#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:17:58 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179962 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/56/7025624.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_7025624
loop_
_publ_author_name
'Sivapackiam, Jothilingam'
'Harpstrite, Scott E.'
'Prior, Julie L.'
'Gu, Hannah'
'Rath, Nigam P.'
'Sharma, Vijay'
_publ_section_title
;
 Synthesis, molecular structure, and validation of metalloprobes for
 assessment of MDR1 P-glycoprotein-mediated functional transport.
;
_journal_issue                   25
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5842
_journal_page_last               5850
_journal_paper_doi               10.1039/c002361b
_journal_volume                  39
_journal_year                    2010
_chemical_absolute_configuration ad
_chemical_formula_sum            'C38 H48 Cl Ga N4 O8'
_chemical_formula_weight         793.97
_chemical_name_systematic
;
?
;
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 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                 118.391(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   21.0875(13)
_cell_length_b                   8.0184(4)
_cell_length_c                   12.1927(6)
_cell_measurement_reflns_used    9822
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      39.73
_cell_measurement_theta_min      3.36
_cell_volume                     1813.67(18)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'CCD area detector'
_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  0.0261
_diffrn_reflns_av_sigmaI/netI    0.0240
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_h_min       -34
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            37850
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         34.99
_diffrn_reflns_theta_min         1.90
_exptl_absorpt_coefficient_mu    0.891
_exptl_absorpt_correction_T_max  0.8618
_exptl_absorpt_correction_T_min  0.7871
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'sadabs v2008/1'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.454
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rhombic
_exptl_crystal_F_000             832
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.17
_refine_diff_density_max         0.735
_refine_diff_density_min         -0.342
_refine_diff_density_rms         0.054
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.383(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     267
_refine_ls_number_reflns         7544
_refine_ls_number_restraints     65
_refine_ls_restrained_S_all      1.050
_refine_ls_R_factor_all          0.0235
_refine_ls_R_factor_gt           0.0224
_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)+(0.0370P)²+0.1344P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0569
_refine_ls_wR_factor_ref         0.0574
_reflns_number_gt                7372
_reflns_number_total             7544
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c002361b.txt
_cod_data_source_block           v2909
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'no' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        1813.67(17)
_cod_original_sg_symbol_H-M      C2
_cod_database_code               7025624
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ga1 Ga 1.0000 0.323308(10) 0.5000 0.00889(3) Uani 1 2 d S . .
O1 O 0.89647(3) 0.32828(11) 0.41589(5) 0.01174(9) Uani 1 1 d . . .
O2 O 0.77815(4) 0.34606(10) 0.20609(6) 0.01684(14) Uani 1 1 d . . .
N1 N 1.00656(5) 0.12372(10) 0.61810(7) 0.01145(13) Uani 1 1 d . . .
H1 H 0.9652 0.1206 0.6091 0.017 Uiso 1 1 d R . .
N2 N 0.99471(4) 0.47786(10) 0.62976(7) 0.01092(13) Uani 1 1 d . . .
C1 C 0.85938(5) 0.46565(11) 0.39782(8) 0.01100(13) Uani 1 1 d . . .
C2 C 0.79245(5) 0.47969(12) 0.28257(8) 0.01290(14) Uani 1 1 d . . .
C3 C 0.75139(5) 0.62013(12) 0.25686(8) 0.01511(15) Uani 1 1 d . . .
H3 H 0.7080 0.6275 0.1800 0.018 Uiso 1 1 calc R . .
C4 C 0.77162(5) 0.75571(12) 0.34173(9) 0.01372(15) Uani 1 1 d . . .
C5 C 0.72921(6) 0.90199(13) 0.31136(10) 0.01826(17) Uani 1 1 d . . .
H5 H 0.6871 0.9097 0.2326 0.022 Uiso 1 1 calc R . .
C6 C 0.74743(6) 1.03282(13) 0.39293(11) 0.01997(18) Uani 1 1 d . . .
H6 H 0.7192 1.1316 0.3701 0.024 Uiso 1 1 calc R . .
C7 C 0.80862(6) 1.01916(12) 0.51121(10) 0.01814(17) Uani 1 1 d . . .
H7 H 0.8205 1.1074 0.5697 0.022 Uiso 1 1 calc R . .
C8 C 0.85135(5) 0.87883(12) 0.54264(9) 0.01497(16) Uani 1 1 d . . .
H8 H 0.8927 0.8726 0.6224 0.018 Uiso 1 1 calc R . .
C9 C 0.83496(5) 0.74357(11) 0.45862(8) 0.01192(14) Uani 1 1 d . . .
C10 C 0.87919(5) 0.59680(11) 0.48389(8) 0.01107(14) Uani 1 1 d . . .
C11 C 0.94131(5) 0.57707(11) 0.60455(8) 0.01158(14) Uani 1 1 d . . .
H11 H 0.9431 0.6424 0.6710 0.014 Uiso 1 1 calc R . .
C12 C 0.70856(5) 0.34308(16) 0.09746(9) 0.0210(2) Uani 1 1 d . . .
H12A H 0.7025 0.4419 0.0446 0.025 Uiso 1 1 calc R . .
H12B H 0.6700 0.3442 0.1220 0.025 Uiso 1 1 calc R . .
C13 C 0.70450(7) 0.18586(17) 0.02739(11) 0.0265(2) Uani 1 1 d . . .
H13A H 0.7400 0.1908 -0.0029 0.040 Uiso 1 1 calc R . .
H13B H 0.6560 0.1745 -0.0436 0.040 Uiso 1 1 calc R . .
H13C H 0.7149 0.0897 0.0830 0.040 Uiso 1 1 calc R . .
C14 C 1.04726(5) 0.45704(12) 0.76222(8) 0.01218(15) Uani 1 1 d . . .
H14A H 1.0408 0.5479 0.8110 0.015 Uiso 1 1 calc R . .
H14B H 1.0966 0.4660 0.7725 0.015 Uiso 1 1 calc R . .
C15 C 1.03902(5) 0.28820(11) 0.81365(8) 0.01238(15) Uani 1 1 d . . .
C16 C 1.05760(6) 0.14356(12) 0.75366(9) 0.01343(16) Uani 1 1 d . . .
H16A H 1.1068 0.1605 0.7647 0.016 Uiso 1 1 calc R . .
H16B H 1.0579 0.0393 0.7974 0.016 Uiso 1 1 calc R . .
C17 C 0.96333(5) 0.27061(13) 0.80028(10) 0.01636(16) Uani 1 1 d . . .
H17A H 0.9273 0.2820 0.7123 0.025 Uiso 1 1 calc R . .
H17B H 0.9557 0.3578 0.8491 0.025 Uiso 1 1 calc R . .
H17C H 0.9585 0.1608 0.8308 0.025 Uiso 1 1 calc R . .
C18 C 1.09456(6) 0.28590(12) 0.95299(9) 0.01729(18) Uani 1 1 d . . .
H18A H 1.0910 0.1801 0.9899 0.026 Uiso 1 1 calc R . .
H18B H 1.0849 0.3786 0.9954 0.026 Uiso 1 1 calc R . .
H18C H 1.1432 0.2975 0.9624 0.026 Uiso 1 1 calc R . .
C19 C 1.02313(6) -0.03023(11) 0.57035(9) 0.01495(16) Uani 1 1 d . . .
H19A H 1.0122 -0.1294 0.6068 0.018 Uiso 1 1 calc R . .
H19B H 1.0748 -0.0331 0.5930 0.018 Uiso 1 1 calc R . .
Cl1 Cl 0.5000 0.26174(5) 0.0000 0.02907(9) Uani 1 2 d SD . .
O3 O 0.5571(7) 0.1690(16) 0.0989(9) 0.0417(16) Uani 0.50 1 d PDU A 1
O4 O 0.4720(3) 0.3390(5) 0.0793(5) 0.0411(9) Uani 0.50 1 d PDU A 1
O3' O 0.4719(3) 0.3878(5) 0.0418(5) 0.0515(12) Uani 0.50 1 d PDU A 2
O4' O 0.5020(14) 0.350(5) 0.106(3) 0.067(12) Uani 0.05 1 d PDU A 3
O4A O 0.5567(8) 0.1488(16) 0.0770(9) 0.0363(15) Uani 0.45 1 d PDU A 3
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'
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'
Ga Ga 0.2307 1.6083 '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
O1 Ga1 O1 177.62(5) . 2_756
O1 Ga1 N2 86.24(3) . .
O1 Ga1 N2 92.32(3) 2_756 .
O1 Ga1 N2 92.32(3) . 2_756
O1 Ga1 N2 86.24(3) 2_756 2_756
N2 Ga1 N2 105.78(5) . 2_756
O1 Ga1 N1 93.96(3) . .
O1 Ga1 N1 87.84(3) 2_756 .
N2 Ga1 N1 86.68(3) . .
N2 Ga1 N1 166.40(3) 2_756 .
O1 Ga1 N1 87.84(3) . 2_756
O1 Ga1 N1 93.96(3) 2_756 2_756
N2 Ga1 N1 166.40(3) . 2_756
N2 Ga1 N1 86.67(3) 2_756 2_756
N1 Ga1 N1 81.52(4) . 2_756
C1 O1 Ga1 122.98(6) . .
C2 O2 C12 116.29(8) . .
C19 N1 C16 110.18(7) . .
C19 N1 Ga1 108.41(5) . .
C16 N1 Ga1 116.96(6) . .
C19 N1 H1 110.8 . .
C16 N1 H1 108.1 . .
Ga1 N1 H1 102.1 . .
C11 N2 C14 116.62(8) . .
C11 N2 Ga1 123.31(6) . .
C14 N2 Ga1 119.27(6) . .
O1 C1 C10 124.37(8) . .
O1 C1 C2 117.28(8) . .
C10 C1 C2 118.33(8) . .
O2 C2 C3 125.81(8) . .
O2 C2 C1 113.67(8) . .
C3 C2 C1 120.48(8) . .
C2 C3 C4 121.82(9) . .
C2 C3 H3 119.1 . .
C4 C3 H3 119.1 . .
C5 C4 C9 119.74(9) . .
C5 C4 C3 120.74(9) . .
C9 C4 C3 119.52(8) . .
C6 C5 C4 121.43(10) . .
C6 C5 H5 119.3 . .
C4 C5 H5 119.3 . .
C5 C6 C7 119.21(9) . .
C5 C6 H6 120.4 . .
C7 C6 H6 120.4 . .
C8 C7 C6 120.51(9) . .
C8 C7 H7 119.7 . .
C6 C7 H7 119.7 . .
C7 C8 C9 121.45(9) . .
C7 C8 H8 119.3 . .
C9 C8 H8 119.3 . .
C8 C9 C4 117.58(8) . .
C8 C9 C10 124.05(8) . .
C4 C9 C10 118.37(8) . .
C1 C10 C11 119.02(8) . .
C1 C10 C9 121.36(8) . .
C11 C10 C9 119.35(8) . .
N2 C11 C10 125.30(8) . .
N2 C11 H11 117.3 . .
C10 C11 H11 117.3 . .
O2 C12 C13 107.19(9) . .
O2 C12 H12A 110.3 . .
C13 C12 H12A 110.3 . .
O2 C12 H12B 110.3 . .
C13 C12 H12B 110.3 . .
H12A C12 H12B 108.5 . .
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 . .
N2 C14 C15 112.08(8) . .
N2 C14 H14A 109.2 . .
C15 C14 H14A 109.2 . .
N2 C14 H14B 109.2 . .
C15 C14 H14B 109.2 . .
H14A C14 H14B 107.9 . .
C16 C15 C17 111.89(8) . .
C16 C15 C14 111.79(7) . .
C17 C15 C14 110.62(8) . .
C16 C15 C18 106.70(7) . .
C17 C15 C18 108.91(8) . .
C14 C15 C18 106.67(7) . .
N1 C16 C15 113.56(8) . .
N1 C16 H16A 108.9 . .
C15 C16 H16A 108.9 . .
N1 C16 H16B 108.9 . .
C15 C16 H16B 108.9 . .
H16A C16 H16B 107.7 . .
C15 C17 H17A 109.5 . .
C15 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C15 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C15 C18 H18A 109.5 . .
C15 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C15 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
N1 C19 C19 107.49(7) . 2_756
N1 C19 H19A 110.2 . .
C19 C19 H19A 110.2 2_756 .
N1 C19 H19B 110.2 . .
C19 C19 H19B 110.2 2_756 .
H19A C19 H19B 108.5 . .
O3' Cl1 O3' 86.4(4) 2_655 .
O3' Cl1 O4A 109.3(7) 2_655 .
O3' Cl1 O4A 126.0(5) . .
O3' Cl1 O4A 126.0(5) 2_655 2_655
O3' Cl1 O4A 109.3(7) . 2_655
O4A Cl1 O4A 101.9(13) . 2_655
O3' Cl1 O3 113.7(4) 2_655 2_655
O3' Cl1 O3 110.6(7) . 2_655
O4A Cl1 O3 109.0(2) . 2_655
O4A Cl1 O3 12.4(7) 2_655 2_655
O3' Cl1 O3 110.6(7) 2_655 .
O3' Cl1 O3 113.7(4) . .
O4A Cl1 O3 12.4(7) . .
O4A Cl1 O3 109.0(2) 2_655 .
O3 Cl1 O3 117.9(12) 2_655 .
O3' Cl1 O4' 98.0(17) 2_655 .
O3' Cl1 O4' 32.6(15) . .
O4A Cl1 O4' 93.4(16) . .
O4A Cl1 O4' 123.3(14) 2_655 .
O3 Cl1 O4' 130.8(12) 2_655 .
O3 Cl1 O4' 81.1(15) . .
O3' Cl1 O4' 32.6(15) 2_655 2_655
O3' Cl1 O4' 98.0(17) . 2_655
O4A Cl1 O4' 123.3(14) . 2_655
O4A Cl1 O4' 93.4(16) 2_655 2_655
O3 Cl1 O4' 81.1(15) 2_655 2_655
O3 Cl1 O4' 130.8(12) . 2_655
O4' Cl1 O4' 122(4) . 2_655
O3' Cl1 O4 107.9(3) 2_655 .
O3' Cl1 O4 23.8(2) . .
O4A Cl1 O4 107.6(5) . .
O4A Cl1 O4 102.9(6) 2_655 .
O3 Cl1 O4 109.1(6) 2_655 .
O3 Cl1 O4 95.9(4) . .
O4' Cl1 O4 22.1(10) . .
O4' Cl1 O4 121.6(17) 2_655 .
O3' Cl1 O4 23.8(2) 2_655 2_655
O3' Cl1 O4 107.9(3) . 2_655
O4A Cl1 O4 102.9(6) . 2_655
O4A Cl1 O4 107.6(5) 2_655 2_655
O3 Cl1 O4 95.9(4) 2_655 2_655
O3 Cl1 O4 109.1(6) . 2_655
O4' Cl1 O4 121.6(17) . 2_655
O4' Cl1 O4 22.1(10) 2_655 2_655
O4 Cl1 O4 130.8(3) . 2_655
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ga1 O1 1.9211(6) .
Ga1 O1 1.9211(6) 2_756
Ga1 N2 2.0541(8) .
Ga1 N2 2.0541(8) 2_756
Ga1 N1 2.1129(8) .
Ga1 N1 2.1129(8) 2_756
O1 C1 1.3075(12) .
O2 C2 1.3569(12) .
O2 C12 1.4353(11) .
N1 C19 1.4759(12) .
N1 C16 1.4913(12) .
N1 H1 0.8263 .
N2 C11 1.2908(12) .
N2 C14 1.4705(12) .
C1 C10 1.4017(12) .
C1 C2 1.4469(12) .
C2 C3 1.3631(13) .
C3 C4 1.4195(14) .
C3 H3 0.9500 .
C4 C5 1.4135(14) .
C4 C9 1.4193(13) .
C5 C6 1.3689(15) .
C5 H5 0.9500 .
C6 C7 1.4097(15) .
C6 H6 0.9500 .
C7 C8 1.3773(14) .
C7 H7 0.9500 .
C8 C9 1.4172(13) .
C8 H8 0.9500 .
C9 C10 1.4410(12) .
C10 C11 1.4397(12) .
C11 H11 0.9500 .
C12 C13 1.5023(17) .
C12 H12A 0.9900 .
C12 H12B 0.9900 .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 C15 1.5362(13) .
C14 H14A 0.9900 .
C14 H14B 0.9900 .
C15 C16 1.5187(13) .
C15 C17 1.5317(13) .
C15 C18 1.5383(13) .
C16 H16A 0.9900 .
C16 H16B 0.9900 .
C17 H17A 0.9800 .
C17 H17B 0.9800 .
C17 H17C 0.9800 .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C19 C19 1.5176(19) 2_756
C19 H19A 0.9900 .
C19 H19B 0.9900 .
Cl1 O3' 1.386(4) 2_655
Cl1 O3' 1.386(4) .
Cl1 O4A 1.437(8) .
Cl1 O4A 1.437(8) 2_655
Cl1 O3 1.441(9) 2_655
Cl1 O3 1.441(9) .
Cl1 O4' 1.458(15) .
Cl1 O4' 1.458(15) 2_655
Cl1 O4 1.488(4) .
Cl1 O4 1.488(4) 2_655
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
O1 Ga1 O1 C1 -7.70(6) 2_756 .
N2 Ga1 O1 C1 45.18(6) . .
N2 Ga1 O1 C1 -60.49(6) 2_756 .
N1 Ga1 O1 C1 131.58(6) . .
N1 Ga1 O1 C1 -147.08(6) 2_756 .
O1 Ga1 N1 C19 102.63(6) . .
O1 Ga1 N1 C19 -78.92(6) 2_756 .
N2 Ga1 N1 C19 -171.37(7) . .
N2 Ga1 N1 C19 -14.66(18) 2_756 .
N1 Ga1 N1 C19 15.41(5) 2_756 .
O1 Ga1 N1 C16 -132.12(7) . .
O1 Ga1 N1 C16 46.33(7) 2_756 .
N2 Ga1 N1 C16 -46.12(7) . .
N2 Ga1 N1 C16 110.58(14) 2_756 .
N1 Ga1 N1 C16 140.66(8) 2_756 .
O1 Ga1 N2 C11 -26.66(8) . .
O1 Ga1 N2 C11 151.44(8) 2_756 .
N2 Ga1 N2 C11 64.69(7) 2_756 .
N1 Ga1 N2 C11 -120.86(8) . .
N1 Ga1 N2 C11 -91.09(16) 2_756 .
O1 Ga1 N2 C14 142.69(7) . .
O1 Ga1 N2 C14 -39.21(7) 2_756 .
N2 Ga1 N2 C14 -125.96(8) 2_756 .
N1 Ga1 N2 C14 48.50(7) . .
N1 Ga1 N2 C14 78.27(17) 2_756 .
Ga1 O1 C1 C10 -37.44(11) . .
Ga1 O1 C1 C2 144.48(6) . .
C12 O2 C2 C3 -9.77(14) . .
C12 O2 C2 C1 172.64(8) . .
O1 C1 C2 O2 -1.54(12) . .
C10 C1 C2 O2 -179.74(8) . .
O1 C1 C2 C3 -179.27(8) . .
C10 C1 C2 C3 2.53(13) . .
O2 C2 C3 C4 -178.47(9) . .
C1 C2 C3 C4 -1.04(15) . .
C2 C3 C4 C5 178.15(9) . .
C2 C3 C4 C9 -2.21(15) . .
C9 C4 C5 C6 -0.61(15) . .
C3 C4 C5 C6 179.04(10) . .
C4 C5 C6 C7 -1.95(16) . .
C5 C6 C7 C8 2.69(16) . .
C6 C7 C8 C9 -0.84(15) . .
C7 C8 C9 C4 -1.69(14) . .
C7 C8 C9 C10 177.18(9) . .
C5 C4 C9 C8 2.40(13) . .
C3 C4 C9 C8 -177.25(9) . .
C5 C4 C9 C10 -176.54(9) . .
C3 C4 C9 C10 3.81(13) . .
O1 C1 C10 C11 -4.89(13) . .
C2 C1 C10 C11 173.17(8) . .
O1 C1 C10 C9 -178.88(8) . .
C2 C1 C10 C9 -0.82(13) . .
C8 C9 C10 C1 178.82(9) . .
C4 C9 C10 C1 -2.32(13) . .
C8 C9 C10 C11 4.85(13) . .
C4 C9 C10 C11 -176.28(8) . .
C14 N2 C11 C10 -170.82(8) . .
Ga1 N2 C11 C10 -1.21(13) . .
C1 C10 C11 N2 24.64(14) . .
C9 C10 C11 N2 -161.26(9) . .
C2 O2 C12 C13 -179.92(9) . .
C11 N2 C14 C15 105.16(10) . .
Ga1 N2 C14 C15 -64.89(9) . .
N2 C14 C15 C16 66.03(10) . .
N2 C14 C15 C17 -59.38(10) . .
N2 C14 C15 C18 -177.68(8) . .
C19 N1 C16 C15 -173.34(7) . .
Ga1 N1 C16 C15 62.31(9) . .
C17 C15 C16 N1 58.59(10) . .
C14 C15 C16 N1 -66.11(10) . .
C18 C15 C16 N1 177.62(8) . .
C16 N1 C19 C19 -171.96(9) . 2_756
Ga1 N1 C19 C19 -42.81(10) . 2_756
