#------------------------------------------------------------------------------
#$Date: 2016-03-21 07:10:14 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178551 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/58/4065846.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_4065846
loop_
_publ_author_name
'Bonello, Owen'
'Jones, Cameron'
'Stasch, Andreas'
'Woodul, William D.'
_publ_section_title
;
 Group 2 and 12 Metal Gallyl Complexes Containing Unsupported Ga−M
 Covalent Bonds (M = Mg, Ca, Sr, Ba, Zn, Cd)†
;
_journal_issue                   21
_journal_name_full               Organometallics
_journal_page_first              4914
_journal_paper_doi               10.1021/om1001606
_journal_volume                  29
_journal_year                    2010
_chemical_formula_sum            'C37 H61 Ga Li N2 O2'
_chemical_formula_weight         642.54
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 113.13(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   19.219(4)
_cell_length_b                   10.009(2)
_cell_length_c                   21.274(4)
_cell_measurement_temperature    123(2)
_cell_volume                     3763.4(15)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Nonius Kappa CCD'
_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  0.0309
_diffrn_reflns_av_sigmaI/netI    0.0619
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            10361
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.91
_exptl_absorpt_coefficient_mu    0.762
_exptl_absorpt_correction_T_max  0.927
_exptl_absorpt_correction_T_min  0.870
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Sortav (Blessing, 1995)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.134
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1388
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.873
_refine_diff_density_min         -0.451
_refine_diff_density_rms         0.062
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.028
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     403
_refine_ls_number_reflns         6604
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.028
_refine_ls_R_factor_all          0.0851
_refine_ls_R_factor_gt           0.0492
_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)+(0.0472P)²+3.2941P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1065
_refine_ls_wR_factor_ref         0.1214
_reflns_number_gt                4638
_reflns_number_total             6604
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om1001606_si_002.cif
_cod_data_source_block           '[[(THF)2Li{H2Ga(DAB)}]'
_cod_original_cell_volume        3763.3(13)
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               4065846
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
Ga1 Ga 0.622370(18) 0.20178(4) 0.933023(18) 0.03265(13) Uani 1 1 d .
O1 O 0.68406(12) 0.5314(2) 1.04605(13) 0.0454(6) Uani 1 1 d .
N1 N 0.72573(13) 0.2030(2) 1.00562(12) 0.0248(6) Uani 1 1 d .
C1 C 0.77349(16) 0.2691(3) 0.97719(16) 0.0273(7) Uani 1 1 d .
H1 H 0.8266 0.2751 1.0021 0.033 Uiso 1 1 calc R
Li1 Li 0.7451(3) 0.3807(6) 1.0549(3) 0.0388(14) Uani 1 1 d .
O2 O 0.83443(12) 0.3991(2) 1.13606(12) 0.0400(6) Uani 1 1 d .
N2 N 0.66354(13) 0.3045(3) 0.87845(12) 0.0278(6) Uani 1 1 d .
C2 C 0.74065(16) 0.3214(3) 0.91489(15) 0.0256(7) Uani 1 1 d .
H2 H 0.7698 0.3700 0.8955 0.031 Uiso 1 1 calc R
C3 C 0.75579(15) 0.0936(3) 1.05135(14) 0.0240(7) Uani 1 1 d .
C4 C 0.73422(17) 0.0807(3) 1.10767(15) 0.0275(7) Uani 1 1 d .
C5 C 0.76710(18) -0.0183(3) 1.15552(16) 0.0321(8) Uani 1 1 d .
H5 H 0.7523 -0.0276 1.1930 0.038 Uiso 1 1 calc R
C6 C 0.82123(17) -0.1044(3) 1.15035(16) 0.0329(8) Uani 1 1 d .
H6 H 0.8458 -0.1677 1.1854 0.039 Uiso 1 1 calc R
C7 C 0.83860(17) -0.0964(3) 1.09367(16) 0.0296(7) Uani 1 1 d .
H7 H 0.8746 -0.1570 1.0894 0.035 Uiso 1 1 calc R
C8 C 0.80510(16) -0.0023(3) 1.04216(15) 0.0261(7) Uani 1 1 d .
C9 C 0.67395(18) 0.1695(3) 1.11593(17) 0.0342(8) Uani 1 1 d .
H9 H 0.6631 0.2435 1.0818 0.041 Uiso 1 1 calc R
C10 C 0.7005(2) 0.2337(4) 1.18727(18) 0.0466(10) Uani 1 1 d .
H10A H 0.7107 0.1636 1.2219 0.070 Uiso 1 1 calc R
H10B H 0.6610 0.2934 1.1892 0.070 Uiso 1 1 calc R
H10C H 0.7468 0.2851 1.1961 0.070 Uiso 1 1 calc R
C11 C 0.59988(19) 0.0908(4) 1.0992(2) 0.0501(10) Uani 1 1 d .
H11A H 0.5825 0.0556 1.0525 0.075 Uiso 1 1 calc R
H11B H 0.5612 0.1501 1.1030 0.075 Uiso 1 1 calc R
H11C H 0.6089 0.0165 1.1315 0.075 Uiso 1 1 calc R
C12 C 0.81942(16) -0.0124(3) 0.97647(15) 0.0294(7) Uani 1 1 d .
H12 H 0.7872 0.0563 0.9439 0.035 Uiso 1 1 calc R
C13 C 0.90188(18) 0.0173(4) 0.98877(18) 0.0434(9) Uani 1 1 d .
H13A H 0.9155 0.1065 1.0089 0.065 Uiso 1 1 calc R
H13B H 0.9080 0.0139 0.9452 0.065 Uiso 1 1 calc R
H13C H 0.9348 -0.0494 1.0201 0.065 Uiso 1 1 calc R
C14 C 0.7960(2) -0.1494(3) 0.94276(17) 0.0408(9) Uani 1 1 d .
H14A H 0.8271 -0.2189 0.9735 0.061 Uiso 1 1 calc R
H14B H 0.8034 -0.1516 0.8998 0.061 Uiso 1 1 calc R
H14C H 0.7426 -0.1655 0.9335 0.061 Uiso 1 1 calc R
C15 C 0.63094(16) 0.3264(3) 0.80645(15) 0.0276(7) Uani 1 1 d .
C16 C 0.57727(16) 0.4296(3) 0.78019(16) 0.0308(7) Uani 1 1 d .
C17 C 0.54089(17) 0.4451(3) 0.70959(17) 0.0346(8) Uani 1 1 d .
H17 H 0.5035 0.5125 0.6917 0.042 Uiso 1 1 calc R
C18 C 0.55830(17) 0.3642(3) 0.66524(17) 0.0353(8) Uani 1 1 d .
H18 H 0.5332 0.3759 0.6172 0.042 Uiso 1 1 calc R
C19 C 0.61285(17) 0.2656(3) 0.69151(16) 0.0319(8) Uani 1 1 d .
H19 H 0.6258 0.2116 0.6610 0.038 Uiso 1 1 calc R
C20 C 0.64914(16) 0.2438(3) 0.76168(16) 0.0282(7) Uani 1 1 d .
C21 C 0.55836(18) 0.5234(3) 0.82736(18) 0.0376(8) Uani 1 1 d .
H21 H 0.5942 0.5037 0.8752 0.045 Uiso 1 1 calc R
C22 C 0.5690(3) 0.6700(4) 0.8125(2) 0.0669(13) Uani 1 1 d .
H22A H 0.6209 0.6838 0.8162 0.100 Uiso 1 1 calc R
H22B H 0.5595 0.7271 0.8457 0.100 Uiso 1 1 calc R
H22C H 0.5335 0.6928 0.7663 0.100 Uiso 1 1 calc R
C23 C 0.4779(2) 0.4989(5) 0.8232(2) 0.0608(12) Uani 1 1 d .
H23A H 0.4417 0.5122 0.7760 0.091 Uiso 1 1 calc R
H23B H 0.4669 0.5617 0.8534 0.091 Uiso 1 1 calc R
H23C H 0.4739 0.4071 0.8375 0.091 Uiso 1 1 calc R
C24 C 0.70363(17) 0.1261(3) 0.78688(17) 0.0326(8) Uani 1 1 d .
H24 H 0.7320 0.1369 0.8373 0.039 Uiso 1 1 calc R
C25 C 0.7613(2) 0.1200(5) 0.7545(3) 0.0726(14) Uani 1 1 d .
H25A H 0.7965 0.0461 0.7746 0.109 Uiso 1 1 calc R
H25B H 0.7894 0.2043 0.7628 0.109 Uiso 1 1 calc R
H25C H 0.7351 0.1058 0.7052 0.109 Uiso 1 1 calc R
C26 C 0.6605(2) -0.0044(4) 0.7752(2) 0.0619(12) Uani 1 1 d .
H26A H 0.6300 -0.0157 0.7263 0.093 Uiso 1 1 calc R
H26B H 0.6272 -0.0033 0.8002 0.093 Uiso 1 1 calc R
H26C H 0.6963 -0.0788 0.7916 0.093 Uiso 1 1 calc R
C27 C 0.6272(2) 0.5535(4) 1.0727(3) 0.0705(14) Uani 1 1 d .
H27A H 0.6440 0.5179 1.1198 0.085 Uiso 1 1 calc R
H27B H 0.5794 0.5084 1.0438 0.085 Uiso 1 1 calc R
C28 C 0.6156(3) 0.7019(4) 1.0724(3) 0.0848(17) Uani 1 1 d .
H28A H 0.6527 0.7445 1.1141 0.102 Uiso 1 1 calc R
H28B H 0.5637 0.7245 1.0678 0.102 Uiso 1 1 calc R
C29 C 0.6290(3) 0.7411(5) 1.0094(2) 0.0724(14) Uani 1 1 d .
H29A H 0.6451 0.8357 1.0120 0.087 Uiso 1 1 calc R
H29B H 0.5826 0.7285 0.9675 0.087 Uiso 1 1 calc R
C30 C 0.6914(2) 0.6485(4) 1.0093(2) 0.0464(9) Uani 1 1 d .
H30A H 0.6846 0.6252 0.9621 0.056 Uiso 1 1 calc R
H30B H 0.7416 0.6905 1.0327 0.056 Uiso 1 1 calc R
C31 C 0.89818(19) 0.3078(4) 1.16474(19) 0.0476(10) Uani 1 1 d .
H31A H 0.9288 0.3068 1.1367 0.057 Uiso 1 1 calc R
H31B H 0.8805 0.2159 1.1673 0.057 Uiso 1 1 calc R
C32 C 0.9434(2) 0.3618(4) 1.2350(2) 0.0521(10) Uani 1 1 d .
H32A H 0.9240 0.3275 1.2687 0.062 Uiso 1 1 calc R
H32B H 0.9976 0.3381 1.2502 0.062 Uiso 1 1 calc R
C33 C 0.9319(2) 0.5101(4) 1.2256(2) 0.0527(10) Uani 1 1 d .
H33A H 0.9385 0.5546 1.2692 0.063 Uiso 1 1 calc R
H33B H 0.9674 0.5499 1.2076 0.063 Uiso 1 1 calc R
C34 C 0.8523(2) 0.5205(4) 1.1751(2) 0.0623(12) Uani 1 1 d .
H34A H 0.8177 0.5327 1.1989 0.075 Uiso 1 1 calc R
H34B H 0.8466 0.5980 1.1446 0.075 Uiso 1 1 calc R
C35 C 0.9805(3) 0.4419(6) 0.9787(3) 0.0989(18) Uani 1 1 d .
H35A H 0.9892 0.3641 1.0096 0.119 Uiso 1 1 calc R
H35B H 0.9256 0.4608 0.9601 0.119 Uiso 1 1 calc R
C36 C 0.9983(4) 0.4019(7) 0.9241(4) 0.132(3) Uani 1 1 d .
H36A H 1.0532 0.3826 0.9422 0.158 Uiso 1 1 calc R
H36B H 0.9892 0.4788 0.8926 0.158 Uiso 1 1 calc R
C37 C 0.9577(3) 0.2837(5) 0.8830(3) 0.0807(15) Uani 1 1 d .
H37A H 0.9755 0.2022 0.9101 0.121 Uiso 1 1 calc R
H37B H 0.9677 0.2778 0.8413 0.121 Uiso 1 1 calc R
H37C H 0.9032 0.2938 0.8707 0.121 Uiso 1 1 calc R
H1A H 0.570(2) 0.286(4) 0.958(2) 0.097 Uiso 1 1 d .
H1B H 0.595(2) 0.062(4) 0.903(2) 0.097 Uiso 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 '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'
Ga Ga 0.2307 1.6083 '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'
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
N2 Ga1 N1 86.76(10) . .
N2 Ga1 Li1 81.22(13) . .
N1 Ga1 Li1 35.71(12) . .
N2 Ga1 H1A 112.7(16) . .
N1 Ga1 H1A 108.2(16) . .
Li1 Ga1 H1A 77.9(16) . .
N2 Ga1 H1B 113.1(16) . .
N1 Ga1 H1B 113.8(16) . .
Li1 Ga1 H1B 147.9(16) . .
H1A Ga1 H1B 118(2) . .
C27 O1 C30 109.9(3) . .
C27 O1 Li1 129.0(3) . .
C30 O1 Li1 121.1(3) . .
C3 N1 C1 118.9(2) . .
C3 N1 Ga1 122.71(19) . .
C1 N1 Ga1 106.51(18) . .
C3 N1 Li1 112.2(2) . .
C1 N1 Li1 78.2(2) . .
Ga1 N1 Li1 109.46(19) . .
C2 C1 N1 117.8(3) . .
C2 C1 Li1 112.5(3) . .
N1 C1 Li1 62.5(2) . .
C2 C1 H1 121.1 . .
N1 C1 H1 121.1 . .
Li1 C1 H1 94.4 . .
O1 Li1 O2 108.6(3) . .
O1 Li1 N1 132.5(3) . .
O2 Li1 N1 118.1(3) . .
O1 Li1 C1 130.8(3) . .
O2 Li1 C1 108.9(3) . .
N1 Li1 C1 39.25(14) . .
O1 Li1 Ga1 97.7(2) . .
O2 Li1 Ga1 152.1(3) . .
N1 Li1 Ga1 34.83(12) . .
C1 Li1 Ga1 56.57(15) . .
C34 O2 C31 108.6(3) . .
C34 O2 Li1 122.1(3) . .
C31 O2 Li1 129.0(3) . .
C2 N2 C15 120.2(2) . .
C2 N2 Ga1 109.16(19) . .
C15 N2 Ga1 127.95(19) . .
C1 C2 N2 119.5(3) . .
C1 C2 H2 120.2 . .
N2 C2 H2 120.2 . .
C8 C3 C4 119.2(3) . .
C8 C3 N1 122.7(3) . .
C4 C3 N1 118.1(3) . .
C5 C4 C3 119.1(3) . .
C5 C4 C9 118.8(3) . .
C3 C4 C9 122.1(3) . .
C4 C5 C6 121.8(3) . .
C4 C5 H5 119.1 . .
C6 C5 H5 119.1 . .
C7 C6 C5 118.8(3) . .
C7 C6 H6 120.6 . .
C5 C6 H6 120.6 . .
C6 C7 C8 122.1(3) . .
C6 C7 H7 118.9 . .
C8 C7 H7 118.9 . .
C7 C8 C3 118.5(3) . .
C7 C8 C12 118.6(3) . .
C3 C8 C12 122.8(3) . .
C4 C9 C10 112.6(3) . .
C4 C9 C11 110.5(3) . .
C10 C9 C11 111.1(3) . .
C4 C9 H9 107.5 . .
C10 C9 H9 107.5 . .
C11 C9 H9 107.5 . .
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 . .
C8 C12 C13 112.1(3) . .
C8 C12 C14 111.2(3) . .
C13 C12 C14 110.4(3) . .
C8 C12 H12 107.6 . .
C13 C12 H12 107.6 . .
C14 C12 H12 107.6 . .
C12 C13 H13A 109.5 . .
C12 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C12 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C12 C14 H14A 109.5 . .
C12 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C12 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C20 C15 C16 120.0(3) . .
C20 C15 N2 121.1(3) . .
C16 C15 N2 118.8(3) . .
C17 C16 C15 119.1(3) . .
C17 C16 C21 119.6(3) . .
C15 C16 C21 121.2(3) . .
C18 C17 C16 121.2(3) . .
C18 C17 H17 119.4 . .
C16 C17 H17 119.4 . .
C17 C18 C19 119.3(3) . .
C17 C18 H18 120.3 . .
C19 C18 H18 120.3 . .
C18 C19 C20 121.6(3) . .
C18 C19 H19 119.2 . .
C20 C19 H19 119.2 . .
C19 C20 C15 118.7(3) . .
C19 C20 C24 118.8(3) . .
C15 C20 C24 122.4(3) . .
C16 C21 C22 111.7(3) . .
C16 C21 C23 111.1(3) . .
C22 C21 C23 110.8(3) . .
C16 C21 H21 107.7 . .
C22 C21 H21 107.7 . .
C23 C21 H21 107.7 . .
C21 C22 H22A 109.5 . .
C21 C22 H22B 109.5 . .
H22A C22 H22B 109.5 . .
C21 C22 H22C 109.5 . .
H22A C22 H22C 109.5 . .
H22B C22 H22C 109.5 . .
C21 C23 H23A 109.5 . .
C21 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C21 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C26 C24 C25 110.0(3) . .
C26 C24 C20 110.6(3) . .
C25 C24 C20 113.2(3) . .
C26 C24 H24 107.6 . .
C25 C24 H24 107.6 . .
C20 C24 H24 107.6 . .
C24 C25 H25A 109.5 . .
C24 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
C24 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
C24 C26 H26A 109.5 . .
C24 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
C24 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
O1 C27 C28 106.6(3) . .
O1 C27 H27A 110.4 . .
C28 C27 H27A 110.4 . .
O1 C27 H27B 110.4 . .
C28 C27 H27B 110.4 . .
H27A C27 H27B 108.6 . .
C27 C28 C29 100.6(4) . .
C27 C28 H28A 111.6 . .
C29 C28 H28A 111.6 . .
C27 C28 H28B 111.6 . .
C29 C28 H28B 111.6 . .
H28A C28 H28B 109.4 . .
C28 C29 C30 104.6(3) . .
C28 C29 H29A 110.8 . .
C30 C29 H29A 110.8 . .
C28 C29 H29B 110.8 . .
C30 C29 H29B 110.8 . .
H29A C29 H29B 108.9 . .
O1 C30 C29 104.6(3) . .
O1 C30 H30A 110.8 . .
C29 C30 H30A 110.8 . .
O1 C30 H30B 110.8 . .
C29 C30 H30B 110.8 . .
H30A C30 H30B 108.9 . .
O2 C31 C32 104.7(3) . .
O2 C31 H31A 110.8 . .
C32 C31 H31A 110.8 . .
O2 C31 H31B 110.8 . .
C32 C31 H31B 110.8 . .
H31A C31 H31B 108.9 . .
C33 C32 C31 103.0(3) . .
C33 C32 H32A 111.2 . .
C31 C32 H32A 111.2 . .
C33 C32 H32B 111.2 . .
C31 C32 H32B 111.2 . .
H32A C32 H32B 109.1 . .
C34 C33 C32 102.8(3) . .
C34 C33 H33A 111.2 . .
C32 C33 H33A 111.2 . .
C34 C33 H33B 111.2 . .
C32 C33 H33B 111.2 . .
H33A C33 H33B 109.1 . .
O2 C34 C33 107.6(3) . .
O2 C34 H34A 110.2 . .
C33 C34 H34A 110.2 . .
O2 C34 H34B 110.2 . .
C33 C34 H34B 110.2 . .
H34A C34 H34B 108.5 . .
C36 C35 C35 120.3(7) . 3_767
C36 C35 H35A 107.2 . .
C35 C35 H35A 107.2 3_767 .
C36 C35 H35B 107.2 . .
C35 C35 H35B 107.2 3_767 .
H35A C35 H35B 106.9 . .
C35 C36 C37 118.1(6) . .
C35 C36 H36A 107.8 . .
C37 C36 H36A 107.8 . .
C35 C36 H36B 107.8 . .
C37 C36 H36B 107.8 . .
H36A C36 H36B 107.1 . .
C36 C37 H37A 109.5 . .
C36 C37 H37B 109.5 . .
H37A C37 H37B 109.5 . .
C36 C37 H37C 109.5 . .
H37A C37 H37C 109.5 . .
H37B C37 H37C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ga1 N2 1.937(2) .
Ga1 N1 1.980(3) .
Ga1 Li1 3.269(6) .
Ga1 H1A 1.55(4) .
Ga1 H1B 1.54(5) .
O1 C27 1.433(4) .
O1 C30 1.446(4) .
O1 Li1 1.874(6) .
N1 C3 1.427(4) .
N1 C1 1.443(4) .
N1 Li1 2.024(6) .
C1 C2 1.331(4) .
C1 Li1 2.233(6) .
C1 H1 0.9500 .
Li1 O2 1.906(6) .
O2 C34 1.435(4) .
O2 C31 1.456(4) .
N2 C2 1.387(4) .
N2 C15 1.426(4) .
C2 H2 0.9500 .
C3 C8 1.415(4) .
C3 C4 1.419(4) .
C4 C5 1.382(4) .
C4 C9 1.524(4) .
C5 C6 1.388(4) .
C5 H5 0.9500 .
C6 C7 1.374(4) .
C6 H6 0.9500 .
C7 C8 1.396(4) .
C7 H7 0.9500 .
C8 C12 1.530(4) .
C9 C10 1.539(5) .
C9 C11 1.541(5) .
C9 H9 1.0000 .
C10 H10A 0.9800 .
C10 H10B 0.9800 .
C10 H10C 0.9800 .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 C13 1.531(4) .
C12 C14 1.531(5) .
C12 H12 1.0000 .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C15 C20 1.405(4) .
C15 C16 1.411(4) .
C16 C17 1.394(4) .
C16 C21 1.518(4) .
C17 C18 1.381(5) .
C17 H17 0.9500 .
C18 C19 1.387(5) .
C18 H18 0.9500 .
C19 C20 1.394(4) .
C19 H19 0.9500 .
C20 C24 1.527(4) .
C21 C22 1.531(5) .
C21 C23 1.533(5) .
C21 H21 1.0000 .
C22 H22A 0.9800 .
C22 H22B 0.9800 .
C22 H22C 0.9800 .
C23 H23A 0.9800 .
C23 H23B 0.9800 .
C23 H23C 0.9800 .
C24 C26 1.514(5) .
C24 C25 1.518(5) .
C24 H24 1.0000 .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
C27 C28 1.502(6) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C28 C29 1.514(6) .
C28 H28A 0.9900 .
C28 H28B 0.9900 .
C29 C30 1.515(5) .
C29 H29A 0.9900 .
C29 H29B 0.9900 .
C30 H30A 0.9900 .
C30 H30B 0.9900 .
C31 C32 1.504(5) .
C31 H31A 0.9900 .
C31 H31B 0.9900 .
C32 C33 1.502(5) .
C32 H32A 0.9900 .
C32 H32B 0.9900 .
C33 C34 1.488(5) .
C33 H33A 0.9900 .
C33 H33B 0.9900 .
C34 H34A 0.9900 .
C34 H34B 0.9900 .
C35 C36 1.391(7) .
C35 C35 1.485(10) 3_767
C35 H35A 0.9900 .
C35 H35B 0.9900 .
C36 C37 1.496(8) .
C36 H36A 0.9900 .
C36 H36B 0.9900 .
C37 H37A 0.9800 .
C37 H37B 0.9800 .
C37 H37C 0.9800 .
