#------------------------------------------------------------------------------
#$Date: 2016-03-23 16:44:02 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179391 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/88/4328872.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_4328872
loop_
_publ_author_name
'Shivaiah Vaddypally'
'Sandeep K. Kondaveeti'
'Michael J. Zdilla'
_publ_section_title
;
 Synthesis of a High-Valent, Four-Coordinate Manganese Cubane Cluster with
 a Pendant Mn Atom: Photosystem II-Inspired Manganese-Nitrogen Clusters
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3950
_journal_page_last               3952
_journal_paper_doi               10.1021/ic300502s
_journal_volume                  51
_journal_year                    2012
_chemical_formula_moiety         'C40 H86 Cl2 Li6 Mn2 N8 O4'
_chemical_formula_sum            'C40 H86 Cl2 Li6 Mn2 N8 O4'
_chemical_formula_weight         965.59
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 104.400(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.202(3)
_cell_length_b                   19.053(4)
_cell_length_c                   20.245(4)
_cell_measurement_reflns_used    9999
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      27.848
_cell_measurement_theta_min      2.192
_cell_volume                     5680(2)
_computing_cell_refinement       'SAINT (Bruker AXS)'
_computing_data_collection       'COSMO (Bruker AXS)'
_computing_data_reduction        'SADABS (Bruker AXS)'
_computing_molecular_graphics    'XP (Sheldrick, 2008)'
_computing_publication_material  'APEX2 (Bruker AXS)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 8.333
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  'Bruker Kappa APEX II DUO'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0256
_diffrn_reflns_av_sigmaI/netI    0.0243
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            65319
_diffrn_reflns_theta_full        27.86
_diffrn_reflns_theta_max         27.86
_diffrn_reflns_theta_min         1.38
_exptl_absorpt_coefficient_mu    0.578
_exptl_absorpt_correction_T_max  0.9444
_exptl_absorpt_correction_T_min  0.8017
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
66447 Corrected reflections written to file  
Estimated minimum and maximum transmission:  0.6568  0.7456
The ratio of these values is more reliable than their absolute values!
Additional spherical absorption correction applied with mu*r =  0.2000
Lambda/2 correction factor = 0.0015
;
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.129
_exptl_crystal_description       plate
_exptl_crystal_F_000             2064
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.742
_refine_diff_density_min         -0.807
_refine_diff_density_rms         0.072
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     569
_refine_ls_number_reflns         13372
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.068
_refine_ls_R_factor_all          0.0754
_refine_ls_R_factor_gt           0.0520
_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)+(0.0575P)²+7.9095P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1278
_refine_ls_wR_factor_ref         0.1480
_reflns_number_gt                10204
_reflns_number_total             13372
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic300502s_si_002_4.cif
_cod_data_source_block           2
_cod_original_cell_volume        5679.6(19)
_cod_database_code               4328872
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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
Mn1 Mn 0.33318(3) 0.625691(19) 0.05458(2) 0.02950(10) Uani 1 1 d . . .
Mn5 Mn 0.15498(3) 0.39452(2) 0.416862(19) 0.03007(10) Uani 1 1 d . . .
Li2 Li 0.4628(3) 0.5686(2) 0.0153(2) 0.0364(10) Uani 1 1 d . . .
Li3 Li 0.2707(3) 0.5323(2) -0.0350(2) 0.0366(10) Uani 1 1 d . . .
Li4 Li 0.3656(4) 0.5025(2) 0.1057(2) 0.0397(10) Uani 1 1 d . . .
Li6 Li 0.0312(3) 0.4691(2) 0.4446(2) 0.0342(9) Uani 1 1 d . . .
Li7 Li 0.1197(3) 0.3501(2) 0.5271(2) 0.0346(9) Uani 1 1 d . . .
Li8 Li 0.2242(4) 0.4788(3) 0.5148(2) 0.0418(11) Uani 1 1 d . . .
N1 N 0.30660(17) 0.70036(12) 0.07449(12) 0.0391(5) Uani 1 1 d . . .
N2 N 0.25318(15) 0.55962(11) 0.05923(11) 0.0331(5) Uani 1 1 d . . .
N3 N 0.43699(16) 0.59412(11) 0.10682(11) 0.0340(5) Uani 1 1 d . . .
N4 N 0.34612(15) 0.62145(10) -0.03026(11) 0.0300(4) Uani 1 1 d . . .
N5 N 0.17781(17) 0.36346(15) 0.35175(12) 0.0436(6) Uani 1 1 d . . .
N6 N 0.23477(15) 0.37313(11) 0.49391(11) 0.0321(5) Uani 1 1 d . . .
N7 N 0.14833(15) 0.48776(12) 0.41676(11) 0.0337(5) Uani 1 1 d . . .
N8 N 0.04863(14) 0.36544(10) 0.42789(10) 0.0276(4) Uani 1 1 d . . .
O3 O 0.17334(16) 0.49095(11) -0.10366(11) 0.0516(6) Uani 1 1 d . . .
O4 O 0.3741(2) 0.42997(11) 0.17199(12) 0.0636(7) Uani 1 1 d . . .
O7 O 0.11310(16) 0.27925(10) 0.59433(10) 0.0428(5) Uani 1 1 d . A .
O8 O 0.31340(19) 0.53875(13) 0.57081(12) 0.0640(7) Uani 1 1 d . . .
Cl1 Cl 0.60426(5) 0.55383(3) -0.00439(3) 0.03637(15) Uani 1 1 d . . .
Cl2 Cl -0.09926(5) 0.53354(3) 0.42588(3) 0.03415(14) Uani 1 1 d . . .
C21 C 0.1653(2) 0.56491(15) 0.07623(15) 0.0398(6) Uani 1 1 d . . .
C22 C 0.1296(2) 0.48975(18) 0.0780(2) 0.0583(9) Uani 1 1 d . . .
H22A H 0.1231 0.4677 0.0333 0.087 Uiso 1 1 calc R . .
H22B H 0.0704 0.4910 0.0890 0.087 Uiso 1 1 calc R . .
H22C H 0.1724 0.4626 0.1127 0.087 Uiso 1 1 calc R . .
C23 C 0.1756(2) 0.6002(2) 0.14607(17) 0.0547(9) Uani 1 1 d . . .
H23A H 0.1983 0.6481 0.1445 0.082 Uiso 1 1 calc R . .
H23B H 0.2187 0.5733 0.1810 0.082 Uiso 1 1 calc R . .
H23C H 0.1165 0.6015 0.1572 0.082 Uiso 1 1 calc R . .
C24 C 0.0984(2) 0.60739(17) 0.02156(17) 0.0463(7) Uani 1 1 d . . .
H24A H 0.0915 0.5849 -0.0230 0.069 Uiso 1 1 calc R . .
H24B H 0.1217 0.6551 0.0200 0.069 Uiso 1 1 calc R . .
H24C H 0.0394 0.6093 0.0328 0.069 Uiso 1 1 calc R . .
C31 C 0.5027(2) 0.62598(15) 0.16436(14) 0.0401(6) Uani 1 1 d . . .
C32 C 0.5721(2) 0.56844(19) 0.19427(18) 0.0583(9) Uani 1 1 d . . .
H32A H 0.5411 0.5295 0.2106 0.087 Uiso 1 1 calc R . .
H32B H 0.6187 0.5877 0.2324 0.087 Uiso 1 1 calc R . .
H32C H 0.6006 0.5514 0.1589 0.087 Uiso 1 1 calc R . .
C33 C 0.4561(3) 0.6513(2) 0.21875(16) 0.0575(9) Uani 1 1 d . . .
H33A H 0.4250 0.6118 0.2341 0.086 Uiso 1 1 calc R . .
H33B H 0.4117 0.6878 0.1995 0.086 Uiso 1 1 calc R . .
H33C H 0.5017 0.6705 0.2575 0.086 Uiso 1 1 calc R . .
C34 C 0.5521(2) 0.68680(17) 0.13927(17) 0.0520(8) Uani 1 1 d . . .
H34A H 0.5083 0.7238 0.1203 0.078 Uiso 1 1 calc R . .
H34B H 0.5807 0.6697 0.1040 0.078 Uiso 1 1 calc R . .
H34C H 0.5988 0.7057 0.1776 0.078 Uiso 1 1 calc R . .
C35 C 0.1348(2) 0.51552(18) -0.17152(16) 0.0512(8) Uani 1 1 d . . .
H35A H 0.1561 0.5636 -0.1778 0.061 Uiso 1 1 calc R . .
H35B H 0.0677 0.5155 -0.1819 0.061 Uiso 1 1 calc R . .
C36 C 0.1685(3) 0.46361(19) -0.21643(18) 0.0572(9) Uani 1 1 d . . .
H36A H 0.2309 0.4750 -0.2194 0.069 Uiso 1 1 calc R . .
H36B H 0.1279 0.4622 -0.2630 0.069 Uiso 1 1 calc R . .
C37 C 0.1658(3) 0.39435(19) -0.1787(2) 0.0649(10) Uani 1 1 d . . .
H37A H 0.1110 0.3670 -0.2007 0.078 Uiso 1 1 calc R . .
H37B H 0.2203 0.3657 -0.1784 0.078 Uiso 1 1 calc R . .
C38 C 0.1639(3) 0.41514(17) -0.10655(18) 0.0584(9) Uani 1 1 d . . .
H38A H 0.1059 0.4008 -0.0968 0.070 Uiso 1 1 calc R . .
H38B H 0.2145 0.3926 -0.0729 0.070 Uiso 1 1 calc R . .
C41 C 0.3398(2) 0.67700(14) -0.08101(14) 0.0371(6) Uani 1 1 d . . .
C42 C 0.2456(2) 0.71007(17) -0.09910(17) 0.0516(8) Uani 1 1 d . . .
H42A H 0.2336 0.7319 -0.0584 0.077 Uiso 1 1 calc R . .
H42B H 0.2000 0.6737 -0.1162 0.077 Uiso 1 1 calc R . .
H42C H 0.2426 0.7458 -0.1344 0.077 Uiso 1 1 calc R . .
C43 C 0.3584(3) 0.64282(17) -0.14525(16) 0.0499(8) Uani 1 1 d . . .
H43A H 0.3128 0.6064 -0.1622 0.075 Uiso 1 1 calc R . .
H43B H 0.4191 0.6217 -0.1338 0.075 Uiso 1 1 calc R . .
H43C H 0.3551 0.6786 -0.1805 0.075 Uiso 1 1 calc R . .
C44 C 0.4117(2) 0.73395(17) -0.05501(18) 0.0525(8) Uani 1 1 d . . .
H44A H 0.4005 0.7560 -0.0141 0.079 Uiso 1 1 calc R . .
H44B H 0.4083 0.7696 -0.0905 0.079 Uiso 1 1 calc R . .
H44C H 0.4723 0.7126 -0.0438 0.079 Uiso 1 1 calc R . .
C45 C 0.3583(4) 0.4368(2) 0.23855(18) 0.0724(12) Uani 1 1 d . . .
H45A H 0.3032 0.4653 0.2366 0.087 Uiso 1 1 calc R . .
H45B H 0.4107 0.4597 0.2701 0.087 Uiso 1 1 calc R . .
C46 C 0.3457(3) 0.3631(2) 0.26197(19) 0.0645(10) Uani 1 1 d . . .
H46A H 0.3823 0.3552 0.3092 0.077 Uiso 1 1 calc R . .
H46B H 0.2811 0.3536 0.2600 0.077 Uiso 1 1 calc R . .
C47 C 0.3779(5) 0.3185(2) 0.2133(2) 0.108(2) Uani 1 1 d . . .
H47A H 0.4419 0.3047 0.2328 0.130 Uiso 1 1 calc R . .
H47B H 0.3407 0.2753 0.2036 0.130 Uiso 1 1 calc R . .
C48 C 0.3707(4) 0.35672(17) 0.1533(2) 0.0717(12) Uani 1 1 d . . .
H48A H 0.3126 0.3459 0.1199 0.086 Uiso 1 1 calc R . .
H48B H 0.4213 0.3450 0.1325 0.086 Uiso 1 1 calc R . .
C61 C 0.3165(2) 0.32957(17) 0.50634(14) 0.0411(6) Uani 1 1 d . . .
C62 C 0.3860(2) 0.3608(3) 0.47142(19) 0.0660(11) Uani 1 1 d . . .
H62A H 0.4002 0.4090 0.4874 0.099 Uiso 1 1 calc R . .
H62B H 0.3607 0.3609 0.4219 0.099 Uiso 1 1 calc R . .
H62C H 0.4415 0.3325 0.4826 0.099 Uiso 1 1 calc R . .
C63 C 0.2931(3) 0.25380(19) 0.4818(2) 0.0622(10) Uani 1 1 d . . .
H63A H 0.2667 0.2537 0.4325 0.093 Uiso 1 1 calc R . .
H63B H 0.2493 0.2342 0.5051 0.093 Uiso 1 1 calc R . .
H63C H 0.3485 0.2253 0.4923 0.093 Uiso 1 1 calc R . .
C64 C 0.3578(2) 0.32834(19) 0.58362(16) 0.0491(7) Uani 1 1 d . . .
H64A H 0.3730 0.3763 0.6000 0.074 Uiso 1 1 calc R . .
H64B H 0.4129 0.2995 0.5938 0.074 Uiso 1 1 calc R . .
H64C H 0.3137 0.3084 0.6065 0.074 Uiso 1 1 calc R . .
C71 C 0.1572(2) 0.53969(18) 0.36523(15) 0.0502(8) Uani 1 1 d . . .
C72 C 0.1316(3) 0.61140(19) 0.3896(2) 0.0692(12) Uani 1 1 d . . .
H72A H 0.1731 0.6229 0.4336 0.104 Uiso 1 1 calc R . .
H72B H 0.0691 0.6097 0.3947 0.104 Uiso 1 1 calc R . .
H72C H 0.1361 0.6474 0.3561 0.104 Uiso 1 1 calc R . .
C73 C 0.0919(3) 0.5225(3) 0.29646(19) 0.0928(18) Uani 1 1 d . . .
H73A H 0.1078 0.4768 0.2805 0.139 Uiso 1 1 calc R . .
H73B H 0.0966 0.5588 0.2632 0.139 Uiso 1 1 calc R . .
H73C H 0.0296 0.5210 0.3017 0.139 Uiso 1 1 calc R . .
C74 C 0.2548(3) 0.5411(2) 0.35856(18) 0.0653(11) Uani 1 1 d . . .
H74A H 0.2705 0.4952 0.3430 0.098 Uiso 1 1 calc R . .
H74B H 0.2958 0.5520 0.4030 0.098 Uiso 1 1 calc R . .
H74C H 0.2609 0.5771 0.3254 0.098 Uiso 1 1 calc R . .
C75 C 0.0758(3) 0.21068(18) 0.58361(18) 0.0640(10) Uani 1 1 d . . .
H75A H 0.1151 0.1803 0.5635 0.077 Uiso 0.68(3) 1 calc PR A 1
H75B H 0.0148 0.2125 0.5516 0.077 Uiso 0.68(3) 1 calc PR A 1
H75C H 0.1231 0.1769 0.5852 0.077 Uiso 0.32(3) 1 d PR A 2
H75D H 0.0336 0.2080 0.5397 0.077 Uiso 0.32(3) 1 d PR A 2
C76 C 0.0688(10) 0.1812(5) 0.6510(5) 0.052(2) Uani 0.68(3) 1 d P A 1
H76A H 0.1195 0.1485 0.6698 0.062 Uiso 0.68(3) 1 calc PR A 1
H76B H 0.0105 0.1563 0.6466 0.062 Uiso 0.68(3) 1 calc PR A 1
C76' C 0.031(3) 0.1981(17) 0.6381(16) 0.071(7) Uani 0.32(3) 1 d P A 2
H76C H 0.0392 0.1485 0.6531 0.085 Uiso 0.32(3) 1 calc PR A 2
H76D H -0.0344 0.2081 0.6224 0.085 Uiso 0.32(3) 1 calc PR A 2
C77 C 0.0744(3) 0.24564(18) 0.69547(18) 0.0609(10) Uani 1 1 d . . .
H77A H 0.0131 0.2646 0.6933 0.073 Uiso 0.68(3) 1 calc PR A 1
H77B H 0.1048 0.2347 0.7435 0.073 Uiso 0.68(3) 1 calc PR A 1
H77C H 0.0298 0.2704 0.7127 0.073 Uiso 0.32(3) 1 d PR A 2
H77D H 0.1131 0.2201 0.7323 0.073 Uiso 0.32(3) 1 d PR A 2
C78 C 0.1293(3) 0.29655(17) 0.66604(15) 0.0554(9) Uani 1 1 d . A .
H78A H 0.1099 0.3453 0.6718 0.066 Uiso 1 1 calc R . .
H78B H 0.1946 0.2920 0.6890 0.066 Uiso 1 1 calc R . .
C81 C -0.02156(18) 0.32162(13) 0.38404(13) 0.0323(5) Uani 1 1 d . . .
C82 C -0.0576(2) 0.35580(16) 0.31391(14) 0.0429(7) Uani 1 1 d . . .
H82A H -0.0819 0.4024 0.3197 0.064 Uiso 1 1 calc R . .
H82B H -0.1058 0.3265 0.2861 0.064 Uiso 1 1 calc R . .
H82C H -0.0080 0.3603 0.2911 0.064 Uiso 1 1 calc R . .
C83 C -0.09928(19) 0.31522(15) 0.41975(16) 0.0408(6) Uani 1 1 d . . .
H83A H -0.1234 0.3620 0.4251 0.061 Uiso 1 1 calc R . .
H83B H -0.0764 0.2937 0.4647 0.061 Uiso 1 1 calc R . .
H83C H -0.1477 0.2859 0.3922 0.061 Uiso 1 1 calc R . .
C84 C 0.0168(2) 0.24831(14) 0.37530(15) 0.0412(6) Uani 1 1 d . . .
H84A H 0.0664 0.2527 0.3525 0.062 Uiso 1 1 calc R . .
H84B H -0.0314 0.2189 0.3477 0.062 Uiso 1 1 calc R . .
H84C H 0.0399 0.2267 0.4202 0.062 Uiso 1 1 calc R . .
C86 C 0.3592(4) 0.5989(3) 0.6734(2) 0.109(2) Uani 1 1 d . . .
H86A H 0.4039 0.5947 0.7181 0.131 Uiso 1 1 calc R . .
H86B H 0.3060 0.6258 0.6793 0.131 Uiso 1 1 calc R . .
C85 C 0.3327(4) 0.5308(4) 0.6440(2) 0.133(3) Uani 1 1 d . . .
H85A H 0.2782 0.5139 0.6576 0.160 Uiso 1 1 calc R . .
H85B H 0.3824 0.4965 0.6600 0.160 Uiso 1 1 calc R . .
C87 C 0.3993(5) 0.6316(3) 0.6235(3) 0.121(3) Uani 1 1 d . . .
H87A H 0.4640 0.6182 0.6312 0.145 Uiso 1 1 calc R . .
H87B H 0.3952 0.6834 0.6259 0.145 Uiso 1 1 calc R . .
C88 C 0.3460(3) 0.6055(2) 0.5569(2) 0.0658(11) Uani 1 1 d . . .
H88A H 0.2949 0.6376 0.5373 0.079 Uiso 1 1 calc R . .
H88B H 0.3848 0.6012 0.5243 0.079 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 0.0000 0.0000 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mn Mn 0.3368 0.7283 '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 Mn1 N2 114.19(12) . .
N1 Mn1 N3 113.90(12) . .
N2 Mn1 N3 104.40(11) . .
N1 Mn1 N4 112.89(11) . .
N2 Mn1 N4 105.16(10) . .
N3 Mn1 N4 105.37(10) . .
N1 Mn1 Li2 137.84(14) . .
N2 Mn1 Li2 107.97(13) . .
N3 Mn1 Li2 52.96(13) . .
N4 Mn1 Li2 53.04(13) . .
N1 Mn1 Li3 138.24(14) . .
N2 Mn1 Li3 53.23(13) . .
N3 Mn1 Li3 107.86(13) . .
N4 Mn1 Li3 52.61(13) . .
Li2 Mn1 Li3 70.14(15) . .
N1 Mn1 Li4 140.14(14) . .
N2 Mn1 Li4 52.60(14) . .
N3 Mn1 Li4 52.77(14) . .
N4 Mn1 Li4 106.97(13) . .
Li2 Mn1 Li4 69.43(15) . .
Li3 Mn1 Li4 69.39(15) . .
N5 Mn5 N6 114.18(12) . .
N5 Mn5 N8 112.88(12) . .
N6 Mn5 N8 105.28(10) . .
N5 Mn5 N7 113.70(13) . .
N6 Mn5 N7 104.91(10) . .
N8 Mn5 N7 104.98(10) . .
N5 Mn5 Li6 137.24(14) . .
N6 Mn5 Li6 108.58(12) . .
N8 Mn5 Li6 52.86(12) . .
N7 Mn5 Li6 52.73(13) . .
N5 Mn5 Li7 138.43(15) . .
N6 Mn5 Li7 53.31(13) . .
N8 Mn5 Li7 52.68(13) . .
N7 Mn5 Li7 107.85(12) . .
Li6 Mn5 Li7 70.40(14) . .
N5 Mn5 Li8 139.05(15) . .
N6 Mn5 Li8 53.36(14) . .
N8 Mn5 Li8 108.05(14) . .
N7 Mn5 Li8 52.26(13) . .
Li6 Mn5 Li8 70.24(16) . .
Li7 Mn5 Li8 70.65(15) . .
N3 Li2 N4 87.21(19) . .
N3 Li2 Cl1 125.8(2) . .
N4 Li2 Cl1 136.4(2) . .
N3 Li2 Cl1 97.70(19) . 3_665
N4 Li2 Cl1 97.38(19) . 3_665
Cl1 Li2 Cl1 104.21(16) . 3_665
N3 Li2 Mn1 43.75(11) . .
N4 Li2 Mn1 43.92(11) . .
Cl1 Li2 Mn1 159.5(2) . .
Cl1 Li2 Mn1 95.43(16) 3_665 .
N3 Li2 Li4 44.88(15) . .
N4 Li2 Li4 88.71(19) . .
Cl1 Li2 Li4 134.4(2) . .
Cl1 Li2 Li4 53.11(13) 3_665 .
Mn1 Li2 Li4 55.57(13) . .
N3 Li2 Li3 88.36(19) . .
N4 Li2 Li3 44.12(14) . .
Cl1 Li2 Li3 143.7(2) . .
Cl1 Li2 Li3 53.62(13) 3_665 .
Mn1 Li2 Li3 55.00(13) . .
Li4 Li2 Li3 59.81(17) . .
N3 Li2 Li2 124.5(3) . 3_665
N4 Li2 Li2 132.0(3) . 3_665
Cl1 Li2 Li2 55.67(15) . 3_665
Cl1 Li2 Li2 48.54(14) 3_665 3_665
Mn1 Li2 Li2 143.6(3) . 3_665
Li4 Li2 Li2 91.7(2) . 3_665
Li3 Li2 Li2 96.8(2) . 3_665
O3 Li3 N4 134.1(3) . .
O3 Li3 N2 121.3(3) . .
N4 Li3 N2 86.95(19) . .
O3 Li3 Cl1 110.5(2) . 3_665
N4 Li3 Cl1 99.11(19) . 3_665
N2 Li3 Cl1 97.75(19) . 3_665
O3 Li3 Mn1 151.8(2) . .
N4 Li3 Mn1 43.88(10) . .
N2 Li3 Mn1 43.56(11) . .
Cl1 Li3 Mn1 96.47(16) 3_665 .
O3 Li3 Li4 136.9(2) . .
N4 Li3 Li4 88.88(19) . .
N2 Li3 Li4 44.70(14) . .
Cl1 Li3 Li4 53.45(13) 3_665 .
Mn1 Li3 Li4 55.53(13) . .
O3 Li3 Li2 150.2(3) . .
N4 Li3 Li2 44.40(14) . .
N2 Li3 Li2 88.03(19) . .
Cl1 Li3 Li2 55.07(13) 3_665 .
Mn1 Li3 Li2 54.86(12) . .
Li4 Li3 Li2 59.78(17) . .
O4 Li4 N2 127.6(3) . .
O4 Li4 N3 131.7(3) . .
N2 Li4 N3 86.08(19) . .
O4 Li4 Cl1 106.1(2) . 3_665
N2 Li4 Cl1 99.0(2) . 3_665
N3 Li4 Cl1 100.0(2) . 3_665
O4 Li4 Mn1 156.9(3) . .
N2 Li4 Mn1 43.36(11) . .
N3 Li4 Mn1 43.42(11) . .
Cl1 Li4 Mn1 96.91(17) 3_665 .
O4 Li4 Li2 143.1(3) . .
N2 Li4 Li2 88.71(19) . .
N3 Li4 Li2 44.68(15) . .
Cl1 Li4 Li2 55.59(14) 3_665 .
Mn1 Li4 Li2 55.00(13) . .
O4 Li4 Li3 139.5(3) . .
N2 Li4 Li3 44.97(15) . .
N3 Li4 Li3 88.70(19) . .
Cl1 Li4 Li3 54.45(14) 3_665 .
Mn1 Li4 Li3 55.09(13) . .
Li2 Li4 Li3 60.41(16) . .
N7 Li6 N8 88.0(2) . .
N7 Li6 Cl2 130.2(2) . .
N8 Li6 Cl2 129.7(2) . .
N7 Li6 Mn5 44.29(11) . .
N8 Li6 Mn5 44.14(11) . .
Cl2 Li6 Mn5 158.3(2) . .
N7 Li6 Cl2 97.37(19) . 3_566
N8 Li6 Cl2 96.60(18) . 3_566
Cl2 Li6 Cl2 106.99(17) . 3_566
Mn5 Li6 Cl2 94.74(15) . 3_566
N7 Li6 Li6 128.5(3) . 3_566
N8 Li6 Li6 127.3(3) . 3_566
Cl2 Li6 Li6 58.05(16) . 3_566
Mn5 Li6 Li6 143.7(3) . 3_566
Cl2 Li6 Li6 48.94(14) 3_566 3_566
N7 Li6 Li8 44.05(14) . .
N8 Li6 Li8 89.21(19) . .
Cl2 Li6 Li8 140.3(2) . .
Mn5 Li6 Li8 55.46(14) . .
Cl2 Li6 Li8 53.54(13) 3_566 .
Li6 Li6 Li8 94.6(2) 3_566 .
N7 Li6 Li7 89.07(19) . .
N8 Li6 Li7 44.28(14) . .
Cl2 Li6 Li7 140.0(2) . .
Mn5 Li6 Li7 55.37(12) . .
Cl2 Li6 Li7 52.63(12) 3_566 .
Li6 Li6 Li7 93.8(2) 3_566 .
Li8 Li6 Li7 60.74(16) . .
O7 Li7 N8 132.9(3) . .
O7 Li7 N6 124.9(3) . .
N8 Li7 N6 86.20(19) . .
O7 Li7 Cl2 108.8(2) . 3_566
N8 Li7 Cl2 99.40(19) . 3_566
N6 Li7 Cl2 97.62(18) . 3_566
O7 Li7 Mn5 154.1(2) . .
N8 Li7 Mn5 43.46(10) . .
N6 Li7 Mn5 43.25(10) . .
Cl2 Li7 Mn5 96.48(15) 3_566 .
O7 Li7 Li6 147.2(2) . .
N8 Li7 Li6 43.73(13) . .
N6 Li7 Li6 87.48(18) . .
Cl2 Li7 Li6 56.00(13) 3_566 .
Mn5 Li7 Li6 54.23(12) . .
O7 Li7 Li8 139.3(2) . .
N8 Li7 Li8 87.85(18) . .
N6 Li7 Li8 44.29(15) . .
Cl2 Li7 Li8 53.83(14) 3_566 .
Mn5 Li7 Li8 54.68(12) . .
Li6 Li7 Li8 59.54(16) . .
O8 Li8 N7 132.3(3) . .
O8 Li8 N6 128.4(3) . .
N7 Li8 N6 86.3(2) . .
O8 Li8 Cl2 106.4(2) . 3_566
N7 Li8 Cl2 99.3(2) . 3_566
N6 Li8 Cl2 96.49(19) . 3_566
O8 Li8 Mn5 157.8(3) . .
N7 Li8 Mn5 43.62(11) . .
N6 Li8 Mn5 43.23(11) . .
Cl2 Li8 Mn5 95.59(16) 3_566 .
O8 Li8 Li6 143.3(3) . .
N7 Li8 Li6 43.74(15) . .
N6 Li8 Li6 87.61(19) . .
Cl2 Li8 Li6 55.80(14) 3_566 .
Mn5 Li8 Li6 54.30(13) . .
O8 Li8 Li7 139.3(2) . .
N7 Li8 Li7 88.03(19) . .
N6 Li8 Li7 44.24(14) . .
Cl2 Li8 Li7 52.74(13) 3_566 .
Mn5 Li8 Li7 54.67(12) . .
Li6 Li8 Li7 59.73(16) . .
C21 N2 Mn1 130.04(18) . .
C21 N2 Li4 129.4(2) . .
Mn1 N2 Li4 84.05(17) . .
C21 N2 Li3 124.9(2) . .
Mn1 N2 Li3 83.21(16) . .
Li4 N2 Li3 90.3(2) . .
C31 N3 Mn1 131.62(18) . .
C31 N3 Li2 124.9(2) . .
Mn1 N3 Li2 83.29(16) . .
C31 N3 Li4 128.0(2) . .
Mn1 N3 Li4 83.80(16) . .
Li2 N3 Li4 90.4(2) . .
C41 N4 Mn1 129.97(17) . .
C41 N4 Li3 129.3(2) . .
Mn1 N4 Li3 83.51(16) . .
C41 N4 Li2 124.8(2) . .
Mn1 N4 Li2 83.04(16) . .
Li3 N4 Li2 91.5(2) . .
C61 N6 Mn5 130.48(18) . .
C61 N6 Li7 125.0(2) . .
Mn5 N6 Li7 83.44(16) . .
C61 N6 Li8 128.4(2) . .
Mn5 N6 Li8 83.41(16) . .
Li7 N6 Li8 91.5(2) . .
C71 N7 Mn5 131.2(2) . .
C71 N7 Li6 123.9(2) . .
Mn5 N7 Li6 82.99(15) . .
C71 N7 Li8 128.2(2) . .
Mn5 N7 Li8 84.11(16) . .
Li6 N7 Li8 92.2(2) . .
C81 N8 Mn5 130.53(17) . .
C81 N8 Li6 123.3(2) . .
Mn5 N8 Li6 83.00(16) . .
C81 N8 Li7 129.6(2) . .
Mn5 N8 Li7 83.86(15) . .
Li6 N8 Li7 91.98(19) . .
C35 O3 C38 105.9(2) . .
C35 O3 Li3 128.0(2) . .
C38 O3 Li3 119.1(2) . .
C45 O4 C48 109.4(3) . .
C45 O4 Li4 126.7(2) . .
C48 O4 Li4 121.6(2) . .
C75 O7 C78 108.9(2) . .
C75 O7 Li7 128.5(2) . .
C78 O7 Li7 121.3(2) . .
C88 O8 C85 107.8(3) . .
C88 O8 Li8 130.4(3) . .
C85 O8 Li8 118.6(3) . .
Li2 Cl1 Li4 125.09(17) . 3_665
Li2 Cl1 Li3 134.30(16) . 3_665
Li4 Cl1 Li3 72.10(15) 3_665 3_665
Li2 Cl1 Li2 75.79(16) . 3_665
Li4 Cl1 Li2 71.30(16) 3_665 3_665
Li3 Cl1 Li2 71.31(15) 3_665 3_665
Li6 Cl2 Li7 127.48(16) . 3_566
Li6 Cl2 Li8 127.06(17) . 3_566
Li7 Cl2 Li8 73.44(15) 3_566 3_566
Li6 Cl2 Li6 73.01(17) . 3_566
Li7 Cl2 Li6 71.37(14) 3_566 3_566
Li8 Cl2 Li6 70.66(15) 3_566 3_566
N2 C21 C24 110.3(2) . .
N2 C21 C22 106.9(2) . .
C24 C21 C22 109.5(3) . .
N2 C21 C23 110.9(3) . .
C24 C21 C23 109.3(2) . .
C22 C21 C23 110.0(3) . .
N3 C31 C33 110.9(3) . .
N3 C31 C34 110.1(2) . .
C33 C31 C34 110.7(3) . .
N3 C31 C32 106.5(2) . .
C33 C31 C32 109.7(3) . .
C34 C31 C32 109.0(3) . .
O3 C35 C36 104.1(3) . .
C35 C36 C37 102.1(3) . .
C38 C37 C36 105.3(3) . .
O3 C38 C37 105.8(3) . .
N4 C41 C42 111.2(2) . .
N4 C41 C44 110.7(2) . .
C42 C41 C44 109.7(3) . .
N4 C41 C43 107.1(2) . .
C42 C41 C43 109.3(3) . .
C44 C41 C43 108.9(3) . .
O4 C45 C46 105.9(3) . .
C47 C46 C45 103.7(3) . .
C48 C47 C46 108.3(4) . .
C47 C48 O4 106.6(3) . .
N6 C61 C62 110.7(3) . .
N6 C61 C64 107.3(2) . .
C62 C61 C64 108.9(3) . .
N6 C61 C63 111.0(2) . .
C62 C61 C63 110.3(3) . .
C64 C61 C63 108.5(3) . .
N7 C71 C74 109.8(3) . .
N7 C71 C73 110.4(2) . .
C74 C71 C73 110.4(3) . .
N7 C71 C72 107.2(3) . .
C74 C71 C72 110.1(3) . .
C73 C71 C72 108.9(4) . .
O7 C75 C76' 106.3(11) . .
O7 C75 C76 108.7(5) . .
C76' C75 C76 25.3(15) . .
C75 C76 C77 103.4(6) . .
C75 C76' C77 107.2(14) . .
C76' C77 C78 105.3(9) . .
C76' C77 C76 25.0(14) . .
C78 C77 C76 104.1(5) . .
O7 C78 C77 106.2(3) . .
N8 C81 C82 110.9(2) . .
N8 C81 C83 106.8(2) . .
C82 C81 C83 109.3(2) . .
N8 C81 C84 110.2(2) . .
C82 C81 C84 109.7(2) . .
C83 C81 C84 109.9(2) . .
C85 C86 C87 102.9(4) . .
C86 C85 O8 107.1(4) . .
C86 C87 C88 105.2(4) . .
O8 C88 C87 105.1(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mn1 N1 1.559(2) .
Mn1 N2 1.769(2) .
Mn1 N3 1.772(2) .
Mn1 N4 1.779(2) .
Mn1 Li2 2.545(5) .
Mn1 Li3 2.549(4) .
Mn1 Li4 2.563(5) .
Mn5 N5 1.561(2) .
Mn5 N6 1.769(2) .
Mn5 N8 1.775(2) .
Mn5 N7 1.779(2) .
Mn5 Li6 2.529(5) .
Mn5 Li7 2.565(4) .
Mn5 Li8 2.565(5) .
Li2 N3 2.046(5) .
Li2 N4 2.049(5) .
Li2 Cl1 2.300(5) .
Li2 Cl1 2.534(5) 3_665
Li2 Li4 2.909(7) .
Li2 Li3 2.927(7) .
Li2 Li2 2.975(9) 3_665
Li3 O3 1.929(5) .
Li3 N4 2.039(5) .
Li3 N2 2.057(5) .
Li3 Cl1 2.488(5) 3_665
Li3 Li4 2.910(7) .
Li4 O4 1.909(5) .
Li4 N2 2.047(5) .
Li4 N3 2.053(6) .
Li4 Cl1 2.456(5) 3_665
Li6 N7 2.028(5) .
Li6 N8 2.031(5) .
Li6 Cl2 2.283(5) .
Li6 Cl2 2.569(5) 3_566
Li6 Li6 2.896(9) 3_566
Li6 Li8 2.931(7) .
Li6 Li7 2.937(6) .
Li7 O7 1.937(5) .
Li7 N8 2.052(5) .
Li7 N6 2.071(5) .
Li7 Cl2 2.463(4) 3_566
Li7 Li8 2.967(6) .
Li8 O8 1.914(5) .
Li8 N7 2.040(5) .
Li8 N6 2.072(5) .
Li8 Cl2 2.498(5) 3_566
N2 C21 1.463(3) .
N3 C31 1.465(3) .
N4 C41 1.461(3) .
N6 C61 1.463(4) .
N7 C71 1.468(3) .
N8 C81 1.467(3) .
O3 C35 1.432(4) .
O3 C38 1.451(4) .
O4 C45 1.432(4) .
O4 C48 1.444(4) .
O7 C75 1.419(4) .
O7 C78 1.449(3) .
O8 C88 1.419(4) .
O8 C85 1.446(5) .
Cl1 Li4 2.456(5) 3_665
Cl1 Li3 2.488(5) 3_665
Cl1 Li2 2.534(5) 3_665
Cl2 Li7 2.463(4) 3_566
Cl2 Li8 2.499(5) 3_566
Cl2 Li6 2.569(5) 3_566
C21 C24 1.534(4) .
C21 C22 1.535(4) .
C21 C23 1.538(4) .
C31 C33 1.528(4) .
C31 C34 1.534(4) .
C31 C32 1.537(4) .
C35 C36 1.516(5) .
C36 C37 1.530(5) .
C37 C38 1.521(5) .
C41 C42 1.524(4) .
C41 C44 1.537(4) .
C41 C43 1.542(4) .
C45 C46 1.510(5) .
C46 C47 1.474(6) .
C47 C48 1.398(5) .
C61 C62 1.530(5) .
C61 C64 1.534(4) .
C61 C63 1.539(5) .
C71 C74 1.524(5) .
C71 C73 1.530(5) .
C71 C72 1.535(6) .
C75 C76' 1.45(2) .
C75 C76 1.503(11) .
C76 C77 1.512(12) .
C76' C77 1.49(3) .
C77 C78 1.496(5) .
C81 C82 1.534(4) .
C81 C83 1.536(4) .
C81 C84 1.541(4) .
C86 C85 1.442(8) .
C86 C87 1.444(8) .
C87 C88 1.476(6) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
N1 Mn1 Li2 N3 85.6(2) . .
N2 Mn1 Li2 N3 -94.75(15) . .
N4 Mn1 Li2 N3 169.5(2) . .
Li3 Mn1 Li2 N3 -132.92(18) . .
Li4 Mn1 Li2 N3 -58.24(17) . .
N1 Mn1 Li2 N4 -83.9(2) . .
N2 Mn1 Li2 N4 95.74(14) . .
N3 Mn1 Li2 N4 -169.5(2) . .
Li3 Mn1 Li2 N4 57.57(16) . .
Li4 Mn1 Li2 N4 132.25(18) . .
N1 Mn1 Li2 Cl1 17.9(8) . .
N2 Mn1 Li2 Cl1 -162.4(6) . .
N3 Mn1 Li2 Cl1 -67.7(6) . .
N4 Mn1 Li2 Cl1 101.8(7) . .
Li3 Mn1 Li2 Cl1 159.4(7) . .
Li4 Mn1 Li2 Cl1 -125.9(7) . .
N1 Mn1 Li2 Cl1 -178.95(14) . 3_665
N2 Mn1 Li2 Cl1 0.73(17) . 3_665
N3 Mn1 Li2 Cl1 95.48(18) . 3_665
N4 Mn1 Li2 Cl1 -95.01(17) . 3_665
Li3 Mn1 Li2 Cl1 -37.44(15) . 3_665
Li4 Mn1 Li2 Cl1 37.24(15) . 3_665
N1 Mn1 Li2 Li4 143.8(2) . .
N2 Mn1 Li2 Li4 -36.51(16) . .
N3 Mn1 Li2 Li4 58.24(17) . .
N4 Mn1 Li2 Li4 -132.25(18) . .
Li3 Mn1 Li2 Li4 -74.68(17) . .
N1 Mn1 Li2 Li3 -141.5(2) . .
N2 Mn1 Li2 Li3 38.17(16) . .
N3 Mn1 Li2 Li3 132.92(18) . .
N4 Mn1 Li2 Li3 -57.57(16) . .
Li4 Mn1 Li2 Li3 74.68(17) . .
N1 Mn1 Li2 Li2 173.5(4) . 3_665
N2 Mn1 Li2 Li2 -6.9(5) . 3_665
N3 Mn1 Li2 Li2 87.9(5) . 3_665
N4 Mn1 Li2 Li2 -102.6(5) . 3_665
Li3 Mn1 Li2 Li2 -45.0(4) . 3_665
Li4 Mn1 Li2 Li2 29.6(4) . 3_665
N1 Mn1 Li3 O3 -17.6(7) . .
N2 Mn1 Li3 O3 68.5(5) . .
N3 Mn1 Li3 O3 163.4(5) . .
N4 Mn1 Li3 O3 -100.7(6) . .
Li2 Mn1 Li3 O3 -158.7(6) . .
Li4 Mn1 Li3 O3 126.5(6) . .
N1 Mn1 Li3 N4 83.1(2) . .
N2 Mn1 Li3 N4 169.1(2) . .
N3 Mn1 Li3 N4 -95.98(15) . .
Li2 Mn1 Li3 N4 -58.09(16) . .
Li4 Mn1 Li3 N4 -132.83(19) . .
N1 Mn1 Li3 N2 -86.1(2) . .
N3 Mn1 Li3 N2 94.90(15) . .
N4 Mn1 Li3 N2 -169.1(2) . .
Li2 Mn1 Li3 N2 132.79(18) . .
Li4 Mn1 Li3 N2 58.06(17) . .
N1 Mn1 Li3 Cl1 179.49(14) . 3_665
N2 Mn1 Li3 Cl1 -94.46(18) . 3_665
N3 Mn1 Li3 Cl1 0.45(18) . 3_665
N4 Mn1 Li3 Cl1 96.43(18) . 3_665
Li2 Mn1 Li3 Cl1 38.34(15) . 3_665
Li4 Mn1 Li3 Cl1 -36.40(16) . 3_665
N1 Mn1 Li3 Li4 -144.1(2) . .
N2 Mn1 Li3 Li4 -58.06(17) . .
N3 Mn1 Li3 Li4 36.85(16) . .
N4 Mn1 Li3 Li4 132.83(19) . .
Li2 Mn1 Li3 Li4 74.74(17) . .
N1 Mn1 Li3 Li2 141.2(2) . .
N2 Mn1 Li3 Li2 -132.79(18) . .
N3 Mn1 Li3 Li2 -37.89(16) . .
N4 Mn1 Li3 Li2 58.09(16) . .
Li4 Mn1 Li3 Li2 -74.74(17) . .
N3 Li2 Li3 O3 -169.7(5) . .
N4 Li2 Li3 O3 102.6(5) . .
Cl1 Li2 Li3 O3 -8.1(8) . .
Cl1 Li2 Li3 O3 -68.9(5) 3_665 .
Mn1 Li2 Li3 O3 159.9(5) . .
Li4 Li2 Li3 O3 -133.2(5) . .
Li2 Li2 Li3 O3 -45.2(6) 3_665 .
N3 Li2 Li3 N4 87.7(2) . .
Cl1 Li2 Li3 N4 -110.7(4) . .
Cl1 Li2 Li3 N4 -171.5(2) 3_665 .
Mn1 Li2 Li3 N4 57.25(14) . .
Li4 Li2 Li3 N4 124.2(2) . .
Li2 Li2 Li3 N4 -147.8(3) 3_665 .
N3 Li2 Li3 N2 0.05(19) . .
N4 Li2 Li3 N2 -87.6(2) . .
Cl1 Li2 Li3 N2 161.6(3) . .
Cl1 Li2 Li3 N2 100.87(18) 3_665 .
Mn1 Li2 Li3 N2 -30.39(12) . .
Li4 Li2 Li3 N2 36.58(16) . .
Li2 Li2 Li3 N2 124.6(2) 3_665 .
N3 Li2 Li3 Cl1 -100.82(18) . 3_665
N4 Li2 Li3 Cl1 171.5(2) . 3_665
Cl1 Li2 Li3 Cl1 60.8(3) . 3_665
Mn1 Li2 Li3 Cl1 -131.26(17) . 3_665
Li4 Li2 Li3 Cl1 -64.28(14) . 3_665
Li2 Li2 Li3 Cl1 23.71(16) 3_665 3_665
N3 Li2 Li3 Mn1 30.44(12) . .
N4 Li2 Li3 Mn1 -57.25(14) . .
Cl1 Li2 Li3 Mn1 -168.0(4) . .
Cl1 Li2 Li3 Mn1 131.26(17) 3_665 .
Li4 Li2 Li3 Mn1 66.98(14) . .
Li2 Li2 Li3 Mn1 155.0(3) 3_665 .
N3 Li2 Li3 Li4 -36.54(16) . .
N4 Li2 Li3 Li4 -124.2(2) . .
Cl1 Li2 Li3 Li4 125.1(4) . .
Cl1 Li2 Li3 Li4 64.28(14) 3_665 .
Mn1 Li2 Li3 Li4 -66.98(14) . .
Li2 Li2 Li3 Li4 88.0(2) 3_665 .
N1 Mn1 Li4 O4 6.0(9) . .
N2 Mn1 Li4 O4 -77.6(7) . .
N3 Mn1 Li4 O4 89.3(7) . .
N4 Mn1 Li4 O4 -174.0(7) . .
Li2 Mn1 Li4 O4 147.8(8) . .
Li3 Mn1 Li4 O4 -136.5(8) . .
N1 Mn1 Li4 N2 83.6(2) . .
N3 Mn1 Li4 N2 167.0(2) . .
N4 Mn1 Li4 N2 -96.37(14) . .
Li2 Mn1 Li4 N2 -134.57(19) . .
Li3 Mn1 Li4 N2 -58.84(16) . .
N1 Mn1 Li4 N3 -83.3(2) . .
N2 Mn1 Li4 N3 -167.0(2) . .
N4 Mn1 Li4 N3 96.67(15) . .
Li2 Mn1 Li4 N3 58.47(16) . .
Li3 Mn1 Li4 N3 134.20(19) . .
N1 Mn1 Li4 Cl1 179.45(15) . 3_665
N2 Mn1 Li4 Cl1 95.82(19) . 3_665
N3 Mn1 Li4 Cl1 -97.22(19) . 3_665
N4 Mn1 Li4 Cl1 -0.55(19) . 3_665
Li2 Mn1 Li4 Cl1 -38.75(16) . 3_665
Li3 Mn1 Li4 Cl1 36.98(16) . 3_665
N1 Mn1 Li4 Li2 -141.8(2) . .
N2 Mn1 Li4 Li2 134.57(19) . .
N3 Mn1 Li4 Li2 -58.47(16) . .
N4 Mn1 Li4 Li2 38.20(15) . .
Li3 Mn1 Li4 Li2 75.73(17) . .
N1 Mn1 Li4 Li3 142.5(2) . .
N2 Mn1 Li4 Li3 58.84(16) . .
N3 Mn1 Li4 Li3 -134.20(19) . .
N4 Mn1 Li4 Li3 -37.53(16) . .
Li2 Mn1 Li4 Li3 -75.73(17) . .
N3 Li2 Li4 O4 -103.2(5) . .
N4 Li2 Li4 O4 169.5(4) . .
Cl1 Li2 Li4 O4 -3.0(6) . .
Cl1 Li2 Li4 O4 69.3(4) 3_665 .
Mn1 Li2 Li4 O4 -159.6(5) . .
Li3 Li2 Li4 O4 134.4(5) . .
Li2 Li2 Li4 O4 37.5(5) 3_665 .
N3 Li2 Li4 N2 85.7(2) . .
N4 Li2 Li4 N2 -1.6(2) . .
Cl1 Li2 Li4 N2 -174.1(3) . .
Cl1 Li2 Li4 N2 -101.85(19) 3_665 .
Mn1 Li2 Li4 N2 29.29(12) . .
Li3 Li2 Li4 N2 -36.77(16) . .
Li2 Li2 Li4 N2 -133.6(2) 3_665 .
N4 Li2 Li4 N3 -87.3(2) . .
Cl1 Li2 Li4 N3 100.2(3) . .
Cl1 Li2 Li4 N3 172.4(2) 3_665 .
Mn1 Li2 Li4 N3 -56.44(13) . .
Li3 Li2 Li4 N3 -122.5(2) . .
Li2 Li2 Li4 N3 140.7(3) 3_665 .
N3 Li2 Li4 Cl1 -172.4(2) . 3_665
N4 Li2 Li4 Cl1 100.23(18) . 3_665
Cl1 Li2 Li4 Cl1 -72.3(3) . 3_665
Mn1 Li2 Li4 Cl1 131.14(18) . 3_665
Li3 Li2 Li4 Cl1 65.08(14) . 3_665
Li2 Li2 Li4 Cl1 -31.78(16) 3_665 3_665
N3 Li2 Li4 Mn1 56.44(13) . .
N4 Li2 Li4 Mn1 -30.90(12) . .
Cl1 Li2 Li4 Mn1 156.6(3) . .
Cl1 Li2 Li4 Mn1 -131.14(18) 3_665 .
Li3 Li2 Li4 Mn1 -66.06(14) . .
Li2 Li2 Li4 Mn1 -162.9(3) 3_665 .
N3 Li2 Li4 Li3 122.5(2) . .
N4 Li2 Li4 Li3 35.15(16) . .
Cl1 Li2 Li4 Li3 -137.3(3) . .
Cl1 Li2 Li4 Li3 -65.08(14) 3_665 .
Mn1 Li2 Li4 Li3 66.06(14) . .
Li2 Li2 Li4 Li3 -96.9(2) 3_665 .
O3 Li3 Li4 O4 9.2(6) . .
N4 Li3 Li4 O4 -174.0(4) . .
N2 Li3 Li4 O4 99.2(4) . .
Cl1 Li3 Li4 O4 -71.8(4) 3_665 .
Mn1 Li3 Li4 O4 155.4(4) . .
Li2 Li3 Li4 O4 -138.7(4) . .
O3 Li3 Li4 N2 -90.0(4) . .
N4 Li3 Li4 N2 86.8(2) . .
Cl1 Li3 Li4 N2 -171.0(2) 3_665 .
Mn1 Li3 Li4 N2 56.22(14) . .
Li2 Li3 Li4 N2 122.1(2) . .
O3 Li3 Li4 N3 -175.7(3) . .
N4 Li3 Li4 N3 1.0(2) . .
N2 Li3 Li4 N3 -85.8(2) . .
Cl1 Li3 Li4 N3 103.2(2) 3_665 .
Mn1 Li3 Li4 N3 -29.53(12) . .
Li2 Li3 Li4 N3 36.39(16) . .
O3 Li3 Li4 Cl1 81.0(3) . 3_665
N4 Li3 Li4 Cl1 -102.21(19) . 3_665
N2 Li3 Li4 Cl1 171.0(2) . 3_665
Mn1 Li3 Li4 Cl1 -132.78(18) . 3_665
Li2 Li3 Li4 Cl1 -66.86(14) . 3_665
O3 Li3 Li4 Mn1 -146.2(4) . .
N4 Li3 Li4 Mn1 30.56(12) . .
N2 Li3 Li4 Mn1 -56.22(14) . .
Cl1 Li3 Li4 Mn1 132.78(18) 3_665 .
Li2 Li3 Li4 Mn1 65.92(14) . .
O3 Li3 Li4 Li2 147.9(4) . .
N4 Li3 Li4 Li2 -35.35(16) . .
N2 Li3 Li4 Li2 -122.1(2) . .
Cl1 Li3 Li4 Li2 66.86(14) 3_665 .
Mn1 Li3 Li4 Li2 -65.92(14) . .
N5 Mn5 Li6 N7 -85.5(2) . .
N6 Mn5 Li6 N7 94.89(14) . .
N8 Mn5 Li6 N7 -169.70(19) . .
Li7 Mn5 Li6 N7 132.83(18) . .
Li8 Mn5 Li6 N7 57.05(16) . .
N5 Mn5 Li6 N8 84.2(2) . .
N6 Mn5 Li6 N8 -95.41(14) . .
N7 Mn5 Li6 N8 169.70(19) . .
Li7 Mn5 Li6 N8 -57.48(15) . .
Li8 Mn5 Li6 N8 -133.25(17) . .
N5 Mn5 Li6 Cl2 0.3(7) . .
N6 Mn5 Li6 Cl2 -179.3(5) . .
N8 Mn5 Li6 Cl2 -83.9(6) . .
N7 Mn5 Li6 Cl2 85.8(6) . .
Li7 Mn5 Li6 Cl2 -141.4(6) . .
Li8 Mn5 Li6 Cl2 142.8(6) . .
N5 Mn5 Li6 Cl2 178.82(15) . 3_566
N6 Mn5 Li6 Cl2 -0.81(16) . 3_566
N8 Mn5 Li6 Cl2 94.60(16) . 3_566
N7 Mn5 Li6 Cl2 -95.71(17) . 3_566
Li7 Mn5 Li6 Cl2 37.12(14) . 3_566
Li8 Mn5 Li6 Cl2 -38.65(14) . 3_566
N5 Mn5 Li6 Li6 178.1(4) . 3_566
N6 Mn5 Li6 Li6 -1.6(5) . 3_566
N8 Mn5 Li6 Li6 93.9(5) . 3_566
N7 Mn5 Li6 Li6 -96.4(5) . 3_566
Li7 Mn5 Li6 Li6 36.4(4) . 3_566
Li8 Mn5 Li6 Li6 -39.4(4) . 3_566
N5 Mn5 Li6 Li8 -142.5(2) . .
N6 Mn5 Li6 Li8 37.84(15) . .
N8 Mn5 Li6 Li8 133.25(17) . .
N7 Mn5 Li6 Li8 -57.05(16) . .
Li7 Mn5 Li6 Li8 75.77(16) . .
N5 Mn5 Li6 Li7 141.7(2) . .
N6 Mn5 Li6 Li7 -37.93(15) . .
N8 Mn5 Li6 Li7 57.48(15) . .
N7 Mn5 Li6 Li7 -132.83(18) . .
Li8 Mn5 Li6 Li7 -75.77(16) . .
N5 Mn5 Li7 O7 12.3(7) . .
N6 Mn5 Li7 O7 -73.7(6) . .
N8 Mn5 Li7 O7 95.2(6) . .
N7 Mn5 Li7 O7 -169.3(5) . .
Li6 Mn5 Li7 O7 152.9(6) . .
Li8 Mn5 Li7 O7 -131.9(6) . .
N5 Mn5 Li7 N8 -82.9(2) . .
N6 Mn5 Li7 N8 -168.91(19) . .
N7 Mn5 Li7 N8 95.51(14) . .
Li6 Mn5 Li7 N8 57.70(15) . .
Li8 Mn5 Li7 N8 132.90(19) . .
N5 Mn5 Li7 N6 86.0(2) . .
N8 Mn5 Li7 N6 168.91(19) . .
N7 Mn5 Li7 N6 -95.58(14) . .
Li6 Mn5 Li7 N6 -133.39(17) . .
Li8 Mn5 Li7 N6 -58.19(17) . .
N5 Mn5 Li7 Cl2 -179.79(14) . 3_566
N6 Mn5 Li7 Cl2 94.24(17) . 3_566
N8 Mn5 Li7 Cl2 -96.85(17) . 3_566
N7 Mn5 Li7 Cl2 -1.33(18) . 3_566
Li6 Mn5 Li7 Cl2 -39.15(15) . 3_566
Li8 Mn5 Li7 Cl2 36.05(16) . 3_566
N5 Mn5 Li7 Li6 -140.6(2) . .
N6 Mn5 Li7 Li6 133.39(17) . .
N8 Mn5 Li7 Li6 -57.70(15) . .
N7 Mn5 Li7 Li6 37.82(15) . .
Li8 Mn5 Li7 Li6 75.21(18) . .
N5 Mn5 Li7 Li8 144.2(2) . .
N6 Mn5 Li7 Li8 58.19(17) . .
N8 Mn5 Li7 Li8 -132.90(19) . .
N7 Mn5 Li7 Li8 -37.39(17) . .
Li6 Mn5 Li7 Li8 -75.21(18) . .
N7 Li6 Li7 O7 170.7(4) . .
N8 Li6 Li7 O7 -101.2(5) . .
Cl2 Li6 Li7 O7 0.5(7) . .
Mn5 Li6 Li7 O7 -158.5(5) . .
Cl2 Li6 Li7 O7 70.7(4) 3_566 .
Li6 Li6 Li7 O7 42.2(5) 3_566 .
Li8 Li6 Li7 O7 135.3(5) . .
N7 Li6 Li7 N8 -88.1(2) . .
Cl2 Li6 Li7 N8 101.7(3) . .
Mn5 Li6 Li7 N8 -57.25(14) . .
Cl2 Li6 Li7 N8 171.9(2) 3_566 .
Li6 Li6 Li7 N8 143.4(3) 3_566 .
Li8 Li6 Li7 N8 -123.5(2) . .
N7 Li6 Li7 N6 -0.92(19) . .
N8 Li6 Li7 N6 87.1(2) . .
Cl2 Li6 Li7 N6 -171.2(3) . .
Mn5 Li6 Li7 N6 29.89(11) . .
Cl2 Li6 Li7 N6 -100.93(18) 3_566 .
Li6 Li6 Li7 N6 -129.5(2) 3_566 .
Li8 Li6 Li7 N6 -36.35(16) . .
N7 Li6 Li7 Cl2 100.02(18) . 3_566
N8 Li6 Li7 Cl2 -171.9(2) . 3_566
Cl2 Li6 Li7 Cl2 -70.3(3) . 3_566
Mn5 Li6 Li7 Cl2 130.82(17) . 3_566
Li6 Li6 Li7 Cl2 -28.56(16) 3_566 3_566
Li8 Li6 Li7 Cl2 64.58(15) . 3_566
N7 Li6 Li7 Mn5 -30.81(12) . .
N8 Li6 Li7 Mn5 57.25(14) . .
Cl2 Li6 Li7 Mn5 158.9(3) . .
Cl2 Li6 Li7 Mn5 -130.82(17) 3_566 .
Li6 Li6 Li7 Mn5 -159.4(3) 3_566 .
Li8 Li6 Li7 Mn5 -66.24(15) . .
N7 Li6 Li7 Li8 35.43(16) . .
N8 Li6 Li7 Li8 123.5(2) . .
Cl2 Li6 Li7 Li8 -134.8(3) . .
Mn5 Li6 Li7 Li8 66.24(15) . .
Cl2 Li6 Li7 Li8 -64.58(15) 3_566 .
Li6 Li6 Li7 Li8 -93.1(2) 3_566 .
N5 Mn5 Li8 O8 -7.3(8) . .
N6 Mn5 Li8 O8 78.2(7) . .
N8 Mn5 Li8 O8 174.1(7) . .
N7 Mn5 Li8 O8 -90.6(7) . .
Li6 Mn5 Li8 O8 -148.2(7) . .
Li7 Mn5 Li8 O8 136.3(7) . .
N5 Mn5 Li8 N7 83.3(3) . .
N6 Mn5 Li8 N7 168.8(2) . .
N8 Mn5 Li8 N7 -95.25(15) . .
Li6 Mn5 Li8 N7 -57.61(16) . .
Li7 Mn5 Li8 N7 -133.04(19) . .
N5 Mn5 Li8 N6 -85.5(2) . .
N8 Mn5 Li8 N6 95.92(15) . .
N7 Mn5 Li8 N6 -168.8(2) . .
Li6 Mn5 Li8 N6 133.56(18) . .
Li7 Mn5 Li8 N6 58.13(16) . .
N5 Mn5 Li8 Cl2 -179.04(16) . 3_566
N6 Mn5 Li8 Cl2 -93.53(17) . 3_566
N8 Mn5 Li8 Cl2 2.39(18) . 3_566
N7 Mn5 Li8 Cl2 97.6(2) . 3_566
Li6 Mn5 Li8 Cl2 40.03(15) . 3_566
Li7 Mn5 Li8 Cl2 -35.40(15) . 3_566
N5 Mn5 Li8 Li6 140.9(2) . .
N6 Mn5 Li8 Li6 -133.56(18) . .
N8 Mn5 Li8 Li6 -37.64(15) . .
N7 Mn5 Li8 Li6 57.61(16) . .
Li7 Mn5 Li8 Li6 -75.43(16) . .
N5 Mn5 Li8 Li7 -143.6(2) . .
N6 Mn5 Li8 Li7 -58.13(16) . .
N8 Mn5 Li8 Li7 37.79(15) . .
N7 Mn5 Li8 Li7 133.04(19) . .
Li6 Mn5 Li8 Li7 75.43(16) . .
N7 Li6 Li8 O8 103.1(4) . .
N8 Li6 Li8 O8 -169.0(4) . .
Cl2 Li6 Li8 O8 1.1(6) . .
Mn5 Li6 Li8 O8 160.5(4) . .
Cl2 Li6 Li8 O8 -70.2(4) 3_566 .
Li6 Li6 Li8 O8 -41.6(5) 3_566 .
Li7 Li6 Li8 O8 -133.4(4) . .
N8 Li6 Li8 N7 87.9(2) . .
Cl2 Li6 Li8 N7 -102.1(4) . .
Mn5 Li6 Li8 N7 57.43(15) . .
Cl2 Li6 Li8 N7 -173.3(2) 3_566 .
Li6 Li6 Li8 N7 -144.7(3) 3_566 .
Li7 Li6 Li8 N7 123.5(2) . .
N7 Li6 Li8 N6 -87.2(2) . .
N8 Li6 Li8 N6 0.69(19) . .
Cl2 Li6 Li8 N6 170.7(3) . .
Mn5 Li6 Li8 N6 -29.79(12) . .
Cl2 Li6 Li8 N6 99.50(17) 3_566 .
Li6 Li6 Li8 N6 128.1(2) 3_566 .
Li7 Li6 Li8 N6 36.31(15) . .
N7 Li6 Li8 Cl2 173.3(2) . 3_566
N8 Li6 Li8 Cl2 -98.81(17) . 3_566
Cl2 Li6 Li8 Cl2 71.2(3) . 3_566
Mn5 Li6 Li8 Cl2 -129.29(16) . 3_566
Li6 Li6 Li8 Cl2 28.55(16) 3_566 3_566
Li7 Li6 Li8 Cl2 -63.19(13) . 3_566
N7 Li6 Li8 Mn5 -57.43(15) . .
N8 Li6 Li8 Mn5 30.48(12) . .
Cl2 Li6 Li8 Mn5 -159.5(3) . .
Cl2 Li6 Li8 Mn5 129.29(16) 3_566 .
Li6 Li6 Li8 Mn5 157.8(2) 3_566 .
Li7 Li6 Li8 Mn5 66.10(13) . .
N7 Li6 Li8 Li7 -123.5(2) . .
N8 Li6 Li8 Li7 -35.62(15) . .
Cl2 Li6 Li8 Li7 134.4(3) . .
Mn5 Li6 Li8 Li7 -66.10(13) . .
Cl2 Li6 Li8 Li7 63.19(13) 3_566 .
Li6 Li6 Li8 Li7 91.7(2) 3_566 .
O7 Li7 Li8 O8 -6.2(7) . .
N8 Li7 Li8 O8 173.4(4) . .
N6 Li7 Li8 O8 -99.9(5) . .
Cl2 Li7 Li8 O8 70.1(4) 3_566 .
Mn5 Li7 Li8 O8 -156.4(5) . .
Li6 Li7 Li8 O8 138.1(5) . .
O7 Li7 Li8 N7 -179.5(3) . .
N8 Li7 Li8 N7 0.0(2) . .
N6 Li7 Li8 N7 86.8(2) . .
Cl2 Li7 Li8 N7 -103.3(2) 3_566 .
Mn5 Li7 Li8 N7 30.30(13) . .
Li6 Li7 Li8 N7 -35.22(17) . .
O7 Li7 Li8 N6 93.7(4) . .
N8 Li7 Li8 N6 -86.8(2) . .
Cl2 Li7 Li8 N6 169.9(2) 3_566 .
Mn5 Li7 Li8 N6 -56.49(14) . .
Li6 Li7 Li8 N6 -122.0(2) . .
O7 Li7 Li8 Cl2 -76.3(4) . 3_566
N8 Li7 Li8 Cl2 103.30(18) . 3_566
N6 Li7 Li8 Cl2 -169.9(2) . 3_566
Mn5 Li7 Li8 Cl2 133.58(18) . 3_566
Li6 Li7 Li8 Cl2 68.06(15) . 3_566
O7 Li7 Li8 Mn5 150.2(4) . .
N8 Li7 Li8 Mn5 -30.28(12) . .
N6 Li7 Li8 Mn5 56.49(14) . .
Cl2 Li7 Li8 Mn5 -133.58(18) 3_566 .
Li6 Li7 Li8 Mn5 -65.52(14) . .
O7 Li7 Li8 Li6 -144.3(4) . .
N8 Li7 Li8 Li6 35.24(16) . .
N6 Li7 Li8 Li6 122.0(2) . .
Cl2 Li7 Li8 Li6 -68.06(15) 3_566 .
Mn5 Li7 Li8 Li6 65.52(14) . .
N1 Mn1 N2 C21 2.6(3) . .
N3 Mn1 N2 C21 127.6(2) . .
N4 Mn1 N2 C21 -121.7(2) . .
Li2 Mn1 N2 C21 -177.2(2) . .
Li3 Mn1 N2 C21 -130.7(3) . .
Li4 Mn1 N2 C21 138.3(3) . .
N1 Mn1 N2 Li4 -135.71(17) . .
N3 Mn1 N2 Li4 -10.69(17) . .
N4 Mn1 N2 Li4 99.98(16) . .
Li2 Mn1 N2 Li4 44.52(19) . .
Li3 Mn1 N2 Li4 91.0(2) . .
N1 Mn1 N2 Li3 133.25(17) . .
N3 Mn1 N2 Li3 -101.73(16) . .
N4 Mn1 N2 Li3 8.94(17) . .
Li2 Mn1 N2 Li3 -46.52(19) . .
Li4 Mn1 N2 Li3 -91.0(2) . .
O4 Li4 N2 C21 12.3(5) . .
N3 Li4 N2 C21 -129.8(3) . .
Cl1 Li4 N2 C21 130.7(2) 3_665 .
Mn1 Li4 N2 C21 -138.7(3) . .
Li2 Li4 N2 C21 -174.4(2) . .
Li3 Li4 N2 C21 138.1(3) . .
O4 Li4 N2 Mn1 151.0(3) . .
N3 Li4 N2 Mn1 8.95(14) . .
Cl1 Li4 N2 Mn1 -90.54(16) 3_665 .
Li2 Li4 N2 Mn1 -35.71(14) . .
Li3 Li4 N2 Mn1 -83.14(15) . .
O4 Li4 N2 Li3 -125.9(3) . .
N3 Li4 N2 Li3 92.1(2) . .
Cl1 Li4 N2 Li3 -7.4(2) 3_665 .
Mn1 Li4 N2 Li3 83.14(15) . .
Li2 Li4 N2 Li3 47.43(19) . .
O3 Li3 N2 C21 -14.1(4) . .
N4 Li3 N2 C21 127.4(2) . .
Cl1 Li3 N2 C21 -133.8(2) 3_665 .
Mn1 Li3 N2 C21 135.0(3) . .
Li4 Li3 N2 C21 -141.1(3) . .
Li2 Li3 N2 C21 171.9(2) . .
O3 Li3 N2 Mn1 -149.0(3) . .
N4 Li3 N2 Mn1 -7.53(14) . .
Cl1 Li3 N2 Mn1 91.25(14) 3_665 .
Li4 Li3 N2 Mn1 83.97(17) . .
Li2 Li3 N2 Mn1 36.90(13) . .
O3 Li3 N2 Li4 127.0(3) . .
N4 Li3 N2 Li4 -91.5(2) . .
Cl1 Li3 N2 Li4 7.3(2) 3_665 .
Mn1 Li3 N2 Li4 -83.97(17) . .
Li2 Li3 N2 Li4 -47.1(2) . .
N1 Mn1 N3 C31 -1.2(3) . .
N2 Mn1 N3 C31 -126.4(3) . .
N4 Mn1 N3 C31 123.1(3) . .
Li2 Mn1 N3 C31 131.8(3) . .
Li3 Mn1 N3 C31 178.1(3) . .
Li4 Mn1 N3 C31 -137.1(3) . .
N1 Mn1 N3 Li2 -132.95(17) . .
N2 Mn1 N3 Li2 101.85(16) . .
N4 Mn1 N3 Li2 -8.68(17) . .
Li3 Mn1 N3 Li2 46.36(19) . .
Li4 Mn1 N3 Li2 91.2(2) . .
N1 Mn1 N3 Li4 135.87(17) . .
N2 Mn1 N3 Li4 10.67(17) . .
N4 Mn1 N3 Li4 -99.86(16) . .
Li2 Mn1 N3 Li4 -91.2(2) . .
Li3 Mn1 N3 Li4 -44.82(19) . .
N4 Li2 N3 C31 -129.9(2) . .
Cl1 Li2 N3 C31 19.3(4) . .
Cl1 Li2 N3 C31 133.0(2) 3_665 .
Mn1 Li2 N3 C31 -137.2(3) . .
Li4 Li2 N3 C31 139.1(3) . .
Li3 Li2 N3 C31 -174.0(2) . .
Li2 Li2 N3 C31 88.9(4) 3_665 .
N4 Li2 N3 Mn1 7.26(14) . .
Cl1 Li2 N3 Mn1 156.4(2) . .
Cl1 Li2 N3 Mn1 -89.81(14) 3_665 .
Li4 Li2 N3 Mn1 -83.71(16) . .
Li3 Li2 N3 Mn1 -36.88(13) . .
Li2 Li2 N3 Mn1 -134.0(3) 3_665 .
N4 Li2 N3 Li4 91.0(2) . .
Cl1 Li2 N3 Li4 -119.9(3) . .
Cl1 Li2 N3 Li4 -6.11(19) 3_665 .
Mn1 Li2 N3 Li4 83.71(16) . .
Li3 Li2 N3 Li4 46.83(19) . .
Li2 Li2 N3 Li4 -50.2(4) 3_665 .
O4 Li4 N3 C31 -8.5(5) . .
N2 Li4 N3 C31 130.8(2) . .
Cl1 Li4 N3 C31 -130.7(2) 3_665 .
Mn1 Li4 N3 C31 139.7(3) . .
Li2 Li4 N3 C31 -137.1(3) . .
Li3 Li4 N3 C31 175.8(2) . .
O4 Li4 N3 Mn1 -148.3(3) . .
N2 Li4 N3 Mn1 -8.94(14) . .
Cl1 Li4 N3 Mn1 89.54(16) 3_665 .
Li2 Li4 N3 Mn1 83.20(15) . .
Li3 Li4 N3 Mn1 36.01(14) . .
O4 Li4 N3 Li2 128.5(4) . .
N2 Li4 N3 Li2 -92.1(2) . .
Cl1 Li4 N3 Li2 6.3(2) 3_665 .
Mn1 Li4 N3 Li2 -83.20(16) . .
Li3 Li4 N3 Li2 -47.19(19) . .
N1 Mn1 N4 C41 3.2(3) . .
N2 Mn1 N4 C41 128.4(2) . .
N3 Mn1 N4 C41 -121.7(2) . .
Li2 Mn1 N4 C41 -130.3(3) . .
Li3 Mn1 N4 C41 137.4(3) . .
Li4 Mn1 N4 C41 -176.8(2) . .
N1 Mn1 N4 Li3 -134.14(17) . .
N2 Mn1 N4 Li3 -9.02(17) . .
N3 Mn1 N4 Li3 100.96(16) . .
Li2 Mn1 N4 Li3 92.3(2) . .
Li4 Mn1 N4 Li3 45.86(19) . .
N1 Mn1 N4 Li2 133.57(17) . .
N2 Mn1 N4 Li2 -101.31(16) . .
N3 Mn1 N4 Li2 8.67(17) . .
Li3 Mn1 N4 Li2 -92.3(2) . .
Li4 Mn1 N4 Li2 -46.43(19) . .
O3 Li3 N4 C41 1.8(5) . .
N2 Li3 N4 C41 -130.4(2) . .
Cl1 Li3 N4 C41 132.2(2) 3_665 .
Mn1 Li3 N4 C41 -137.9(3) . .
Li4 Li3 N4 C41 -175.1(2) . .
Li2 Li3 N4 C41 139.3(3) . .
O3 Li3 N4 Mn1 139.7(4) . .
N2 Li3 N4 Mn1 7.49(14) . .
Cl1 Li3 N4 Mn1 -89.88(15) 3_665 .
Li4 Li3 N4 Mn1 -37.21(14) . .
Li2 Li3 N4 Mn1 -82.82(15) . .
O3 Li3 N4 Li2 -137.5(4) . .
N2 Li3 N4 Li2 90.3(2) . .
Cl1 Li3 N4 Li2 -7.1(2) 3_665 .
Mn1 Li3 N4 Li2 82.82(15) . .
Li4 Li3 N4 Li2 45.61(19) . .
N3 Li2 N4 C41 127.4(2) . .
Cl1 Li2 N4 C41 -15.5(5) . .
Cl1 Li2 N4 C41 -135.2(2) 3_665 .
Mn1 Li2 N4 C41 134.7(2) . .
Li4 Li2 N4 C41 172.3(2) . .
Li3 Li2 N4 C41 -142.1(3) . .
Li2 Li2 N4 C41 -96.6(4) 3_665 .
N3 Li2 N4 Mn1 -7.24(14) . .
Cl1 Li2 N4 Mn1 -150.2(3) . .
Cl1 Li2 N4 Mn1 90.17(14) 3_665 .
Li4 Li2 N4 Mn1 37.64(14) . .
Li3 Li2 N4 Mn1 83.27(16) . .
Li2 Li2 N4 Mn1 128.7(4) 3_665 .
N3 Li2 N4 Li3 -90.5(2) . .
Cl1 Li2 N4 Li3 126.6(3) . .
Cl1 Li2 N4 Li3 6.9(2) 3_665 .
Mn1 Li2 N4 Li3 -83.27(16) . .
Li4 Li2 N4 Li3 -45.63(19) . .
Li2 Li2 N4 Li3 45.5(4) 3_665 .
N5 Mn5 N6 C61 -2.1(3) . .
N8 Mn5 N6 C61 122.2(2) . .
N7 Mn5 N6 C61 -127.3(2) . .
Li6 Mn5 N6 C61 177.6(3) . .
Li7 Mn5 N6 C61 131.4(3) . .
Li8 Mn5 N6 C61 -136.4(3) . .
N5 Mn5 N6 Li7 -133.49(17) . .
N8 Mn5 N6 Li7 -9.12(16) . .
N7 Mn5 N6 Li7 101.37(15) . .
Li6 Mn5 N6 Li7 46.24(18) . .
Li8 Mn5 N6 Li7 92.2(2) . .
N5 Mn5 N6 Li8 134.26(19) . .
N8 Mn5 N6 Li8 -101.37(17) . .
N7 Mn5 N6 Li8 9.12(18) . .
Li6 Mn5 N6 Li8 -46.01(19) . .
Li7 Mn5 N6 Li8 -92.2(2) . .
O7 Li7 N6 C61 13.5(4) . .
N8 Li7 N6 C61 -128.2(2) . .
Cl2 Li7 N6 C61 132.8(2) 3_566 .
Mn5 Li7 N6 C61 -135.8(3) . .
Li6 Li7 N6 C61 -172.0(2) . .
Li8 Li7 N6 C61 141.0(3) . .
O7 Li7 N6 Mn5 149.3(3) . .
N8 Li7 N6 Mn5 7.62(13) . .
Cl2 Li7 N6 Mn5 -91.37(14) 3_566 .
Li6 Li7 N6 Mn5 -36.17(13) . .
Li8 Li7 N6 Mn5 -83.19(16) . .
O7 Li7 N6 Li8 -127.5(3) . .
N8 Li7 N6 Li8 90.81(19) . .
Cl2 Li7 N6 Li8 -8.2(2) 3_566 .
Mn5 Li7 N6 Li8 83.19(16) . .
Li6 Li7 N6 Li8 47.02(19) . .
O8 Li8 N6 C61 -13.8(5) . .
N7 Li8 N6 C61 130.2(2) . .
Cl2 Li8 N6 C61 -130.8(2) 3_566 .
Mn5 Li8 N6 C61 137.9(3) . .
Li6 Li8 N6 C61 174.0(2) . .
Li7 Li8 N6 C61 -138.8(3) . .
O8 Li8 N6 Mn5 -151.8(3) . .
N7 Li8 N6 Mn5 -7.70(15) . .
Cl2 Li8 N6 Mn5 91.27(15) 3_566 .
Li6 Li8 N6 Mn5 36.09(13) . .
Li7 Li8 N6 Mn5 83.23(15) . .
O8 Li8 N6 Li7 125.0(3) . .
N7 Li8 N6 Li7 -90.9(2) . .
Cl2 Li8 N6 Li7 8.05(19) 3_566 .
Mn5 Li8 N6 Li7 -83.23(15) . .
Li6 Li8 N6 Li7 -47.14(19) . .
N5 Mn5 N7 C71 2.6(3) . .
N6 Mn5 N7 C71 128.1(3) . .
N8 Mn5 N7 C71 -121.2(3) . .
Li6 Mn5 N7 C71 -129.7(3) . .
Li7 Mn5 N7 C71 -176.2(3) . .
Li8 Mn5 N7 C71 137.3(3) . .
N5 Mn5 N7 Li6 132.34(17) . .
N6 Mn5 N7 Li6 -102.22(16) . .
N8 Mn5 N7 Li6 8.49(16) . .
Li7 Mn5 N7 Li6 -46.54(18) . .
Li8 Mn5 N7 Li6 -93.0(2) . .
N5 Mn5 N7 Li8 -134.69(19) . .
N6 Mn5 N7 Li8 -9.26(19) . .
N8 Mn5 N7 Li8 101.45(18) . .
Li6 Mn5 N7 Li8 93.0(2) . .
Li7 Mn5 N7 Li8 46.4(2) . .
N8 Li6 N7 C71 128.6(2) . .
Cl2 Li6 N7 C71 -15.3(4) . .
Mn5 Li6 N7 C71 135.8(3) . .
Cl2 Li6 N7 C71 -135.0(2) 3_566 .
Li6 Li6 N7 C71 -93.0(4) 3_566 .
Li8 Li6 N7 C71 -140.4(3) . .
Li7 Li6 N7 C71 172.9(2) . .
N8 Li6 N7 Mn5 -7.16(14) . .
Cl2 Li6 N7 Mn5 -151.1(3) . .
Cl2 Li6 N7 Mn5 89.24(13) 3_566 .
Li6 Li6 N7 Mn5 131.2(3) 3_566 .
Li8 Li6 N7 Mn5 83.79(17) . .
Li7 Li6 N7 Mn5 37.13(13) . .
N8 Li6 N7 Li8 -90.9(2) . .
Cl2 Li6 N7 Li8 125.2(3) . .
Mn5 Li6 N7 Li8 -83.79(17) . .
Cl2 Li6 N7 Li8 5.4(2) 3_566 .
Li6 Li6 N7 Li8 47.4(4) 3_566 .
Li7 Li6 N7 Li8 -46.7(2) . .
O8 Li8 N7 C71 9.7(6) . .
N6 Li8 N7 C71 -131.9(3) . .
Cl2 Li8 N7 C71 132.1(3) 3_566 .
Mn5 Li8 N7 C71 -139.6(3) . .
Li6 Li8 N7 C71 137.7(4) . .
Li7 Li8 N7 C71 -176.2(3) . .
O8 Li8 N7 Mn5 149.2(4) . .
N6 Li8 N7 Mn5 7.64(15) . .
Cl2 Li8 N7 Mn5 -88.34(15) 3_566 .
Li6 Li8 N7 Mn5 -82.71(15) . .
Li7 Li8 N7 Mn5 -36.63(14) . .
O8 Li8 N7 Li6 -128.1(4) . .
N6 Li8 N7 Li6 90.4(2) . .
Cl2 Li8 N7 Li6 -5.6(2) 3_566 .
Mn5 Li8 N7 Li6 82.71(15) . .
Li7 Li8 N7 Li6 46.09(19) . .
N5 Mn5 N8 C81 -4.4(3) . .
N6 Mn5 N8 C81 -129.6(2) . .
N7 Mn5 N8 C81 120.0(2) . .
Li6 Mn5 N8 C81 128.5(3) . .
Li7 Mn5 N8 C81 -138.8(3) . .
Li8 Mn5 N8 C81 174.6(2) . .
N5 Mn5 N8 Li6 -132.85(17) . .
N6 Mn5 N8 Li6 101.97(15) . .
N7 Mn5 N8 Li6 -8.47(16) . .
Li7 Mn5 N8 Li6 92.77(19) . .
Li8 Mn5 N8 Li6 46.14(19) . .
N5 Mn5 N8 Li7 134.38(17) . .
N6 Mn5 N8 Li7 9.20(16) . .
N7 Mn5 N8 Li7 -101.24(15) . .
Li6 Mn5 N8 Li7 -92.77(19) . .
Li8 Mn5 N8 Li7 -46.63(18) . .
N7 Li6 N8 C81 -127.4(2) . .
Cl2 Li6 N8 C81 16.8(4) . .
Mn5 Li6 N8 C81 -134.6(2) . .
Cl2 Li6 N8 C81 135.4(2) 3_566 .
Li6 Li6 N8 C81 93.4(4) 3_566 .
Li8 Li6 N8 C81 -171.5(2) . .
Li7 Li6 N8 C81 141.8(3) . .
N7 Li6 N8 Mn5 7.18(14) . .
Cl2 Li6 N8 Mn5 151.4(3) . .
Cl2 Li6 N8 Mn5 -90.01(14) 3_566 .
Li6 Li6 N8 Mn5 -132.0(3) 3_566 .
Li8 Li6 N8 Mn5 -36.87(13) . .
Li7 Li6 N8 Mn5 -83.56(15) . .
N7 Li6 N8 Li7 90.7(2) . .
Cl2 Li6 N8 Li7 -125.1(3) . .
Mn5 Li6 N8 Li7 83.56(15) . .
Cl2 Li6 N8 Li7 -6.45(19) 3_566 .
Li6 Li6 N8 Li7 -48.5(4) 3_566 .
Li8 Li6 N8 Li7 46.69(19) . .
O7 Li7 N8 C81 -4.2(5) . .
N6 Li7 N8 C81 131.8(2) . .
Cl2 Li7 N8 C81 -131.1(2) 3_566 .
Mn5 Li7 N8 C81 139.4(3) . .
Li6 Li7 N8 C81 -137.8(3) . .
Li8 Li7 N8 C81 176.2(2) . .
O7 Li7 N8 Mn5 -143.7(3) . .
N6 Li7 N8 Mn5 -7.59(13) . .
Cl2 Li7 N8 Mn5 89.51(14) 3_566 .
Li6 Li7 N8 Mn5 82.74(16) . .
Li8 Li7 N8 Mn5 36.74(14) . .
O7 Li7 N8 Li6 133.6(3) . .
N6 Li7 N8 Li6 -90.3(2) . .
Cl2 Li7 N8 Li6 6.8(2) 3_566 .
Mn5 Li7 N8 Li6 -82.74(16) . .
Li8 Li7 N8 Li6 -46.0(2) . .
N4 Li3 O3 C35 3.3(5) . .
N2 Li3 O3 C35 123.4(3) . .
Cl1 Li3 O3 C35 -123.3(3) 3_665 .
Mn1 Li3 O3 C35 74.9(6) . .
Li4 Li3 O3 C35 178.8(3) . .
Li2 Li3 O3 C35 -68.6(6) . .
N4 Li3 O3 C38 149.7(3) . .
N2 Li3 O3 C38 -90.2(4) . .
Cl1 Li3 O3 C38 23.1(4) 3_665 .
Mn1 Li3 O3 C38 -138.8(5) . .
Li4 Li3 O3 C38 -34.8(5) . .
Li2 Li3 O3 C38 77.8(6) . .
N2 Li4 O4 C45 -62.0(5) . .
N3 Li4 O4 C45 62.8(5) . .
Cl1 Li4 O4 C45 -177.4(3) 3_665 .
Mn1 Li4 O4 C45 -4.1(10) . .
Li2 Li4 O4 C45 129.2(5) . .
Li3 Li4 O4 C45 -123.8(4) . .
N2 Li4 O4 C48 98.7(4) . .
N3 Li4 O4 C48 -136.5(4) . .
Cl1 Li4 O4 C48 -16.6(4) 3_665 .
Mn1 Li4 O4 C48 156.6(6) . .
Li2 Li4 O4 C48 -70.0(6) . .
Li3 Li4 O4 C48 36.9(6) . .
N8 Li7 O7 C75 21.0(5) . .
N6 Li7 O7 C75 -101.5(4) . .
Cl2 Li7 O7 C75 144.5(3) 3_566 .
Mn5 Li7 O7 C75 -48.2(7) . .
Li6 Li7 O7 C75 88.7(5) . .
Li8 Li7 O7 C75 -159.6(4) . .
N8 Li7 O7 C78 -144.8(3) . .
N6 Li7 O7 C78 92.7(4) . .
Cl2 Li7 O7 C78 -21.3(4) 3_566 .
Mn5 Li7 O7 C78 146.0(5) . .
Li6 Li7 O7 C78 -77.1(5) . .
Li8 Li7 O7 C78 34.6(5) . .
N7 Li8 O8 C88 1.8(7) . .
N6 Li8 O8 C88 129.5(4) . .
Cl2 Li8 O8 C88 -118.0(4) 3_566 .
Mn5 Li8 O8 C88 70.6(9) . .
Li6 Li8 O8 C88 -63.7(6) . .
Li7 Li8 O8 C88 -169.2(4) . .
N7 Li8 O8 C85 158.9(5) . .
N6 Li8 O8 C85 -73.4(6) . .
Cl2 Li8 O8 C85 39.1(5) 3_566 .
Mn5 Li8 O8 C85 -132.3(7) . .
Li6 Li8 O8 C85 93.4(6) . .
Li7 Li8 O8 C85 -12.1(7) . .
N3 Li2 Cl1 Li4 165.1(2) . 3_665
N4 Li2 Cl1 Li4 -62.9(4) . 3_665
Cl1 Li2 Cl1 Li4 54.4(2) 3_665 3_665
Mn1 Li2 Cl1 Li4 -142.9(6) . 3_665
Li4 Li2 Cl1 Li4 106.2(3) . 3_665
Li3 Li2 Cl1 Li4 8.0(4) . 3_665
Li2 Li2 Cl1 Li4 54.4(2) 3_665 3_665
N3 Li2 Cl1 Li3 65.8(3) . 3_665
N4 Li2 Cl1 Li3 -162.1(3) . 3_665
Cl1 Li2 Cl1 Li3 -44.9(3) 3_665 3_665
Mn1 Li2 Cl1 Li3 117.8(6) . 3_665
Li4 Li2 Cl1 Li3 6.9(4) . 3_665
Li3 Li2 Cl1 Li3 -91.3(4) . 3_665
Li2 Li2 Cl1 Li3 -44.9(3) 3_665 3_665
N3 Li2 Cl1 Li2 110.7(3) . 3_665
N4 Li2 Cl1 Li2 -117.3(4) . 3_665
Cl1 Li2 Cl1 Li2 0.0 3_665 3_665
Mn1 Li2 Cl1 Li2 162.7(8) . 3_665
Li4 Li2 Cl1 Li2 51.8(2) . 3_665
Li3 Li2 Cl1 Li2 -46.4(3) . 3_665
N7 Li6 Cl2 Li7 -66.7(3) . 3_566
N8 Li6 Cl2 Li7 163.3(2) . 3_566
Mn5 Li6 Cl2 Li7 -132.5(5) . 3_566
Cl2 Li6 Cl2 Li7 49.1(2) 3_566 3_566
Li6 Li6 Cl2 Li7 49.1(2) 3_566 3_566
Li8 Li6 Cl2 Li7 -3.7(4) . 3_566
Li7 Li6 Cl2 Li7 100.5(3) . 3_566
N7 Li6 Cl2 Li8 -164.1(2) . 3_566
N8 Li6 Cl2 Li8 65.9(3) . 3_566
Mn5 Li6 Cl2 Li8 130.1(5) . 3_566
Cl2 Li6 Cl2 Li8 -48.3(2) 3_566 3_566
Li6 Li6 Cl2 Li8 -48.3(2) 3_566 3_566
Li8 Li6 Cl2 Li8 -101.1(3) . 3_566
Li7 Li6 Cl2 Li8 3.1(4) . 3_566
N7 Li6 Cl2 Li6 -115.7(4) . 3_566
N8 Li6 Cl2 Li6 114.2(3) . 3_566
Mn5 Li6 Cl2 Li6 178.4(7) . 3_566
Cl2 Li6 Cl2 Li6 0.0 3_566 3_566
Li8 Li6 Cl2 Li6 -52.8(3) . 3_566
Li7 Li6 Cl2 Li6 51.5(3) . 3_566
Mn1 N2 C21 C24 65.7(3) . .
Li4 N2 C21 C24 -173.3(3) . .
Li3 N2 C21 C24 -47.7(3) . .
Mn1 N2 C21 C22 -175.4(2) . .
Li4 N2 C21 C22 -54.3(4) . .
Li3 N2 C21 C22 71.2(3) . .
Mn1 N2 C21 C23 -55.5(3) . .
Li4 N2 C21 C23 65.5(4) . .
Li3 N2 C21 C23 -168.9(2) . .
Mn1 N3 C31 C33 53.3(4) . .
Li2 N3 C31 C33 168.7(3) . .
Li4 N3 C31 C33 -67.5(4) . .
Mn1 N3 C31 C34 -69.5(3) . .
Li2 N3 C31 C34 45.9(3) . .
Li4 N3 C31 C34 169.7(3) . .
Mn1 N3 C31 C32 172.5(2) . .
Li2 N3 C31 C32 -72.1(3) . .
Li4 N3 C31 C32 51.8(4) . .
C38 O3 C35 C36 -41.8(4) . .
Li3 O3 C35 C36 108.0(3) . .
O3 C35 C36 C37 37.1(4) . .
C35 C36 C37 C38 -19.2(4) . .
C35 O3 C38 C37 28.9(4) . .
Li3 O3 C38 C37 -124.1(3) . .
C36 C37 C38 O3 -4.8(4) . .
Mn1 N4 C41 C42 -61.4(3) . .
Li3 N4 C41 C42 58.2(4) . .
Li2 N4 C41 C42 -174.3(2) . .
Mn1 N4 C41 C44 60.8(3) . .
Li3 N4 C41 C44 -179.6(3) . .
Li2 N4 C41 C44 -52.1(3) . .
Mn1 N4 C41 C43 179.3(2) . .
Li3 N4 C41 C43 -61.1(3) . .
Li2 N4 C41 C43 66.4(3) . .
C48 O4 C45 C46 0.8(5) . .
Li4 O4 C45 C46 163.4(3) . .
O4 C45 C46 C47 13.5(5) . .
C45 C46 C47 C48 -23.8(6) . .
C46 C47 C48 O4 24.8(6) . .
C45 O4 C48 C47 -15.8(6) . .
Li4 O4 C48 C47 -179.6(4) . .
Mn5 N6 C61 C62 62.7(4) . .
Li7 N6 C61 C62 177.2(3) . .
Li8 N6 C61 C62 -56.3(4) . .
Mn5 N6 C61 C64 -178.6(2) . .
Li7 N6 C61 C64 -64.1(3) . .
Li8 N6 C61 C64 62.4(4) . .
Mn5 N6 C61 C63 -60.1(4) . .
Li7 N6 C61 C63 54.3(3) . .
Li8 N6 C61 C63 -179.1(3) . .
Mn5 N7 C71 C74 -68.4(3) . .
Li6 N7 C71 C74 178.6(3) . .
Li8 N7 C71 C74 52.6(4) . .
Mn5 N7 C71 C73 53.6(4) . .
Li6 N7 C71 C73 -59.5(4) . .
Li8 N7 C71 C73 174.5(4) . .
Mn5 N7 C71 C72 172.1(2) . .
Li6 N7 C71 C72 59.0(3) . .
Li8 N7 C71 C72 -66.9(4) . .
C78 O7 C75 C76' 25.3(19) . .
Li7 O7 C75 C76' -141.9(19) . .
C78 O7 C75 C76 -1.2(7) . .
Li7 O7 C75 C76 -168.4(6) . .
O7 C75 C76 C77 18.6(10) . .
C76' C75 C76 C77 -70(3) . .
O7 C75 C76' C77 -23(3) . .
C76 C75 C76' C77 76(3) . .
C75 C76' C77 C78 12(3) . .
C75 C76' C77 C76 -78(3) . .
C75 C76 C77 C76' 68(3) . .
C75 C76 C77 C78 -28.2(9) . .
C75 O7 C78 C77 -17.2(4) . .
Li7 O7 C78 C77 151.1(3) . .
C76' C77 C78 O7 2.6(19) . .
C76 C77 C78 O7 28.4(6) . .
Mn5 N8 C81 C82 -60.1(3) . .
Li6 N8 C81 C82 51.6(3) . .
Li7 N8 C81 C82 178.2(2) . .
Mn5 N8 C81 C83 -179.07(18) . .
Li6 N8 C81 C83 -67.4(3) . .
Li7 N8 C81 C83 59.2(3) . .
Mn5 N8 C81 C84 61.6(3) . .
Li6 N8 C81 C84 173.2(2) . .
Li7 N8 C81 C84 -60.1(3) . .
C87 C86 C85 O8 -29.1(7) . .
C88 O8 C85 C86 12.2(7) . .
Li8 O8 C85 C86 -149.7(4) . .
C85 C86 C87 C88 34.8(6) . .
C85 O8 C88 C87 9.6(6) . .
Li8 O8 C88 C87 168.6(5) . .
C86 C87 C88 O8 -27.9(6) . .
