B 109.4 . .
C19 C20 H20B 109.4 . .
H20A C20 H20B 108 . .
C22 O21 C20 108.23(17) . .
O21 C22 C23 111.8(2) . .
O21 C22 H22A 109.3 . .
C23 C22 H22A 109.3 . .
O21 C22 H22B 109.3 . .
C23 C22 H22B 109.3 . .
H22A C22 H22B 107.9 . .
N18 C23 C22 110.87(19) . .
N18 C23 H23A 109.5 . .
C22 C23 H23A 109.5 . .
N18 C23 H23B 109.5 . .
C22 C23 H23B 109.5 . .
H23A C23 H23B 108.1 . .
O52 Li51 O52 95.51(18) 2_566 .
O52 Li51 O101 110.9(2) 2_566 .
O52 Li51 O101 118.8(2) . .
O52 Li51 N68 130.4(2) 2_566 .
O52 Li51 N68 98.11(17) . .
O101 Li51 N68 103.52(18) . .
O52 Li51 Li51 48.42(13) 2_566 2_566
O52 Li51 Li51 47.09(13) . 2_566
O101 Li51 Li51 128.6(3) . 2_566
N68 Li51 Li51 125.6(2) . 2_566
O52 Li51 C67 113.96(18) 2_566 .
O52 Li51 C67 71.39(13) . .
O101 Li51 C67 132.61(19) . .
N68 Li51 C67 32.46(8) . .
Li51 Li51 C67 93.4(2) 2_566 .
C53 O52 Li51 141.99(18) . 2_566
C53 O52 Li51 121.22(17) . .
Li51 O52 Li51 84.49(18) 2_566 .
O52 C53 C58 119.26(18) . .
O52 C53 C54 123.78(19) . .
C58 C53 C54 116.96(19) . .
C55 C54 C53 118.73(19) . .
C55 C54 C59 120.77(18) . .
C53 C54 C59 120.40(18) . .
C54 C55 C56 124.56(19) . .
C54 C55 H55 117.7 . .
C56 C55 H55 117.7 . .
C57 C56 C55 115.6(2) . .
C57 C56 C63A 121.8(2) . .
C55 C56 C63A 122.49(19) . .
C56 C57 C58 122.8(2) . .
C56 C57 H57 118.6 . .
C58 C57 H57 118.6 . .
C57 C58 C53 121.30(19) . .
C57 C58 C67 118.75(19) . .
C53 C58 C67 119.79(19) . .
C60 C59 C61 109.56(18) . .
C60 C59 C62 107.09(19) . .
C61 C59 C62 107.88(19) . .
C60 C59 C54 107.65(18) . .
C61 C59 C54 112.02(18) . .
C62 C59 C54 112.52(18) . .
C59 C60 H60A 109.5 . .
C59 C60 H60B 109.5 . .
H60A C60 H60B 109.5 . .
C59 C60 H60C 109.5 . .
H60A C60 H60C 109.5 . .
H60B C60 H60C 109.5 . .
C59 C61 H61A 109.5 . .
C59 C61 H61B 109.5 . .
H61A C61 H61B 109.5 . .
C59 C61 H61C 109.5 . .
H61A C61 H61C 109.5 . .
H61B C61 H61C 109.5 . .
C59 C62 H62A 109.5 . .
C59 C62 H62B 109.5 . .
H62A C62 H62B 109.5 . .
C59 C62 H62C 109.5 . .
H62A C62 H62C 109.5 . .
H62B C62 H62C 109.5 . .
C65A C63A C56 113.6(3) . .
C65A C63A C66A 110.5(4) . .
C56 C63A C66A 114.0(3) . .
C65A C63A C64A 107.9(4) . .
C56 C63A C64A 107.0(3) . .
C66A C63A C64A 103.2(3) . .
H64D C64B H64E 109.5 . .
H64D C64B H64F 109.5 . .
H64E C64B H64F 109.5 . .
H65D C65B H65E 109.5 . .
H65D C65B H65F 109.5 . .
H65E C65B H65F 109.5 . .
H66D C66B H66E 109.5 . .
H66D C66B H66F 109.5 . .
H66E C66B H66F 109.5 . .
N68 C67 C58 113.09(18) . .
N68 C67 Li51 54.20(13) . .
C58 C67 Li51 92.68(15) . .
N68 C67 H67A 109 . .
C58 C67 H67A 109 . .
Li51 C67 H67A 69.7 . .
N68 C67 H67B 109 . .
C58 C67 H67B 109 . .
Li51 C67 H67B 157.4 . .
H67A C67 H67B 107.8 . .
C73 N68 C69 107.21(17) . .
C73 N68 C67 108.46(17) . .
C69 N68 C67 110.13(17) . .
C73 N68 Li51 117.01(16) . .
C69 N68 Li51 119.39(17) . .
C67 N68 Li51 93.34(16) . .
N68 C73 C72 111.33(19) . .
N68 C73 H73A 109.4 . .
C72 C73 H73A 109.4 . .
N68 C73 H73B 109.4 . .
C72 C73 H73B 109.4 . .
H73A C73 H73B 108 . .
O71 C72 C73 110.67(19) . .
O71 C72 H72A 109.5 . .
C73 C72 H72A 109.5 . .
O71 C72 H72B 109.5 . .
C73 C72 H72B 109.5 . .
H72A C72 H72B 108.1 . .
C70 O71 C72 108.81(17) . .
O71 C70 C69 112.3(2) . .
O71 C70 H70A 109.2 . .
C69 C70 H70A 109.2 . .
O71 C70 H70B 109.2 . .
C69 C70 H70B 109.2 . .
H70A C70 H70B 107.9 . .
N68 C69 C70 110.83(19) . .
N68 C69 H69A 109.5 . .
C70 C69 H69A 109.5 . .
N68 C69 H69B 109.5 . .
C70 C69 H69B 109.5 . .
H69A C69 H69B 108.1 . .
C102 O101 C105 109.81(19) . .
C102 O101 Li51 117.65(18) . .
C105 O101 Li51 126.57(19) . .
O101 C102 C103 104.4(2) . .
O101 C102 H10D 110.9 . .
C103 C102 H10D 110.9 . .
O101 C102 H10E 110.9 . .
C103 C102 H10E 110.9 . .
H10D C102 H10E 108.9 . .
C102 C103 C104 102.7(2) . .
C102 C103 H10F 111.2 . .
C104 C103 H10F 111.2 . .
C102 C103 H10G 111.2 . .
C104 C103 H10G 111.2 . .
H10F C103 H10G 109.1 . .
C103 C104 C105 103.5(2) . .
C103 C104 H10H 111.1 . .
C105 C104 H10H 111.1 . .
C103 C104 H10I 111.1 . .
C105 C104 H10I 111.1 . .
H10H C104 H10I 109 . .
O101 C105 C104 105.4(2) . .
O101 C105 H10J 110.7 . .
C104 C105 H10J 110.7 . .
O101 C105 H10K 110.7 . .
C104 C105 H10K 110.7 . .
H10J C105 H10K 108.8 . .
C115 C111 C112 105.3(2) . .
C115 C111 H11D 110.7 . .
C112 C111 H11D 110.7 . .
C115 C111 H11E 110.7 . .
C112 C111 H11E 110.7 . .
H11D C111 H11E 108.8 . .
C113 C112 C111 104.2(2) . .
C113 C112 H11F 110.9 . .
C111 C112 H11F 110.9 . .
C113 C112 H11G 110.9 . .
C111 C112 H11G 110.9 . .
H11F C112 H11G 108.9 . .
O114 C113 C112 104.5(2) . .
O114 C113 H11I 110.8 . .
C112 C113 H11I 110.8 . .
O114 C113 H11J 110.8 . .
C112 C113 H11J 110.8 . .
H11I C113 H11J 108.9 . .
C113 O114 C115 106.73(17) . .
C113 O114 Li1 125.27(18) . .
C115 O114 Li1 126.45(17) . .
O114 C115 C111 106.4(2) . .
O114 C115 H11K 110.4 . .
C111 C115 H11K 110.4 . .
O114 C115 H11L 110.4 . .
C111 C115 H11L 110.4 . .
H11K C115 H11L 108.6 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Li1 O2 1.918(4) .
Li1 O2 1.931(4) 2
Li1 O114 1.968(4) .
Li1 N18 2.252(4) 2
Li1 Li1 2.576(7) 2
Li1 C17 2.784(4) 2
O2 C3 1.331(2) .
O2 Li1 1.931(4) 2
C3 C8 1.416(3) .
C3 C4 1.429(3) .
C4 C5 1.405(3) .
C4 C9 1.540(3) .
C5 C6 1.390(3) .
C5 H5 0.95 .
C6 C7 1.382(3) .
C6 C13 1.547(3) .
C7 C8 1.388(3) .
C7 H7 0.95 .
C8 C17 1.508(3) .
C9 C12 1.529(3) .
C9 C10 1.538(3) .
C9 C11 1.542(3) .
C10 H10A 0.98 .
C10 H10B 0.98 .
C10 H10C 0.98 .
C11 H11A 0.98 .
C11 H11B 0.98 .
C11 H11C 0.98 .
C12 H12A 0.98 .
C12 H12B 0.98 .
C12 H12C 0.98 .
C13 C15 1.525(3) .
C13 C14 1.538(3) .
C13 C16 1.542(3) .
C14 H14A 0.98 .
C14 H14B 0.98 .
C14 H14C 0.98 .
C15 H15A 0.98 .
C15 H15B 0.98 .
C15 H15C 0.98 .
C16 H16A 0.98 .
C16 H16B 0.98 .
C16 H16C 0.98 .
C17 N18 1.494(3) .
C17 Li1 2.784(4) 2
C17 H17A 0.99 .
C17 H17B 0.99 .
N18 C19 1.467(3) .
N18 C23 1.481(3) .
N18 Li1 2.252(4) 2
C19 C20 1.516(3) .
C19 H19A 0.99 .
C19 H19B 0.99 .
C20 O21 1.426(3) .
C20 H20A 0.99 .
C20 H20B 0.99 .
O21 C22 1.423(3) .
C22 C23 1.508(3) .
C22 H22A 0.99 .
C22 H22B 0.99 .
C23 H23A 0.99 .
C23 H23B 0.99 .
Li51 O52 1.889(4) 2_566
Li51 O52 1.929(4) .
Li51 O101 1.958(4) .
Li51 N68 2.248(4) .
Li51 Li51 2.567(8) 2_566
Li51 C67 2.768(5) .
O52 C53 1.333(2) .
O52 Li51 1.889(4) 2_566
C53 C58 1.420(3) .
C53 C54 1.429(3) .
C54 C55 1.396(3) .
C54 C59 1.546(3) .
C55 C56 1.399(3) .
C55 H55 0.95 .
C56 C57 1.384(3) .
C56 C63A 1.534(3) .
C57 C58 1.391(3) .
C57 H57 0.95 .
C58 C67 1.504(3) .
C59 C60 1.526(3) .
C59 C61 1.532(3) .
C59 C62 1.534(3) .
C60 H60A 0.98 .
C60 H60B 0.98 .
C60 H60C 0.98 .
C61 H61A 0.98 .
C61 H61B 0.98 .
C61 H61C 0.98 .
C62 H62A 0.98 .
C62 H62B 0.98 .
C62 H62C 0.98 .
C63A C65A 1.459(6) .
C63A C66A 1.539(6) .
C63A C64A 1.597(6) .
C64A H64A 0.98 .
C64A H64B 0.98 .
C64A H64C 0.98 .
C65A H65A 0.98 .
C65A H65B 0.98 .
C65A H65C 0.98 .
C66A H66A 0.98 .
C66A H66B 0.98 .
C66A H66C 0.98 .
C64B H64D 0.98 .
C64B H64E 0.98 .
C64B H64F 0.98 .
C65B H65D 0.98 .
C65B H65E 0.98 .
C65B H65F 0.98 .
C66B H66D 0.98 .
C66B H66E 0.98 .
C66B H66F 0.98 .
C67 N68 1.488(3) .
C67 H67A 0.99 .
C67 H67B 0.99 .
N68 C73 1.473(3) .
N68 C69 1.477(3) .
C73 C72 1.516(3) .
C73 H73A 0.99 .
C73 H73B 0.99 .
C72 O71 1.423(3) .
C72 H72A 0.99 .
C72 H72B 0.99 .
O71 C70 1.417(3) .
C70 C69 1.502(3) .
C70 H70A 0.99 .
C70 H70B 0.99 .
C69 H69A 0.99 .
C69 H69B 0.99 .
O101 C102 1.434(3) .
O101 C105 1.439(3) .
C102 C103 1.477(4) .
C102 H10D 0.99 .
C102 H10E 0.99 .
C103 C104 1.518(4) .
C103 H10F 0.99 .
C103 H10G 0.99 .
C104 C105 1.528(4) .
C104 H10H 0.99 .
C104 H10I 0.99 .
C105 H10J 0.99 .
C105 H10K 0.99 .
C111 C115 1.495(4) .
C111 C112 1.512(4) .
C111 H11D 0.99 .
C111 H11E 0.99 .
C112 C113 1.498(4) .
C112 H11F 0.99 .
C112 H11G 0.99 .
C113 O114 1.426(3) .
C113 H11I 0.99 .
C113 H11J 0.99 .
O114 C115 1.436(3) .
C115 H11K 0.99 .
C115 H11L 0.99 .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
O2 Li1 O2 C3 -132.3(3) 2 .
O114 Li1 O2 C3 -8.7(4) . .
N18 Li1 O2 C3 123.0(3) 2 .
Li1 Li1 O2 C3 -132.4(3) 2 .
C17 Li1 O2 C3 155.8(2) 2 .
O2 Li1 O2 Li1 0 2 2
O114 Li1 O2 Li1 123.7(2) . 2
N18 Li1 O2 Li1 -104.7(3) 2 2
C17 Li1 O2 Li1 -71.83(15) 2 2
Li1 O2 C3 C8 78.0(3) . .
Li1 O2 C3 C8 -44.5(3) 2 .
Li1 O2 C3 C4 -102.2(3) . .
Li1 O2 C3 C4 135.2(2) 2 .
O2 C3 C4 C5 178.36(18) . .
C8 C3 C4 C5 -1.9(3) . .
O2 C3 C4 C9 1.5(3) . .
C8 C3 C4 C9 -178.74(18) . .
C3 C4 C5 C6 0.1(3) . .
C9 C4 C5 C6 177.04(19) . .
C4 C5 C6 C7 1.4(3) . .
C4 C5 C6 C13 175.87(19) . .
C5 C6 C7 C8 -1.2(3) . .
C13 C6 C7 C8 -175.8(2) . .
C6 C7 C8 C3 -0.6(3) . .
C6 C7 C8 C17 176.01(19) . .
O2 C3 C8 C7 -178.10(19) . .
C4 C3 C8 C7 2.1(3) . .
O2 C3 C8 C17 5.3(3) . .
C4 C3 C8 C17 -174.46(18) . .
C5 C4 C9 C12 -106.2(2) . .
C3 C4 C9 C12 70.6(2) . .
C5 C4 C9 C10 131.8(2) . .
C3 C4 C9 C10 -51.4(3) . .
C5 C4 C9 C11 12.1(3) . .
C3 C4 C9 C11 -171.0(2) . .
C7 C6 C13 C15 -166.0(2) . .
C5 C6 C13 C15 19.7(3) . .
C7 C6 C13 C14 73.7(3) . .
C5 C6 C13 C14 -100.5(2) . .
C7 C6 C13 C16 -45.5(3) . .
C5 C6 C13 C16 140.3(2) . .
C7 C8 C17 N18 -105.9(2) . .
C3 C8 C17 N18 70.8(3) . .
C7 C8 C17 Li1 -157.00(19) . 2
C3 C8 C17 Li1 19.7(2) . 2
C8 C17 N18 C19 167.17(18) . .
Li1 C17 N18 C19 -118.29(18) 2 .
C8 C17 N18 C23 50.5(2) . .
Li1 C17 N18 C23 125.01(19) 2 .
C8 C17 N18 Li1 -74.5(2) . 2
C23 N18 C19 C20 -56.6(2) . .
C17 N18 C19 C20 -175.44(19) . .
Li1 N18 C19 C20 81.2(2) 2 .
N18 C19 C20 O21 60.5(3) . .
C19 C20 O21 C22 -59.6(3) . .
C20 O21 C22 C23 59.5(3) . .
C19 N18 C23 C22 56.2(2) . .
C17 N18 C23 C22 173.46(19) . .
Li1 N18 C23 C22 -78.8(2) 2 .
O21 C22 C23 N18 -59.6(3) . .
O52 Li51 O52 C53 -150.13(19) 2_566 .
O101 Li51 O52 C53 92.4(3) . .
N68 Li51 O52 C53 -18.0(2) . .
Li51 Li51 O52 C53 -150.13(19) 2_566 .
C67 Li51 O52 C53 -36.68(18) . .
O52 Li51 O52 Li51 0 2_566 2_566
O101 Li51 O52 Li51 -117.5(3) . 2_566
N68 Li51 O52 Li51 132.1(2) . 2_566
C67 Li51 O52 Li51 113.45(17) . 2_566
Li51 O52 C53 C58 -85.9(3) 2_566 .
Li51 O52 C53 C58 40.5(3) . .
Li51 O52 C53 C54 94.7(3) 2_566 .
Li51 O52 C53 C54 -138.9(2) . .
O52 C53 C54 C55 178.24(19) . .
C58 C53 C54 C55 -1.2(3) . .
O52 C53 C54 C59 -5.3(3) . .
C58 C53 C54 C59 175.35(19) . .
C53 C54 C55 C56 1.6(3) . .
C59 C54 C55 C56 -174.9(2) . .
C54 C55 C56 C57 -0.5(3) . .
C54 C55 C56 C63A -178.4(2) . .
C55 C56 C57 C58 -0.9(3) . .
C63A C56 C57 C58 176.9(2) . .
C56 C57 C58 C53 1.3(3) . .
C56 C57 C58 C67 -174.1(2) . .
O52 C53 C58 C57 -179.64(19) . .
C54 C53 C58 C57 -0.2(3) . .
O52 C53 C58 C67 -4.3(3) . .
C54 C53 C58 C67 175.16(19) . .
C55 C54 C59 C60 111.5(2) . .
C53 C54 C59 C60 -65.0(2) . .
C55 C54 C59 C61 -128.0(2) . .
C53 C54 C59 C61 55.5(3) . .
C55 C54 C59 C62 -6.3(3) . .
C53 C54 C59 C62 177.3(2) . .
C57 C56 C63A C65A 127.8(4) . .
C55 C56 C63A C65A -54.5(4) . .
C57 C56 C63A C66A 0.2(4) . .
C55 C56 C63A C66A 177.9(3) . .
C57 C56 C63A C64A -113.2(3) . .
C55 C56 C63A C64A 64.5(3) . .
C57 C58 C67 N68 105.2(2) . .
C53 C58 C67 N68 -70.3(3) . .
C57 C58 C67 Li51 157.1(2) . .
C53 C58 C67 Li51 -18.4(2) . .
O52 Li51 C67 N68 -128.4(2) 2_566 .
O52 Li51 C67 N68 143.77(19) . .
O101 Li51 C67 N68 31.4(2) . .
Li51 Li51 C67 N68 -173.9(2) 2_566 .
O52 Li51 C67 C58 114.8(2) 2_566 .
O52 Li51 C67 C58 27.00(15) . .
O101 Li51 C67 C58 -85.4(3) . .
N68 Li51 C67 C58 -116.77(19) . .
Li51 Li51 C67 C58 69.3(2) 2_566 .
C58 C67 N68 C73 -164.23(18) . .
Li51 C67 N68 C73 119.94(19) . .
C58 C67 N68 C69 -47.2(2) . .
Li51 C67 N68 C69 -123.02(19) . .
C58 C67 N68 Li51 75.8(2) . .
O52 Li51 N68 C73 -42.8(3) 2_566 .
O52 Li51 N68 C73 -147.15(17) . .
O101 Li51 N68 C73 90.5(2) . .
Li51 Li51 N68 C73 -105.2(3) 2_566 .
C67 Li51 N68 C73 -112.7(2) . .
O52 Li51 N68 C69 -174.7(2) 2_566 .
O52 Li51 N68 C69 80.9(2) . .
O101 Li51 N68 C69 -41.4(2) . .
Li51 Li51 N68 C69 122.9(3) 2_566 .
C67 Li51 N68 C69 115.4(2) . .
O52 Li51 N68 C67 69.9(3) 2_566 .
O52 Li51 N68 C67 -34.46(18) . .
O101 Li51 N68 C67 -156.80(17) . .
Li51 Li51 N68 C67 7.5(3) 2_566 .
C69 N68 C73 C72 56.2(2) . .
C67 N68 C73 C72 175.11(18) . .
Li51 N68 C73 C72 -81.1(2) . .
N68 C73 C72 O71 -59.8(3) . .
C73 C72 O71 C70 59.2(3) . .
C72 O71 C70 C69 -59.6(3) . .
C73 N68 C69 C70 -55.4(2) . .
C67 N68 C69 C70 -173.20(19) . .
Li51 N68 C69 C70 80.7(2) . .
O71 C70 C69 N68 59.1(3) . .
O52 Li51 O101 C102 -131.1(2) 2_566 .
O52 Li51 O101 C102 -22.0(3) . .
N68 Li51 O101 C102 85.3(2) . .
Li51 Li51 O101 C102 -78.3(3) 2_566 .
C67 Li51 O101 C102 68.6(3) . .
O52 Li51 O101 C105 18.8(3) 2_566 .
O52 Li51 O101 C105 127.9(2) . .
N68 Li51 O101 C105 -124.8(2) . .
Li51 Li51 O101 C105 71.6(4) 2_566 .
C67 Li51 O101 C105 -141.5(2) . .
C105 O101 C102 C103 -28.8(3) . .
Li51 O101 C102 C103 125.8(2) . .
O101 C102 C103 C104 37.8(3) . .
C102 C103 C104 C105 -32.8(3) . .
C102 O101 C105 C104 7.4(3) . .
Li51 O101 C105 C104 -144.4(2) . .
C103 C104 C105 O101 16.1(3) . .
C115 C111 C112 C113 -12.5(4) . .
C111 C112 C113 O114 30.1(3) . .
C112 C113 O114 C115 -37.1(3) . .
C112 C113 O114 Li1 129.4(2) . .
O2 Li1 O114 C113 -147.2(2) . .
O2 Li1 O114 C113 -38.1(3) 2 .
N18 Li1 O114 C113 73.1(3) 2 .
Li1 Li1 O114 C113 -95.3(3) 2 .
C17 Li1 O114 C113 54.4(3) 2 .
O2 Li1 O114 C115 16.6(3) . .
O2 Li1 O114 C115 125.7(2) 2 .
N18 Li1 O114 C115 -123.1(2) 2 .
Li1 Li1 O114 C115 68.6(4) 2 .
C17 Li1 O114 C115 -141.8(2) 2 .
C113 O114 C115 C111 29.0(3) . .
Li1 O114 C115 C111 -137.3(3) . .
C112 C111 C115 O114 -9.3(4) . .
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1 PubChem 139160044
