#------------------------------------------------------------------------------
#$Date: 2016-03-21 08:20:38 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178603 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/14/4071489.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_4071489
loop_
_publ_author_name
'Chen, Chao'
'Fröhlich, Roland'
'Kehr, Gerald'
'Erker, Gerhard'
_publ_section_title
;
 Structural Features of Lithio[3]ferrocenophane Systems Bearing
 Stabilizing Dimethylamino Substituents
;
_journal_issue                   13
_journal_name_full               Organometallics
_journal_page_first              3248
_journal_paper_doi               10.1021/om8001894
_journal_volume                  27
_journal_year                    2008
_chemical_formula_sum            'C38 H54 Fe2 Li4 N2'
_chemical_formula_weight         678.29
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/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                 124.613(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   21.6614(3)
_cell_length_b                   10.6671(2)
_cell_length_c                   19.0435(3)
_cell_measurement_reflns_used    3958
_cell_measurement_temperature    198(2)
_cell_measurement_theta_max      27.88
_cell_measurement_theta_min      0.41
_cell_volume                     3621.46(11)
_computing_cell_refinement       'Collect (Nonius B.V., 1998)'
_computing_data_collection       'Collect (Nonius B.V., 1998)'
_computing_data_reduction        'Denzo-SMN (Otwinowski & Minor, 1997)'
_computing_molecular_graphics
'XP (BrukerAXS, 2000) & SCHAKAL (Keller, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      198(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode Nonius FR591'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0480
_diffrn_reflns_av_sigmaI/netI    0.0383
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            13024
_diffrn_reflns_theta_full        27.86
_diffrn_reflns_theta_max         27.86
_diffrn_reflns_theta_min         2.28
_exptl_absorpt_coefficient_mu    0.828
_exptl_absorpt_correction_T_max  0.8518
_exptl_absorpt_correction_T_min  0.7069
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SORTAV (Blessing, 1995 & 1997)'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.244
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1440
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.406
_refine_diff_density_min         -0.442
_refine_diff_density_rms         0.046
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     240
_refine_ls_number_reflns         4263
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0525
_refine_ls_R_factor_gt           0.0371
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0448P)²+2.9764P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0943
_refine_ls_wR_factor_ref         0.1023
_reflns_number_gt                3394
_reflns_number_total             4263
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om8001894-file002.cif
_cod_data_source_block           erk4179
_cod_original_cell_volume        3621.46(10)
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               4071489
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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
Fe Fe 0.140354(14) 0.16359(2) 0.186921(17) 0.03693(11) Uani 1 1 d . A .
Li1 Li 0.04667(19) 0.3182(3) 0.2332(2) 0.0436(8) Uani 1 1 d . . .
Li2 Li 0.05669(17) 0.1535(3) 0.3294(2) 0.0387(7) Uani 1 1 d . . .
N1 N 0.13748(9) 0.01311(16) 0.39236(11) 0.0450(4) Uani 1 1 d . . .
C1 C 0.24170(11) 0.23041(19) 0.27789(14) 0.0450(5) Uani 1 1 d . . .
C2 C 0.24325(12) 0.1833(2) 0.20870(16) 0.0496(5) Uani 1 1 d . A .
H2 H 0.2748 0.1182 0.2123 0.059 Uiso 1 1 calc R . .
C3 C 0.18981(13) 0.2500(2) 0.13386(16) 0.0556(6) Uani 1 1 d . . .
H3 H 0.1789 0.2364 0.0786 0.067 Uiso 1 1 calc R A .
C4 C 0.15523(13) 0.3408(2) 0.15555(17) 0.0533(6) Uani 1 1 d . A .
H4 H 0.1171 0.3983 0.1175 0.064 Uiso 1 1 calc R . .
C5 C 0.18793(12) 0.33010(18) 0.24447(16) 0.0473(5) Uani 1 1 d . A .
H5 H 0.1761 0.3806 0.2764 0.057 Uiso 1 1 calc R . .
C6 C 0.28339(11) 0.1783(2) 0.36635(15) 0.0518(5) Uani 1 1 d . A .
H6A H 0.3226 0.2389 0.4058 0.062 Uiso 1 1 calc R . .
H6B H 0.3089 0.1001 0.3682 0.062 Uiso 1 1 calc R . .
C8 C 0.23358(11) 0.1497(2) 0.39810(14) 0.0479(5) Uani 1 1 d . . .
H8A H 0.2018 0.2238 0.3873 0.057 Uiso 1 1 calc R A .
H8B H 0.2662 0.1361 0.4606 0.057 Uiso 1 1 calc R . .
C9 C 0.18250(10) 0.03440(19) 0.35588(13) 0.0412(4) Uani 1 1 d . A .
H9 H 0.2151 -0.0406 0.3691 0.049 Uiso 1 1 calc R . .
C10 C 0.12770(9) 0.04383(16) 0.25971(12) 0.0347(4) Uani 1 1 d . . .
C11 C 0.13378(10) -0.02412(18) 0.19927(14) 0.0425(5) Uani 1 1 d . A .
H11 H 0.1711 -0.0846 0.2125 0.051 Uiso 1 1 calc R . .
C12 C 0.07486(11) 0.01397(19) 0.11664(14) 0.0459(5) Uani 1 1 d . . .
H12 H 0.0657 -0.0150 0.0643 0.055 Uiso 1 1 calc R A .
C13 C 0.03165(10) 0.10415(19) 0.12636(13) 0.0407(4) Uani 1 1 d . . .
H13 H -0.0116 0.1449 0.0803 0.049 Uiso 1 1 calc R . .
C14 C 0.06238(10) 0.12577(18) 0.21602(12) 0.0350(4) Uani 1 1 d . . .
C15 C 0.09938(14) -0.1074(2) 0.36243(18) 0.0608(6) Uani 1 1 d . A .
H15A H 0.1366 -0.1749 0.3858 0.091 Uiso 1 1 calc R . .
H15B H 0.0698 -0.1099 0.3000 0.091 Uiso 1 1 calc R . .
H15C H 0.0661 -0.1183 0.3814 0.091 Uiso 1 1 calc R . .
C16 C 0.18370(14) 0.0130(3) 0.48683(15) 0.0652(7) Uani 1 1 d . A .
H16A H 0.1530 -0.0141 0.5069 0.098 Uiso 1 1 calc R . .
H16B H 0.2027 0.0978 0.5079 0.098 Uiso 1 1 calc R . .
H16C H 0.2260 -0.0447 0.5083 0.098 Uiso 1 1 calc R . .
C21 C -0.07276(12) 0.3657(2) 0.13916(14) 0.0468(5) Uani 0.696(7) 1 d P A 1
H21A H -0.1019 0.3085 0.0898 0.056 Uiso 0.696(7) 1 calc PR A 1
H21B H -0.1010 0.3958 0.1623 0.056 Uiso 0.696(7) 1 calc PR A 1
C22 C -0.0213(3) 0.4637(4) 0.1346(3) 0.0463(10) Uani 0.696(7) 1 d P A 1
H22A H 0.0124 0.5008 0.1921 0.056 Uiso 0.696(7) 1 calc PR A 1
H22B H 0.0106 0.4180 0.1212 0.056 Uiso 0.696(7) 1 calc PR A 1
C23 C -0.0592(2) 0.5695(3) 0.0716(2) 0.0557(11) Uani 0.696(7) 1 d P A 1
H23A H -0.0896 0.6186 0.0856 0.067 Uiso 0.696(7) 1 calc PR A 1
H23B H -0.0937 0.5340 0.0137 0.067 Uiso 0.696(7) 1 calc PR A 1
C24 C -0.0037(4) 0.6572(7) 0.0709(4) 0.0634(15) Uani 0.696(7) 1 d P A 1
H24A H 0.0303 0.6935 0.1278 0.095 Uiso 0.696(7) 1 calc PR A 1
H24B H -0.0312 0.7245 0.0294 0.095 Uiso 0.696(7) 1 calc PR A 1
H24C H 0.0254 0.6098 0.0551 0.095 Uiso 0.696(7) 1 calc PR A 1
C21A C -0.07276(12) 0.3657(2) 0.13916(14) 0.0468(5) Uani 0.304(7) 1 d P A 2
H21C H -0.1039 0.2930 0.1051 0.056 Uiso 0.304(7) 1 calc PR A 2
H21D H -0.0958 0.4109 0.1643 0.056 Uiso 0.304(7) 1 calc PR A 2
C22A C -0.0512(6) 0.4543(9) 0.0895(7) 0.054(2) Uani 0.304(7) 1 d P A 2
H22C H -0.0185 0.4091 0.0771 0.065 Uiso 0.304(7) 1 calc PR A 2
H22D H -0.0969 0.4818 0.0348 0.065 Uiso 0.304(7) 1 calc PR A 2
C23A C -0.0103(5) 0.5661(8) 0.1460(6) 0.064(3) Uani 0.304(7) 1 d P A 2
H23C H 0.0310 0.5351 0.2028 0.076 Uiso 0.304(7) 1 calc PR A 2
H23D H -0.0455 0.6127 0.1538 0.076 Uiso 0.304(7) 1 calc PR A 2
C24A C 0.0227(11) 0.6580(17) 0.1134(11) 0.080(4) Uani 0.304(7) 1 d P A 2
H24D H 0.0542 0.6120 0.1004 0.120 Uiso 0.304(7) 1 calc PR A 2
H24E H 0.0530 0.7211 0.1574 0.120 Uiso 0.304(7) 1 calc PR A 2
H24F H -0.0182 0.6996 0.0617 0.120 Uiso 0.304(7) 1 calc PR A 2
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'
Fe Fe 0.3463 0.8444 '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
C1 Fe C10 98.12(8) . .
C1 Fe C11 111.44(8) . .
C10 Fe C11 41.35(8) . .
C1 Fe C2 41.45(9) . .
C10 Fe C2 119.15(8) . .
C11 Fe C2 102.67(8) . .
C1 Fe C5 41.56(8) . .
C10 Fe C5 114.10(8) . .
C11 Fe C5 147.82(9) . .
C2 Fe C5 68.80(8) . .
C1 Fe C13 160.50(8) . .
C10 Fe C13 68.21(8) . .
C11 Fe C13 68.03(8) . .
C2 Fe C13 157.48(9) . .
C5 Fe C13 130.00(8) . .
C1 Fe C12 148.77(9) . .
C10 Fe C12 68.97(8) . .
C11 Fe C12 40.45(8) . .
C2 Fe C12 119.09(8) . .
C5 Fe C12 169.68(9) . .
C13 Fe C12 40.75(8) . .
C1 Fe C3 69.22(9) . .
C10 Fe C3 158.82(9) . .
C11 Fe C3 126.01(9) . .
C2 Fe C3 40.43(9) . .
C5 Fe C3 68.17(9) . .
C13 Fe C3 127.89(9) . .
C12 Fe C3 112.84(9) . .
C1 Fe C4 69.47(9) . .
C10 Fe C4 152.26(9) . .
C11 Fe C4 165.99(9) . .
C2 Fe C4 68.32(9) . .
C5 Fe C4 40.59(10) . .
C13 Fe C4 116.08(9) . .
C12 Fe C4 133.57(10) . .
C3 Fe C4 40.35(9) . .
C1 Fe C14 119.49(8) . .
C10 Fe C14 41.45(7) . .
C11 Fe C14 70.08(7) . .
C2 Fe C14 157.13(9) . .
C5 Fe C14 105.29(8) . .
C13 Fe C14 41.15(8) . .
C12 Fe C14 70.09(8) . .
C3 Fe C14 159.69(9) . .
C4 Fe C14 122.37(8) . .
C1 Fe Li1 97.90(9) . .
C10 Fe Li1 77.01(8) . .
C11 Fe Li1 112.99(8) . .
C2 Fe Li1 134.78(9) . .
C5 Fe Li1 66.18(8) . .
C13 Fe Li1 66.20(8) . .
C12 Fe Li1 106.11(8) . .
C3 Fe Li1 120.48(9) . .
C4 Fe Li1 80.23(9) . .
C14 Fe Li1 43.28(8) . .
C14 Li1 C21 108.13(16) . .
C14 Li1 C21A 115.09(17) . 2
C21 Li1 C21A 106.70(16) . 2
C14 Li1 C21 115.09(17) . 2
C21 Li1 C21 106.70(16) . 2
C21A Li1 C21 0.00(10) 2 2
C14 Li1 C22 128.8(2) . .
C21 Li1 C22 41.29(13) . .
C21A Li1 C22 113.5(2) 2 .
C21 Li1 C22 113.5(2) 2 .
C14 Li1 Li1 105.53(10) . 2
C21 Li1 Li1 56.68(14) . 2
C21A Li1 Li1 56.42(15) 2 2
C21 Li1 Li1 56.42(15) 2 2
C22 Li1 Li1 88.36(17) . 2
C14 Li1 Li2 58.22(12) . .
C21 Li1 Li2 109.57(16) . .
C21A Li1 Li2 59.13(13) 2 .
C21 Li1 Li2 59.13(13) 2 .
C22 Li1 Li2 149.61(19) . .
Li1 Li1 Li2 62.63(13) 2 .
C14 Li1 Li2 55.93(11) . 2
C21 Li1 Li2 57.74(12) . 2
C21A Li1 Li2 106.26(16) 2 2
C21 Li1 Li2 106.26(16) 2 2
C22 Li1 Li2 95.82(19) . 2
Li1 Li1 Li2 58.96(12) 2 2
Li2 Li1 Li2 62.50(16) . 2
C14 Li1 C22A 117.2(3) . .
C21 Li1 C22A 35.3(2) . .
C21A Li1 C22A 123.0(3) 2 .
C21 Li1 C22A 123.0(3) 2 .
C22 Li1 C22A 12.2(2) . .
Li1 Li1 C22A 88.6(3) 2 .
Li2 Li1 C22A 144.6(3) . .
Li2 Li1 C22A 85.5(3) 2 .
C14 Li1 Fe 42.24(8) . .
C21 Li1 Fe 122.96(15) . .
C21A Li1 Fe 129.15(15) 2 .
C21 Li1 Fe 129.15(15) 2 .
C22 Li1 Fe 110.89(17) . .
Li1 Li1 Fe 147.76(6) 2 .
Li2 Li1 Fe 92.13(12) . .
Li2 Li1 Fe 92.48(12) 2 .
C22A Li1 Fe 104.9(2) . .
N1 Li2 C14 122.42(16) . 2
N1 Li2 C14 88.36(13) . .
C14 Li2 C14 106.99(14) 2 .
N1 Li2 C21A 126.78(17) . 2
C14 Li2 C21A 101.62(14) 2 2
C14 Li2 C21A 107.10(15) . 2
N1 Li2 C21 126.78(17) . 2
C14 Li2 C21 101.62(14) 2 2
C14 Li2 C21 107.10(15) . 2
C21A Li2 C21 0.00(13) 2 2
N1 Li2 Li1 129.12(17) . .
C14 Li2 Li1 102.31(15) 2 .
C14 Li2 Li1 53.73(12) . .
C21A Li2 Li1 55.31(12) 2 .
C21 Li2 Li1 55.31(12) 2 .
N1 Li2 C13 101.78(14) . 2
C14 Li2 C13 34.73(8) 2 2
C14 Li2 C13 138.69(16) . 2
C21A Li2 C13 98.50(13) 2 2
C21 Li2 C13 98.50(13) 2 2
Li1 Li2 C13 129.06(16) . 2
N1 Li2 Li1 172.20(18) . 2
C14 Li2 Li1 52.65(11) 2 2
C14 Li2 Li1 98.86(15) . 2
C21A Li2 Li1 53.87(11) 2 2
C21 Li2 Li1 53.87(11) 2 2
Li1 Li2 Li1 58.41(16) . 2
C13 Li2 Li1 70.82(12) 2 2
N1 Li2 Li2 126.75(13) . 2
C14 Li2 Li2 55.02(12) 2 2
C14 Li2 Li2 54.08(12) . 2
C21A Li2 Li2 101.82(10) 2 2
C21 Li2 Li2 101.82(10) 2 2
Li1 Li2 Li2 60.44(13) . 2
C13 Li2 Li2 89.67(16) 2 2
Li1 Li2 Li2 57.06(12) 2 2
N1 Li2 C9 32.09(7) . .
C14 Li2 C9 144.04(15) 2 .
C14 Li2 C9 62.08(10) . .
C21A Li2 C9 114.30(14) 2 .
C21 Li2 C9 114.30(14) 2 .
Li1 Li2 C9 97.12(14) . .
C13 Li2 C9 133.55(14) 2 .
Li1 Li2 C9 155.53(16) 2 .
Li2 Li2 C9 113.07(16) 2 .
C15 N1 C16 108.46(18) . .
C15 N1 C9 108.96(17) . .
C16 N1 C9 113.18(16) . .
C15 N1 Li2 107.72(16) . .
C16 N1 Li2 117.74(18) . .
C9 N1 Li2 100.30(14) . .
C2 C1 C5 106.9(2) . .
C2 C1 C6 126.4(2) . .
C5 C1 C6 126.56(19) . .
C2 C1 Fe 70.45(12) . .
C5 C1 Fe 70.40(11) . .
C6 C1 Fe 120.42(14) . .
C3 C2 C1 108.55(19) . .
C3 C2 Fe 70.84(12) . .
C1 C2 Fe 68.10(11) . .
C2 C3 C4 108.3(2) . .
C2 C3 Fe 68.73(12) . .
C4 C3 Fe 69.88(11) . .
C5 C4 C3 107.6(2) . .
C5 C4 Fe 68.61(11) . .
C3 C4 Fe 69.77(12) . .
C4 C5 C1 108.58(19) . .
C4 C5 Fe 70.80(12) . .
C1 C5 Fe 68.05(11) . .
C1 C6 C8 114.02(17) . .
C6 C8 C9 114.17(18) . .
N1 C9 C10 107.45(14) . .
N1 C9 C8 110.00(16) . .
C10 C9 C8 114.49(16) . .
N1 C9 Li2 47.61(10) . .
C10 C9 Li2 74.75(12) . .
C8 C9 Li2 93.96(13) . .
C11 C10 C14 110.40(17) . .
C11 C10 C9 124.88(16) . .
C14 C10 C9 124.70(16) . .
C11 C10 Fe 69.91(11) . .
C14 C10 Fe 72.19(10) . .
C9 C10 Fe 123.60(12) . .
C12 C11 C10 108.28(17) . .
C12 C11 Fe 70.44(12) . .
C10 C11 Fe 68.74(11) . .
C11 C12 C13 107.12(18) . .
C11 C12 Fe 69.11(11) . .
C13 C12 Fe 69.60(11) . .
C12 C13 C14 111.26(18) . .
C12 C13 Fe 69.65(11) . .
C14 C13 Fe 71.16(10) . .
C12 C13 Li2 148.76(17) . 2
C14 C13 Li2 60.54(12) . 2
Fe C13 Li2 126.15(11) . 2
C13 C14 C10 102.92(16) . .
C13 C14 Fe 67.69(10) . .
C10 C14 Fe 66.35(9) . .
C13 C14 Li1 108.99(17) . .
C10 C14 Li1 132.60(16) . .
Fe C14 Li1 94.48(12) . .
C13 C14 Li2 84.72(14) . 2
C10 C14 Li2 146.86(15) . 2
Fe C14 Li2 143.33(13) . 2
Li1 C14 Li2 71.42(13) . 2
C13 C14 Li2 155.21(15) . .
C10 C14 Li2 95.50(14) . .
Fe C14 Li2 136.08(12) . .
Li1 C14 Li2 68.05(14) . .
Li2 C14 Li2 70.90(14) 2 .
C22 C21 Li1 69.9(2) . .
C23 C22 C21 117.5(3) . .
C23 C22 Li1 173.6(3) . .
C21 C22 Li1 68.81(18) . .
C22 C23 C24 113.0(4) . .
C23A C22A Li1 84.2(6) . .
C22A C23A C24A 115.7(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Fe C1 2.0019(19) .
Fe C10 2.0150(18) .
Fe C11 2.031(2) .
Fe C2 2.0332(19) .
Fe C5 2.033(2) .
Fe C13 2.0473(18) .
Fe C12 2.0480(19) .
Fe C3 2.061(2) .
Fe C4 2.062(2) .
Fe C14 2.0943(17) .
Fe Li1 3.106(3) .
Li1 C14 2.136(4) .
Li1 C21 2.212(4) .
Li1 C21A 2.219(4) 2
Li1 C21 2.219(4) 2
Li1 C22 2.228(5) .
Li1 Li1 2.443(7) 2
Li1 Li2 2.457(5) .
Li1 Li2 2.547(5) 2
Li1 C22A 2.739(12) .
Li2 N1 2.088(4) .
Li2 C14 2.226(3) 2
Li2 C14 2.252(4) .
Li2 C21A 2.316(4) 2
Li2 C21 2.316(4) 2
Li2 C13 2.545(4) 2
Li2 Li1 2.547(5) 2
Li2 Li2 2.597(6) 2
Li2 C9 2.781(4) .
N1 C15 1.457(3) .
N1 C16 1.481(3) .
N1 C9 1.502(2) .
C1 C2 1.428(3) .
C1 C5 1.432(3) .
C1 C6 1.495(3) .
C2 C3 1.415(3) .
C3 C4 1.422(3) .
C4 C5 1.421(3) .
C6 C8 1.537(3) .
C8 C9 1.540(3) .
C9 C10 1.518(3) .
C10 C11 1.428(3) .
C10 C14 1.456(2) .
C11 C12 1.410(3) .
C12 C13 1.426(3) .
C13 C14 1.456(3) .
C13 Li2 2.545(4) 2
C14 Li2 2.226(3) 2
C21 C22 1.566(4) .
C22 C23 1.506(5) .
C23 C24 1.529(8) .
C22A C23A 1.510(14) .
C23A C24A 1.537(19) .
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
C1 Fe Li1 C14 -125.28(12) . .
C10 Fe Li1 C14 -28.72(11) . .
C11 Fe Li1 C14 -7.92(14) . .
C2 Fe Li1 C14 -147.10(13) . .
C5 Fe Li1 C14 -152.78(14) . .
C13 Fe Li1 C14 42.94(11) . .
C12 Fe Li1 C14 34.53(13) . .
C3 Fe Li1 C14 164.22(12) . .
C4 Fe Li1 C14 167.24(13) . .
C1 Fe Li1 C21 154.07(16) . .
C10 Fe Li1 C21 -109.37(17) . .
C11 Fe Li1 C21 -88.57(17) . .
C2 Fe Li1 C21 132.25(16) . .
C5 Fe Li1 C21 126.57(19) . .
C13 Fe Li1 C21 -37.71(15) . .
C12 Fe Li1 C21 -46.12(18) . .
C3 Fe Li1 C21 83.57(18) . .
C4 Fe Li1 C21 86.59(17) . .
C14 Fe Li1 C21 -80.65(17) . .
C1 Fe Li1 C21A -40.06(19) . 2
C10 Fe Li1 C21A 56.50(17) . 2
C11 Fe Li1 C21A 77.30(19) . 2
C2 Fe Li1 C21A -61.9(2) . 2
C5 Fe Li1 C21A -67.55(18) . 2
C13 Fe Li1 C21A 128.2(2) . 2
C12 Fe Li1 C21A 119.75(18) . 2
C3 Fe Li1 C21A -110.55(18) . 2
C4 Fe Li1 C21A -107.53(19) . 2
C14 Fe Li1 C21A 85.2(2) . 2
C1 Fe Li1 C21 -40.06(19) . 2
C10 Fe Li1 C21 56.50(17) . 2
C11 Fe Li1 C21 77.30(19) . 2
C2 Fe Li1 C21 -61.9(2) . 2
C5 Fe Li1 C21 -67.55(18) . 2
C13 Fe Li1 C21 128.2(2) . 2
C12 Fe Li1 C21 119.75(18) . 2
C3 Fe Li1 C21 -110.55(18) . 2
C4 Fe Li1 C21 -107.53(19) . 2
C14 Fe Li1 C21 85.2(2) . 2
C1 Fe Li1 C22 109.39(18) . .
C10 Fe Li1 C22 -154.05(19) . .
C11 Fe Li1 C22 -133.25(17) . .
C2 Fe Li1 C22 87.6(2) . .
C5 Fe Li1 C22 81.89(19) . .
C13 Fe Li1 C22 -82.39(19) . .
C12 Fe Li1 C22 -90.80(19) . .
C3 Fe Li1 C22 38.9(2) . .
C4 Fe Li1 C22 41.91(18) . .
C14 Fe Li1 C22 -125.3(2) . .
C1 Fe Li1 Li1 -127.4(4) . 2
C10 Fe Li1 Li1 -30.9(4) . 2
C11 Fe Li1 Li1 -10.1(5) . 2
C2 Fe Li1 Li1 -149.2(4) . 2
C5 Fe Li1 Li1 -154.9(5) . 2
C13 Fe Li1 Li1 40.8(4) . 2
C12 Fe Li1 Li1 32.4(4) . 2
C3 Fe Li1 Li1 162.1(4) . 2
C4 Fe Li1 Li1 165.1(4) . 2
C14 Fe Li1 Li1 -2.1(4) . 2
C1 Fe Li1 Li2 -90.87(13) . .
C10 Fe Li1 Li2 5.69(11) . .
C11 Fe Li1 Li2 26.49(15) . .
C2 Fe Li1 Li2 -112.69(15) . .
C5 Fe Li1 Li2 -118.37(15) . .
C13 Fe Li1 Li2 77.35(13) . .
C12 Fe Li1 Li2 68.94(14) . .
C3 Fe Li1 Li2 -161.36(12) . .
C4 Fe Li1 Li2 -158.35(14) . .
C14 Fe Li1 Li2 34.41(11) . .
C1 Fe Li1 Li2 -153.43(12) . 2
C10 Fe Li1 Li2 -56.87(12) . 2
C11 Fe Li1 Li2 -36.06(14) . 2
C2 Fe Li1 Li2 -175.24(13) . 2
C5 Fe Li1 Li2 179.08(15) . 2
C13 Fe Li1 Li2 14.80(11) . 2
C12 Fe Li1 Li2 6.39(14) . 2
C3 Fe Li1 Li2 136.08(12) . 2
C4 Fe Li1 Li2 139.10(14) . 2
C14 Fe Li1 Li2 -28.14(11) . 2
C1 Fe Li1 C22A 120.5(2) . .
C10 Fe Li1 C22A -142.9(3) . .
C11 Fe Li1 C22A -122.1(2) . .
C2 Fe Li1 C22A 98.7(3) . .
C5 Fe Li1 C22A 93.0(3) . .
C13 Fe Li1 C22A -71.2(2) . .
C12 Fe Li1 C22A -79.7(2) . .
C3 Fe Li1 C22A 50.0(3) . .
C4 Fe Li1 C22A 53.1(2) . .
C14 Fe Li1 C22A -114.2(3) . .
C14 Li1 Li2 N1 50.0(2) . .
C21 Li1 Li2 N1 149.72(19) . .
C21A Li1 Li2 N1 -112.1(2) 2 .
C21 Li1 Li2 N1 -112.1(2) 2 .
C22 Li1 Li2 N1 163.7(4) . .
Li1 Li1 Li2 N1 -177.5(2) 2 .
Li2 Li1 Li2 N1 115.2(2) 2 .
C22A Li1 Li2 N1 143.2(4) . .
Fe Li1 Li2 N1 23.5(2) . .
C14 Li1 Li2 C14 -102.17(15) . 2
C21 Li1 Li2 C14 -2.5(2) . 2
C21A Li1 Li2 C14 95.73(15) 2 2
C21 Li1 Li2 C14 95.73(15) 2 2
C22 Li1 Li2 C14 11.5(5) . 2
Li1 Li1 Li2 C14 30.32(16) 2 2
Li2 Li1 Li2 C14 -37.03(14) 2 2
C22A Li1 Li2 C14 -9.0(5) . 2
Fe Li1 Li2 C14 -128.72(12) . 2
C21 Li1 Li2 C14 99.69(18) . .
C21A Li1 Li2 C14 -162.10(16) 2 .
C21 Li1 Li2 C14 -162.10(16) 2 .
C22 Li1 Li2 C14 113.7(5) . .
Li1 Li1 Li2 C14 132.49(19) 2 .
Li2 Li1 Li2 C14 65.14(11) 2 .
C22A Li1 Li2 C14 93.2(5) . .
Fe Li1 Li2 C14 -26.55(8) . .
C14 Li1 Li2 C21A 162.10(16) . 2
C21 Li1 Li2 C21A -98.21(18) . 2
C21 Li1 Li2 C21A 0.0 2 2
C22 Li1 Li2 C21A -84.2(4) . 2
Li1 Li1 Li2 C21A -65.41(13) 2 2
Li2 Li1 Li2 C21A -132.76(17) 2 2
C22A Li1 Li2 C21A -104.7(5) . 2
Fe Li1 Li2 C21A 135.55(13) . 2
C14 Li1 Li2 C21 162.10(16) . 2
C21 Li1 Li2 C21 -98.21(18) . 2
C21A Li1 Li2 C21 0.0 2 2
C22 Li1 Li2 C21 -84.2(4) . 2
Li1 Li1 Li2 C21 -65.41(13) 2 2
Li2 Li1 Li2 C21 -132.76(17) 2 2
C22A Li1 Li2 C21 -104.7(5) . 2
Fe Li1 Li2 C21 135.55(13) . 2
C14 Li1 Li2 C13 -127.2(2) . 2
C21 Li1 Li2 C13 -27.5(3) . 2
C21A Li1 Li2 C13 70.7(2) 2 2
C21 Li1 Li2 C13 70.7(2) 2 2
C22 Li1 Li2 C13 -13.5(5) . 2
Li1 Li1 Li2 C13 5.3(2) 2 2
Li2 Li1 Li2 C13 -62.0(2) 2 2
C22A Li1 Li2 C13 -34.0(5) . 2
Fe Li1 Li2 C13 -153.73(17) . 2
C14 Li1 Li2 Li1 -132.49(19) . 2
C21 Li1 Li2 Li1 -32.81(16) . 2
C21A Li1 Li2 Li1 65.41(13) 2 2
C21 Li1 Li2 Li1 65.41(13) 2 2
C22 Li1 Li2 Li1 -18.8(4) . 2
Li2 Li1 Li2 Li1 -67.35(17) 2 2
C22A Li1 Li2 Li1 -39.3(5) . 2
Fe Li1 Li2 Li1 -159.04(18) . 2
C14 Li1 Li2 Li2 -65.14(11) . 2
C21 Li1 Li2 Li2 34.54(16) . 2
C21A Li1 Li2 Li2 132.76(17) 2 2
C21 Li1 Li2 Li2 132.76(17) 2 2
C22 Li1 Li2 Li2 48.6(4) . 2
Li1 Li1 Li2 Li2 67.35(17) 2 2
C22A Li1 Li2 Li2 28.0(5) . 2
Fe Li1 Li2 Li2 -91.69(13) . 2
C14 Li1 Li2 C9 47.39(11) . .
C21 Li1 Li2 C9 147.08(15) . .
C21A Li1 Li2 C9 -114.71(14) 2 .
C21 Li1 Li2 C9 -114.71(14) 2 .
C22 Li1 Li2 C9 161.1(4) . .
Li1 Li1 Li2 C9 179.88(17) 2 .
Li2 Li1 Li2 C9 112.53(14) 2 .
C22A Li1 Li2 C9 140.6(5) . .
Fe Li1 Li2 C9 20.84(12) . .
C14 Li2 N1 C15 28.5(2) 2 .
C14 Li2 N1 C15 -80.63(17) . .
C21A Li2 N1 C15 169.13(19) 2 .
C21 Li2 N1 C15 169.13(19) 2 .
Li1 Li2 N1 C15 -118.8(2) . .
C13 Li2 N1 C15 58.98(19) 2 .
Li1 Li2 N1 C15 77.2(14) 2 .
Li2 Li2 N1 C15 -39.5(3) 2 .
C9 Li2 N1 C15 -113.9(2) . .
C14 Li2 N1 C16 -94.4(2) 2 .
C14 Li2 N1 C16 156.44(16) . .
C21A Li2 N1 C16 46.2(3) 2 .
C21 Li2 N1 C16 46.2(3) 2 .
Li1 Li2 N1 C16 118.3(2) . .
C13 Li2 N1 C16 -63.9(2) 2 .
Li1 Li2 N1 C16 -45.7(14) 2 .
Li2 Li2 N1 C16 -162.5(2) 2 .
C9 Li2 N1 C16 123.2(2) . .
C14 Li2 N1 C9 142.40(18) 2 .
C14 Li2 N1 C9 33.24(15) . .
C21A Li2 N1 C9 -77.0(2) 2 .
C21 Li2 N1 C9 -77.0(2) 2 .
Li1 Li2 N1 C9 -4.9(3) . .
C13 Li2 N1 C9 172.85(14) 2 .
Li1 Li2 N1 C9 -168.9(13) 2 .
Li2 Li2 N1 C9 74.3(2) 2 .
C10 Fe C1 C2 125.58(13) . .
C11 Fe C1 C2 84.92(14) . .
C5 Fe C1 C2 -116.97(18) . .
C13 Fe C1 C2 169.5(2) . .
C12 Fe C1 C2 63.2(2) . .
C3 Fe C1 C2 -36.85(13) . .
C4 Fe C1 C2 -80.10(14) . .
C14 Fe C1 C2 163.47(12) . .
Li1 Fe C1 C2 -156.52(13) . .
C10 Fe C1 C5 -117.45(12) . .
C11 Fe C1 C5 -158.10(12) . .
C2 Fe C1 C5 116.97(18) . .
C13 Fe C1 C5 -73.6(3) . .
C12 Fe C1 C5 -179.80(15) . .
C3 Fe C1 C5 80.13(14) . .
C4 Fe C1 C5 36.88(13) . .
C14 Fe C1 C5 -79.55(14) . .
Li1 Fe C1 C5 -39.54(14) . .
C10 Fe C1 C6 4.16(18) . .
C11 Fe C1 C6 -36.49(19) . .
C2 Fe C1 C6 -121.4(2) . .
C5 Fe C1 C6 121.6(2) . .
C13 Fe C1 C6 48.0(3) . .
C12 Fe C1 C6 -58.2(2) . .
C3 Fe C1 C6 -158.26(19) . .
C4 Fe C1 C6 158.48(19) . .
C14 Fe C1 C6 42.05(19) . .
Li1 Fe C1 C6 82.06(17) . .
C5 C1 C2 C3 -1.9(2) . .
C6 C1 C2 C3 173.42(18) . .
Fe C1 C2 C3 59.47(14) . .
C5 C1 C2 Fe -61.33(13) . .
C6 C1 C2 Fe 113.94(19) . .
C1 Fe C2 C3 -120.17(18) . .
C10 Fe C2 C3 172.61(13) . .
C11 Fe C2 C3 131.70(14) . .
C5 Fe C2 C3 -80.82(15) . .
C13 Fe C2 C3 69.0(3) . .
C12 Fe C2 C3 91.82(15) . .
C4 Fe C2 C3 -37.06(14) . .
C14 Fe C2 C3 -159.75(19) . .
Li1 Fe C2 C3 -86.39(18) . .
C10 Fe C2 C1 -67.22(14) . .
C11 Fe C2 C1 -108.13(13) . .
C5 Fe C2 C1 39.35(13) . .
C13 Fe C2 C1 -170.8(2) . .
C12 Fe C2 C1 -148.01(13) . .
C3 Fe C2 C1 120.17(18) . .
C4 Fe C2 C1 83.11(14) . .
C14 Fe C2 C1 -39.6(3) . .
Li1 Fe C2 C1 33.78(19) . .
C1 C2 C3 C4 1.0(2) . .
Fe C2 C3 C4 58.81(14) . .
C1 C2 C3 Fe -57.79(13) . .
C1 Fe C3 C2 37.74(13) . .
C10 Fe C3 C2 -18.1(3) . .
C11 Fe C3 C2 -64.23(16) . .
C5 Fe C3 C2 82.49(14) . .
C13 Fe C3 C2 -153.06(13) . .
C12 Fe C3 C2 -108.62(14) . .
C4 Fe C3 C2 120.1(2) . .
C14 Fe C3 C2 157.2(2) . .
Li1 Fe C3 C2 124.72(14) . .
C1 Fe C3 C4 -82.38(15) . .
C10 Fe C3 C4 -138.2(2) . .
C11 Fe C3 C4 175.65(14) . .
C2 Fe C3 C4 -120.1(2) . .
C5 Fe C3 C4 -37.63(14) . .
C13 Fe C3 C4 86.81(16) . .
C12 Fe C3 C4 131.26(14) . .
C14 Fe C3 C4 37.1(3) . .
Li1 Fe C3 C4 4.59(18) . .
C2 C3 C4 C5 0.2(2) . .
Fe C3 C4 C5 58.33(14) . .
C2 C3 C4 Fe -58.11(14) . .
C1 Fe C4 C5 -37.72(12) . .
C10 Fe C4 C5 29.4(2) . .
C11 Fe C4 C5 -134.1(3) . .
C2 Fe C4 C5 -82.29(14) . .
C13 Fe C4 C5 121.91(13) . .
C12 Fe C4 C5 167.59(12) . .
C3 Fe C4 C5 -119.41(19) . .
C14 Fe C4 C5 74.93(15) . .
Li1 Fe C4 C5 64.60(13) . .
C1 Fe C4 C3 81.70(15) . .
C10 Fe C4 C3 148.86(17) . .
C11 Fe C4 C3 -14.7(4) . .
C2 Fe C4 C3 37.13(14) . .
C5 Fe C4 C3 119.41(19) . .
C13 Fe C4 C3 -118.68(14) . .
C12 Fe C4 C3 -72.99(17) . .
C14 Fe C4 C3 -165.66(13) . .
Li1 Fe C4 C3 -175.98(16) . .
C3 C4 C5 C1 -1.4(2) . .
Fe C4 C5 C1 57.68(13) . .
C3 C4 C5 Fe -59.06(14) . .
C2 C1 C5 C4 2.0(2) . .
C6 C1 C5 C4 -173.26(18) . .
Fe C1 C5 C4 -59.36(14) . .
C2 C1 C5 Fe 61.36(13) . .
C6 C1 C5 Fe -113.90(19) . .
C1 Fe C5 C4 120.27(18) . .
C10 Fe C5 C4 -165.48(12) . .
C11 Fe C5 C4 160.95(14) . .
C2 Fe C5 C4 81.01(14) . .
C13 Fe C5 C4 -84.43(15) . .
C12 Fe C5 C4 -60.3(5) . .
C3 Fe C5 C4 37.41(13) . .
C14 Fe C5 C4 -122.28(13) . .
Li1 Fe C5 C4 -103.31(15) . .
C10 Fe C5 C1 74.25(13) . .
C11 Fe C5 C1 40.7(2) . .
C2 Fe C5 C1 -39.26(13) . .
C13 Fe C5 C1 155.30(12) . .
C12 Fe C5 C1 179(21) . .
C3 Fe C5 C1 -82.86(14) . .
C4 Fe C5 C1 -120.27(18) . .
C14 Fe C5 C1 117.45(12) . .
Li1 Fe C5 C1 136.42(15) . .
C2 C1 C6 C8 -126.9(2) . .
C5 C1 C6 C8 47.5(3) . .
Fe C1 C6 C8 -39.7(2) . .
C1 C6 C8 C9 72.3(2) . .
C15 N1 C9 C10 64.3(2) . .
C16 N1 C9 C10 -175.01(18) . .
Li2 N1 C9 C10 -48.67(18) . .
C15 N1 C9 C8 -170.53(17) . .
C16 N1 C9 C8 -49.8(2) . .
Li2 N1 C9 C8 76.55(18) . .
C15 N1 C9 Li2 112.93(19) . .
C16 N1 C9 Li2 -126.3(2) . .
C6 C8 C9 N1 178.88(17) . .
C6 C8 C9 C10 -60.0(2) . .
C6 C8 C9 Li2 -135.07(17) . .
C14 Li2 C9 N1 -61.3(3) 2 .
C14 Li2 C9 N1 -141.67(18) . .
C21A Li2 C9 N1 121.1(2) 2 .
C21 Li2 C9 N1 121.1(2) 2 .
Li1 Li2 C9 N1 176.1(2) . .
C13 Li2 C9 N1 -9.67(19) 2 .
Li1 Li2 C9 N1 176.4(4) 2 .
Li2 Li2 C9 N1 -123.01(16) 2 .
N1 Li2 C9 C10 132.05(18) . .
C14 Li2 C9 C10 70.7(3) 2 .
C14 Li2 C9 C10 -9.62(10) . .
C21A Li2 C9 C10 -106.85(17) 2 .
C21 Li2 C9 C10 -106.85(17) 2 .
Li1 Li2 C9 C10 -51.81(15) . .
C13 Li2 C9 C10 122.4(2) 2 .
Li1 Li2 C9 C10 -51.6(4) 2 .
Li2 Li2 C9 C10 9.04(13) 2 .
N1 Li2 C9 C8 -113.64(18) . .
C14 Li2 C9 C8 -174.9(3) 2 .
C14 Li2 C9 C8 104.69(14) . .
C21A Li2 C9 C8 7.46(18) 2 .
C21 Li2 C9 C8 7.46(18) 2 .
Li1 Li2 C9 C8 62.51(17) . .
C13 Li2 C9 C8 -123.3(2) 2 .
Li1 Li2 C9 C8 62.7(4) 2 .
Li2 Li2 C9 C8 123.35(14) 2 .
N1 C9 C10 C11 -130.28(18) . .
C8 C9 C10 C11 107.2(2) . .
Li2 C9 C10 C11 -165.37(19) . .
N1 C9 C10 C14 51.2(2) . .
C8 C9 C10 C14 -71.3(2) . .
Li2 C9 C10 C14 16.13(17) . .
N1 C9 C10 Fe 141.99(13) . .
C8 C9 C10 Fe 19.5(2) . .
Li2 C9 C10 Fe 106.90(14) . .
C1 Fe C10 C11 -113.37(11) . .
C2 Fe C10 C11 -75.31(13) . .
C5 Fe C10 C11 -153.53(11) . .
C13 Fe C10 C11 81.06(12) . .
C12 Fe C10 C11 37.15(11) . .
C3 Fe C10 C11 -62.0(3) . .
C4 Fe C10 C11 -174.05(17) . .
C14 Fe C10 C11 120.49(15) . .
Li1 Fe C10 C11 150.34(13) . .
C1 Fe C10 C14 126.14(11) . .
C11 Fe C10 C14 -120.49(15) . .
C2 Fe C10 C14 164.20(11) . .
C5 Fe C10 C14 85.98(12) . .
C13 Fe C10 C14 -39.43(11) . .
C12 Fe C10 C14 -83.35(12) . .
C3 Fe C10 C14 177.5(2) . .
C4 Fe C10 C14 65.5(2) . .
Li1 Fe C10 C14 29.85(11) . .
C1 Fe C10 C9 5.84(16) . .
C11 Fe C10 C9 119.21(19) . .
C2 Fe C10 C9 43.90(17) . .
C5 Fe C10 C9 -34.32(17) . .
C13 Fe C10 C9 -159.73(17) . .
C12 Fe C10 C9 156.36(16) . .
C3 Fe C10 C9 57.2(3) . .
C4 Fe C10 C9 -54.8(2) . .
C14 Fe C10 C9 -120.30(19) . .
Li1 Fe C10 C9 -90.45(16) . .
C14 C10 C11 C12 1.5(2) . .
C9 C10 C11 C12 -177.14(17) . .
Fe C10 C11 C12 -59.55(14) . .
C14 C10 C11 Fe 61.09(13) . .
C9 C10 C11 Fe -117.60(17) . .
C1 Fe C11 C12 -162.81(11) . .
C10 Fe C11 C12 119.70(15) . .
C2 Fe C11 C12 -120.29(12) . .
C5 Fe C11 C12 169.51(14) . .
C13 Fe C11 C12 38.18(11) . .
C3 Fe C11 C12 -83.52(14) . .
C4 Fe C11 C12 -71.8(4) . .
C14 Fe C11 C12 82.34(12) . .
Li1 Fe C11 C12 88.11(13) . .
C1 Fe C11 C10 77.49(12) . .
C2 Fe C11 C10 120.01(12) . .
C5 Fe C11 C10 49.81(18) . .
C13 Fe C11 C10 -81.52(11) . .
C12 Fe C11 C10 -119.70(15) . .
C3 Fe C11 C10 156.78(12) . .
C4 Fe C11 C10 168.5(3) . .
C14 Fe C11 C10 -37.36(10) . .
Li1 Fe C11 C10 -31.59(13) . .
C10 C11 C12 C13 -1.0(2) . .
Fe C11 C12 C13 -59.47(13) . .
C10 C11 C12 Fe 58.50(13) . .
C1 Fe C12 C11 32.0(2) . .
C10 Fe C12 C11 -37.94(11) . .
C2 Fe C12 C11 74.60(14) . .
C5 Fe C12 C11 -147.2(4) . .
C13 Fe C12 C11 -118.56(17) . .
C3 Fe C12 C11 119.29(13) . .
C4 Fe C12 C11 161.49(12) . .
C14 Fe C12 C11 -82.32(12) . .
Li1 Fe C12 C11 -106.73(12) . .
C1 Fe C12 C13 150.60(15) . .
C10 Fe C12 C13 80.62(13) . .
C11 Fe C12 C13 118.56(17) . .
C2 Fe C12 C13 -166.84(13) . .
C5 Fe C12 C13 -28.7(5) . .
C3 Fe C12 C13 -122.15(13) . .
C4 Fe C12 C13 -79.95(16) . .
C14 Fe C12 C13 36.25(12) . .
Li1 Fe C12 C13 11.83(15) . .
C11 C12 C13 C14 0.1(2) . .
Fe C12 C13 C14 -59.08(14) . .
C11 C12 C13 Fe 59.16(13) . .
C11 C12 C13 Li2 -67.8(3) . 2
Fe C12 C13 Li2 -127.0(3) . 2
C1 Fe C13 C12 -130.3(2) . .
C10 Fe C13 C12 -82.63(13) . .
C11 Fe C13 C12 -37.91(13) . .
C2 Fe C13 C12 31.3(3) . .
C5 Fe C13 C12 173.56(13) . .
C3 Fe C13 C12 81.38(16) . .
C4 Fe C13 C12 127.42(14) . .
C14 Fe C13 C12 -122.35(17) . .
Li1 Fe C13 C12 -167.57(15) . .
C1 Fe C13 C14 -7.9(3) . .
C10 Fe C13 C14 39.72(11) . .
C11 Fe C13 C14 84.44(12) . .
C2 Fe C13 C14 153.6(2) . .
C5 Fe C13 C14 -64.09(15) . .
C12 Fe C13 C14 122.35(17) . .
C3 Fe C13 C14 -156.26(12) . .
C4 Fe C13 C14 -110.23(13) . .
Li1 Fe C13 C14 -45.21(12) . .
C1 Fe C13 Li2 18.8(3) . 2
C10 Fe C13 Li2 66.50(14) . 2
C11 Fe C13 Li2 111.22(16) . 2
C2 Fe C13 Li2 -179.6(2) . 2
C5 Fe C13 Li2 -37.31(19) . 2
C12 Fe C13 Li2 149.1(2) . 2
C3 Fe C13 Li2 -129.48(15) . 2
C4 Fe C13 Li2 -83.45(16) . 2
C14 Fe C13 Li2 26.78(13) . 2
Li1 Fe C13 Li2 -18.43(14) . 2
C12 C13 C14 C10 0.8(2) . .
Fe C13 C14 C10 -57.39(11) . .
Li2 C13 C14 C10 147.30(16) 2 .
C12 C13 C14 Fe 58.20(14) . .
Li2 C13 C14 Fe -155.30(11) 2 .
C12 C13 C14 Li1 145.23(16) . .
Fe C13 C14 Li1 87.03(13) . .
Li2 C13 C14 Li1 -68.28(14) 2 .
C12 C13 C14 Li2 -146.50(17) . 2
Fe C13 C14 Li2 155.30(11) . 2
C12 C13 C14 Li2 -136.2(4) . .
Fe C13 C14 Li2 165.6(4) . .
Li2 C13 C14 Li2 10.3(3) 2 .
C11 C10 C14 C13 -1.4(2) . .
C9 C10 C14 C13 177.28(16) . .
Fe C10 C14 C13 58.30(12) . .
C11 C10 C14 Fe -59.71(13) . .
C9 C10 C14 Fe 118.98(17) . .
C11 C10 C14 Li1 -133.0(2) . .
C9 C10 C14 Li1 45.6(3) . .
Fe C10 C14 Li1 -73.3(2) . .
C11 C10 C14 Li2 98.9(3) . 2
C9 C10 C14 Li2 -82.4(3) . 2
Fe C10 C14 Li2 158.6(3) . 2
C11 C10 C14 Li2 161.89(15) . .
C9 C10 C14 Li2 -19.4(2) . .
Fe C10 C14 Li2 -138.40(11) . .
C1 Fe C14 C13 176.96(12) . .
C10 Fe C14 C13 -116.32(16) . .
C11 Fe C14 C13 -79.06(12) . .
C2 Fe C14 C13 -154.1(2) . .
C5 Fe C14 C13 134.41(12) . .
C12 Fe C14 C13 -35.91(12) . .
C3 Fe C14 C13 66.2(3) . .
C4 Fe C14 C13 93.76(14) . .
Li1 Fe C14 C13 108.70(16) . .
C1 Fe C14 C10 -66.72(13) . .
C11 Fe C14 C10 37.26(11) . .
C2 Fe C14 C10 -37.7(2) . .
C5 Fe C14 C10 -109.27(12) . .
C13 Fe C14 C10 116.32(16) . .
C12 Fe C14 C10 80.42(12) . .
C3 Fe C14 C10 -177.4(2) . .
C4 Fe C14 C10 -149.92(12) . .
Li1 Fe C14 C10 -134.98(16) . .
C1 Fe C14 Li1 68.27(14) . .
C10 Fe C14 Li1 134.98(16) . .
C11 Fe C14 Li1 172.25(14) . .
C2 Fe C14 Li1 97.2(2) . .
C5 Fe C14 Li1 25.71(14) . .
C13 Fe C14 Li1 -108.70(16) . .
C12 Fe C14 Li1 -144.60(14) . .
C3 Fe C14 Li1 -42.5(3) . .
C4 Fe C14 Li1 -14.94(16) . .
C1 Fe C14 Li2 132.8(2) . 2
C10 Fe C14 Li2 -160.5(3) . 2
C11 Fe C14 Li2 -123.2(2) . 2
C2 Fe C14 Li2 161.8(2) . 2
C5 Fe C14 Li2 90.2(2) . 2
C13 Fe C14 Li2 -44.2(2) . 2
C12 Fe C14 Li2 -80.1(2) . 2
C3 Fe C14 Li2 22.1(4) . 2
C4 Fe C14 Li2 49.6(2) . 2
Li1 Fe C14 Li2 64.5(2) . 2
C1 Fe C14 Li2 5.6(2) . .
C10 Fe C14 Li2 72.31(18) . .
C11 Fe C14 Li2 109.57(18) . .
C2 Fe C14 Li2 34.6(3) . .
C5 Fe C14 Li2 -36.96(19) . .
C13 Fe C14 Li2 -171.4(2) . .
C12 Fe C14 Li2 152.72(19) . .
C3 Fe C14 Li2 -105.1(3) . .
C4 Fe C14 Li2 -77.6(2) . .
Li1 Fe C14 Li2 -62.67(19) . .
C21 Li1 C14 C13 51.5(2) . .
C21A Li1 C14 C13 170.64(16) 2 .
C21 Li1 C14 C13 170.64(16) 2 .
C22 Li1 C14 C13 10.2(3) . .
Li1 Li1 C14 C13 110.9(2) 2 .
Li2 Li1 C14 C13 153.70(16) . .
Li2 Li1 C14 C13 77.40(15) 2 .
C22A Li1 C14 C13 14.3(3) . .
Fe Li1 C14 C13 -67.94(12) . .
C21 Li1 C14 C10 -178.91(17) . .
C21A Li1 C14 C10 -59.8(3) 2 .
C21 Li1 C14 C10 -59.8(3) 2 .
C22 Li1 C14 C10 139.8(2) . .
Li1 Li1 C14 C10 -119.5(2) 2 .
Li2 Li1 C14 C10 -76.7(2) . .
Li2 Li1 C14 C10 -153.0(2) 2 .
C22A Li1 C14 C10 143.9(3) . .
Fe Li1 C14 C10 61.67(17) . .
C21 Li1 C14 Fe 119.41(14) . .
C21A Li1 C14 Fe -121.43(15) 2 .
C21 Li1 C14 Fe -121.43(15) 2 .
C22 Li1 C14 Fe 78.1(2) . .
Li1 Li1 C14 Fe 178.8(2) 2 .
Li2 Li1 C14 Fe -138.36(12) . .
Li2 Li1 C14 Fe 145.33(13) 2 .
C22A Li1 C14 Fe 82.2(3) . .
C21 Li1 C14 Li2 -25.92(15) . 2
C21A Li1 C14 Li2 93.24(18) 2 2
C21 Li1 C14 Li2 93.24(18) 2 2
C22 Li1 C14 Li2 -67.2(2) . 2
Li1 Li1 C14 Li2 33.5(2) 2 2
Li2 Li1 C14 Li2 76.31(15) . 2
C22A Li1 C14 Li2 -63.1(3) . 2
Fe Li1 C14 Li2 -145.33(13) . 2
C21 Li1 C14 Li2 -102.22(17) . .
C21A Li1 C14 Li2 16.94(15) 2 .
C21 Li1 C14 Li2 16.94(15) 2 .
C22 Li1 C14 Li2 -143.5(3) . .
Li1 Li1 C14 Li2 -42.8(2) 2 .
Li2 Li1 C14 Li2 -76.31(15) 2 .
C22A Li1 C14 Li2 -139.4(3) . .
Fe Li1 C14 Li2 138.36(12) . .
N1 Li2 C14 C13 128.6(4) . .
C14 Li2 C14 C13 5.0(5) 2 .
C21A Li2 C14 C13 -103.3(4) 2 .
C21 Li2 C14 C13 -103.3(4) 2 .
Li1 Li2 C14 C13 -87.9(4) . .
C13 Li2 C14 C13 22.5(5) 2 .
Li1 Li2 C14 C13 -48.5(4) 2 .
Li2 Li2 C14 C13 -10.9(3) 2 .
C9 Li2 C14 C13 147.8(4) . .
N1 Li2 C14 C10 -9.52(15) . .
C14 Li2 C14 C10 -133.03(13) 2 .
C21A Li2 C14 C10 118.64(15) 2 .
C21 Li2 C14 C10 118.64(15) 2 .
Li1 Li2 C14 C10 133.98(16) . .
C13 Li2 C14 C10 -115.6(2) 2 .
Li1 Li2 C14 C10 173.44(14) 2 .
Li2 Li2 C14 C10 -148.97(14) 2 .
C9 Li2 C14 C10 9.72(10) . .
N1 Li2 C14 Fe -70.77(19) . .
C14 Li2 C14 Fe 165.72(9) 2 .
C21A Li2 C14 Fe 57.4(2) 2 .
C21 Li2 C14 Fe 57.4(2) 2 .
Li1 Li2 C14 Fe 72.72(18) . .
C13 Li2 C14 Fe -176.85(15) 2 .
Li1 Li2 C14 Fe 112.19(17) 2 .
Li2 Li2 C14 Fe 149.8(2) 2 .
C9 Li2 C14 Fe -51.53(16) . .
N1 Li2 C14 Li1 -143.50(16) . .
C14 Li2 C14 Li1 92.99(17) 2 .
C21A Li2 C14 Li1 -15.33(14) 2 .
C21 Li2 C14 Li1 -15.33(14) 2 .
C13 Li2 C14 Li1 110.4(2) 2 .
Li1 Li2 C14 Li1 39.47(17) 2 .
Li2 Li2 C14 Li1 77.06(13) 2 .
C9 Li2 C14 Li1 -124.26(13) . .
N1 Li2 C14 Li2 139.45(9) . 2
C14 Li2 C14 Li2 15.94(19) 2 2
C21A Li2 C14 Li2 -92.39(13) 2 2
C21 Li2 C14 Li2 -92.39(13) 2 2
Li1 Li2 C14 Li2 -77.06(13) . 2
C13 Li2 C14 Li2 33.4(3) 2 2
Li1 Li2 C14 Li2 -37.59(16) 2 2
C9 Li2 C14 Li2 158.69(9) . 2
C14 Li1 C21 C22 -128.8(2) . .
C21A Li1 C21 C22 106.8(2) 2 .
C21 Li1 C21 C22 106.8(2) 2 .
Li1 Li1 C21 C22 134.1(2) 2 .
Li2 Li1 C21 C22 169.3(3) . .
Li2 Li1 C21 C22 -154.2(2) 2 .
C22A Li1 C21 C22 -17.2(4) . .
Fe Li1 C21 C22 -84.6(2) . .
Li1 C21 C22 C23 -179.2(4) . .
C14 Li1 C22 C23 -115(3) . .
C21 Li1 C22 C23 173(3) . .
C21A Li1 C22 C23 84(3) 2 .
C21 Li1 C22 C23 84(3) 2 .
Li1 Li1 C22 C23 136(3) 2 .
Li2 Li1 C22 C23 153(3) . .
Li2 Li1 C22 C23 -165(3) 2 .
C22A Li1 C22 C23 -133(4) . .
Fe Li1 C22 C23 -70(3) . .
C14 Li1 C22 C21 71.9(3) . .
C21A Li1 C22 C21 -88.8(2) 2 .
C21 Li1 C22 C21 -88.8(2) 2 .
Li1 Li1 C22 C21 -36.86(19) 2 .
Li2 Li1 C22 C21 -20.2(5) . .
Li2 Li1 C22 C21 21.71(19) 2 .
C22A Li1 C22 C21 54.3(12) . .
Fe Li1 C22 C21 116.62(19) . .
C21 C22 C23 C24 -178.4(4) . .
Li1 C22 C23 C24 9(3) . .
C14 Li1 C22A C23A -160.5(5) . .
C21 Li1 C22A C23A 116.4(7) . .
C21A Li1 C22A C23A 45.2(6) 2 .
C21 Li1 C22A C23A 45.2(6) 2 .
C22 Li1 C22A C23A 4.2(9) . .
Li1 Li1 C22A C23A 92.7(5) 2 .
Li2 Li1 C22A C23A 127.0(5) . .
Li2 Li1 C22A C23A 151.7(5) 2 .
Fe Li1 C22A C23A -116.9(5) . .
Li1 C22A C23A C24A 124.9(10) . .
