#------------------------------------------------------------------------------
#$Date: 2018-09-12 14:55:14 +0300 (Wed, 12 Sep 2018) $
#$Revision: 210888 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/10/59/7105924.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_7105924
loop_
_publ_author_name
'Heimann, Samuel'
'Holynska, Malgorzata'
'Dehnen, Stefanie'
_publ_section_title
;
 In situ Ge--Ge bond formation under ambient conditions:
 synthesis, characterization and reactivity of organo-functionalized
 telluridogermanate complexes
;
_journal_coden_ASTM              CHCOFS
_journal_issue                   6
_journal_name_full
;
 Chemical Communications (Cambridge, United Kingdom)
;
_journal_page_first              1881
_journal_page_last               1883
_journal_paper_doi               10.1039/c0cc03727c
_journal_volume                  47
_journal_year                    2011
_chemical_formula_moiety         '(C6 H13 Ge N2 Te2), (N2H5), 0.5(N2H4)'
_chemical_formula_sum            'C6 H20 Ge N5 Te2'
_chemical_formula_weight         490.06
_space_group_IT_number           9
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 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                 105.94(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            16
_cell_length_a                   31.866(7)
_cell_length_b                   15.441(4)
_cell_length_c                   12.271(4)
_cell_measurement_reflns_used    21909
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.73
_cell_measurement_theta_min      2.83
_cell_volume                     5806(3)
_computing_cell_refinement       'Stoe, X-Area ver. 1.54'
_computing_data_collection       'Stoe, X-Area ver. 1.54'
_computing_data_reduction        'Stoe, X-Area ver. 1.54'
_computing_molecular_graphics    'DIAMOND 3.1'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  IPDS2
_diffrn_measurement_method       /w
_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  0.0767
_diffrn_reflns_av_sigmaI/netI    0.0538
_diffrn_reflns_limit_h_max       39
_diffrn_reflns_limit_h_min       -40
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            21516
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         26.73
_diffrn_reflns_theta_min         4.63
_exptl_absorpt_coefficient_mu    6.030
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    2.243
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'cut needle'
_exptl_crystal_F_000             3632
_exptl_crystal_size_max          0.05
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.78
_refine_diff_density_min         -2.08
_refine_diff_density_rms         0.19
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.46(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     500
_refine_ls_number_reflns         11569
_refine_ls_number_restraints     167
_refine_ls_restrained_S_all      1.770
_refine_ls_R_factor_all          0.0376
_refine_ls_R_factor_gt           0.0329
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0487P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0857
_refine_ls_wR_factor_ref         0.0911
_reflns_number_gt                10471
_reflns_number_total             11569
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0CC03727C.TXT
_cod_data_source_block           compound4
_cod_original_sg_symbol_H-M      'C c'
_cod_database_code               7105924
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'x, -y, z+1/2'
'x+1/2, y+1/2, 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
_atom_site_disorder_assembly
_atom_site_disorder_group
C11 C 0.6435(4) 0.0579(9) 0.4781(12) 0.016(2) Uani 1 1 d U . .
C63 C 0.7843(5) 0.5488(11) 0.7747(13) 0.023(3) Uani 1 1 d U . .
H63A H 0.7749 0.5823 0.7044 0.035 Uiso 1 1 calc R . .
H63B H 0.7616 0.5069 0.7780 0.035 Uiso 1 1 calc R . .
H63C H 0.8114 0.5179 0.7767 0.035 Uiso 1 1 calc R . .
C64 C 0.7855(5) 0.9568(11) 0.2849(12) 0.022(3) Uani 1 1 d U . .
H64A H 0.8122 0.9878 0.2839 0.032 Uiso 1 1 calc R . .
H64B H 0.7631 0.9987 0.2911 0.032 Uiso 1 1 calc R . .
H64C H 0.7750 0.9235 0.2147 0.032 Uiso 1 1 calc R . .
C22 C 0.6736(5) 0.4980(11) 0.5392(12) 0.021(3) Uani 1 1 d U . .
H22C H 0.6697 0.4418 0.5008 0.032 Uiso 1 1 calc R . .
H22D H 0.6689 0.4918 0.6145 0.032 Uiso 1 1 calc R . .
H22E H 0.7033 0.5190 0.5472 0.032 Uiso 1 1 calc R . .
C31 C 0.6746(5) -0.0080(11) 0.5500(13) 0.023(3) Uani 1 1 d U . .
H31A H 0.7048 0.0094 0.5567 0.034 Uiso 1 1 calc R . .
H31B H 0.6692 -0.0651 0.5140 0.034 Uiso 1 1 calc R . .
H31C H 0.6699 -0.0108 0.6256 0.034 Uiso 1 1 calc R . .
C53 C 0.7918(5) 0.6068(10) 0.8708(13) 0.017(3) Uani 1 1 d U . .
C34 C 0.7668(5) 0.8237(11) 0.6521(13) 0.023(3) Uani 1 1 d U . .
H34A H 0.7378 0.8483 0.6443 0.034 Uiso 1 1 calc R . .
H34B H 0.7890 0.8621 0.6987 0.034 Uiso 1 1 calc R . .
H34C H 0.7687 0.7667 0.6883 0.034 Uiso 1 1 calc R . .
C23 C 0.7585(5) 0.6756(11) 1.1362(13) 0.026(3) Uani 1 1 d U . .
H23C H 0.7610 0.7311 1.1761 0.038 Uiso 1 1 calc R . .
H23D H 0.7789 0.6338 1.1829 0.038 Uiso 1 1 calc R . .
H23E H 0.7286 0.6537 1.1218 0.038 Uiso 1 1 calc R . .
C42 C 0.6424(5) 0.6496(10) 0.5356(13) 0.020(3) Uani 1 1 d U . .
H42A H 0.6731 0.6655 0.5727 0.024 Uiso 1 1 calc R . .
H42B H 0.6292 0.6963 0.4818 0.024 Uiso 1 1 calc R . .
C52 C 0.6181(4) 0.6412(10) 0.6230(11) 0.014(2) Uani 1 1 d U . .
C51 C 0.6190(4) 0.1412(10) 0.6256(11) 0.013(2) Uani 1 1 d U . .
C41 C 0.6456(5) 0.1453(10) 0.5417(12) 0.020(2) Uani 1 1 d U . .
H41A H 0.6764 0.1587 0.5819 0.024 Uiso 1 1 calc R . .
H41B H 0.6344 0.1922 0.4864 0.024 Uiso 1 1 calc R . .
C54 C 0.7947(5) 0.8976(11) 0.3827(14) 0.020(3) Uani 1 1 d U . .
C21 C 0.6529(5) 0.0686(11) 0.3612(13) 0.021(3) Uani 1 1 d U . .
H21C H 0.6814 0.0964 0.3716 0.031 Uiso 1 1 calc R . .
H21D H 0.6301 0.1045 0.3118 0.031 Uiso 1 1 calc R . .
H21E H 0.6532 0.0115 0.3265 0.031 Uiso 1 1 calc R . .
C32 C 0.6492(5) 0.5754(10) 0.3516(12) 0.020(3) Uani 1 1 d U . .
H32A H 0.6766 0.6069 0.3606 0.030 Uiso 1 1 calc R . .
H32B H 0.6251 0.6086 0.3027 0.030 Uiso 1 1 calc R . .
H32C H 0.6510 0.5187 0.3172 0.030 Uiso 1 1 calc R . .
C12 C 0.6409(4) 0.5625(9) 0.4699(12) 0.014(2) Uani 1 1 d U . .
C13 C 0.7693(5) 0.6880(10) 1.0252(13) 0.0205(17) Uani 1 1 d U . .
C43 C 0.7669(5) 0.6035(11) 0.9590(14) 0.0205(17) Uani 1 1 d U . .
H43A H 0.7787 0.5560 1.0128 0.025 Uiso 1 1 calc R . .
H43B H 0.7360 0.5902 0.9213 0.025 Uiso 1 1 calc R . .
C33 C 0.7398(5) 0.7547(10) 0.9526(13) 0.0205(17) Uani 1 1 d U . .
H33A H 0.7093 0.7388 0.9437 0.031 Uiso 1 1 calc R . .
H33B H 0.7453 0.7570 0.8779 0.031 Uiso 1 1 calc R . .
H33C H 0.7456 0.8116 0.9889 0.031 Uiso 1 1 calc R . .
C14 C 0.7741(4) 0.8143(9) 0.5376(11) 0.013(2) Uani 1 1 d U . .
C44 C 0.7718(5) 0.8991(10) 0.4738(13) 0.019(3) Uani 1 1 d U . .
H44A H 0.7407 0.9140 0.4394 0.023 Uiso 1 1 calc R . .
H44B H 0.7847 0.9454 0.5285 0.023 Uiso 1 1 calc R . .
C24 C 0.7424(5) 0.7495(11) 0.4646(12) 0.020(3) Uani 1 1 d U . .
H24C H 0.7454 0.6935 0.5036 0.030 Uiso 1 1 calc R . .
H24D H 0.7492 0.7425 0.3918 0.030 Uiso 1 1 calc R . .
H24E H 0.7125 0.7707 0.4515 0.030 Uiso 1 1 calc R . .
C62 C 0.6269(5) 0.7040(10) 0.7222(13) 0.022(3) Uani 1 1 d U . .
H62A H 0.6028 0.7454 0.7106 0.033 Uiso 1 1 calc R . .
H62B H 0.6542 0.7353 0.7275 0.033 Uiso 1 1 calc R . .
H62C H 0.6296 0.6717 0.7926 0.033 Uiso 1 1 calc R . .
C61 C 0.6271(5) 0.2048(10) 0.7220(14) 0.023(3) Uani 1 1 d U . .
H61A H 0.6046 0.2501 0.7042 0.035 Uiso 1 1 calc R . .
H61B H 0.6559 0.2312 0.7335 0.035 Uiso 1 1 calc R . .
H61C H 0.6258 0.1746 0.7913 0.035 Uiso 1 1 calc R . .
N21 N 0.5586(4) 0.0789(8) 0.6686(10) 0.0147(16) Uani 1 1 d DU . .
H1 H 0.559(5) 0.0234(11) 0.674(13) 0.022 Uiso 1 1 d D . .
H2 H 0.572(5) 0.096(9) 0.736(5) 0.022 Uiso 1 1 d D . .
N22 N 0.5602(4) 0.5735(8) 0.6720(10) 0.0141(15) Uani 1 1 d DU . .
H3 H 0.866(3) 0.721(2) 0.821(8) 0.021 Uiso 1 1 d D . .
H4 H 0.845(5) 0.637(7) 0.779(8) 0.021 Uiso 1 1 d D . .
N23 N 0.8539(4) 0.6738(9) 0.8327(10) 0.020(2) Uani 1 1 d DU . .
H5 H 0.571(5) 0.586(10) 0.742(4) 0.030 Uiso 1 1 d D . .
H6 H 0.557(5) 0.5182(15) 0.673(15) 0.030 Uiso 1 1 d D . .
N24 N 0.8549(4) 0.8303(9) 0.3339(11) 0.022(2) Uani 1 1 d DU . .
H7 H 0.861(6) 0.776(3) 0.332(16) 0.033 Uiso 1 1 d D . .
H8 H 0.844(6) 0.862(9) 0.276(9) 0.033 Uiso 1 1 d D . .
N13 N 0.8230(4) 0.6638(8) 0.8945(9) 0.0127(19) Uani 1 1 d DU . .
N14 N 0.8256(4) 0.8388(7) 0.3989(9) 0.0126(19) Uani 1 1 d U . .
N11 N 0.5892(4) 0.0837(8) 0.6087(10) 0.0147(16) Uani 1 1 d U . .
N12 N 0.5891(4) 0.5829(8) 0.6068(9) 0.0141(15) Uani 1 1 d U . .
N100 N 0.4620(4) 0.2534(5) 0.4889(9) 0.0251(16) Uani 1 1 d DU . .
H101 H 0.4401 0.2812 0.5095 0.038 Uiso 1 1 calc RD . .
H102 H 0.4592 0.2629 0.4140 0.038 Uiso 1 1 calc RD . .
H103 H 0.4882 0.2740 0.5307 0.038 Uiso 1 1 calc RD . .
N101 N 0.4595(4) 0.1619(5) 0.5087(9) 0.0251(16) Uani 1 1 d DU . .
H104 H 0.463(5) 0.1219(11) 0.463(7) 0.038 Uiso 1 1 d D . .
N102 N 0.4325(3) 0.0842(7) 0.9648(8) 0.0262(13) Uani 1 1 d DU . .
H121 H 0.409(3) 0.078(11) 0.985(13) 0.039 Uiso 1 1 d D . .
H122 H 0.426(5) 0.037(6) 0.927(12) 0.039 Uiso 1 1 d D . .
N103 N 0.4667(3) 0.0307(7) 1.0336(9) 0.0262(13) Uani 1 1 d DU . .
N104 N 0.4229(3) 0.5201(7) 0.9511(8) 0.0262(13) Uani 1 1 d DU . .
H141 H 0.4030 0.4767 0.9301 0.039 Uiso 1 1 calc RD . .
H142 H 0.4298 0.5410 0.8889 0.039 Uiso 1 1 calc RD . .
H143 H 0.4114 0.5634 0.9842 0.039 Uiso 1 1 calc RD . .
N105 N 0.4617(3) 0.4872(7) 1.0305(8) 0.0262(4) Uani 1 1 d DU . .
H151 H 0.4799 0.5162(13) 1.0822 0.039 Uiso 1 1 d D . .
N106 N 0.4492(4) 0.3185(6) 1.2537(9) 0.0291(18) Uani 1 1 d DU . .
H161 H 0.428(3) 0.335(11) 1.197(9) 0.044 Uiso 1 1 d D . .
N107 N 0.4556(5) 0.4091(6) 1.2810(11) 0.0291(18) Uani 1 1 d DU . .
H171 H 0.444(5) 0.4502(14) 1.231(5) 0.044 Uiso 1 1 d D . .
N108 N 0.4911(3) 0.2779(8) 1.0925(7) 0.0267(17) Uani 1 1 d DU . .
H181 H 0.513(3) 0.311(8) 1.097(4) 0.040 Uiso 1 1 d D . .
N109 N 0.4567(3) 0.2642(7) 0.9898(8) 0.0267(17) Uani 1 1 d DU . .
H191 H 0.4304 0.2685 1.0050 0.040 Uiso 1 1 calc RD . .
H192 H 0.4594 0.2105 0.9620 0.040 Uiso 1 1 calc RD . .
H193 H 0.4585 0.3048 0.9377 0.040 Uiso 1 1 calc RD . .
N110 N 0.4447(4) 0.0695(6) 0.7581(10) 0.027(2) Uani 1 1 d DU . .
N111 N 0.4641(4) 0.1489(6) 0.7339(10) 0.027(3) Uani 1 1 d DU . .
H111 H 0.4468 0.1944 0.7402 0.040 Uiso 1 1 calc RD . .
H112 H 0.4670 0.1469 0.6622 0.040 Uiso 1 1 calc RD . .
H113 H 0.4909 0.1556 0.7840 0.040 Uiso 1 1 calc RD . .
Ge4 Ge 0.83520(5) 0.77324(9) 0.54739(12) 0.0126(3) Uani 1 1 d U . .
Ge3 Ge 0.83153(5) 0.72308(9) 1.04742(12) 0.0128(3) Uani 1 1 d U . .
Ge1 Ge 0.58153(5) 0.02253(9) 0.45821(12) 0.0121(3) Uani 1 1 d U . .
Ge2 Ge 0.57968(5) 0.52349(9) 0.45472(12) 0.0124(3) Uani 1 1 d U . .
Te6 Te 0.84662(3) 0.87921(6) 1.02955(7) 0.0168(2) Uani 1 1 d U . .
Te8 Te 0.89524(4) 0.85961(7) 0.67768(7) 0.0186(2) Uani 1 1 d U . .
Te4 Te 0.52084(3) 0.61114(6) 0.32405(6) 0.0163(2) Uani 1 1 d U . .
Te7 Te 0.84522(3) 0.61729(6) 0.51807(7) 0.0170(2) Uani 1 1 d U . .
Te1 Te 0.56751(3) -0.13411(6) 0.47656(7) 0.0162(2) Uani 1 1 d U . .
Te3 Te 0.56829(3) 0.36603(6) 0.47609(7) 0.0177(2) Uani 1 1 d U . .
Te5 Te 0.88390(4) 0.63138(6) 1.18766(7) 0.0203(2) Uani 1 1 d U . .
Te2 Te 0.52725(3) 0.11622(6) 0.32444(6) 0.0173(2) Uani 1 1 d 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'
N N 0.0061 0.0033 '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'
Te Te -0.5308 1.6751 '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
C31 C11 C41 111.0(12) . . ?
C31 C11 C21 110.2(11) . . ?
C41 C11 C21 112.3(11) . . ?
C31 C11 Ge1 110.6(9) . . ?
C41 C11 Ge1 101.8(8) . . ?
C21 C11 Ge1 110.6(10) . . ?
C53 C63 H63A 109.5 . . ?
C53 C63 H63B 109.5 . . ?
H63A C63 H63B 109.5 . . ?
C53 C63 H63C 109.5 . . ?
H63A C63 H63C 109.5 . . ?
H63B C63 H63C 109.5 . . ?
C54 C64 H64A 109.5 . . ?
C54 C64 H64B 109.5 . . ?
H64A C64 H64B 109.5 . . ?
C54 C64 H64C 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
C12 C22 H22C 109.5 . . ?
C12 C22 H22D 109.5 . . ?
H22C C22 H22D 109.5 . . ?
C12 C22 H22E 109.5 . . ?
H22C C22 H22E 109.5 . . ?
H22D C22 H22E 109.5 . . ?
C11 C31 H31A 109.5 . . ?
C11 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C11 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
N13 C53 C63 123.1(13) . . ?
N13 C53 C43 112.5(13) . . ?
C63 C53 C43 124.2(14) . . ?
C14 C34 H34A 109.5 . . ?
C14 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
C14 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C13 C23 H23C 109.5 . . ?
C13 C23 H23D 109.5 . . ?
H23C C23 H23D 109.5 . . ?
C13 C23 H23E 109.5 . . ?
H23C C23 H23E 109.5 . . ?
H23D C23 H23E 109.5 . . ?
C52 C42 C12 110.4(11) . . ?
C52 C42 H42A 109.6 . . ?
C12 C42 H42A 109.6 . . ?
C52 C42 H42B 109.6 . . ?
C12 C42 H42B 109.6 . . ?
H42A C42 H42B 108.1 . . ?
N12 C52 C42 116.8(13) . . ?
N12 C52 C62 123.1(12) . . ?
C42 C52 C62 120.0(13) . . ?
N11 C51 C41 116.9(13) . . ?
N11 C51 C61 122.7(12) . . ?
C41 C51 C61 120.4(13) . . ?
C51 C41 C11 110.7(12) . . ?
C51 C41 H41A 109.5 . . ?
C11 C41 H41A 109.5 . . ?
C51 C41 H41B 109.5 . . ?
C11 C41 H41B 109.5 . . ?
H41A C41 H41B 108.1 . . ?
N14 C54 C64 121.7(13) . . ?
N14 C54 C44 113.5(13) . . ?
C64 C54 C44 124.8(13) . . ?
C11 C21 H21C 109.5 . . ?
C11 C21 H21D 109.5 . . ?
H21C C21 H21D 109.5 . . ?
C11 C21 H21E 109.5 . . ?
H21C C21 H21E 109.5 . . ?
H21D C21 H21E 109.5 . . ?
C12 C32 H32A 109.5 . . ?
C12 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C12 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C22 C12 C32 109.9(11) . . ?
C22 C12 C42 110.8(11) . . ?
C32 C12 C42 112.5(11) . . ?
C22 C12 Ge2 110.8(9) . . ?
C32 C12 Ge2 111.2(9) . . ?
C42 C12 Ge2 101.4(8) . . ?
C23 C13 C33 111.1(12) . . ?
C23 C13 C43 112.4(13) . . ?
C33 C13 C43 109.7(13) . . ?
C23 C13 Ge3 112.1(11) . . ?
C33 C13 Ge3 109.3(10) . . ?
C43 C13 Ge3 102.0(9) . . ?
C53 C43 C13 113.2(13) . . ?
C53 C43 H43A 108.9 . . ?
C13 C43 H43A 108.9 . . ?
C53 C43 H43B 108.9 . . ?
C13 C43 H43B 108.9 . . ?
H43A C43 H43B 107.8 . . ?
C13 C33 H33A 109.5 . . ?
C13 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C13 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C34 C14 C44 113.8(12) . . ?
C34 C14 C24 111.6(11) . . ?
C44 C14 C24 109.5(11) . . ?
C34 C14 Ge4 111.8(10) . . ?
C44 C14 Ge4 102.1(8) . . ?
C24 C14 Ge4 107.4(9) . . ?
C54 C44 C14 114.1(13) . . ?
C54 C44 H44A 108.7 . . ?
C14 C44 H44A 108.7 . . ?
C54 C44 H44B 108.7 . . ?
C14 C44 H44B 108.7 . . ?
H44A C44 H44B 107.6 . . ?
C14 C24 H24C 109.5 . . ?
C14 C24 H24D 109.5 . . ?
H24C C24 H24D 109.5 . . ?
C14 C24 H24E 109.5 . . ?
H24C C24 H24E 109.5 . . ?
H24D C24 H24E 109.5 . . ?
C52 C62 H62A 109.5 . . ?
C52 C62 H62B 109.5 . . ?
H62A C62 H62B 109.5 . . ?
C52 C62 H62C 109.5 . . ?
H62A C62 H62C 109.5 . . ?
H62B C62 H62C 109.5 . . ?
C51 C61 H61A 109.5 . . ?
C51 C61 H61B 109.5 . . ?
H61A C61 H61B 109.5 . . ?
C51 C61 H61C 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?
N11 N21 H1 95(10) . . ?
N11 N21 H2 105(10) . . ?
H1 N21 H2 104(10) . . ?
N12 N22 H5 113(10) . . ?
N12 N22 H6 102(10) . . ?
H5 N22 H6 103(10) . . ?
N13 N23 H3 128(3) . . ?
N13 N23 H4 102(10) . . ?
H3 N23 H4 120(10) . . ?
N14 N24 H7 107(10) . . ?
N14 N24 H8 105(10) . . ?
H7 N24 H8 125(10) . . ?
C53 N13 N23 124.0(12) . . ?
C53 N13 Ge3 114.2(9) . . ?
N23 N13 Ge3 120.7(9) . . ?
C54 N14 N24 124.9(12) . . ?
C54 N14 Ge4 113.7(9) . . ?
N24 N14 Ge4 120.5(9) . . ?
C51 N11 N21 123.8(12) . . ?
C51 N11 Ge1 111.8(8) . . ?
N21 N11 Ge1 122.4(9) . . ?
C52 N12 N22 123.9(12) . . ?
C52 N12 Ge2 112.6(8) . . ?
N22 N12 Ge2 122.0(9) . . ?
N101 N100 H101 109.5 . . ?
N101 N100 H102 109.5 . . ?
H101 N100 H102 109.5 . . ?
N101 N100 H103 109.5 . . ?
H101 N100 H103 109.5 . . ?
H102 N100 H103 109.5 . . ?
N100 N101 H104 125.0(15) . . ?
N103 N102 H121 111(10) . . ?
N103 N102 H122 82(10) . . ?
H121 N102 H122 88(10) . . ?
N105 N104 H141 109.5 . . ?
N105 N104 H142 109.5 . . ?
H141 N104 H142 109.5 . . ?
N105 N104 H143 109.5 . . ?
H141 N104 H143 109.5 . . ?
H142 N104 H143 109.5 . . ?
N104 N105 H151 126.5(11) . . ?
N107 N106 H161 87(10) . . ?
N106 N107 H171 121.6(19) . . ?
N109 N108 H181 124(2) . . ?
N108 N109 H191 109.5 . . ?
N108 N109 H192 109.5 . . ?
H191 N109 H192 109.5 . . ?
N108 N109 H193 109.5 . . ?
H191 N109 H193 109.5 . . ?
H192 N109 H193 109.5 . . ?
N110 N111 H111 109.5 . . ?
N110 N111 H112 109.5 . . ?
H111 N111 H112 109.5 . . ?
N110 N111 H113 109.5 . . ?
H111 N111 H113 109.5 . . ?
H112 N111 H113 109.5 . . ?
C14 Ge4 N14 83.4(5) . . ?
C14 Ge4 Te7 117.3(4) . . ?
N14 Ge4 Te7 110.4(3) . . ?
C14 Ge4 Te8 115.1(4) . . ?
N14 Ge4 Te8 101.9(3) . . ?
Te7 Ge4 Te8 120.27(7) . . ?
C13 Ge3 N13 82.9(5) . . ?
C13 Ge3 Te6 117.4(4) . . ?
N13 Ge3 Te6 109.6(3) . . ?
C13 Ge3 Te5 113.1(5) . . ?
N13 Ge3 Te5 106.0(3) . . ?
Te6 Ge3 Te5 120.37(8) . . ?
C11 Ge1 N11 83.9(5) . . ?
C11 Ge1 Te1 116.9(4) . . ?
N11 Ge1 Te1 110.6(3) . . ?
C11 Ge1 Te2 113.9(4) . . ?
N11 Ge1 Te2 102.5(4) . . ?
Te1 Ge1 Te2 121.04(7) . . ?
C12 Ge2 N12 83.3(5) . . ?
C12 Ge2 Te3 116.9(4) . . ?
N12 Ge2 Te3 109.6(3) . . ?
C12 Ge2 Te4 115.9(4) . . ?
N12 Ge2 Te4 103.9(3) . . ?
Te3 Ge2 Te4 119.44(7) . . ?
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
C11 C31 1.52(2) . ?
C11 C41 1.55(2) . ?
C11 C21 1.553(18) . ?
C11 Ge1 1.998(13) . ?
C63 C53 1.45(2) . ?
C63 H63A 0.9800 . ?
C63 H63B 0.9800 . ?
C63 H63C 0.9800 . ?
C64 C54 1.47(2) . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C22 C12 1.520(19) . ?
C22 H22C 0.9800 . ?
C22 H22D 0.9800 . ?
C22 H22E 0.9800 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C53 N13 1.299(19) . ?
C53 C43 1.508(19) . ?
C34 C14 1.492(18) . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C23 C13 1.506(19) . ?
C23 H23C 0.9800 . ?
C23 H23D 0.9800 . ?
C23 H23E 0.9800 . ?
C42 C52 1.491(18) . ?
C42 C12 1.563(19) . ?
C42 H42A 0.9900 . ?
C42 H42B 0.9900 . ?
C52 N12 1.264(19) . ?
C52 C62 1.52(2) . ?
C51 N11 1.275(18) . ?
C51 C41 1.503(18) . ?
C51 C61 1.50(2) . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C54 N14 1.314(19) . ?
C54 C44 1.49(2) . ?
C21 H21C 0.9800 . ?
C21 H21D 0.9800 . ?
C21 H21E 0.9800 . ?
C32 C12 1.556(18) . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C12 Ge2 2.001(13) . ?
C13 C33 1.51(2) . ?
C13 C43 1.53(2) . ?
C13 Ge3 1.999(14) . ?
C43 H43A 0.9900 . ?
C43 H43B 0.9900 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C14 C44 1.52(2) . ?
C14 C24 1.524(19) . ?
C14 Ge4 2.021(13) . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
C24 H24C 0.9800 . ?
C24 H24D 0.9800 . ?
C24 H24E 0.9800 . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C61 H61A 0.9800 . ?
C61 H61B 0.9800 . ?
C61 H61C 0.9800 . ?
N21 N11 1.375(15) . ?
N22 N12 1.385(14) . ?
N23 N13 1.406(15) . ?
N24 N14 1.390(16) . ?
N13 Ge3 2.038(12) . ?
N14 Ge4 2.033(11) . ?
N11 Ge1 2.028(12) . ?
N12 Ge2 2.027(12) . ?
N100 N101 1.439(3) . ?
N100 H101 0.9100 . ?
N100 H102 0.9100 . ?
N100 H103 0.9100 . ?
N102 N103 1.441(3) . ?
N104 N105 1.440(3) . ?
N104 H141 0.9100 . ?
N104 H142 0.9100 . ?
N104 H143 0.9100 . ?
N108 N109 1.440(3) . ?
N109 H191 0.9100 . ?
N109 H192 0.9100 . ?
N109 H193 0.9100 . ?
N110 N111 1.442(3) . ?
N111 H111 0.9100 . ?
N111 H112 0.9100 . ?
N111 H113 0.9100 . ?
Ge4 Te7 2.4684(19) . ?
Ge4 Te8 2.513(2) . ?
Ge3 Te6 2.4799(19) . ?
Ge3 Te5 2.485(2) . ?
Ge1 Te1 2.4810(19) . ?
Ge1 Te2 2.4940(19) . ?
Ge2 Te3 2.4827(19) . ?
Ge2 Te4 2.5034(19) . ?
