#------------------------------------------------------------------------------
#$Date: 2023-07-21 01:53:37 +0300 (Fri, 21 Jul 2023) $
#$Revision: 285301 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/35/7713540.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_7713540
loop_
_publ_author_name
'Roesky, Herbert W.'
'Huo, Shuai-Cong'
'Li, Yao'
'Ji, Peng-Fei'
'Zhang, De-Xiang'
'Yang, Ying'
_publ_section_title
;
 Interaction of Germanium Analogue of Organic Isonitrile with Cu(I) imide
 in Side-on Mode
;
_journal_name_full               'Dalton Transactions'
_journal_paper_doi               10.1039/D3DT02094K
_journal_year                    2023
_chemical_formula_moiety         'C35 H56 Ge N4'
_chemical_formula_sum            'C35 H56 Ge N4'
_chemical_formula_weight         605.42
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_audit_creation_date             2023-07-15
_audit_creation_method
;
Olex2 1.5
(compiled 2023.03.06 svn.rbb2c1857 for OlexSys, GUI svn.r6748)
;
_audit_update_record
;
2023-07-15 deposited with the CCDC.	2023-07-20 downloaded from the CCDC.
;
_cell_angle_alpha                108.667(13)
_cell_angle_beta                 90.773(13)
_cell_angle_gamma                115.078(13)
_cell_formula_units_Z            2
_cell_length_a                   11.128(3)
_cell_length_b                   11.721(3)
_cell_length_c                   15.731(4)
_cell_measurement_reflns_used    9696
_cell_measurement_temperature    296.15
_cell_measurement_theta_max      27.011
_cell_measurement_theta_min      2.268
_cell_volume                     1733.8(8)
_computing_cell_refinement       'SAINT v8.27A (Bruker, 2012)'
_computing_data_reduction        'SAINT v8.27A (Bruker, 2012)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS  (Sheldrick, 2008)'
_diffrn_ambient_temperature      296.15
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0612
_diffrn_reflns_av_unetI/netI     0.0654
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.979
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            27349
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.979
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.395
_diffrn_reflns_theta_min         2.025
_diffrn_source_current           30.0
_diffrn_source_power             1.5
_diffrn_source_voltage           50.0
_exptl_absorpt_coefficient_mu    0.911
_exptl_absorpt_correction_T_max  0.7455
_exptl_absorpt_correction_T_min  0.4819
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS-2012/1 (Bruker,2012) was used for absorption correction. wR2(int) was 0.1116 before and 0.0840 after correction. The Ratio of minimum to maximum transmission is 0.6464. The λ/2 correction factor is 0.0015.'
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.160
_exptl_crystal_description       block
_exptl_crystal_F_000             652
_exptl_crystal_size_max          0.173
_exptl_crystal_size_mid          0.124
_exptl_crystal_size_min          0.086
_refine_diff_density_max         0.506
_refine_diff_density_min         -0.391
_refine_diff_density_rms         0.060
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     382
_refine_ls_number_reflns         7718
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.002
_refine_ls_R_factor_all          0.0636
_refine_ls_R_factor_gt           0.0416
_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)+(0.0557P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0991
_refine_ls_wR_factor_ref         0.1073
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5950
_reflns_number_total             7718
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3dt02094k2.cif
_cod_data_source_block           ArNHGeNHC
_cod_database_code               7713540
_shelx_shelxl_version_number     2019/2
_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.
;
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C7(H7), C10(H10), C19(H19), C22(H22), C29(H29), C32(H32)
2.b Me refined with riding coordinates:
 C28(H28A,H28B,H28C)
2.c Aromatic/amide H refined with riding coordinates:
 C3(H3), C4(H4), C5(H5), C16(H16), C17(H17), C18(H18)
2.d Idealised Me refined as rotating group:
 C8(H8A,H8B,H8C), C9(H9A,H9B,H9C), C11(H11A,H11B,H11C), C12(H12A,H12B,H12C),
 C20(H20A,H20B,H20C), C21(H21A,H21B,H21C), C23(H23A,H23B,H23C), C24(H24A,H24B,
 H24C), C25(H25A,H25B,H25C), C30(H30A,H30B,H30C), C31(H31A,H31B,H31C), C33(H33A,
 H33B,H33C), C34(H34A,H34B,H34C)
;
_olex2_submission_special_instructions 'No special instructions were received'
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 0.51096(2) 0.79635(2) 0.17767(2) 0.02875(9) Uani 1 1 d . . . . .
N1 N 0.68537(19) 0.9233(2) 0.16344(14) 0.0345(5) Uani 1 1 d . . . . .
N2 N 0.5531(2) 0.8447(2) 0.30892(13) 0.0341(4) Uani 1 1 d . . . . .
N3 N 0.34053(17) 0.89488(18) 0.09716(12) 0.0318(4) Uani 1 1 d . . . . .
N4 N 0.44161(18) 1.05061(18) 0.22747(12) 0.0331(4) Uani 1 1 d . . . . .
C1 C 0.8042(2) 0.9166(2) 0.18516(15) 0.0319(5) Uani 1 1 d . . . . .
C2 C 0.9111(2) 1.0253(2) 0.25321(16) 0.0373(5) Uani 1 1 d . . . . .
C3 C 1.0247(2) 1.0116(3) 0.27406(19) 0.0488(7) Uani 1 1 d . . . . .
H3 H 1.095167 1.083050 0.318991 0.059 Uiso 1 1 calc R U . . .
C4 C 1.0363(3) 0.8958(3) 0.2304(2) 0.0543(7) Uani 1 1 d . . . . .
H4 H 1.112916 0.888492 0.246089 0.065 Uiso 1 1 calc R U . . .
C5 C 0.9342(3) 0.7920(3) 0.16383(19) 0.0495(7) Uani 1 1 d . . . . .
H5 H 0.942285 0.713652 0.134467 0.059 Uiso 1 1 calc R U . . .
C6 C 0.8179(2) 0.7988(2) 0.13803(16) 0.0379(5) Uani 1 1 d . . . . .
C7 C 0.7122(3) 0.6791(3) 0.06128(17) 0.0462(6) Uani 1 1 d . . . . .
H7 H 0.641192 0.702960 0.048807 0.055 Uiso 1 1 calc R U . . .
C8 C 0.7692(3) 0.6465(3) -0.0267(2) 0.0704(9) Uani 1 1 d . . . . .
H8A H 0.807534 0.724925 -0.043444 0.106 Uiso 1 1 calc R U . . .
H8B H 0.698170 0.573873 -0.074677 0.106 Uiso 1 1 calc R U . . .
H8C H 0.837676 0.620363 -0.017043 0.106 Uiso 1 1 calc R U . . .
C9 C 0.6477(3) 0.5549(3) 0.0875(2) 0.0642(8) Uani 1 1 d . . . . .
H9A H 0.716080 0.533063 0.104663 0.096 Uiso 1 1 calc R U . . .
H9B H 0.583810 0.480269 0.036580 0.096 Uiso 1 1 calc R U . . .
H9C H 0.602363 0.573003 0.137932 0.096 Uiso 1 1 calc R U . . .
C10 C 0.9062(3) 1.1581(2) 0.30132(18) 0.0468(6) Uani 1 1 d . . . . .
H10 H 0.812134 1.136318 0.307035 0.056 Uiso 1 1 calc R U . . .
C11 C 0.9893(3) 1.2383(3) 0.3968(2) 0.0725(9) Uani 1 1 d . . . . .
H11A H 0.961015 1.183353 0.433658 0.109 Uiso 1 1 calc R U . . .
H11B H 0.976404 1.317368 0.423406 0.109 Uiso 1 1 calc R U . . .
H11C H 1.082903 1.264619 0.393554 0.109 Uiso 1 1 calc R U . . .
C12 C 0.9476(3) 1.2454(3) 0.2432(2) 0.0710(9) Uani 1 1 d . . . . .
H12A H 0.935374 1.324598 0.271174 0.107 Uiso 1 1 calc R U . . .
H12B H 0.892862 1.195161 0.183666 0.107 Uiso 1 1 calc R U . . .
H12C H 1.040565 1.271457 0.237941 0.107 Uiso 1 1 calc R U . . .
C13 C 0.5827(2) 0.6847(2) 0.36804(15) 0.0342(5) Uani 1 1 d . . . . .
C14 C 0.5006(2) 0.7363(2) 0.34158(14) 0.0316(5) Uani 1 1 d . . . . .
C15 C 0.3632(2) 0.6776(2) 0.34650(16) 0.0363(5) Uani 1 1 d . . . . .
C16 C 0.3098(3) 0.5701(3) 0.37815(17) 0.0444(6) Uani 1 1 d . . . . .
H16 H 0.218089 0.529964 0.379907 0.053 Uiso 1 1 calc R U . . .
C17 C 0.3916(3) 0.5232(3) 0.40677(17) 0.0466(6) Uani 1 1 d . . . . .
H17 H 0.356058 0.453829 0.429580 0.056 Uiso 1 1 calc R U . . .
C18 C 0.5246(3) 0.5796(3) 0.40123(16) 0.0431(6) Uani 1 1 d . . . . .
H18 H 0.578983 0.546989 0.420210 0.052 Uiso 1 1 calc R U . . .
C19 C 0.7307(2) 0.7437(3) 0.36262(18) 0.0441(6) Uani 1 1 d . . . . .
H19 H 0.740467 0.770862 0.309299 0.053 Uiso 1 1 calc R U . . .
C20 C 0.8118(3) 0.8710(3) 0.4454(2) 0.0697(9) Uani 1 1 d . . . . .
H20A H 0.776363 0.934404 0.450971 0.105 Uiso 1 1 calc R U . . .
H20B H 0.904357 0.910521 0.438082 0.105 Uiso 1 1 calc R U . . .
H20C H 0.805708 0.848487 0.499203 0.105 Uiso 1 1 calc R U . . .
C21 C 0.7902(3) 0.6439(4) 0.3487(2) 0.0741(10) Uani 1 1 d . . . . .
H21A H 0.792083 0.622864 0.402735 0.111 Uiso 1 1 calc R U . . .
H21B H 0.880152 0.683720 0.336699 0.111 Uiso 1 1 calc R U . . .
H21C H 0.735516 0.562763 0.298058 0.111 Uiso 1 1 calc R U . . .
C22 C 0.2700(2) 0.7296(3) 0.32085(18) 0.0433(6) Uani 1 1 d . . . . .
H22 H 0.324140 0.807737 0.304208 0.052 Uiso 1 1 calc R U . . .
C23 C 0.1619(3) 0.6239(3) 0.2388(2) 0.0699(9) Uani 1 1 d . . . . .
H23A H 0.203782 0.595766 0.188737 0.105 Uiso 1 1 calc R U . . .
H23B H 0.108287 0.661938 0.221897 0.105 Uiso 1 1 calc R U . . .
H23C H 0.105310 0.547456 0.254148 0.105 Uiso 1 1 calc R U . . .
C24 C 0.2061(3) 0.7766(4) 0.4013(2) 0.0745(10) Uani 1 1 d . . . . .
H24A H 0.149371 0.700897 0.417322 0.112 Uiso 1 1 calc R U . . .
H24B H 0.153026 0.815422 0.384853 0.112 Uiso 1 1 calc R U . . .
H24C H 0.275508 0.842990 0.452353 0.112 Uiso 1 1 calc R U . . .
C25 C 0.3566(3) 1.2235(3) 0.2283(2) 0.0646(8) Uani 1 1 d . . . . .
H25A H 0.439941 1.296391 0.227911 0.097 Uiso 1 1 calc R U . . .
H25B H 0.341475 1.236687 0.289919 0.097 Uiso 1 1 calc R U . . .
H25C H 0.283953 1.221327 0.193203 0.097 Uiso 1 1 calc R U . . .
C26 C 0.3637(2) 1.0922(2) 0.18759(17) 0.0386(6) Uani 1 1 d . . . . .
C27 C 0.3000(2) 0.9950(3) 0.10621(17) 0.0387(6) Uani 1 1 d . . . . .
C28 C 0.2025(3) 0.9918(3) 0.0380(2) 0.0615(8) Uani 1 1 d . . . . .
H28A H 0.172490 0.910057 -0.014241 0.092 Uiso 1 1 calc R U . . .
H28B H 0.126573 0.995104 0.064845 0.092 Uiso 1 1 calc R U . . .
H28C H 0.245988 1.068134 0.019562 0.092 Uiso 1 1 calc R U . . .
C29 C 0.3028(2) 0.7698(2) 0.01620(15) 0.0377(5) Uani 1 1 d . . . . .
H29 H 0.342378 0.718613 0.033957 0.045 Uiso 1 1 calc R U . . .
C30 C 0.3676(3) 0.8022(3) -0.06172(19) 0.0678(9) Uani 1 1 d . . . . .
H30A H 0.336835 0.857945 -0.079217 0.102 Uiso 1 1 calc R U . . .
H30B H 0.343687 0.720007 -0.112487 0.102 Uiso 1 1 calc R U . . .
H30C H 0.463727 0.849455 -0.043245 0.102 Uiso 1 1 calc R U . . .
C31 C 0.1531(3) 0.6799(3) -0.0082(2) 0.0633(8) Uani 1 1 d . . . . .
H31A H 0.118722 0.665853 0.045189 0.095 Uiso 1 1 calc R U . . .
H31B H 0.135305 0.594660 -0.053699 0.095 Uiso 1 1 calc R U . . .
H31C H 0.109858 0.722016 -0.031477 0.095 Uiso 1 1 calc R U . . .
C32 C 0.5243(3) 1.1207(2) 0.31956(16) 0.0414(6) Uani 1 1 d . . . . .
H32 H 0.568431 1.066687 0.326626 0.050 Uiso 1 1 calc R U . . .
C33 C 0.6354(3) 1.2595(3) 0.3309(2) 0.0598(8) Uani 1 1 d . . . . .
H33A H 0.682929 1.252468 0.280501 0.090 Uiso 1 1 calc R U . . .
H33B H 0.696840 1.294535 0.386669 0.090 Uiso 1 1 calc R U . . .
H33C H 0.596471 1.319150 0.332641 0.090 Uiso 1 1 calc R U . . .
C34 C 0.4383(3) 1.1269(3) 0.39316(19) 0.0680(9) Uani 1 1 d . . . . .
H34A H 0.408536 1.193880 0.396888 0.102 Uiso 1 1 calc R U . . .
H34B H 0.490491 1.150324 0.450641 0.102 Uiso 1 1 calc R U . . .
H34C H 0.361537 1.040453 0.378586 0.102 Uiso 1 1 calc R U . . .
C35 C 0.4286(2) 0.9295(2) 0.17142(14) 0.0288(5) Uani 1 1 d . . . . .
H1 H 0.688(2) 0.991(2) 0.1846(15) 0.025(7) Uiso 1 1 d . . . . .
H2 H 0.634(3) 0.886(3) 0.3251(18) 0.049(8) 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'
Ge Ge 0.1547 1.8001 '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'
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
N1 Ge1 C35 89.75(8) . . ?
N2 Ge1 N1 97.04(9) . . ?
N2 Ge1 C35 101.40(8) . . ?
Ge1 N1 H1 105.5(18) . . ?
C1 N1 Ge1 121.56(15) . . ?
C1 N1 H1 114.5(18) . . ?
Ge1 N2 H2 109.1(19) . . ?
C14 N2 Ge1 116.13(15) . . ?
C14 N2 H2 109.7(19) . . ?
C27 N3 C29 126.87(18) . . ?
C35 N3 C27 110.58(18) . . ?
C35 N3 C29 122.43(18) . . ?
C26 N4 C32 126.95(19) . . ?
C35 N4 C26 110.71(19) . . ?
C35 N4 C32 122.28(17) . . ?
N1 C1 C2 121.3(2) . . ?
N1 C1 C6 119.6(2) . . ?
C2 C1 C6 119.06(19) . . ?
C1 C2 C10 121.4(2) . . ?
C3 C2 C1 118.9(2) . . ?
C3 C2 C10 119.7(2) . . ?
C2 C3 H3 119.0 . . ?
C4 C3 C2 122.0(2) . . ?
C4 C3 H3 119.0 . . ?
C3 C4 H4 120.5 . . ?
C5 C4 C3 119.0(2) . . ?
C5 C4 H4 120.5 . . ?
C4 C5 H5 118.8 . . ?
C4 C5 C6 122.4(2) . . ?
C6 C5 H5 118.8 . . ?
C1 C6 C7 123.44(19) . . ?
C5 C6 C1 118.5(2) . . ?
C5 C6 C7 118.1(2) . . ?
C6 C7 H7 107.5 . . ?
C6 C7 C8 112.0(2) . . ?
C6 C7 C9 111.8(2) . . ?
C8 C7 H7 107.5 . . ?
C9 C7 H7 107.5 . . ?
C9 C7 C8 110.3(2) . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C2 C10 H10 107.2 . . ?
C11 C10 C2 114.9(2) . . ?
C11 C10 H10 107.2 . . ?
C12 C10 C2 110.2(2) . . ?
C12 C10 H10 107.2 . . ?
C12 C10 C11 109.9(2) . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C13 C19 120.7(2) . . ?
C18 C13 C14 118.6(2) . . ?
C18 C13 C19 120.6(2) . . ?
C13 C14 N2 121.8(2) . . ?
C15 C14 N2 119.17(19) . . ?
C15 C14 C13 119.0(2) . . ?
C14 C15 C22 121.8(2) . . ?
C16 C15 C14 119.9(2) . . ?
C16 C15 C22 118.3(2) . . ?
C15 C16 H16 119.6 . . ?
C17 C16 C15 120.7(2) . . ?
C17 C16 H16 119.6 . . ?
C16 C17 H17 120.4 . . ?
C18 C17 C16 119.3(2) . . ?
C18 C17 H17 120.4 . . ?
C13 C18 H18 118.8 . . ?
C17 C18 C13 122.4(2) . . ?
C17 C18 H18 118.8 . . ?
C13 C19 H19 106.9 . . ?
C13 C19 C20 111.1(2) . . ?
C13 C19 C21 114.1(2) . . ?
C20 C19 H19 106.9 . . ?
C20 C19 C21 110.6(2) . . ?
C21 C19 H19 106.9 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C15 C22 H22 107.9 . . ?
C15 C22 C23 111.6(2) . . ?
C15 C22 C24 111.0(2) . . ?
C23 C22 H22 107.9 . . ?
C23 C22 C24 110.5(2) . . ?
C24 C22 H22 107.9 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
H25A C25 H25B 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C26 C25 H25A 109.5 . . ?
C26 C25 H25B 109.5 . . ?
C26 C25 H25C 109.5 . . ?
N4 C26 C25 125.7(2) . . ?
C27 C26 N4 106.9(2) . . ?
C27 C26 C25 127.5(2) . . ?
N3 C27 C28 126.0(2) . . ?
C26 C27 N3 106.76(19) . . ?
C26 C27 C28 127.3(2) . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28B 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
N3 C29 H29 106.0 . . ?
N3 C29 C30 111.0(2) . . ?
N3 C29 C31 112.8(2) . . ?
C30 C29 H29 106.0 . . ?
C30 C29 C31 114.3(2) . . ?
C31 C29 H29 106.0 . . ?
C29 C30 H30A 109.5 . . ?
C29 C30 H30B 109.5 . . ?
C29 C30 H30C 109.5 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C29 C31 H31A 109.5 . . ?
C29 C31 H31B 109.5 . . ?
C29 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
N4 C32 H32 107.0 . . ?
N4 C32 C33 111.9(2) . . ?
N4 C32 C34 111.7(2) . . ?
C33 C32 H32 107.0 . . ?
C34 C32 H32 107.0 . . ?
C34 C32 C33 111.9(2) . . ?
C32 C33 H33A 109.5 . . ?
C32 C33 H33B 109.5 . . ?
C32 C33 H33C 109.5 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C32 C34 H34A 109.5 . . ?
C32 C34 H34B 109.5 . . ?
C32 C34 H34C 109.5 . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
N3 C35 Ge1 119.53(15) . . ?
N3 C35 N4 105.07(17) . . ?
N4 C35 Ge1 135.40(15) . . ?
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
Ge1 N1 1.951(2) . ?
Ge1 N2 1.950(2) . ?
Ge1 C35 2.144(2) . ?
N1 C1 1.401(3) . ?
N1 H1 0.74(2) . ?
N2 C14 1.420(3) . ?
N2 H2 0.81(3) . ?
N3 C27 1.394(3) . ?
N3 C29 1.488(3) . ?
N3 C35 1.348(3) . ?
N4 C26 1.386(3) . ?
N4 C32 1.477(3) . ?
N4 C35 1.354(3) . ?
C1 C2 1.412(3) . ?
C1 C6 1.416(3) . ?
C2 C3 1.388(3) . ?
C2 C10 1.523(3) . ?
C3 H3 0.9300 . ?
C3 C4 1.373(4) . ?
C4 H4 0.9300 . ?
C4 C5 1.360(4) . ?
C5 H5 0.9300 . ?
C5 C6 1.393(3) . ?
C6 C7 1.512(3) . ?
C7 H7 0.9800 . ?
C7 C8 1.534(4) . ?
C7 C9 1.520(4) . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C10 H10 0.9800 . ?
C10 C11 1.522(4) . ?
C10 C12 1.518(4) . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C14 1.412(3) . ?
C13 C18 1.398(3) . ?
C13 C19 1.508(3) . ?
C14 C15 1.401(3) . ?
C15 C16 1.401(3) . ?
C15 C22 1.514(3) . ?
C16 H16 0.9300 . ?
C16 C17 1.381(3) . ?
C17 H17 0.9300 . ?
C17 C18 1.359(3) . ?
C18 H18 0.9300 . ?
C19 H19 0.9800 . ?
C19 C20 1.523(4) . ?
C19 C21 1.533(4) . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 H22 0.9800 . ?
C22 C23 1.523(4) . ?
C22 C24 1.523(4) . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C25 C26 1.503(3) . ?
C26 C27 1.341(3) . ?
C27 C28 1.496(3) . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
C29 H29 0.9800 . ?
C29 C30 1.502(4) . ?
C29 C31 1.506(3) . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
C31 H31A 0.9600 . ?
C31 H31B 0.9600 . ?
C31 H31C 0.9600 . ?
C32 H32 0.9800 . ?
C32 C33 1.520(4) . ?
C32 C34 1.515(4) . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 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
Ge1 N1 C1 C2 -119.1(2) . . . . ?
Ge1 N1 C1 C6 61.0(3) . . . . ?
Ge1 N2 C14 C13 103.9(2) . . . . ?
Ge1 N2 C14 C15 -75.2(2) . . . . ?
N1 C1 C2 C3 177.9(2) . . . . ?
N1 C1 C2 C10 -4.4(3) . . . . ?
N1 C1 C6 C5 -177.0(2) . . . . ?
N1 C1 C6 C7 2.7(3) . . . . ?
N2 C14 C15 C16 179.7(2) . . . . ?
N2 C14 C15 C22 -2.1(3) . . . . ?
N4 C26 C27 N3 -0.3(3) . . . . ?
N4 C26 C27 C28 178.9(2) . . . . ?
C1 C2 C3 C4 0.2(4) . . . . ?
C1 C2 C10 C11 153.5(2) . . . . ?
C1 C2 C10 C12 -81.7(3) . . . . ?
C1 C6 C7 C8 122.5(3) . . . . ?
C1 C6 C7 C9 -113.2(3) . . . . ?
C2 C1 C6 C5 3.1(3) . . . . ?
C2 C1 C6 C7 -177.3(2) . . . . ?
C2 C3 C4 C5 0.9(4) . . . . ?
C3 C2 C10 C11 -28.8(4) . . . . ?
C3 C2 C10 C12 96.0(3) . . . . ?
C3 C4 C5 C6 0.1(4) . . . . ?
C4 C5 C6 C1 -2.1(4) . . . . ?
C4 C5 C6 C7 178.2(3) . . . . ?
C5 C6 C7 C8 -57.8(3) . . . . ?
C5 C6 C7 C9 66.5(3) . . . . ?
C6 C1 C2 C3 -2.2(3) . . . . ?
C6 C1 C2 C10 175.6(2) . . . . ?
C10 C2 C3 C4 -177.6(2) . . . . ?
C13 C14 C15 C16 0.6(3) . . . . ?
C13 C14 C15 C22 178.8(2) . . . . ?
C14 C13 C18 C17 1.7(4) . . . . ?
C14 C13 C19 C20 81.8(3) . . . . ?
C14 C13 C19 C21 -152.4(2) . . . . ?
C14 C15 C16 C17 1.6(4) . . . . ?
C14 C15 C22 C23 116.3(3) . . . . ?
C14 C15 C22 C24 -119.9(3) . . . . ?
C15 C16 C17 C18 -2.1(4) . . . . ?
C16 C15 C22 C23 -65.4(3) . . . . ?
C16 C15 C22 C24 58.4(3) . . . . ?
C16 C17 C18 C13 0.5(4) . . . . ?
C18 C13 C14 N2 178.8(2) . . . . ?
C18 C13 C14 C15 -2.2(3) . . . . ?
C18 C13 C19 C20 -96.8(3) . . . . ?
C18 C13 C19 C21 29.0(3) . . . . ?
C19 C13 C14 N2 0.1(3) . . . . ?
C19 C13 C14 C15 179.2(2) . . . . ?
C19 C13 C18 C17 -179.7(2) . . . . ?
C22 C15 C16 C17 -176.7(2) . . . . ?
C25 C26 C27 N3 178.3(2) . . . . ?
C25 C26 C27 C28 -2.5(5) . . . . ?
C26 N4 C32 C33 -61.8(3) . . . . ?
C26 N4 C32 C34 64.6(3) . . . . ?
C26 N4 C35 Ge1 179.44(17) . . . . ?
C26 N4 C35 N3 -1.0(2) . . . . ?
C27 N3 C29 C30 69.6(3) . . . . ?
C27 N3 C29 C31 -60.2(3) . . . . ?
C27 N3 C35 Ge1 -179.54(14) . . . . ?
C27 N3 C35 N4 0.9(2) . . . . ?
C29 N3 C27 C26 -176.4(2) . . . . ?
C29 N3 C27 C28 4.3(4) . . . . ?
C29 N3 C35 Ge1 -3.3(3) . . . . ?
C29 N3 C35 N4 177.12(19) . . . . ?
C32 N4 C26 C25 4.9(4) . . . . ?
C32 N4 C26 C27 -176.4(2) . . . . ?
C32 N4 C35 Ge1 -3.1(3) . . . . ?
C32 N4 C35 N3 176.40(19) . . . . ?
C35 N3 C27 C26 -0.4(3) . . . . ?
C35 N3 C27 C28 -179.6(2) . . . . ?
C35 N3 C29 C30 -106.0(3) . . . . ?
C35 N3 C29 C31 124.1(2) . . . . ?
C35 N4 C26 C25 -177.8(2) . . . . ?
C35 N4 C26 C27 0.9(3) . . . . ?
C35 N4 C32 C33 121.2(2) . . . . ?
C35 N4 C32 C34 -112.4(2) . . . . ?
