data_mt16_nikonov_0m
_audit_creation_date               2020-01-17
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2008). Acta Cryst. A64, 112-122.
;
_chemical_name_common              ?
_chemical_name_systematic
;
 ? 
;
_chemical_formula_moiety           'C46 H46 F5 Ge N5, 2(C3 H3)'
_chemical_formula_sum              'C52 H52 F5 Ge N5'
_chemical_formula_weight           914.58
_chemical_melting_point            ?
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'
 'F' 'F' 0.0171 0.0103 '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'

_space_group_crystal_system        'monoclinic'
_space_group_IT_number             15
_space_group_name_H-M_alt          'C 1 2/c 1'
_space_group_name_Hall             '-C 2yc'
loop_
  _space_group_symop_id
  _space_group_symop_operation_xyz
 1 'x, y, z'
 2 '-x, y, -z+1/2'
 3 'x+1/2, y+1/2, z'
 4 '-x+1/2, y+1/2, -z+1/2'
 5 '-x, -y, -z'
 6 'x, -y, z-1/2'
 7 '-x+1/2, -y+1/2, -z'
 8 'x+1/2, -y+1/2, z-1/2'

_cell_length_a                     27.994(4)
_cell_length_b                     8.6238(12)
_cell_length_c                     40.445(6)
_cell_angle_alpha                  90.00
_cell_angle_beta                   109.698(11)
_cell_angle_gamma                  90.00
_cell_volume                       9193(2)
_cell_formula_units_Z              8
_cell_measurement_reflns_used      1571
_cell_measurement_temperature      100
_cell_measurement_theta_max        18.619
_cell_measurement_theta_min        2.600
_exptl_absorpt_coefficient_mu      0.728
_exptl_absorpt_correction_T_max    0.8621
_exptl_absorpt_correction_T_min    0.7371
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details    
 'SADABS-2014/4 (Bruker,2014/4) was used for absorption correction. wR2(int) was 0.0710 before and 0.0640 after correction. The Ratio of minimum to maximum transmission is 0.8550. The λ/2 correction factor is 0.00150.'
_exptl_crystal_colour              'clear light yellow'
_exptl_crystal_colour_lustre       clear
_exptl_crystal_colour_modifier     light
_exptl_crystal_colour_primary      yellow
_exptl_crystal_density_diffrn      1.322
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      'not measured'
_exptl_crystal_description         Needle
_exptl_crystal_F_000               3808
_exptl_crystal_recrystallization_method 
 'The material was recrystallised from benzene by freezing at -30C'
_exptl_crystal_size_max            0.22
_exptl_crystal_size_mid            0.06
_exptl_crystal_size_min            0.06
_exptl_special_details
;
 ? 
;
_diffrn_reflns_av_R_equivalents    0.1687
_diffrn_reflns_av_unetI/netI       0.1255
_diffrn_reflns_limit_h_max         37
_diffrn_reflns_limit_h_min         -37
_diffrn_reflns_limit_k_max         11
_diffrn_reflns_limit_k_min         -11
_diffrn_reflns_limit_l_max         53
_diffrn_reflns_limit_l_min         -53
_diffrn_reflns_number              69379
_diffrn_reflns_theta_full          28.37
_diffrn_reflns_theta_max           28.37
_diffrn_reflns_theta_min           1.55
_diffrn_ambient_temperature        100.0
_diffrn_detector_area_resol_mean   ?
_diffrn_measured_fraction_theta_full  0.989
_diffrn_measured_fraction_theta_max  0.989
_diffrn_measurement_device_type    'Bruker APEX-II CCD'
_diffrn_measurement_method         'φ and ω scans'
_diffrn_radiation_monochromator    graphite
_diffrn_radiation_type             MoK\a
_diffrn_radiation_wavelength       0.71073
_diffrn_source                     'fine-focus sealed tube'
_diffrn_standards_decay_%          ?
_diffrn_standards_interval_count   ?
_diffrn_standards_interval_time    ?
_diffrn_standards_number           ?
_reflns_number_gt                  6579
_reflns_number_total               11403
_reflns_threshold_expression       >2sigma(I)
_computing_cell_refinement         'SAINT v8.34A (Bruker, 2013)'
_computing_data_collection         ?
_computing_data_reduction          'SAINT v8.34A (Bruker, 2013)'
_computing_molecular_graphics      'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement    'XL (Sheldrick, 2008)'
_computing_structure_solution      'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max           0.542
_refine_diff_density_min           -0.646
_refine_diff_density_rms           0.090
_refine_ls_extinction_coef         ?
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.011
_refine_ls_hydrogen_treatment      constr
_refine_ls_matrix_type             full
_refine_ls_number_parameters       576
_refine_ls_number_reflns           11403
_refine_ls_number_restraints       0
_refine_ls_R_factor_all            0.1306
_refine_ls_R_factor_gt             0.0593
_refine_ls_restrained_S_all        1.011
_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)+(0.0414P)²+5.3505P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.1060
_refine_ls_wR_factor_ref           0.1258
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;
_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:
 C17(H17), C20(H20), C36(H36), C39(H39)
2.b Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C6(H6), C7(H7), C8(H8), C9(H9), C10(H10), C13(H13), C14(H14),
 C15(H15), C25(H25), C26(H26), C27(H27), C28(H28), C29(H29), C32(H32), C33(H33),
  C34(H34), C47(H47), C48(H48), C49(H49), C50(H50), C51(H51), C52(H52)
2.c Idealised Me refined as rotating group:
 C18(H18A,H18B,H18C), C19(H19A,H19B,H19C), C21(H21A,H21B,H21C), C22(H22A,H22B,
 H22C), C37(H37A,H37B,H37C), C38(H38A,H38B,H38C), C40(H40A,H40B,H40C), C41(H41A,
 H41B,H41C)
;
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary       direct
_atom_sites_solution_secondary     difmap
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_calc_flag
  _atom_site_disorder_assembly
  _atom_site_disorder_group
  _atom_site_refinement_flags_posn
 Ge1 Ge 0.242162(13) 0.41887(4) 0.625349(9) 0.01732(10) Uani 1 d . . .
 F1 F 0.26426(6) 0.4826(2) 0.59015(4) 0.0226(4) Uani 1 d . . .
 F2 F 0.37213(7) 0.7120(2) 0.71666(5) 0.0330(5) Uani 1 d . . .
 F3 F 0.38162(8) 0.6564(3) 0.78268(5) 0.0455(6) Uani 1 d . . .
 F4 F 0.22958(8) 0.4146(3) 0.75364(5) 0.0439(6) Uani 1 d . . .
 F5 F 0.20986(7) 0.4658(2) 0.68472(5) 0.0293(5) Uani 1 d . . .
 N1 N 0.24686(9) 0.7497(3) 0.64406(6) 0.0132(5) Uani 1 d . . .
 N2 N 0.32467(9) 0.6523(3) 0.64879(6) 0.0151(6) Uani 1 d . . .
 N3 N 0.35006(9) 0.4020(3) 0.65779(6) 0.0162(6) Uani 1 d . . .
 N4 N 0.18217(9) 0.5943(3) 0.60961(6) 0.0145(5) Uani 1 d . . .
 N5 N 0.30548(12) 0.5358(4) 0.76821(7) 0.0318(8) Uani 1 d . . .
 C1 C 0.28019(11) 0.8733(4) 0.64218(8) 0.0178(7) Uani 1 d . . .
 H1 H 0.2714 0.9801 0.6394 0.021 Uiso 1 calc . . R
 C2 C 0.32525(12) 0.8148(4) 0.64488(8) 0.0180(7) Uani 1 d . . .
 H2 H 0.3536 0.8736 0.6443 0.022 Uiso 1 calc . . R
 C3 C 0.27856(11) 0.6088(4) 0.65604(8) 0.0161(7) Uani 1 d . . .
 C4 C 0.36014(11) 0.5408(4) 0.64972(8) 0.0147(7) Uani 1 d . . .
 C5 C 0.40563(12) 0.5924(4) 0.64108(8) 0.0195(7) Uani 1 d . . .
 C6 C 0.45443(12) 0.5597(4) 0.66361(10) 0.0256(8) Uani 1 d . . .
 H6 H 0.4593 0.5080 0.6852 0.031 Uiso 1 calc . . R
 C7 C 0.49618(13) 0.6034(4) 0.65420(12) 0.0376(10) Uani 1 d . . .
 H7 H 0.5295 0.5816 0.6696 0.045 Uiso 1 calc . . R
 C8 C 0.48951(15) 0.6779(4) 0.62280(12) 0.0378(10) Uani 1 d . . .
 H8 H 0.5182 0.7062 0.6166 0.045 Uiso 1 calc . . R
 C9 C 0.44079(15) 0.7119(4) 0.60015(10) 0.0323(9) Uani 1 d . . .
 H9 H 0.4362 0.7634 0.5785 0.039 Uiso 1 calc . . R
 C10 C 0.39902(13) 0.6700(4) 0.60933(9) 0.0229(8) Uani 1 d . . .
 H10 H 0.3658 0.6940 0.5940 0.027 Uiso 1 calc . . R
 C11 C 0.38339(11) 0.2741(4) 0.65958(8) 0.0180(7) Uani 1 d . . .
 C12 C 0.39197(12) 0.2123(4) 0.62975(9) 0.0194(7) Uani 1 d . . .
 C13 C 0.42440(12) 0.0847(4) 0.63490(9) 0.0254(8) Uani 1 d . . .
 H13 H 0.4314 0.0427 0.6153 0.030 Uiso 1 calc . . R
 C14 C 0.44676(12) 0.0170(4) 0.66751(10) 0.0270(8) Uani 1 d . . .
 H14 H 0.4690 -0.0688 0.6701 0.032 Uiso 1 calc . . R
 C15 C 0.43648(12) 0.0750(4) 0.69614(10) 0.0288(8) Uani 1 d . . .
 H15 H 0.4514 0.0273 0.7184 0.035 Uiso 1 calc . . R
 C16 C 0.40457(12) 0.2026(4) 0.69297(9) 0.0231(8) Uani 1 d . . .
 C17 C 0.39097(15) 0.2607(4) 0.72407(9) 0.0348(9) Uani 1 d . . .
 H17 H 0.3779 0.3688 0.7184 0.042 Uiso 1 calc . . R
 C18 C 0.43545(18) 0.2689(7) 0.75811(11) 0.0731(17) Uani 1 d . . .
 H18A H 0.4460 0.1637 0.7666 0.110 Uiso 1 calc . . GR
 H18B H 0.4253 0.3256 0.7757 0.110 Uiso 1 calc . . GR
 H18C H 0.4638 0.3229 0.7540 0.110 Uiso 1 calc . . GR
 C19 C 0.34832(16) 0.1658(6) 0.72881(12) 0.0667(16) Uani 1 d . . .
 H19A H 0.3192 0.1667 0.7069 0.100 Uiso 1 calc . . GR
 H19B H 0.3383 0.2103 0.7478 0.100 Uiso 1 calc . . GR
 H19C H 0.3598 0.0587 0.7348 0.100 Uiso 1 calc . . GR
 C20 C 0.36486(12) 0.2724(4) 0.59284(8) 0.0223(8) Uani 1 d . . .
 H20 H 0.3490 0.3741 0.5950 0.027 Uiso 1 calc . . R
 C21 C 0.40150(14) 0.3007(4) 0.57243(10) 0.0315(9) Uani 1 d . . .
 H21A H 0.4292 0.3685 0.5862 0.047 Uiso 1 calc . . GR
 H21B H 0.3832 0.3501 0.5499 0.047 Uiso 1 calc . . GR
 H21C H 0.4155 0.2014 0.5682 0.047 Uiso 1 calc . . GR
 C22 C 0.32199(13) 0.1613(4) 0.57265(9) 0.0310(9) Uani 1 d . . .
 H22A H 0.3364 0.0597 0.5705 0.047 Uiso 1 calc . . GR
 H22B H 0.3043 0.2033 0.5492 0.047 Uiso 1 calc . . GR
 H22C H 0.2979 0.1502 0.5854 0.047 Uiso 1 calc . . GR
 C23 C 0.19824(11) 0.7336(4) 0.62111(8) 0.0145(7) Uani 1 d . . .
 C24 C 0.16820(11) 0.8800(3) 0.61328(8) 0.0151(7) Uani 1 d . . .
 C25 C 0.17159(12) 0.9799(4) 0.64141(8) 0.0178(7) Uani 1 d . . .
 H25 H 0.1929 0.9538 0.6645 0.021 Uiso 1 calc . . R
 C26 C 0.14388(12) 1.1170(4) 0.63551(9) 0.0201(7) Uani 1 d . . .
 H26 H 0.1458 1.1841 0.6546 0.024 Uiso 1 calc . . R
 C27 C 0.11337(12) 1.1554(4) 0.60170(9) 0.0214(8) Uani 1 d . . .
 H27 H 0.0946 1.2495 0.5976 0.026 Uiso 1 calc . . R
 C28 C 0.11004(12) 1.0563(4) 0.57368(9) 0.0214(7) Uani 1 d . . .
 H28 H 0.0891 1.0834 0.5506 0.026 Uiso 1 calc . . R
 C29 C 0.13708(11) 0.9193(4) 0.57943(8) 0.0179(7) Uani 1 d . . .
 H29 H 0.1345 0.8518 0.5603 0.021 Uiso 1 calc . . R
 C30 C 0.12908(11) 0.5615(3) 0.59049(8) 0.0138(6) Uani 1 d . . .
 C31 C 0.09200(11) 0.5748(4) 0.60711(8) 0.0159(6) Uani 1 d . . .
 C32 C 0.04208(12) 0.5285(4) 0.58790(8) 0.0196(7) Uani 1 d . . .
 H32 H 0.0164 0.5392 0.5983 0.023 Uiso 1 calc . . R
 C33 C 0.02940(12) 0.4681(4) 0.55447(8) 0.0194(7) Uani 1 d . . .
 H33 H -0.0043 0.4345 0.5423 0.023 Uiso 1 calc . . R
 C34 C 0.06628(11) 0.4568(3) 0.53881(8) 0.0187(7) Uani 1 d . . .
 H34 H 0.0574 0.4148 0.5158 0.022 Uiso 1 calc . . R
 C35 C 0.11602(11) 0.5050(3) 0.55574(8) 0.0160(7) Uani 1 d . . .
 C36 C 0.15389(12) 0.4990(4) 0.53597(8) 0.0175(7) Uani 1 d . . .
 H36 H 0.1855 0.5533 0.5507 0.021 Uiso 1 calc . . R
 C37 C 0.16841(13) 0.3307(4) 0.53051(9) 0.0256(8) Uani 1 d . . .
 H37A H 0.1821 0.2788 0.5533 0.038 Uiso 1 calc . . GR
 H37B H 0.1941 0.3313 0.5190 0.038 Uiso 1 calc . . GR
 H37C H 0.1382 0.2750 0.5158 0.038 Uiso 1 calc . . GR
 C38 C 0.13368(12) 0.5847(4) 0.50040(8) 0.0236(7) Uani 1 d . . .
 H38A H 0.1028 0.5332 0.4853 0.035 Uiso 1 calc . . GR
 H38B H 0.1595 0.5828 0.4890 0.035 Uiso 1 calc . . GR
 H38C H 0.1259 0.6925 0.5044 0.035 Uiso 1 calc . . GR
 C39 C 0.10229(12) 0.6357(4) 0.64428(8) 0.0184(7) Uani 1 d . . .
 H39 H 0.1387 0.6675 0.6541 0.022 Uiso 1 calc . . R
 C40 C 0.06907(12) 0.7787(4) 0.64390(9) 0.0249(8) Uani 1 d . . .
 H40A H 0.0715 0.8521 0.6260 0.037 Uiso 1 calc . . GR
 H40B H 0.0809 0.8287 0.6670 0.037 Uiso 1 calc . . GR
 H40C H 0.0337 0.7462 0.6384 0.037 Uiso 1 calc . . GR
 C41 C 0.09281(13) 0.5082(4) 0.66785(9) 0.0240(8) Uani 1 d . . .
 H41A H 0.0568 0.4795 0.6593 0.036 Uiso 1 calc . . GR
 H41B H 0.1021 0.5465 0.6920 0.036 Uiso 1 calc . . GR
 H41C H 0.1135 0.4171 0.6673 0.036 Uiso 1 calc . . GR
 C42 C 0.28980(11) 0.5900(4) 0.69591(8) 0.0177(7) Uani 1 d . . .
 C43 C 0.33345(12) 0.6379(4) 0.72290(9) 0.0226(8) Uani 1 d . . .
 C44 C 0.33868(14) 0.6078(4) 0.75759(9) 0.0314(9) Uani 1 d . . .
 C45 C 0.26369(14) 0.4916(4) 0.74329(9) 0.0287(8) Uani 1 d . . .
 C46 C 0.25458(12) 0.5169(4) 0.70814(8) 0.0217(7) Uani 1 d . . .
 C47 C 0.02229(12) 0.8543(4) 0.50608(9) 0.0243(8) Uani 1 d . . .
 H47 H 0.0377 0.7548 0.5104 0.029 Uiso 1 calc . . R
 C48 C 0.03191(12) 0.9533(4) 0.48186(9) 0.0256(8) Uani 1 d . . .
 H48 H 0.0535 0.9213 0.4694 0.031 Uiso 1 calc . . R
 C49 C 0.00965(12) 1.0994(4) 0.47608(8) 0.0239(8) Uani 1 d . . .
 H49 H 0.0164 1.1679 0.4598 0.029 Uiso 1 calc . . R
 C50 C 0.25785(13) 0.7582(5) 0.53565(10) 0.0352(10) Uani 1 d . . .
 H50 H 0.2633 0.7639 0.5601 0.042 Uiso 1 calc . . R
 C51 C 0.27366(13) 0.6286(5) 0.52181(10) 0.0339(9) Uani 1 d . . .
 H51 H 0.2898 0.5454 0.5368 0.041 Uiso 1 calc . . R
 C52 C 0.26595(14) 0.6203(5) 0.48630(10) 0.0351(10) Uani 1 d . . .
 H52 H 0.2769 0.5317 0.4769 0.042 Uiso 1 calc . . R


_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;
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 F1 1.8181(18) . ?
 Ge1 N4 2.189(2) . ?
 Ge1 C3 2.100(3) . ?
 F2 C43 1.352(4) . ?
 F3 C44 1.352(4) . ?
 F4 C45 1.341(4) . ?
 F5 C46 1.364(4) . ?
 N1 C1 1.435(4) . ?
 N1 C3 1.486(4) . ?
 N1 C23 1.372(4) . ?
 N2 C2 1.411(4) . ?
 N2 C3 1.466(4) . ?
 N2 C4 1.373(4) . ?
 N3 C4 1.297(4) . ?
 N3 C11 1.431(4) . ?
 N4 C23 1.312(4) . ?
 N4 C30 1.453(4) . ?
 N5 C44 1.304(5) . ?
 N5 C45 1.317(5) . ?
 C1 C2 1.329(4) . ?
 C3 C42 1.544(4) . ?
 C4 C5 1.497(4) . ?
 C5 C6 1.392(4) . ?
 C5 C10 1.404(4) . ?
 C6 C7 1.397(5) . ?
 C7 C8 1.379(5) . ?
 C8 C9 1.394(5) . ?
 C9 C10 1.388(5) . ?
 C11 C12 1.412(4) . ?
 C11 C16 1.420(4) . ?
 C12 C13 1.397(4) . ?
 C12 C20 1.519(5) . ?
 C13 C14 1.384(5) . ?
 C14 C15 1.378(5) . ?
 C15 C16 1.396(5) . ?
 C16 C17 1.517(5) . ?
 C17 C18 1.515(5) . ?
 C17 C19 1.512(6) . ?
 C20 C21 1.538(4) . ?
 C20 C22 1.537(5) . ?
 C23 C24 1.490(4) . ?
 C24 C25 1.405(4) . ?
 C24 C29 1.394(4) . ?
 C25 C26 1.390(4) . ?
 C26 C27 1.386(4) . ?
 C27 C28 1.397(4) . ?
 C28 C29 1.381(4) . ?
 C30 C31 1.419(4) . ?
 C30 C35 1.414(4) . ?
 C31 C32 1.408(4) . ?
 C31 C39 1.526(4) . ?
 C32 C33 1.380(4) . ?
 C33 C34 1.385(4) . ?
 C34 C35 1.392(4) . ?
 C35 C36 1.529(4) . ?
 C36 C37 1.543(4) . ?
 C36 C38 1.545(4) . ?
 C39 C40 1.541(4) . ?
 C39 C41 1.536(4) . ?
 C42 C43 1.399(4) . ?
 C42 C46 1.394(4) . ?
 C43 C44 1.385(5) . ?
 C45 C46 1.374(4) . ?
 C47 C48 1.392(5) . ?
 C47 C49 1.383(5) 5_576 ?
 C48 C49 1.390(5) . ?
 C49 C47 1.383(5) 5_576 ?
 C50 C51 1.387(5) . ?
 C50 C52 1.389(5) 7_566 ?
 C51 C52 1.381(5) . ?
 C52 C50 1.389(5) 7_566 ?

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
 F1 Ge1 N4 89.63(8) . . ?
 F1 Ge1 C3 90.09(10) . . ?
 C3 Ge1 N4 78.74(10) . . ?
 C1 N1 C3 107.3(2) . . ?
 C23 N1 C1 123.6(2) . . ?
 C23 N1 C3 119.0(2) . . ?
 C2 N2 C3 108.7(2) . . ?
 C4 N2 C2 131.5(3) . . ?
 C4 N2 C3 119.5(2) . . ?
 C4 N3 C11 122.1(3) . . ?
 C23 N4 Ge1 113.08(19) . . ?
 C23 N4 C30 122.2(2) . . ?
 C30 N4 Ge1 124.55(19) . . ?
 C44 N5 C45 115.7(3) . . ?
 C2 C1 N1 109.3(3) . . ?
 C1 C2 N2 109.9(3) . . ?
 N1 C3 Ge1 109.12(18) . . ?
 N1 C3 C42 108.4(2) . . ?
 N2 C3 Ge1 111.47(19) . . ?
 N2 C3 N1 101.2(2) . . ?
 N2 C3 C42 110.7(2) . . ?
 C42 C3 Ge1 115.0(2) . . ?
 N2 C4 C5 116.7(3) . . ?
 N3 C4 N2 115.9(3) . . ?
 N3 C4 C5 127.4(3) . . ?
 C6 C5 C4 120.8(3) . . ?
 C6 C5 C10 119.5(3) . . ?
 C10 C5 C4 119.7(3) . . ?
 C5 C6 C7 119.6(3) . . ?
 C8 C7 C6 120.7(4) . . ?
 C7 C8 C9 120.1(3) . . ?
 C10 C9 C8 119.7(4) . . ?
 C9 C10 C5 120.3(3) . . ?
 C12 C11 N3 122.9(3) . . ?
 C12 C11 C16 120.8(3) . . ?
 C16 C11 N3 116.1(3) . . ?
 C11 C12 C20 122.6(3) . . ?
 C13 C12 C11 117.3(3) . . ?
 C13 C12 C20 120.0(3) . . ?
 C14 C13 C12 122.5(3) . . ?
 C15 C14 C13 119.5(3) . . ?
 C14 C15 C16 121.2(3) . . ?
 C11 C16 C17 120.3(3) . . ?
 C15 C16 C11 118.6(3) . . ?
 C15 C16 C17 121.0(3) . . ?
 C18 C17 C16 114.2(3) . . ?
 C19 C17 C16 110.8(3) . . ?
 C19 C17 C18 110.7(3) . . ?
 C12 C20 C21 112.3(3) . . ?
 C12 C20 C22 110.6(3) . . ?
 C22 C20 C21 110.9(3) . . ?
 N1 C23 C24 114.7(3) . . ?
 N4 C23 N1 118.4(3) . . ?
 N4 C23 C24 126.8(3) . . ?
 C25 C24 C23 117.9(3) . . ?
 C29 C24 C23 122.4(3) . . ?
 C29 C24 C25 119.7(3) . . ?
 C26 C25 C24 120.1(3) . . ?
 C27 C26 C25 119.7(3) . . ?
 C26 C27 C28 120.3(3) . . ?
 C29 C28 C27 120.3(3) . . ?
 C28 C29 C24 120.0(3) . . ?
 C31 C30 N4 120.8(3) . . ?
 C35 C30 N4 118.1(2) . . ?
 C35 C30 C31 120.9(3) . . ?
 C30 C31 C39 124.7(3) . . ?
 C32 C31 C30 117.6(3) . . ?
 C32 C31 C39 117.6(3) . . ?
 C33 C32 C31 121.8(3) . . ?
 C32 C33 C34 119.3(3) . . ?
 C33 C34 C35 122.0(3) . . ?
 C30 C35 C36 122.6(3) . . ?
 C34 C35 C30 118.2(3) . . ?
 C34 C35 C36 119.2(3) . . ?
 C35 C36 C37 111.7(3) . . ?
 C35 C36 C38 111.7(3) . . ?
 C37 C36 C38 110.4(3) . . ?
 C31 C39 C40 110.6(3) . . ?
 C31 C39 C41 110.5(3) . . ?
 C41 C39 C40 110.5(3) . . ?
 C43 C42 C3 126.9(3) . . ?
 C46 C42 C3 119.9(3) . . ?
 C46 C42 C43 113.1(3) . . ?
 F2 C43 C42 122.5(3) . . ?
 F2 C43 C44 117.4(3) . . ?
 C44 C43 C42 120.1(3) . . ?
 F3 C44 C43 117.8(3) . . ?
 N5 C44 F3 116.9(3) . . ?
 N5 C44 C43 125.4(3) . . ?
 F4 C45 C46 119.9(3) . . ?
 N5 C45 F4 116.5(3) . . ?
 N5 C45 C46 123.5(3) . . ?
 F5 C46 C42 119.5(3) . . ?
 F5 C46 C45 118.3(3) . . ?
 C45 C46 C42 122.1(3) . . ?
 C49 C47 C48 120.2(3) 5_576 . ?
 C49 C48 C47 119.5(3) . . ?
 C47 C49 C48 120.4(3) 5_576 . ?
 C51 C50 C52 119.9(4) . 7_566 ?
 C52 C51 C50 120.1(4) . . ?
 C51 C52 C50 119.9(4) . 7_566 ?

_olex2_diffrn_ambient_temperature_device  'Oxford Cryosystems'
_olex2_submission_special_instructions  'No special instructions were received'
