#------------------------------------------------------------------------------
#$Date: 2016-03-25 10:32:45 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179753 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/49/7004961.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_7004961
loop_
_publ_author_name
'Uhl, Werner'
'Claesener, Michael'
'Haddadpour, Sima'
'Jasper, Beate'
'Hepp, Alexander'
_publ_section_title
;
 The reactions of dialkylgallium hydrides with
 tert-butylethynylbenzenes--a systematic investigation into the course
 of hydrogallation reactions.
;
_journal_issue                   4
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              417
_journal_page_last               423
_journal_paper_doi               10.1039/b614003c
_journal_year                    2007
_chemical_formula_sum            'C75 H123 Ga3'
_chemical_formula_weight         1233.89
_chemical_name_systematic
;
?
;
_space_group_IT_number           165
_symmetry_space_group_name_Hall  '-P 3 2"c'
_symmetry_space_group_name_H-M   'P -3 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                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            4
_cell_length_a                   17.6535(3)
_cell_length_b                   17.6535(3)
_cell_length_c                   25.9914(4)
_cell_measurement_reflns_used    'all measured'
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      70.07
_cell_measurement_theta_min      2.89
_cell_volume                     7014.9(2)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0739
_diffrn_reflns_av_sigmaI/netI    0.0613
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            39035
_diffrn_reflns_theta_full        70.07
_diffrn_reflns_theta_max         70.07
_diffrn_reflns_theta_min         2.89
_exptl_absorpt_coefficient_mu    1.619
_exptl_absorpt_correction_T_max  1
_exptl_absorpt_correction_T_min  0.8112
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_density_diffrn    1.168
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2664
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.14
_refine_diff_density_max         0.630
_refine_diff_density_min         -0.521
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.858
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     242
_refine_ls_number_reflns         4456
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.858
_refine_ls_R_factor_all          0.0613
_refine_ls_R_factor_gt           0.0424
_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)+(0.0683P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1039
_refine_ls_wR_factor_ref         0.1088
_reflns_number_gt                3096
_reflns_number_total             4456
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b614003c.txt
_cod_data_source_block           Uhl-2b
_cod_original_sg_symbol_H-M      P-3c1
_cod_database_code               7004961
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z+1/2'
'x-y, -y, -z+1/2'
'-x, -x+y, -z+1/2'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z-1/2'
'-x+y, y, z-1/2'
'x, x-y, 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
Ga1 Ga 0.46354(2) 0.10670(2) 1.018129(13) 0.01751(11) Uani 1 1 d . . .
C1 C 0.49890(18) 0.17299(17) 1.08315(10) 0.0157(5) Uani 1 1 d . . .
C11 C 0.44008(18) 0.14081(18) 1.12106(11) 0.0181(6) Uani 1 1 d . . .
H11 H 0.3873 0.0881 1.1121 0.022 Uiso 1 1 calc R . .
C12 C 0.44085(19) 0.17200(19) 1.17595(11) 0.0215(6) Uani 1 1 d . . .
C121 C 0.5317(2) 0.2158(2) 1.20087(11) 0.0298(7) Uani 1 1 d . . .
H12A H 0.5567 0.1787 1.1970 0.036 Uiso 1 1 calc R . .
H12B H 0.5266 0.2252 1.2368 0.036 Uiso 1 1 calc R . .
H12C H 0.5687 0.2710 1.1844 0.036 Uiso 1 1 calc R . .
C122 C 0.3793(2) 0.0922(2) 1.20846(12) 0.0319(8) Uani 1 1 d . . .
H12D H 0.3218 0.0642 1.1937 0.038 Uiso 1 1 calc R . .
H12E H 0.3769 0.1106 1.2429 0.038 Uiso 1 1 calc R . .
H12F H 0.4007 0.0518 1.2092 0.038 Uiso 1 1 calc R . .
C123 C 0.4055(3) 0.2358(2) 1.17548(13) 0.0389(9) Uani 1 1 d . . .
H12G H 0.4447 0.2873 1.1564 0.047 Uiso 1 1 calc R . .
H12H H 0.4008 0.2517 1.2102 0.047 Uiso 1 1 calc R . .
H12I H 0.3489 0.2082 1.1595 0.047 Uiso 1 1 calc R . .
C13 C 0.58534(17) 0.25585(17) 1.08524(10) 0.0150(6) Uani 1 1 d . . .
C14 C 0.66273(18) 0.25291(17) 1.08506(10) 0.0160(6) Uani 1 1 d . . .
H14 H 0.6600 0.1972 1.0848 0.019 Uiso 1 1 calc R . .
C2 C 0.52718(18) 0.15277(18) 0.95290(10) 0.0167(6) Uani 1 1 d . . .
C21 C 0.49989(19) 0.09594(18) 0.91350(11) 0.0207(6) Uani 1 1 d . . .
H21 H 0.4544 0.0380 0.9222 0.025 Uiso 1 1 calc R . .
C22 C 0.5284(2) 0.1072(2) 0.85738(11) 0.0247(7) Uani 1 1 d . . .
C221 C 0.6142(2) 0.1061(2) 0.85227(12) 0.0307(7) Uani 1 1 d . . .
H22A H 0.6600 0.1560 0.8697 0.037 Uiso 1 1 calc R . .
H22B H 0.6289 0.1082 0.8165 0.037 Uiso 1 1 calc R . .
H22C H 0.6076 0.0535 0.8674 0.037 Uiso 1 1 calc R . .
C222 C 0.5392(2) 0.1914(2) 0.83391(11) 0.0302(7) Uani 1 1 d . . .
H22D H 0.4857 0.1925 0.8378 0.036 Uiso 1 1 calc R . .
H22E H 0.5531 0.1936 0.7980 0.036 Uiso 1 1 calc R . .
H22F H 0.5857 0.2409 0.8512 0.036 Uiso 1 1 calc R . .
C223 C 0.4581(3) 0.0296(2) 0.82733(12) 0.0408(9) Uani 1 1 d . . .
H22G H 0.4527 -0.0236 0.8406 0.049 Uiso 1 1 calc R . .
H22H H 0.4742 0.0356 0.7917 0.049 Uiso 1 1 calc R . .
H22I H 0.4033 0.0281 0.8308 0.049 Uiso 1 1 calc R . .
C23 C 0.59890(18) 0.24567(17) 0.95042(10) 0.0159(6) Uani 1 1 d . . .
C24 C 0.58026(17) 0.31374(18) 0.95083(10) 0.0163(6) Uani 1 1 d . . .
H24 H 0.5204 0.3002 0.9514 0.020 Uiso 1 1 calc R . .
C3 C 0.35917(19) -0.01154(19) 1.01469(11) 0.0257(7) Uani 1 1 d . . .
H3A H 0.3768 -0.0512 1.0015 0.031 Uiso 1 1 calc R . .
H3B H 0.3379 -0.0299 1.0490 0.031 Uiso 1 1 calc R . .
C31 C 0.2841(2) -0.0197(2) 0.98184(13) 0.0297(7) Uani 1 1 d . . .
H31A H 0.2609 0.0138 0.9974 0.036 Uiso 1 1 calc R . .
H31B H 0.3062 0.0049 0.9485 0.036 Uiso 1 1 calc R . .
C32 C 0.2108(2) -0.1135(2) 0.97533(15) 0.0394(9) Uani 1 1 d . . .
H32A H 0.2333 -0.1472 0.9593 0.047 Uiso 1 1 calc R . .
H32B H 0.1656 -0.1147 0.9542 0.047 Uiso 1 1 calc R . .
H32C H 0.1871 -0.1380 1.0084 0.047 Uiso 1 1 calc R . .
CP1 C 0.1580(4) 0.9343(4) 0.1165(2) 0.0856(17) Uani 1 1 d . . .
HP1A H 0.1278 0.9205 0.0841 0.103 Uiso 1 1 calc R . .
HP1B H 0.2192 0.9728 0.1101 0.103 Uiso 1 1 calc R . .
CP2 C 0.1248(4) 0.9761(4) 0.1500(2) 0.095(2) Uani 1 1 d . . .
HP2A H 0.0825 0.9856 0.1323 0.114 Uiso 1 1 calc R . .
HP2B H 0.1715 1.0315 0.1617 0.114 Uiso 1 1 calc R . .
CP3 C 0.0836(6) 0.9154(7) 0.1941(3) 0.144(3) Uani 1 1 d . . .
HP3A H 0.0282 0.9101 0.2024 0.172 Uiso 1 1 calc R . .
HP3B H 0.1206 0.9363 0.2238 0.172 Uiso 1 1 calc R . .
CP4 C 0.0719(5) 0.8304(5) 0.1775(3) 0.123(3) Uani 1 1 d . . .
HP4A H 0.0163 0.7953 0.1610 0.148 Uiso 1 1 calc R . .
HP4B H 0.0769 0.7985 0.2059 0.148 Uiso 1 1 calc R . .
CP5 C 0.1449(6) 0.8570(5) 0.1406(3) 0.126(3) Uani 1 1 d . . .
HP5A H 0.1970 0.8676 0.1583 0.152 Uiso 1 1 calc R . .
HP5B H 0.1304 0.8119 0.1155 0.152 Uiso 1 1 calc R . .
CH1 C 0.0605(17) 0.988(3) -0.0104(6) 0.239(12) Uani 1 1 d . . .
HH1A H 0.1081 0.9782 -0.0025 0.286 Uiso 1 1 calc R . .
HH1B H 0.0549 0.9889 -0.0470 0.286 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 0.0181 0.0091 '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'
Ga Ga -1.2846 0.7763 '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
_geom_angle_publ_flag
C2 Ga1 C1 123.13(11) . . ?
C2 Ga1 C3 115.76(12) . . ?
C1 Ga1 C3 121.10(12) . . ?
C11 C1 C13 125.8(2) . . ?
C11 C1 Ga1 115.6(2) . . ?
C13 C1 Ga1 118.49(19) . . ?
C1 C11 C12 132.2(3) . . ?
C1 C11 H11 113.9 . . ?
C12 C11 H11 113.9 . . ?
C11 C12 C123 108.9(2) . . ?
C11 C12 C122 108.0(2) . . ?
C123 C12 C122 108.5(3) . . ?
C11 C12 C121 113.3(2) . . ?
C123 C12 C121 109.8(3) . . ?
C122 C12 C121 108.2(3) . . ?
C12 C121 H12A 109.5 . . ?
C12 C121 H12B 109.5 . . ?
H12A C121 H12B 109.5 . . ?
C12 C121 H12C 109.5 . . ?
H12A C121 H12C 109.5 . . ?
H12B C121 H12C 109.5 . . ?
C12 C122 H12D 109.5 . . ?
C12 C122 H12E 109.5 . . ?
H12D C122 H12E 109.5 . . ?
C12 C122 H12F 109.5 . . ?
H12D C122 H12F 109.5 . . ?
H12E C122 H12F 109.5 . . ?
C12 C123 H12G 109.5 . . ?
C12 C123 H12H 109.5 . . ?
H12G C123 H12H 109.5 . . ?
C12 C123 H12I 109.5 . . ?
H12G C123 H12I 109.5 . . ?
H12H C123 H12I 109.5 . . ?
C14 C13 C14 118.8(3) 3_665 . ?
C14 C13 C1 120.9(2) 3_665 . ?
C14 C13 C1 120.2(2) . . ?
C13 C14 C13 121.2(3) 2_655 . ?
C13 C14 H14 119.4 2_655 . ?
C13 C14 H14 119.4 . . ?
C21 C2 C23 125.4(3) . . ?
C21 C2 Ga1 115.5(2) . . ?
C23 C2 Ga1 119.13(19) . . ?
C2 C21 C22 131.4(3) . . ?
C2 C21 H21 114.3 . . ?
C22 C21 H21 114.3 . . ?
C21 C22 C223 107.8(3) . . ?
C21 C22 C221 110.3(3) . . ?
C223 C22 C221 108.1(3) . . ?
C21 C22 C222 112.4(2) . . ?
C223 C22 C222 108.6(3) . . ?
C221 C22 C222 109.5(3) . . ?
C22 C221 H22A 109.5 . . ?
C22 C221 H22B 109.5 . . ?
H22A C221 H22B 109.5 . . ?
C22 C221 H22C 109.5 . . ?
H22A C221 H22C 109.5 . . ?
H22B C221 H22C 109.5 . . ?
C22 C222 H22D 109.5 . . ?
C22 C222 H22E 109.5 . . ?
H22D C222 H22E 109.5 . . ?
C22 C222 H22F 109.5 . . ?
H22D C222 H22F 109.5 . . ?
H22E C222 H22F 109.5 . . ?
C22 C223 H22G 109.5 . . ?
C22 C223 H22H 109.5 . . ?
H22G C223 H22H 109.5 . . ?
C22 C223 H22I 109.5 . . ?
H22G C223 H22I 109.5 . . ?
H22H C223 H22I 109.5 . . ?
C24 C23 C24 118.6(3) 2_655 . ?
C24 C23 C2 120.6(2) 2_655 . ?
C24 C23 C2 120.7(3) . . ?
C23 C24 C23 121.4(3) 3_665 . ?
C23 C24 H24 119.3 3_665 . ?
C23 C24 H24 119.3 . . ?
C31 C3 Ga1 115.6(2) . . ?
C31 C3 H3A 108.4 . . ?
Ga1 C3 H3A 108.4 . . ?
C31 C3 H3B 108.4 . . ?
Ga1 C3 H3B 108.4 . . ?
H3A C3 H3B 107.4 . . ?
C32 C31 C3 113.1(3) . . ?
C32 C31 H31A 109.0 . . ?
C3 C31 H31A 109.0 . . ?
C32 C31 H31B 109.0 . . ?
C3 C31 H31B 109.0 . . ?
H31A C31 H31B 107.8 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
CP5 CP1 CP2 108.4(5) . . ?
CP5 CP1 HP1A 110.0 . . ?
CP2 CP1 HP1A 110.0 . . ?
CP5 CP1 HP1B 110.0 . . ?
CP2 CP1 HP1B 110.0 . . ?
HP1A CP1 HP1B 108.4 . . ?
CP1 CP2 CP3 105.8(6) . . ?
CP1 CP2 HP2A 110.6 . . ?
CP3 CP2 HP2A 110.6 . . ?
CP1 CP2 HP2B 110.6 . . ?
CP3 CP2 HP2B 110.6 . . ?
HP2A CP2 HP2B 108.7 . . ?
CP2 CP3 CP4 106.1(6) . . ?
CP2 CP3 HP3A 110.5 . . ?
CP4 CP3 HP3A 110.5 . . ?
CP2 CP3 HP3B 110.5 . . ?
CP4 CP3 HP3B 110.5 . . ?
HP3A CP3 HP3B 108.7 . . ?
CP3 CP4 CP5 102.1(6) . . ?
CP3 CP4 HP4A 111.4 . . ?
CP5 CP4 HP4A 111.4 . . ?
CP3 CP4 HP4B 111.4 . . ?
CP5 CP4 HP4B 111.4 . . ?
HP4A CP4 HP4B 109.2 . . ?
CP1 CP5 CP4 106.8(6) . . ?
CP1 CP5 HP5A 110.4 . . ?
CP4 CP5 HP5A 110.4 . . ?
CP1 CP5 HP5B 110.4 . . ?
CP4 CP5 HP5B 110.4 . . ?
HP5A CP5 HP5B 108.6 . . ?
CH1 CH1 CH1 104.2(16) 9_665 8_455 ?
CH1 CH1 HH1A 110.9 9_665 . ?
CH1 CH1 HH1A 110.9 8_455 . ?
CH1 CH1 HH1B 110.9 9_665 . ?
CH1 CH1 HH1B 110.9 8_455 . ?
HH1A CH1 HH1B 108.9 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ga1 C2 1.971(3) . ?
Ga1 C1 1.971(3) . ?
Ga1 C3 1.978(3) . ?
C1 C11 1.335(4) . ?
C1 C13 1.496(4) . ?
C11 C12 1.527(4) . ?
C11 H11 0.9600 . ?
C12 C123 1.536(4) . ?
C12 C122 1.532(4) . ?
C12 C121 1.533(4) . ?
C121 H12A 0.9599 . ?
C121 H12B 0.9599 . ?
C121 H12C 0.9599 . ?
C122 H12D 0.9599 . ?
C122 H12E 0.9599 . ?
C122 H12F 0.9599 . ?
C123 H12G 0.9599 . ?
C123 H12H 0.9599 . ?
C123 H12I 0.9599 . ?
C13 C14 1.397(3) 3_665 ?
C13 C14 1.393(4) . ?
C14 C13 1.397(4) 2_655 ?
C14 H14 0.9600 . ?
C2 C21 1.343(4) . ?
C2 C23 1.490(4) . ?
C21 C22 1.523(4) . ?
C21 H21 0.9600 . ?
C22 C223 1.524(4) . ?
C22 C221 1.530(4) . ?
C22 C222 1.528(4) . ?
C221 H22A 0.9599 . ?
C221 H22B 0.9599 . ?
C221 H22C 0.9599 . ?
C222 H22D 0.9599 . ?
C222 H22E 0.9599 . ?
C222 H22F 0.9599 . ?
C223 H22G 0.9599 . ?
C223 H22H 0.9599 . ?
C223 H22I 0.9599 . ?
C23 C24 1.395(4) 2_655 ?
C23 C24 1.396(4) . ?
C24 C23 1.395(4) 3_665 ?
C24 H24 0.9600 . ?
C3 C31 1.522(4) . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C31 C32 1.518(4) . ?
C31 H31A 0.9600 . ?
C31 H31B 0.9600 . ?
C32 H32A 0.9599 . ?
C32 H32B 0.9599 . ?
C32 H32C 0.9599 . ?
CP1 CP5 1.411(8) . ?
CP1 CP2 1.443(7) . ?
CP1 HP1A 0.9600 . ?
CP1 HP1B 0.9600 . ?
CP2 CP3 1.487(9) . ?
CP2 HP2A 0.9600 . ?
CP2 HP2B 0.9600 . ?
CP3 CP4 1.474(9) . ?
CP3 HP3A 0.9600 . ?
CP3 HP3B 0.9600 . ?
CP4 CP5 1.482(9) . ?
CP4 HP4A 0.9600 . ?
CP4 HP4B 0.9600 . ?
CP5 HP5A 0.9600 . ?
CP5 HP5B 0.9600 . ?
CH1 CH1 1.306(17) 9_665 ?
CH1 CH1 1.306(17) 8_455 ?
CH1 HH1A 0.9600 . ?
CH1 HH1B 0.9600 . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C2 Ga1 C1 C11 167.06(19) . . . . ?
C3 Ga1 C1 C11 -12.1(3) . . . . ?
C2 Ga1 C1 C13 -9.8(3) . . . . ?
C3 Ga1 C1 C13 170.96(19) . . . . ?
C13 C1 C11 C12 -2.5(5) . . . . ?
Ga1 C1 C11 C12 -179.1(2) . . . . ?
C1 C11 C12 C123 88.3(4) . . . . ?
C1 C11 C12 C122 -154.0(3) . . . . ?
C1 C11 C12 C121 -34.2(4) . . . . ?
C11 C1 C13 C14 -71.1(4) . . . 3_665 ?
Ga1 C1 C13 C14 105.5(3) . . . 3_665 ?
C11 C1 C13 C14 111.9(3) . . . . ?
Ga1 C1 C13 C14 -71.6(3) . . . . ?
C14 C13 C14 C13 0.7(5) 3_665 . . 2_655 ?
C1 C13 C14 C13 177.83(17) . . . 2_655 ?
C1 Ga1 C2 C21 173.4(2) . . . . ?
C3 Ga1 C2 C21 -7.3(3) . . . . ?
C1 Ga1 C2 C23 -7.6(3) . . . . ?
C3 Ga1 C2 C23 171.6(2) . . . . ?
C23 C2 C21 C22 -2.3(5) . . . . ?
Ga1 C2 C21 C22 176.6(3) . . . . ?
C2 C21 C22 C223 -163.7(3) . . . . ?
C2 C21 C22 C221 78.4(4) . . . . ?
C2 C21 C22 C222 -44.1(5) . . . . ?
C21 C2 C23 C24 -77.2(4) . . . 2_655 ?
Ga1 C2 C23 C24 104.0(3) . . . 2_655 ?
C21 C2 C23 C24 106.8(3) . . . . ?
Ga1 C2 C23 C24 -72.1(3) . . . . ?
C24 C23 C24 C23 1.5(5) 2_655 . . 3_665 ?
C2 C23 C24 C23 177.63(18) . . . 3_665 ?
C2 Ga1 C3 C31 -65.1(3) . . . . ?
C1 Ga1 C3 C31 114.1(2) . . . . ?
Ga1 C3 C31 C32 172.9(2) . . . . ?
CP5 CP1 CP2 CP3 -4.8(9) . . . . ?
CP1 CP2 CP3 CP4 -15.9(10) . . . . ?
CP2 CP3 CP4 CP5 29.2(9) . . . . ?
CP2 CP1 CP5 CP4 23.8(9) . . . . ?
CP3 CP4 CP5 CP1 -32.7(9) . . . . ?
