#------------------------------------------------------------------------------
#$Date: 2019-11-17 05:32:58 +0100 (Sun 17 de Nov de 2019) $
#$Revision: 228438 $
#$URL: svn://www.crystallography.net/cod/cif/7/12/11/7121143.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_7121143
loop_
_publ_author_name
'Suzuki, Katsunori'
'Numata, Yasuyuki'
'Fujita, Naoko'
'Hayakawa, Naoki'
'Tanikawa, Tomoharu'
'Hashizume, Daisuke'
'Tamao, Kohei'
'Fueno, Hiroyuki'
'Tanaka, Kazuyoshi'
'Matsuo, Tsukasa'
_publ_section_title
;
 A stable free tetragermacyclobutadiene incorporating fused-ring bulky
 EMind groups.
;
_journal_issue                   18
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              2200
_journal_page_last               2203
_journal_paper_doi               10.1039/c7cc09443d
_journal_volume                  54
_journal_year                    2018
_chemical_formula_moiety         'C48 H74 Cl2 Ge2'
_chemical_formula_sum            'C48 H74 Cl2 Ge2'
_chemical_formula_weight         867.15
_chemical_name_common            (EMind)ClGe=GeCl(EMind)
_chemical_name_systematic        dichlorodigermene
_chemical_properties_physical
Air-sensitive,Moisture-sensitive,Heat-sensitive,Oxygen-sensitive
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2017-10-19 deposited with the CCDC.
2018-01-15 downloaded from the CCDC.
;
_cell_angle_alpha                118.544(4)
_cell_angle_beta                 92.150(3)
_cell_angle_gamma                113.282(3)
_cell_formula_units_Z            1
_cell_length_a                   10.9924(4)
_cell_length_b                   11.3428(4)
_cell_length_c                   11.8084(5)
_cell_measurement_reflns_used    8311
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      30.9590
_cell_measurement_theta_min      3.7020
_cell_volume                     1140.33(10)
_computing_cell_refinement       'CrysAlisPro 1.171.39.7e (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.39.7e (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.39.7e (Rigaku OD, 2015)'
_computing_molecular_graphics    SHELXLE
_computing_publication_material  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    SIR2008
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 5.811
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'XtaLAB Pro: Kappa single'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0370
_diffrn_reflns_av_unetI/netI     0.0432
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            18211
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.489
_diffrn_reflns_theta_min         3.626
_diffrn_source                   'fine-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    1.466
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.78275
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.7e (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.263
_exptl_crystal_description       Block
_exptl_crystal_F_000             460
_exptl_crystal_recrystallization_method
'Re-crystallisation from solvent: THF and pentane'
_exptl_crystal_size_max          0.184
_exptl_crystal_size_mid          0.123
_exptl_crystal_size_min          0.111
_refine_diff_density_max         0.783
_refine_diff_density_min         -0.468
_refine_diff_density_rms         0.076
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.133
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     258
_refine_ls_number_reflns         5213
_refine_ls_number_restraints     21
_refine_ls_restrained_S_all      1.141
_refine_ls_R_factor_all          0.0552
_refine_ls_R_factor_gt           0.0438
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0293P)²+2.1871P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1116
_refine_ls_wR_factor_ref         0.1150
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4378
_reflns_number_total             5213
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7cc09443d2.cif
_cod_data_source_block           EMind2Ge2Cl2
_cod_depositor_comments
'Adding full bibliography for 7121142--7121143.cif.'
_cod_original_cell_volume        1140.33(9)
_cod_database_code               7121143
_shelx_shelxl_version_number     2017/1
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.774
_shelx_estimated_absorpt_t_max   0.854
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ge1 Ge 0.10887(4) 0.57260(4) 0.08221(4) 0.02512(11) Uani 0.9565(8) 1 d D . P A
1
Cl1 Cl 0.06647(15) 0.52799(19) 0.24211(18) 0.0419(4) Uani 0.9565(8) 1 d D . P A
1
Ge1B Ge 0.0444(8) 0.6096(8) 0.1129(8) 0.02512(11) Uani 0.0435(8) 1 d D . P A 2
Cl1B Cl 0.034(5) 0.502(5) 0.228(5) 0.0419(4) Uani 0.0435(8) 1 d D . P A 2
C1 C 0.2254(3) 0.7948(3) 0.1691(3) 0.0223(6) Uani 1 1 d . . . . .
C2 C 0.1847(3) 0.9096(3) 0.2262(3) 0.0207(6) Uani 1 1 d . . . . .
C3 C 0.0409(3) 0.8962(3) 0.2332(3) 0.0239(6) Uani 1 1 d . . . . .
C4 C 0.0779(3) 1.0642(3) 0.3364(3) 0.0272(7) Uani 1 1 d . . . . .
H4A H 0.007184 1.087312 0.311256 0.033 Uiso 1 1 calc R U . . .
H4B H 0.080228 1.080836 0.426911 0.033 Uiso 1 1 calc R U . . .
C5 C 0.2201(3) 1.1694(3) 0.3379(3) 0.0235(6) Uani 1 1 d . . . . .
C6 C 0.2827(3) 1.0621(3) 0.2850(3) 0.0215(6) Uani 1 1 d . . . . .
C7 C 0.4208(3) 1.1031(3) 0.2912(3) 0.0240(6) Uani 1 1 d . . . . .
H7 H 0.487076 1.207269 0.334266 0.029 Uiso 1 1 calc R U . . .
C8 C 0.4613(3) 0.9907(3) 0.2341(3) 0.0241(6) Uani 1 1 d . . . . .
C9 C 0.6078(3) 1.0170(4) 0.2321(3) 0.0292(7) Uani 1 1 d D . . . .
C10 C 0.5907(4) 0.8546(4) 0.1580(5) 0.0540(12) Uani 1 1 d . . . . .
H10A H 0.643420 0.843290 0.218596 0.065 Uiso 1 1 calc DR U . . .
H10B H 0.627302 0.835304 0.079174 0.065 Uiso 1 1 calc R U . . .
C11 C 0.4339(4) 0.7368(4) 0.1110(4) 0.0328(8) Uani 1 1 d . . . . .
C12 C 0.3645(3) 0.8377(3) 0.1717(3) 0.0243(6) Uani 1 1 d . . . . .
C13 C -0.0475(3) 0.8366(4) 0.0954(3) 0.0282(7) Uani 1 1 d . . . . .
H13A H -0.062481 0.733528 0.030997 0.034 Uiso 1 1 calc R U . . .
H13B H 0.000261 0.903656 0.063953 0.034 Uiso 1 1 calc R U . . .
H13C H -0.136640 0.834535 0.103203 0.034 Uiso 1 1 calc R U . . .
C14 C -0.0390(4) 0.7976(4) 0.2864(4) 0.0322(7) Uani 1 1 d . . . . .
H14A H 0.021330 0.826314 0.368250 0.039 Uiso 1 1 calc R U . . .
H14B H -0.070555 0.690215 0.218234 0.039 Uiso 1 1 calc R U . . .
H14C H -0.118961 0.813352 0.306807 0.039 Uiso 1 1 calc R U . . .
C15 C 0.3059(4) 1.3060(4) 0.4813(3) 0.0333(7) Uani 1 1 d . . . . .
H15A H 0.314327 1.267244 0.539012 0.040 Uiso 1 1 calc R U . . .
H15B H 0.399898 1.363120 0.478845 0.040 Uiso 1 1 calc R U . . .
C16 C 0.2461(4) 1.4158(4) 0.5457(4) 0.0460(10) Uani 1 1 d . . . . .
H16A H 0.254206 1.470341 0.499973 0.055 Uiso 1 1 calc R U . . .
H16B H 0.297207 1.489014 0.640858 0.055 Uiso 1 1 calc R U . . .
H16C H 0.148695 1.358467 0.537375 0.055 Uiso 1 1 calc R U . . .
C17 C 0.2030(3) 1.2216(4) 0.2413(3) 0.0292(7) Uani 1 1 d . . . . .
H17A H 0.149007 1.129775 0.150665 0.035 Uiso 1 1 calc R U . . .
H17B H 0.147789 1.276181 0.271223 0.035 Uiso 1 1 calc R U . . .
C18 C 0.3343(4) 1.3229(4) 0.2293(4) 0.0393(8) Uani 1 1 d . . . . .
H18A H 0.311427 1.345074 0.163136 0.047 Uiso 1 1 calc R U . . .
H18B H 0.390879 1.271184 0.200400 0.047 Uiso 1 1 calc R U . . .
H18C H 0.385839 1.418226 0.316732 0.047 Uiso 1 1 calc R U . . .
C19 C 0.7114(4) 1.1267(5) 0.3740(4) 0.0435(13) Uani 0.835(7) 1 d D . P B 1
H19A H 0.801999 1.129901 0.367082 0.052 Uiso 0.835(7) 1 calc R U P B 1
H19B H 0.723623 1.230434 0.408750 0.052 Uiso 0.835(7) 1 calc R U P B 1
C20 C 0.6660(6) 1.0815(8) 0.4741(5) 0.0686(18) Uani 0.835(7) 1 d D U P B 1
H20A H 0.578849 1.083441 0.485318 0.103 Uiso 0.835(7) 1 calc R U P B 1
H20B H 0.736875 1.153223 0.560796 0.103 Uiso 0.835(7) 1 calc R U P B 1
H20C H 0.653235 0.978651 0.440284 0.103 Uiso 0.835(7) 1 calc R U P B 1
C19B C 0.6790(15) 1.0608(12) 0.3714(6) 0.0435(13) Uani 0.165(7) 1 d D . P B 2
H19C H 0.620267 0.984769 0.391297 0.052 Uiso 0.165(7) 1 calc DR U P B 2
H19D H 0.768005 1.058445 0.369724 0.052 Uiso 0.165(7) 1 calc DR U P B 2
C20B C 0.705(3) 1.2188(19) 0.4827(12) 0.0686(18) Uani 0.165(7) 1 d D U P B 2
H20D H 0.717184 1.282336 0.445581 0.103 Uiso 0.165(7) 1 calc R U P B 2
H20E H 0.788666 1.265456 0.553691 0.103 Uiso 0.165(7) 1 calc R U P B 2
H20F H 0.626214 1.209803 0.520178 0.103 Uiso 0.165(7) 1 calc R U P B 2
C21 C 0.6590(4) 1.0949(5) 0.1545(5) 0.0433(9) Uani 1 1 d . . . . .
H21A H 0.593598 1.030010 0.063579 0.052 Uiso 1 1 calc R U . . .
H21B H 0.655559 1.192388 0.200149 0.052 Uiso 1 1 calc R U . . .
C22 C 0.8042(4) 1.1276(5) 0.1394(5) 0.0527(11) Uani 1 1 d . . . . .
H22A H 0.811177 1.033084 0.098494 0.063 Uiso 1 1 calc R U . . .
H22B H 0.871755 1.201635 0.228055 0.063 Uiso 1 1 calc R U . . .
H22C H 0.822969 1.168989 0.082040 0.063 Uiso 1 1 calc R U . . .
C23 C 0.4184(4) 0.6347(5) 0.1635(5) 0.0436(9) Uani 1 1 d . . . . .
H23A H 0.479267 0.588613 0.134329 0.052 Uiso 1 1 calc R U . . .
H23B H 0.322514 0.554420 0.128399 0.052 Uiso 1 1 calc R U . . .
H23C H 0.443552 0.695001 0.261892 0.052 Uiso 1 1 calc R U . . .
C24 C 0.3823(4) 0.6421(5) -0.0412(4) 0.0447(9) Uani 1 1 d . . . . .
H24A H 0.282004 0.578712 -0.069299 0.054 Uiso 1 1 calc R U . . .
H24B H 0.426312 0.576898 -0.077366 0.054 Uiso 1 1 calc R U . . .
H24C H 0.405211 0.709610 -0.075259 0.054 Uiso 1 1 calc R U . . .
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 '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_3
C1 Ge1 Cl1 107.57(10) .
C1 Ge1 Ge1 124.24(9) 2_565
Cl1 Ge1 Ge1 104.89(4) 2_565
C1 Ge1B Cl1B 115.5(13) .
C1 Ge1B Ge1B 120.7(5) 2_565
Cl1B Ge1B Ge1B 100.5(15) 2_565
C12 C1 C2 118.4(3) .
C12 C1 Ge1 113.6(2) .
C2 C1 Ge1 128.0(2) .
C12 C1 Ge1B 141.1(3) .
C2 C1 Ge1B 100.4(3) .
C6 C2 C1 120.0(3) .
C6 C2 C3 110.2(2) .
C1 C2 C3 129.9(3) .
C14 C3 C13 109.2(3) .
C14 C3 C2 114.8(3) .
C13 C3 C2 110.8(2) .
C14 C3 C4 108.9(3) .
C13 C3 C4 111.7(2) .
C2 C3 C4 101.3(2) .
C5 C4 C3 109.0(2) .
C5 C4 H4A 109.9 .
C3 C4 H4A 109.9 .
C5 C4 H4B 109.9 .
C3 C4 H4B 109.9 .
H4A C4 H4B 108.3 .
C6 C5 C4 100.9(2) .
C6 C5 C15 111.0(2) .
C4 C5 C15 111.6(3) .
C6 C5 C17 111.1(2) .
C4 C5 C17 110.3(3) .
C15 C5 C17 111.6(3) .
C7 C6 C2 120.9(3) .
C7 C6 C5 126.4(3) .
C2 C6 C5 112.7(3) .
C6 C7 C8 119.5(3) .
C6 C7 H7 120.3 .
C8 C7 H7 120.3 .
C7 C8 C12 120.4(3) .
C7 C8 C9 125.8(3) .
C12 C8 C9 113.8(3) .
C8 C9 C21 109.0(2) .
C8 C9 C10 102.8(3) .
C21 C9 C10 111.9(3) .
C8 C9 C19B 105.7(6) .
C21 C9 C19B 129.2(6) .
C10 C9 C19B 94.9(4) .
C8 C9 C19 112.8(3) .
C21 C9 C19 105.4(3) .
C10 C9 C19 115.0(3) .
C9 C10 C11 109.6(3) .
C9 C10 H10A 109.7 .
C11 C10 H10A 109.7 .
C9 C10 H10B 109.7 .
C11 C10 H10B 109.7 .
H10A C10 H10B 108.2 .
C23 C11 C24 109.9(3) .
C23 C11 C12 113.9(3) .
C24 C11 C12 111.1(3) .
C23 C11 C10 108.2(3) .
C24 C11 C10 110.1(3) .
C12 C11 C10 103.3(3) .
C8 C12 C1 120.8(3) .
C8 C12 C11 110.2(3) .
C1 C12 C11 129.0(3) .
C3 C13 H13A 109.5 .
C3 C13 H13B 109.5 .
H13A C13 H13B 109.5 .
C3 C13 H13C 109.5 .
H13A C13 H13C 109.5 .
H13B C13 H13C 109.5 .
C3 C14 H14A 109.5 .
C3 C14 H14B 109.5 .
H14A C14 H14B 109.5 .
C3 C14 H14C 109.5 .
H14A C14 H14C 109.5 .
H14B C14 H14C 109.5 .
C16 C15 C5 114.6(3) .
C16 C15 H15A 108.6 .
C5 C15 H15A 108.6 .
C16 C15 H15B 108.6 .
C5 C15 H15B 108.6 .
H15A C15 H15B 107.6 .
C15 C16 H16A 109.5 .
C15 C16 H16B 109.5 .
H16A C16 H16B 109.5 .
C15 C16 H16C 109.5 .
H16A C16 H16C 109.5 .
H16B C16 H16C 109.5 .
C18 C17 C5 116.5(3) .
C18 C17 H17A 108.2 .
C5 C17 H17A 108.2 .
C18 C17 H17B 108.2 .
C5 C17 H17B 108.2 .
H17A C17 H17B 107.3 .
C17 C18 H18A 109.5 .
C17 C18 H18B 109.5 .
H18A C18 H18B 109.5 .
C17 C18 H18C 109.5 .
H18A C18 H18C 109.5 .
H18B C18 H18C 109.5 .
C20 C19 C9 113.4(3) .
C20 C19 H19A 108.9 .
C9 C19 H19A 108.9 .
C20 C19 H19B 108.9 .
C9 C19 H19B 108.9 .
H19A C19 H19B 107.7 .
C19 C20 H20A 109.5 .
C19 C20 H20B 109.5 .
H20A C20 H20B 109.5 .
C19 C20 H20C 109.5 .
H20A C20 H20C 109.5 .
H20B C20 H20C 109.5 .
C20B C19B C9 112.1(7) .
C20B C19B H19C 109.2 .
C9 C19B H19C 109.2 .
C20B C19B H19D 109.2 .
C9 C19B H19D 109.2 .
H19C C19B H19D 107.9 .
C19B C20B H20D 109.5 .
C19B C20B H20E 109.5 .
H20D C20B H20E 109.5 .
C19B C20B H20F 109.5 .
H20D C20B H20F 109.5 .
H20E C20B H20F 109.5 .
C22 C21 C9 116.5(3) .
C22 C21 H21A 108.2 .
C9 C21 H21A 108.2 .
C22 C21 H21B 108.2 .
C9 C21 H21B 108.2 .
H21A C21 H21B 107.3 .
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 .
C11 C23 H23A 109.5 .
C11 C23 H23B 109.5 .
H23A C23 H23B 109.5 .
C11 C23 H23C 109.5 .
H23A C23 H23C 109.5 .
H23B C23 H23C 109.5 .
C11 C24 H24A 109.5 .
C11 C24 H24B 109.5 .
H24A C24 H24B 109.5 .
C11 C24 H24C 109.5 .
H24A C24 H24C 109.5 .
H24B C24 H24C 109.5 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ge1 C1 1.981(3) .
Ge1 Cl1 2.1980(13) .
Ge1 Ge1 2.3853(7) 2_565
Ge1B C1 2.019(8) .
Ge1B Cl1B 2.198(4) .
Ge1B Ge1B 2.407(15) 2_565
C1 C12 1.403(4) .
C1 C2 1.412(4) .
C2 C6 1.400(4) .
C2 C3 1.537(4) .
C3 C14 1.534(4) .
C3 C13 1.536(4) .
C3 C4 1.553(4) .
C4 C5 1.539(4) .
C4 H4A 0.9900 .
C4 H4B 0.9900 .
C5 C6 1.520(4) .
C5 C15 1.541(4) .
C5 C17 1.552(4) .
C6 C7 1.388(4) .
C7 C8 1.389(4) .
C7 H7 0.9500 .
C8 C12 1.395(4) .
C8 C9 1.520(4) .
C9 C21 1.534(5) .
C9 C10 1.539(5) .
C9 C19B 1.543(5) .
C9 C19 1.548(4) .
C10 C11 1.569(5) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 C23 1.515(5) .
C11 C24 1.517(6) .
C11 C12 1.534(4) .
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 C16 1.529(5) .
C15 H15A 0.9900 .
C15 H15B 0.9900 .
C16 H16A 0.9800 .
C16 H16B 0.9800 .
C16 H16C 0.9800 .
C17 C18 1.511(5) .
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C19 C20 1.526(4) .
C19 H19A 0.9900 .
C19 H19B 0.9900 .
C20 H20A 0.9800 .
C20 H20B 0.9800 .
C20 H20C 0.9800 .
C19B C20B 1.528(5) .
C19B H19C 0.9900 .
C19B H19D 0.9900 .
C20B H20D 0.9800 .
C20B H20E 0.9800 .
C20B H20F 0.9800 .
C21 C22 1.528(5) .
C21 H21A 0.9900 .
C21 H21B 0.9900 .
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 H24A 0.9800 .
C24 H24B 0.9800 .
C24 H24C 0.9800 .
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
C12 C1 C2 C6 -0.7(4)
Ge1 C1 C2 C6 179.3(2)
Ge1B C1 C2 C6 177.2(3)
C12 C1 C2 C3 177.6(3)
Ge1 C1 C2 C3 -2.5(5)
Ge1B C1 C2 C3 -4.5(4)
C6 C2 C3 C14 -131.3(3)
C1 C2 C3 C14 50.3(4)
C6 C2 C3 C13 104.4(3)
C1 C2 C3 C13 -74.0(4)
C6 C2 C3 C4 -14.2(3)
C1 C2 C3 C4 167.4(3)
C14 C3 C4 C5 144.8(3)
C13 C3 C4 C5 -94.5(3)
C2 C3 C4 C5 23.5(3)
C3 C4 C5 C6 -23.3(3)
C3 C4 C5 C15 -141.2(3)
C3 C4 C5 C17 94.2(3)
C1 C2 C6 C7 -1.7(4)
C3 C2 C6 C7 179.7(3)
C1 C2 C6 C5 178.5(3)
C3 C2 C6 C5 -0.1(3)
C4 C5 C6 C7 -165.3(3)
C15 C5 C6 C7 -47.0(4)
C17 C5 C6 C7 77.8(4)
C4 C5 C6 C2 14.5(3)
C15 C5 C6 C2 132.8(3)
C17 C5 C6 C2 -102.5(3)
C2 C6 C7 C8 2.3(4)
C5 C6 C7 C8 -177.9(3)
C6 C7 C8 C12 -0.5(5)
C6 C7 C8 C9 179.7(3)
C7 C8 C9 C21 -61.6(4)
C12 C8 C9 C21 118.7(3)
C7 C8 C9 C10 179.5(3)
C12 C8 C9 C10 -0.2(4)
C7 C8 C9 C19B 80.7(5)
C12 C8 C9 C19B -99.1(5)
C7 C8 C9 C19 55.1(4)
C12 C8 C9 C19 -124.7(3)
C8 C9 C10 C11 3.3(4)
C21 C9 C10 C11 -113.5(4)
C19B C9 C10 C11 110.6(7)
C19 C9 C10 C11 126.4(4)
C9 C10 C11 C23 -126.1(4)
C9 C10 C11 C24 113.8(4)
C9 C10 C11 C12 -5.0(4)
C7 C8 C12 C1 -1.9(5)
C9 C8 C12 C1 177.9(3)
C7 C8 C12 C11 177.2(3)
C9 C8 C12 C11 -3.1(4)
C2 C1 C12 C8 2.5(4)
Ge1 C1 C12 C8 -177.5(2)
Ge1B C1 C12 C8 -174.3(4)
C2 C1 C12 C11 -176.4(3)
Ge1 C1 C12 C11 3.6(4)
Ge1B C1 C12 C11 6.9(7)
C23 C11 C12 C8 122.0(3)
C24 C11 C12 C8 -113.2(3)
C10 C11 C12 C8 4.8(4)
C23 C11 C12 C1 -59.0(5)
C24 C11 C12 C1 65.7(4)
C10 C11 C12 C1 -176.2(3)
C6 C5 C15 C16 -176.9(3)
C4 C5 C15 C16 -65.2(4)
C17 C5 C15 C16 58.6(4)
C6 C5 C17 C18 -67.5(4)
C4 C5 C17 C18 -178.6(3)
C15 C5 C17 C18 56.8(4)
C8 C9 C19 C20 52.2(5)
C21 C9 C19 C20 171.0(4)
C10 C9 C19 C20 -65.3(5)
C8 C9 C19B C20B -70.5(16)
C21 C9 C19B C20B 61.1(18)
C10 C9 C19B C20B -175.3(16)
C8 C9 C21 C22 -178.8(3)
C10 C9 C21 C22 -65.7(5)
C19B C9 C21 C22 50.8(8)
C19 C9 C21 C22 59.9(5)
