# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_TH205_orange
_database_code_depnum_ccdc_archive 'CCDC 1859587'
_audit_update_record             
;
2018-08-01 deposited with the CCDC.
2018-10-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_formula_moiety         
'C12 H11 Ge4 Zn, 2(C12 H24 K0.045 O6 Rb0.955), C12 H30 K N2 O6, 6(H3 N)'
_chemical_formula_sum            'C48 H107 Ge4 K1.09 N8 O18 Rb1.91 Zn'
_chemical_formula_weight         1646.01

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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rb Rb -0.9393 2.9676 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 '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'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           60
_space_group_name_H-M_alt        'P b c n'
_space_group_name_Hall           '-P 2n 2ab'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y+1/2, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x-1/2, y-1/2, -z-1/2'
'-x-1/2, y-1/2, z'
'x, -y, z-1/2'

_cell_length_a                   12.8668(5)
_cell_length_b                   28.2571(9)
_cell_length_c                   20.0883(6)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     7303.7(4)
_cell_formula_units_Z            4
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    18626
_cell_measurement_theta_min      2.6560
_cell_measurement_theta_max      30.6064

_exptl_crystal_description       block
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.497
_exptl_crystal_F_000             3378
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.15
_exptl_absorpt_coefficient_mu    3.341
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.72597
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
;
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm. 
;

_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Xcalibur 3'
_diffrn_measurement_method       'ω and π scans'
_diffrn_detector_area_resol_mean 16.0238
_diffrn_reflns_number            84521
_diffrn_reflns_av_unetI/netI     0.0728
_diffrn_reflns_av_R_equivalents  0.0790
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         2.672
_diffrn_reflns_theta_max         25.996
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             7173
_reflns_number_gt                4177
_reflns_threshold_expression     'I > 2σ(I)'

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
;

_computing_data_collection       
; 
 CrysAlis CCD, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_cell_refinement       
; 
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_data_reduction        
; 
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_structure_solution    SHELXS-97
_computing_structure_refinement  SHELXL-2014/7
_computing_molecular_graphics    DIAMOND

_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0357P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7173
_refine_ls_number_parameters     378
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0694
_refine_ls_R_factor_gt           0.0345
_refine_ls_wR_factor_ref         0.0757
_refine_ls_wR_factor_gt          0.0707
_refine_ls_goodness_of_fit_ref   0.866
_refine_ls_restrained_S_all      0.866
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
Rb Rb 0.52220(3) 0.34806(2) 0.08624(2) 0.03131(15) Uani 0.955(3) 1 d . . P . .
K2 K 0.52220(3) 0.34806(2) 0.08624(2) 0.03131(15) Uani 0.045(3) 1 d . . P . .
O1 O 0.3520(2) 0.36019(9) -0.01518(12) 0.0350(7) Uani 1 1 d . . . . .
O2 O 0.32987(19) 0.28441(9) 0.07461(13) 0.0358(7) Uani 1 1 d . . . . .
O3 O 0.5037(2) 0.25330(9) 0.14822(12) 0.0379(7) Uani 1 1 d . . . . .
O4 O 0.7039(2) 0.27473(9) 0.10043(13) 0.0368(7) Uani 1 1 d . . . . .
O5 O 0.72406(19) 0.35307(9) 0.01530(12) 0.0329(7) Uani 1 1 d . . . . .
O6 O 0.5526(2) 0.37655(9) -0.06582(12) 0.0343(7) Uani 1 1 d . . . . .
C1 C 0.2579(3) 0.33500(15) -0.0072(2) 0.0442(12) Uani 1 1 d . . . . .
H1A H 0.2566 0.3074 -0.0375 0.053 Uiso 1 1 calc R U . . .
H1B H 0.1982 0.3557 -0.0181 0.053 Uiso 1 1 calc R U . . .
C2 C 0.2500(3) 0.31871(14) 0.0634(2) 0.0393(11) Uani 1 1 d . . . . .
H2A H 0.2590 0.3458 0.0941 0.047 Uiso 1 1 calc R U . . .
H2B H 0.1809 0.3045 0.0716 0.047 Uiso 1 1 calc R U . . .
C3 C 0.3218(3) 0.26297(15) 0.1381(2) 0.0466(12) Uani 1 1 d . . . . .
H3A H 0.2541 0.2466 0.1424 0.056 Uiso 1 1 calc R U . . .
H3B H 0.3264 0.2874 0.1734 0.056 Uiso 1 1 calc R U . . .
C4 C 0.4090(3) 0.22810(15) 0.1454(2) 0.0456(12) Uani 1 1 d . . . . .
H4A H 0.3996 0.2093 0.1866 0.055 Uiso 1 1 calc R U . . .
H4B H 0.4095 0.2061 0.1071 0.055 Uiso 1 1 calc R U . . .
C5 C 0.5898(3) 0.22327(15) 0.1579(2) 0.0485(12) Uani 1 1 d . . . . .
H5A H 0.5964 0.2011 0.1200 0.058 Uiso 1 1 calc R U . . .
H5B H 0.5804 0.2045 0.1991 0.058 Uiso 1 1 calc R U . . .
C6 C 0.6867(3) 0.25357(16) 0.1634(2) 0.0460(12) Uani 1 1 d . . . . .
H6A H 0.6770 0.2783 0.1978 0.055 Uiso 1 1 calc R U . . .
H6B H 0.7470 0.2338 0.1760 0.055 Uiso 1 1 calc R U . . .
C7 C 0.7928(3) 0.30416(14) 0.1004(2) 0.0393(11) Uani 1 1 d . . . . .
H7A H 0.8545 0.2859 0.1147 0.047 Uiso 1 1 calc R U . . .
H7B H 0.7828 0.3308 0.1317 0.047 Uiso 1 1 calc R U . . .
C8 C 0.8082(3) 0.32250(15) 0.0315(2) 0.0426(11) Uani 1 1 d . . . . .
H8A H 0.8747 0.3400 0.0287 0.051 Uiso 1 1 calc R U . . .
H8B H 0.8109 0.2958 -0.0004 0.051 Uiso 1 1 calc R U . . .
C9 C 0.7349(3) 0.37333(15) -0.04953(19) 0.0413(11) Uani 1 1 d . . . . .
H9A H 0.7378 0.3479 -0.0835 0.050 Uiso 1 1 calc R U . . .
H9B H 0.8002 0.3918 -0.0521 0.050 Uiso 1 1 calc R U . . .
C10 C 0.6446(3) 0.40470(14) -0.0625(2) 0.0397(11) Uani 1 1 d . . . . .
H10A H 0.6382 0.4284 -0.0264 0.048 Uiso 1 1 calc R U . . .
H10B H 0.6547 0.4218 -0.1051 0.048 Uiso 1 1 calc R U . . .
C11 C 0.4651(3) 0.40424(14) -0.0850(2) 0.0395(10) Uani 1 1 d . . . . .
H11A H 0.4751 0.4167 -0.1307 0.047 Uiso 1 1 calc R U . . .
H11B H 0.4567 0.4314 -0.0544 0.047 Uiso 1 1 calc R U . . .
C12 C 0.3707(3) 0.37319(14) -0.0825(2) 0.0412(11) Uani 1 1 d . . . . .
H12A H 0.3098 0.3904 -0.1006 0.049 Uiso 1 1 calc R U . . .
H12B H 0.3819 0.3445 -0.1099 0.049 Uiso 1 1 calc R U . . .
N1 N 0.5340(3) 0.26018(17) -0.0246(2) 0.0975(17) Uani 1 1 d . . . . .
H1C H 0.5312 0.2319 -0.0030 0.146 Uiso 1 1 calc R U . . .
H1D H 0.5946 0.2622 -0.0477 0.146 Uiso 1 1 calc R U . . .
H1E H 0.4794 0.2625 -0.0532 0.146 Uiso 1 1 calc R U . . .
K K 0.0000 0.5000 0.0000 0.0319(3) Uani 1 2 d S . P . .
O7 O 0.21615(19) 0.50759(9) -0.00821(12) 0.0301(7) Uani 1 1 d . . . . .
O8 O 0.12381(18) 0.45243(9) 0.09381(12) 0.0344(7) Uani 1 1 d . . . . .
O9 O -0.08997(19) 0.46437(9) 0.11790(12) 0.0345(7) Uani 1 1 d . . . . .
C13 C 0.2714(3) 0.47380(14) 0.0303(2) 0.0365(10) Uani 1 1 d . . . . .
H13A H 0.3456 0.4829 0.0330 0.044 Uiso 1 1 calc R U . . .
H13B H 0.2671 0.4424 0.0087 0.044 Uiso 1 1 calc R U . . .
C14 C 0.2268(3) 0.47131(14) 0.0978(2) 0.0360(10) Uani 1 1 d . . . . .
H14A H 0.2705 0.4508 0.1263 0.043 Uiso 1 1 calc R U . . .
H14B H 0.2248 0.5033 0.1178 0.043 Uiso 1 1 calc R U . . .
C15 C 0.0794(3) 0.44633(15) 0.1573(2) 0.0430(11) Uani 1 1 d . . . . .
H15A H 0.0790 0.4768 0.1815 0.052 Uiso 1 1 calc R U . . .
H15B H 0.1206 0.4233 0.1833 0.052 Uiso 1 1 calc R U . . .
C16 C -0.0293(3) 0.42865(15) 0.1487(2) 0.0427(11) Uani 1 1 d . . . . .
H16A H -0.0292 0.3998 0.1207 0.051 Uiso 1 1 calc R U . . .
H16B H -0.0593 0.4205 0.1926 0.051 Uiso 1 1 calc R U . . .
C17 C -0.1957(3) 0.45099(14) 0.11022(19) 0.0381(11) Uani 1 1 d . . . . .
H17A H -0.2274 0.4455 0.1545 0.046 Uiso 1 1 calc R U . . .
H17B H -0.2002 0.4212 0.0844 0.046 Uiso 1 1 calc R U . . .
C18 C -0.2531(3) 0.48932(14) 0.07483(19) 0.0369(11) Uani 1 1 d . . . . .
H18A H -0.3285 0.4823 0.0748 0.044 Uiso 1 1 calc R U . . .
H18B H -0.2421 0.5199 0.0979 0.044 Uiso 1 1 calc R U . . .
N2 N -0.0078(3) 0.57671(15) 0.09734(19) 0.0706(12) Uani 1 1 d . . . . .
H2C H 0.0541 0.5785 0.1192 0.106 Uiso 1 1 calc R U . . .
H2D H -0.0595 0.5710 0.1271 0.106 Uiso 1 1 calc R U . . .
H2E H -0.0203 0.6046 0.0761 0.106 Uiso 1 1 calc R U . . .
H1 H 0.5000 0.356(2) 0.2500 0.065(18) Uiso 1 2 d S . P . .
Ge1 Ge 0.39035(3) 0.39216(2) 0.24683(2) 0.02775(11) Uani 1 1 d . . . . .
Ge2 Ge 0.50391(3) 0.44863(2) 0.18353(2) 0.02497(11) Uani 1 1 d . . . . .
Zn Zn 0.5000 0.52639(2) 0.2500 0.02597(15) Uani 1 2 d S T P . .
C19 C 0.3625(3) 0.56332(12) 0.24786(18) 0.0267(8) Uani 1 1 d . . . . .
C20 C 0.2681(3) 0.53943(13) 0.25532(18) 0.0298(9) Uani 1 1 d . . . . .
H20 H 0.2693 0.5060 0.2609 0.036 Uiso 1 1 calc R U . . .
C21 C 0.1728(3) 0.56232(14) 0.2549(2) 0.0405(10) Uani 1 1 d . . . . .
H21 H 0.1106 0.5447 0.2610 0.049 Uiso 1 1 calc R U . . .
C22 C 0.1683(3) 0.61100(14) 0.2457(2) 0.0405(10) Uani 1 1 d . . . . .
H22 H 0.1032 0.6269 0.2448 0.049 Uiso 1 1 calc R U . . .
C23 C 0.2591(3) 0.63567(13) 0.23785(17) 0.0325(10) Uani 1 1 d . . . . .
H23 H 0.2572 0.6690 0.2313 0.039 Uiso 1 1 calc R U . . .
C24 C 0.3534(3) 0.61237(13) 0.23947(17) 0.0298(9) Uani 1 1 d . . . . .
H24 H 0.4151 0.6305 0.2347 0.036 Uiso 1 1 calc R U . . .
N3 N 0.1176(3) 0.32462(17) 0.2279(2) 0.0850(15) Uani 1 1 d . . . . .
H3C H 0.0725 0.3384 0.2570 0.127 Uiso 1 1 d R U . . .
H3D H 0.1265 0.3439 0.1921 0.127 Uiso 1 1 d R U . . .
H3E H 0.1798 0.3199 0.2484 0.127 Uiso 1 1 d R U . . .
N4 N 0.0284(4) 0.2282(2) 0.1786(4) 0.198(4) Uani 1 1 d . . . . .
H4C H -0.0373 0.2207 0.1917 0.298 Uiso 1 1 d R U . . .
H4D H 0.0483 0.2558 0.1982 0.298 Uiso 1 1 d R U . . .
H4E H 0.0726 0.2046 0.1910 0.298 Uiso 1 1 d R U . . .


_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
Rb O3 2.963(2) . ?
Rb O5 2.966(2) . ?
Rb O1 3.011(3) . ?
Rb O2 3.068(2) . ?
Rb O4 3.137(3) . ?
Rb O6 3.183(2) . ?
Rb N1 3.338(4) . ?
Rb Ge2 3.4570(5) . ?
Rb C2 3.628(4) . ?
Rb C3 3.676(4) . ?
Rb C7 3.707(4) . ?
Rb C10 3.739(4) . ?
O1 C1 1.414(4) . ?
O1 C12 1.423(4) . ?
O2 C3 1.416(5) . ?
O2 C2 1.430(4) . ?
O3 C5 1.409(4) . ?
O3 C4 1.412(4) . ?
O4 C7 1.413(4) . ?
O4 C6 1.416(4) . ?
O5 C8 1.423(4) . ?
O5 C9 1.429(4) . ?
O6 C11 1.424(4) . ?
O6 C10 1.428(4) . ?
C1 C2 1.494(5) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 C4 1.500(5) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C5 C6 1.516(5) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 C8 1.492(5) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 C10 1.485(5) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.500(5) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
N1 H1C 0.9100 . ?
N1 H1D 0.9100 . ?
N1 H1E 0.9100 . ?
K O7 2.794(2) . ?
K O7 2.794(2) 5_565 ?
K O8 2.810(2) 5_565 ?
K O8 2.810(2) . ?
K O9 2.822(2) . ?
K O9 2.822(2) 5_565 ?
K N2 2.921(4) 5_565 ?
K N2 2.921(4) . ?
O7 C13 1.419(4) . ?
O7 C18 1.423(4) 5_565 ?
O8 C15 1.407(4) . ?
O8 C14 1.431(4) . ?
O9 C16 1.418(4) . ?
O9 C17 1.421(4) . ?
C13 C14 1.474(5) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 C16 1.495(5) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C17 C18 1.491(5) . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C18 O7 1.423(4) 5_565 ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
N2 H2C 0.9100 . ?
N2 H2D 0.9100 . ?
N2 H2E 0.9100 . ?
Ge1 Ge2 2.5098(5) . ?
Ge1 Ge2 2.5209(5) 4_655 ?
Ge1 Ge1 2.8247(8) 4_655 ?
Ge1 K2 3.7501(6) 4_655 ?
Ge1 Rb 3.7501(6) 4_655 ?
Ge1 H1 1.74(3) . ?
Ge2 Ge1 2.5209(5) 4_655 ?
Ge2 Zn 2.5717(6) . ?
Ge2 Ge2 2.6726(7) 4_655 ?
Zn C19 2.055(4) 4_655 ?
Zn C19 2.055(4) . ?
Zn Ge2 2.5718(6) 4_655 ?
C19 C20 1.397(5) . ?
C19 C24 1.401(5) . ?
C20 C21 1.387(5) . ?
C20 H20 0.9500 . ?
C21 C22 1.389(5) . ?
C21 H21 0.9500 . ?
C22 C23 1.370(5) . ?
C22 H22 0.9500 . ?
C23 C24 1.380(5) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
N3 H3C 0.9100 . ?
N3 H3D 0.9100 . ?
N3 H3E 0.9100 . ?
N4 H4C 0.9100 . ?
N4 H4D 0.9100 . ?
N4 H4E 0.9100 . ?

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
O3 Rb O5 108.40(7) . . ?
O3 Rb O1 109.19(7) . . ?
O5 Rb O1 107.84(7) . . ?
O3 Rb O2 55.75(7) . . ?
O5 Rb O2 134.24(7) . . ?
O1 Rb O2 55.14(7) . . ?
O3 Rb O4 54.89(7) . . ?
O5 Rb O4 54.73(7) . . ?
O1 Rb O4 132.75(7) . . ?
O2 Rb O4 102.76(7) . . ?
O3 Rb O6 129.93(7) . . ?
O5 Rb O6 54.49(7) . . ?
O1 Rb O6 53.93(7) . . ?
O2 Rb O6 100.04(7) . . ?
O4 Rb O6 99.36(7) . . ?
O3 Rb N1 67.14(10) . . ?
O5 Rb N1 71.05(9) . . ?
O1 Rb N1 70.52(9) . . ?
O2 Rb N1 63.24(9) . . ?
O4 Rb N1 62.32(9) . . ?
O6 Rb N1 62.78(10) . . ?
O3 Rb Ge2 120.00(5) . . ?
O5 Rb Ge2 106.98(5) . . ?
O1 Rb Ge2 103.85(5) . . ?
O2 Rb Ge2 118.04(5) . . ?
O4 Rb Ge2 122.84(5) . . ?
O6 Rb Ge2 110.06(5) . . ?
N1 Rb Ge2 172.54(9) . . ?
O3 Rb C2 76.63(8) . . ?
O5 Rb C2 142.70(8) . . ?
O1 Rb C2 40.39(8) . . ?
O2 Rb C2 22.75(8) . . ?
O4 Rb C2 125.45(8) . . ?
O6 Rb C2 93.17(8) . . ?
N1 Rb C2 77.85(9) . . ?
Ge2 Rb C2 101.16(6) . . ?
O3 Rb C3 39.94(8) . . ?
O5 Rb C3 141.41(8) . . ?
O1 Rb C3 75.89(8) . . ?
O2 Rb C3 21.96(8) . . ?
O4 Rb C3 93.73(8) . . ?
O6 Rb C3 121.58(8) . . ?
N1 Rb C3 74.60(11) . . ?
Ge2 Rb C3 109.24(7) . . ?
C2 Rb C3 37.75(9) . . ?
O3 Rb C7 74.98(8) . . ?
O5 Rb C7 39.68(8) . . ?
O1 Rb C7 140.65(8) . . ?
O2 Rb C7 124.55(7) . . ?
O4 Rb C7 21.87(7) . . ?
O6 Rb C7 92.45(8) . . ?
N1 Rb C7 76.09(9) . . ?
Ge2 Rb C7 107.20(6) . . ?
C2 Rb C7 147.12(9) . . ?
C3 Rb C7 114.71(9) . . ?
O3 Rb C10 139.19(8) . . ?
O5 Rb C10 39.32(8) . . ?
O1 Rb C10 73.55(8) . . ?
O2 Rb C10 122.00(8) . . ?
O4 Rb C10 92.37(8) . . ?
O6 Rb C10 21.98(7) . . ?
N1 Rb C10 76.48(11) . . ?
Ge2 Rb C10 97.39(6) . . ?
C2 Rb C10 113.81(9) . . ?
C3 Rb C10 143.34(9) . . ?
C7 Rb C10 78.98(9) . . ?
C1 O1 C12 112.5(3) . . ?
C1 O1 Rb 119.2(2) . . ?
C12 O1 Rb 123.4(2) . . ?
C3 O2 C2 112.3(3) . . ?
C3 O2 Rb 103.9(2) . . ?
C2 O2 Rb 101.2(2) . . ?
C5 O3 C4 112.3(3) . . ?
C5 O3 Rb 122.6(2) . . ?
C4 O3 Rb 120.6(2) . . ?
C7 O4 C6 112.1(3) . . ?
C7 O4 Rb 102.4(2) . . ?
C6 O4 Rb 104.1(2) . . ?
C8 O5 C9 112.1(3) . . ?
C8 O5 Rb 121.8(2) . . ?
C9 O5 Rb 122.9(2) . . ?
C11 O6 C10 111.2(3) . . ?
C11 O6 Rb 107.6(2) . . ?
C10 O6 Rb 101.5(2) . . ?
O1 C1 C2 108.7(3) . . ?
O1 C1 H1A 109.9 . . ?
C2 C1 H1A 109.9 . . ?
O1 C1 H1B 109.9 . . ?
C2 C1 H1B 109.9 . . ?
H1A C1 H1B 108.3 . . ?
O2 C2 C1 108.0(3) . . ?
O2 C2 Rb 56.06(17) . . ?
C1 C2 Rb 89.1(2) . . ?
O2 C2 H2A 110.1 . . ?
C1 C2 H2A 110.1 . . ?
Rb C2 H2A 68.4 . . ?
O2 C2 H2B 110.1 . . ?
C1 C2 H2B 110.1 . . ?
Rb C2 H2B 159.9 . . ?
H2A C2 H2B 108.4 . . ?
O2 C3 C4 108.3(3) . . ?
O2 C3 Rb 54.10(17) . . ?
C4 C3 Rb 86.2(2) . . ?
O2 C3 H3A 110.0 . . ?
C4 C3 H3A 110.0 . . ?
Rb C3 H3A 161.3 . . ?
O2 C3 H3B 110.0 . . ?
C4 C3 H3B 110.0 . . ?
Rb C3 H3B 72.9 . . ?
H3A C3 H3B 108.4 . . ?
O3 C4 C3 108.5(3) . . ?
O3 C4 H4A 110.0 . . ?
C3 C4 H4A 110.0 . . ?
O3 C4 H4B 110.0 . . ?
C3 C4 H4B 110.0 . . ?
H4A C4 H4B 108.4 . . ?
O3 C5 C6 108.5(3) . . ?
O3 C5 H5A 110.0 . . ?
C6 C5 H5A 110.0 . . ?
O3 C5 H5B 110.0 . . ?
C6 C5 H5B 110.0 . . ?
H5A C5 H5B 108.4 . . ?
O4 C6 C5 107.6(3) . . ?
O4 C6 Rb 54.38(18) . . ?
C5 C6 Rb 84.7(2) . . ?
O4 C6 H6A 110.2 . . ?
C5 C6 H6A 110.2 . . ?
Rb C6 H6A 73.4 . . ?
O4 C6 H6B 110.2 . . ?
C5 C6 H6B 110.2 . . ?
Rb C6 H6B 162.3 . . ?
H6A C6 H6B 108.5 . . ?
O4 C7 C8 108.2(3) . . ?
O4 C7 Rb 55.77(17) . . ?
C8 C7 Rb 86.4(2) . . ?
O4 C7 H7A 110.1 . . ?
C8 C7 H7A 110.1 . . ?
Rb C7 H7A 161.9 . . ?
O4 C7 H7B 110.1 . . ?
C8 C7 H7B 110.1 . . ?
Rb C7 H7B 70.9 . . ?
H7A C7 H7B 108.4 . . ?
O5 C8 C7 108.8(3) . . ?
O5 C8 H8A 109.9 . . ?
C7 C8 H8A 109.9 . . ?
O5 C8 H8B 109.9 . . ?
C7 C8 H8B 109.9 . . ?
H8A C8 H8B 108.3 . . ?
O5 C9 C10 108.8(3) . . ?
O5 C9 H9A 109.9 . . ?
C10 C9 H9A 109.9 . . ?
O5 C9 H9B 109.9 . . ?
C10 C9 H9B 109.9 . . ?
H9A C9 H9B 108.3 . . ?
O6 C10 C9 108.9(3) . . ?
O6 C10 Rb 56.56(17) . . ?
C9 C10 Rb 86.2(2) . . ?
O6 C10 H10A 109.9 . . ?
C9 C10 H10A 109.9 . . ?
Rb C10 H10A 70.6 . . ?
O6 C10 H10B 109.9 . . ?
C9 C10 H10B 109.9 . . ?
Rb C10 H10B 162.6 . . ?
H10A C10 H10B 108.3 . . ?
O6 C11 C12 108.1(3) . . ?
O6 C11 H11A 110.1 . . ?
C12 C11 H11A 110.1 . . ?
O6 C11 H11B 110.1 . . ?
C12 C11 H11B 110.1 . . ?
H11A C11 H11B 108.4 . . ?
O1 C12 C11 108.7(3) . . ?
O1 C12 H12A 110.0 . . ?
C11 C12 H12A 110.0 . . ?
O1 C12 H12B 110.0 . . ?
C11 C12 H12B 110.0 . . ?
H12A C12 H12B 108.3 . . ?
Rb N1 H1C 109.5 . . ?
Rb N1 H1D 109.5 . . ?
H1C N1 H1D 109.5 . . ?
Rb N1 H1E 109.5 . . ?
H1C N1 H1E 109.5 . . ?
H1D N1 H1E 109.5 . . ?
O7 K O7 180.0 . 5_565 ?
O7 K O8 119.21(7) . 5_565 ?
O7 K O8 60.79(7) 5_565 5_565 ?
O7 K O8 60.80(7) . . ?
O7 K O8 119.21(7) 5_565 . ?
O8 K O8 180.00(7) 5_565 . ?
O7 K O9 119.03(7) . . ?
O7 K O9 60.97(7) 5_565 . ?
O8 K O9 120.06(7) 5_565 . ?
O8 K O9 59.93(7) . . ?
O7 K O9 60.97(7) . 5_565 ?
O7 K O9 119.03(7) 5_565 5_565 ?
O8 K O9 59.94(7) 5_565 5_565 ?
O8 K O9 120.06(7) . 5_565 ?
O9 K O9 180.0 . 5_565 ?
O7 K N2 89.05(8) . 5_565 ?
O7 K N2 90.95(8) 5_565 5_565 ?
O8 K N2 85.72(10) 5_565 5_565 ?
O8 K N2 94.28(10) . 5_565 ?
O9 K N2 108.13(10) . 5_565 ?
O9 K N2 71.87(10) 5_565 5_565 ?
O7 K N2 90.95(8) . . ?
O7 K N2 89.05(8) 5_565 . ?
O8 K N2 94.28(10) 5_565 . ?
O8 K N2 85.72(10) . . ?
O9 K N2 71.87(10) . . ?
O9 K N2 108.13(10) 5_565 . ?
N2 K N2 180.0 5_565 . ?
C13 O7 C18 112.7(3) . 5_565 ?
C13 O7 K 114.5(2) . . ?
C18 O7 K 113.1(2) 5_565 . ?
C15 O8 C14 111.8(3) . . ?
C15 O8 K 115.8(2) . . ?
C14 O8 K 112.6(2) . . ?
C16 O9 C17 112.7(3) . . ?
C16 O9 K 113.2(2) . . ?
C17 O9 K 113.4(2) . . ?
O7 C13 C14 109.7(3) . . ?
O7 C13 H13A 109.7 . . ?
C14 C13 H13A 109.7 . . ?
O7 C13 H13B 109.7 . . ?
C14 C13 H13B 109.7 . . ?
H13A C13 H13B 108.2 . . ?
O8 C14 C13 109.1(3) . . ?
O8 C14 H14A 109.9 . . ?
C13 C14 H14A 109.9 . . ?
O8 C14 H14B 109.9 . . ?
C13 C14 H14B 109.9 . . ?
H14A C14 H14B 108.3 . . ?
O8 C15 C16 108.4(3) . . ?
O8 C15 H15A 110.0 . . ?
C16 C15 H15A 110.0 . . ?
O8 C15 H15B 110.0 . . ?
C16 C15 H15B 110.0 . . ?
H15A C15 H15B 108.4 . . ?
O9 C16 C15 109.1(3) . . ?
O9 C16 H16A 109.9 . . ?
C15 C16 H16A 109.9 . . ?
O9 C16 H16B 109.9 . . ?
C15 C16 H16B 109.9 . . ?
H16A C16 H16B 108.3 . . ?
O9 C17 C18 109.4(3) . . ?
O9 C17 H17A 109.8 . . ?
C18 C17 H17A 109.8 . . ?
O9 C17 H17B 109.8 . . ?
C18 C17 H17B 109.8 . . ?
H17A C17 H17B 108.2 . . ?
O7 C18 C17 109.2(3) 5_565 . ?
O7 C18 H18A 109.9 5_565 . ?
C17 C18 H18A 109.9 . . ?
O7 C18 H18B 109.9 5_565 . ?
C17 C18 H18B 109.9 . . ?
H18A C18 H18B 108.3 . . ?
K N2 H2C 109.5 . . ?
K N2 H2D 109.5 . . ?
H2C N2 H2D 109.5 . . ?
K N2 H2E 109.5 . . ?
H2C N2 H2E 109.5 . . ?
H2D N2 H2E 109.5 . . ?
Ge2 Ge1 Ge2 64.180(17) . 4_655 ?
Ge2 Ge1 Ge1 56.028(14) . 4_655 ?
Ge2 Ge1 Ge1 55.654(14) 4_655 4_655 ?
Ge2 Ge1 K2 119.318(16) . 4_655 ?
Ge2 Ge1 K2 63.394(13) 4_655 4_655 ?
Ge1 Ge1 K2 70.121(16) 4_655 4_655 ?
Ge2 Ge1 Rb 119.318(16) . 4_655 ?
Ge2 Ge1 Rb 63.394(13) 4_655 4_655 ?
Ge1 Ge1 Rb 70.121(16) 4_655 4_655 ?
Ge2 Ge1 Rb 61.636(13) . . ?
Ge2 Ge1 Rb 115.583(16) 4_655 . ?
Ge1 Ge1 Rb 66.280(16) 4_655 . ?
K2 Ge1 Rb 120.6 4_655 . ?
Rb Ge1 Rb 120.612(13) 4_655 . ?
Ge2 Ge1 H1 85.3(13) . . ?
Ge2 Ge1 H1 85.0(13) 4_655 . ?
K2 Ge1 H1 61.96(12) 4_655 . ?
Rb Ge1 H1 61.96(12) 4_655 . ?
Rb Ge1 H1 58.97(5) . . ?
Ge1 Ge2 Ge1 68.318(19) . 4_655 ?
Ge1 Ge2 Zn 105.593(17) . . ?
Ge1 Ge2 Zn 105.265(17) 4_655 . ?
Ge1 Ge2 Ge2 58.112(14) . 4_655 ?
Ge1 Ge2 Ge2 57.707(14) 4_655 4_655 ?
Zn Ge2 Ge2 58.696(10) . 4_655 ?
Ge1 Ge2 Rb 78.659(14) . . ?
Ge1 Ge2 Rb 75.910(14) 4_655 . ?
Zn Ge2 Rb 175.741(16) . . ?
Ge2 Ge2 Rb 124.572(9) 4_655 . ?
C19 Zn C19 118.96(19) 4_655 . ?
C19 Zn Ge2 115.33(10) 4_655 . ?
C19 Zn Ge2 116.10(10) . . ?
C19 Zn Ge2 116.10(10) 4_655 4_655 ?
C19 Zn Ge2 115.33(10) . 4_655 ?
Ge2 Zn Ge2 62.61(2) . 4_655 ?
C20 C19 C24 114.7(3) . . ?
C20 C19 Zn 120.0(3) . . ?
C24 C19 Zn 125.2(3) . . ?
C21 C20 C19 122.8(3) . . ?
C21 C20 H20 118.6 . . ?
C19 C20 H20 118.6 . . ?
C20 C21 C22 120.0(4) . . ?
C20 C21 H21 120.0 . . ?
C22 C21 H21 120.0 . . ?
C23 C22 C21 118.9(4) . . ?
C23 C22 H22 120.5 . . ?
C21 C22 H22 120.5 . . ?
C22 C23 C24 120.3(4) . . ?
C22 C23 H23 119.9 . . ?
C24 C23 H23 119.9 . . ?
C23 C24 C19 123.2(4) . . ?
C23 C24 H24 118.4 . . ?
C19 C24 H24 118.4 . . ?
H3C N3 H3D 109.5 . . ?
H3C N3 H3E 109.5 . . ?
H3D N3 H3E 109.5 . . ?
H4C N4 H4D 109.5 . . ?
H4C N4 H4E 109.5 . . ?
H4D N4 H4E 109.5 . . ?

_refine_diff_density_max         0.688
_refine_diff_density_min         -0.540
_refine_diff_density_rms         0.090


#============================================================================== 
# END of CIF  
#============================================================================== 
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: Ammonia'
_chemical_properties_physical    Air-sensitive,Moisture-sensitive
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_TH205_yellow
_database_code_depnum_ccdc_archive 'CCDC 1859588'
_audit_update_record             
;
2018-08-01 deposited with the CCDC.
2018-10-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_formula_moiety         
'Ge9, C12 H24 K0.28 O6 Rb0.72, 3(K0.18 Rb2.82), 3(H3 N), 3(H1.50 N0.50)'
_chemical_formula_sum            'C12 H37.50 Ge9 K0.45 N4.50 O6 Rb3.55'
_chemical_formula_weight         1315.11

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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rb Rb -0.9393 2.9676 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_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.
;

loop_
_space_group_symop_operation_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'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   38.5713(8)
_cell_length_b                   9.9970(2)
_cell_length_c                   19.0042(4)
_cell_angle_alpha                90
_cell_angle_beta                 94.337(2)
_cell_angle_gamma                90
_cell_volume                     7307.0(3)
_cell_formula_units_Z            8
_cell_measurement_temperature    120(2)
_cell_measurement_reflns_used    21797
_cell_measurement_theta_min      2.6449
_cell_measurement_theta_max      30.5078

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.391
_exptl_crystal_F_000             4935
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.05
_exptl_absorpt_coefficient_mu    12.071
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.36029
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
;
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm. 
;

_diffrn_ambient_temperature      120(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Oxford Xcalibur 3'
_diffrn_measurement_method       'ω and π scans'
_diffrn_detector_area_resol_mean 16.0238
_diffrn_reflns_number            62423
_diffrn_reflns_av_unetI/netI     0.0516
_diffrn_reflns_av_R_equivalents  0.0563
_diffrn_reflns_limit_h_min       -47
_diffrn_reflns_limit_h_max       47
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         2.752
_diffrn_reflns_theta_max         26.000
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             7181
_reflns_number_gt                5219
_reflns_threshold_expression     'I > 2σ(I)'

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
;

_computing_data_collection       
; 
 CrysAlis CCD, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_cell_refinement       
; 
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_data_reduction        
; 
 CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.33.34d 
;
_computing_structure_solution    SHELXS-97
_computing_structure_refinement  SHELXL-2014/7
_computing_molecular_graphics    DIAMOND

_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0228P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7181
_refine_ls_number_parameters     342
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0440
_refine_ls_R_factor_gt           0.0271
_refine_ls_wR_factor_ref         0.0500
_refine_ls_wR_factor_gt          0.0480
_refine_ls_goodness_of_fit_ref   0.924
_refine_ls_restrained_S_all      0.924
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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 0.15006(2) 0.10739(4) 0.39931(3) 0.02478(12) Uani 1 1 d . . . . .
Ge2 Ge 0.14163(2) 0.31360(4) 0.48075(2) 0.01982(11) Uani 1 1 d . . . . .
Ge3 Ge 0.12325(2) 0.15025(4) 0.57507(2) 0.02327(12) Uani 1 1 d . . . . .
Ge4 Ge 0.12948(2) -0.05282(4) 0.49427(3) 0.02472(12) Uani 1 1 d . . . . .
Ge5 Ge 0.08940(2) -0.00295(4) 0.38068(2) 0.02091(11) Uani 1 1 d . . . . .
Ge6 Ge 0.09929(2) 0.27284(4) 0.37093(2) 0.02001(11) Uani 1 1 d . . . . .
Ge7 Ge 0.07713(2) 0.30471(4) 0.51099(2) 0.02259(12) Uani 1 1 d . . . . .
Ge8 Ge 0.06843(2) 0.02795(4) 0.51908(3) 0.02506(12) Uani 1 1 d . . . . .
Ge9 Ge 0.04332(2) 0.17024(4) 0.41284(3) 0.02386(12) Uani 1 1 d . . . . .
Rb1 Rb 0.19034(2) 0.38448(5) 0.32892(2) 0.01951(19) Uani 0.722(3) 1 d . . P . .
K1 K 0.19034(2) 0.38448(5) 0.32892(2) 0.01951(19) Uani 0.278(3) 1 d . . P . .
O1 O 0.17453(7) 0.2803(3) 0.18312(14) 0.0239(7) Uani 1 1 d . . . . .
O2 O 0.23690(7) 0.1969(3) 0.26183(14) 0.0245(7) Uani 1 1 d . . . . .
O3 O 0.25423(6) 0.2987(3) 0.39968(14) 0.0217(7) Uani 1 1 d . . . . .
O4 O 0.23391(7) 0.5634(3) 0.42971(15) 0.0234(7) Uani 1 1 d . . . . .
O5 O 0.17127(7) 0.6614(3) 0.35215(15) 0.0241(7) Uani 1 1 d . . . . .
O6 O 0.15659(7) 0.5461(3) 0.21610(15) 0.0244(7) Uani 1 1 d . . . . .
C1 C 0.19998(11) 0.1950(5) 0.1561(2) 0.0325(12) Uani 1 1 d . . . . .
H1A H 0.2179 0.2494 0.1347 0.039 Uiso 1 1 calc R U . . .
H1B H 0.1889 0.1360 0.1191 0.039 Uiso 1 1 calc R U . . .
C2 C 0.21635(11) 0.1130(4) 0.2146(2) 0.0310(11) Uani 1 1 d . . . . .
H2A H 0.1981 0.0684 0.2401 0.037 Uiso 1 1 calc R U . . .
H2B H 0.2312 0.0431 0.1954 0.037 Uiso 1 1 calc R U . . .
C3 C 0.25557(11) 0.1238(4) 0.3162(2) 0.0283(11) Uani 1 1 d . . . . .
H3A H 0.2708 0.0572 0.2953 0.034 Uiso 1 1 calc R U . . .
H3B H 0.2391 0.0754 0.3446 0.034 Uiso 1 1 calc R U . . .
C4 C 0.27715(10) 0.2177(4) 0.3625(2) 0.0239(10) Uani 1 1 d . . . . .
H4A H 0.2928 0.1667 0.3963 0.029 Uiso 1 1 calc R U . . .
H4B H 0.2915 0.2746 0.3336 0.029 Uiso 1 1 calc R U . . .
C5 C 0.27260(10) 0.3814(4) 0.4512(2) 0.0236(10) Uani 1 1 d . . . . .
H5A H 0.2906 0.4335 0.4289 0.028 Uiso 1 1 calc R U . . .
H5B H 0.2842 0.3250 0.4888 0.028 Uiso 1 1 calc R U . . .
C6 C 0.24751(11) 0.4741(4) 0.4822(2) 0.0246(10) Uani 1 1 d . . . . .
H6A H 0.2284 0.4221 0.5009 0.030 Uiso 1 1 calc R U . . .
H6B H 0.2595 0.5248 0.5217 0.030 Uiso 1 1 calc R U . . .
C7 C 0.20985(10) 0.6552(4) 0.4554(2) 0.0264(11) Uani 1 1 d . . . . .
H7A H 0.2216 0.7121 0.4926 0.032 Uiso 1 1 calc R U . . .
H7B H 0.1908 0.6061 0.4762 0.032 Uiso 1 1 calc R U . . .
C8 C 0.19524(11) 0.7409(4) 0.3953(2) 0.0294(11) Uani 1 1 d . . . . .
H8A H 0.1832 0.8196 0.4136 0.035 Uiso 1 1 calc R U . . .
H8B H 0.2142 0.7730 0.3672 0.035 Uiso 1 1 calc R U . . .
C9 C 0.15782(12) 0.7338(4) 0.2921(2) 0.0340(12) Uani 1 1 d . . . . .
H9A H 0.1772 0.7680 0.2658 0.041 Uiso 1 1 calc R U . . .
H9B H 0.1441 0.8111 0.3071 0.041 Uiso 1 1 calc R U . . .
C10 C 0.13527(12) 0.6441(4) 0.2459(2) 0.0357(12) Uani 1 1 d . . . . .
H10A H 0.1179 0.5999 0.2738 0.043 Uiso 1 1 calc R U . . .
H10B H 0.1227 0.6968 0.2079 0.043 Uiso 1 1 calc R U . . .
C11 C 0.13725(11) 0.4674(4) 0.1637(2) 0.0306(11) Uani 1 1 d . . . . .
H11A H 0.1260 0.5265 0.1269 0.037 Uiso 1 1 calc R U . . .
H11B H 0.1189 0.4167 0.1857 0.037 Uiso 1 1 calc R U . . .
C12 C 0.16122(11) 0.3738(4) 0.1317(2) 0.0276(11) Uani 1 1 d . . . . .
H12A H 0.1487 0.3258 0.0919 0.033 Uiso 1 1 calc R U . . .
H12B H 0.1806 0.4243 0.1131 0.033 Uiso 1 1 calc R U . . .
Rb2 Rb 0.10780(2) 0.10256(5) 0.19860(3) 0.0410(2) Uani 0.990(3) 1 d . . P . .
K2 K 0.10780(2) 0.10256(5) 0.19860(3) 0.0410(2) Uani 0.010(3) 1 d . . P . .
N1 N 0.04574(11) 0.2796(6) 0.1987(2) 0.0864(19) Uani 1 1 d . . . . .
H1C H 0.0388 0.2858 0.2433 0.130 Uiso 1 1 calc R U . . .
H1D H 0.0282 0.2446 0.1697 0.130 Uiso 1 1 calc R U . . .
H1E H 0.0512 0.3624 0.1831 0.130 Uiso 1 1 calc R U . . .
Rb3 Rb 0.09965(2) 0.62998(4) 0.42527(2) 0.02669(18) Uani 0.951(3) 1 d . . P . .
K3 K 0.09965(2) 0.62998(4) 0.42527(2) 0.02669(18) Uani 0.049(3) 1 d . . P . .
Rb4 Rb -0.00470(2) 0.16274(5) 0.58979(3) 0.0327(2) Uani 0.883(3) 1 d . . P . .
K4 K -0.00470(2) 0.16274(5) 0.58979(3) 0.0327(2) Uani 0.117(3) 1 d . . P . .
N2 N 0.03555(11) 0.6466(4) 0.5230(2) 0.0473(12) Uani 1 1 d . . . . .
H2C H 0.0474 0.6839 0.5614 0.071 Uiso 1 1 d R U . . .
H2D H 0.0427 0.5606 0.5180 0.071 Uiso 1 1 d R U . . .
H2E H 0.0124 0.6478 0.5290 0.071 Uiso 1 1 d R U . . .
N3 N 0.02815(10) 0.5509(4) 0.3522(2) 0.0490(12) Uani 1 1 d . . . . .
H3C H 0.0287 0.4702 0.3744 0.073 Uiso 1 1 d R U . . .
H3D H 0.0391 0.5442 0.3116 0.073 Uiso 1 1 d R U . . .
H3E H 0.0057 0.5761 0.3419 0.073 Uiso 1 1 d R U . . .
N4A N 0.0467(2) 0.2217(11) 0.7147(6) 0.053(3) Uani 0.5 1 d . . P . .
H4AA H 0.0682 0.1931 0.7050 0.079 Uiso 0.5 1 calc R U P . .
H4AB H 0.0400 0.1782 0.7535 0.079 Uiso 0.5 1 calc R U P . .
H4AC H 0.0473 0.3113 0.7230 0.079 Uiso 0.5 1 calc R U P . .
N4B N 0.0450(3) 0.3188(13) 0.6978(7) 0.080(4) Uani 0.5 1 d . . P . .
H4BA H 0.0393 0.3005 0.7424 0.119 Uiso 0.5 1 calc R U P . .
H4BB H 0.0429 0.4082 0.6895 0.119 Uiso 0.5 1 calc R U P . .
H4BC H 0.0674 0.2932 0.6930 0.119 Uiso 0.5 1 calc R U P . .
N5 N 0.0167(2) 0.0073(10) 0.7289(5) 0.079(3) Uani 0.5 1 d . . P . .
H5C H 0.0192 -0.0810 0.7190 0.118 Uiso 0.5 1 calc R U P . .
H5D H 0.0000 0.0176 0.7597 0.118 Uiso 0.5 1 calc R U P . .
H5E H 0.0372 0.0402 0.7485 0.118 Uiso 0.5 1 calc R U P . .


_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 Ge4 2.5825(7) . ?
Ge1 Ge5 2.5869(6) . ?
Ge1 Ge6 2.5888(6) . ?
Ge1 Ge2 2.6129(6) . ?
Ge1 Rb1 3.4915(6) . ?
Ge1 Ge3 3.5962(7) . ?
Ge1 Rb2 4.0334(7) . ?
Ge2 Ge3 2.5640(6) . ?
Ge2 Ge6 2.5833(6) . ?
Ge2 Ge7 2.5968(6) . ?
Ge2 Rb1 3.6302(6) . ?
Ge2 Rb3 3.6713(6) . ?
Ge2 Ge4 3.7043(6) . ?
Ge3 Ge4 2.5676(6) . ?
Ge3 Ge7 2.5891(6) . ?
Ge3 Ge8 2.5993(6) . ?
Ge3 K2 3.5308(6) 6_556 ?
Ge3 Rb2 3.5308(6) 6_556 ?
Ge4 Ge8 2.5665(6) . ?
Ge4 Ge5 2.6066(6) . ?
Ge4 K3 3.5876(6) 1_545 ?
Ge4 Rb3 3.5876(6) 1_545 ?
Ge5 Ge9 2.5872(6) . ?
Ge5 Ge6 2.7915(6) . ?
Ge5 Ge8 2.8263(7) . ?
Ge5 K4 3.7171(6) 5_556 ?
Ge5 Rb4 3.7171(6) 5_556 ?
Ge5 Rb2 3.7365(7) . ?
Ge5 Rb3 3.7802(6) 1_545 ?
Ge5 K3 3.7802(6) 1_545 ?
Ge6 Ge9 2.5705(6) . ?
Ge6 Ge7 2.8742(6) . ?
Ge6 Rb3 3.7163(6) . ?
Ge6 Rb2 3.7274(6) . ?
Ge6 Rb1 3.8262(6) . ?
Ge7 Ge9 2.5728(6) . ?
Ge7 Ge8 2.7926(6) . ?
Ge7 Rb3 3.7678(6) . ?
Ge7 Rb4 3.8644(6) . ?
Ge8 Ge9 2.5966(6) . ?
Ge8 Rb4 3.4859(7) . ?
Ge8 K4 3.6317(7) 5_556 ?
Ge8 Rb4 3.6317(7) 5_556 ?
Ge8 Rb2 3.8553(7) 6_556 ?
Ge8 K2 3.8553(7) 6_556 ?
Ge9 K4 3.6457(6) 5_556 ?
Ge9 Rb4 3.6457(6) 5_556 ?
Ge9 Rb4 3.9606(7) . ?
Rb1 O3 2.849(3) . ?
Rb1 O5 2.907(3) . ?
Rb1 O6 2.912(3) . ?
Rb1 O2 2.952(3) . ?
Rb1 O1 2.980(3) . ?
Rb1 O4 3.034(3) . ?
Rb1 C6 3.630(4) . ?
Rb1 C10 3.637(4) . ?
Rb1 C3 3.643(4) . ?
Rb1 C7 3.660(4) . ?
O1 C12 1.420(5) . ?
O1 C1 1.426(5) . ?
O1 Rb2 3.160(3) . ?
O2 C3 1.417(5) . ?
O2 C2 1.424(5) . ?
O3 C4 1.425(4) . ?
O3 C5 1.427(5) . ?
O4 C6 1.410(5) . ?
O4 C7 1.418(4) . ?
O5 C9 1.416(5) . ?
O5 C8 1.430(5) . ?
O5 Rb3 3.200(3) . ?
O6 C10 1.423(5) . ?
O6 C11 1.433(5) . ?
C1 C2 1.484(6) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 C4 1.496(6) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C5 C6 1.493(5) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 C8 1.504(6) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 C10 1.489(6) . ?
C9 Rb3 3.656(5) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.479(6) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 Rb2 3.690(4) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
Rb2 N1 2.977(4) . ?
Rb2 Ge3 3.5307(6) 6 ?
Rb2 Ge8 3.8554(7) 6 ?
Rb2 Ge4 4.0640(7) 6 ?
N1 H1C 0.9100 . ?
N1 H1D 0.9100 . ?
N1 H1E 0.9100 . ?
Rb3 N3 3.095(4) . ?
Rb3 N2 3.208(4) . ?
Rb3 Ge4 3.5875(6) 1_565 ?
Rb3 Ge5 3.7803(6) 1_565 ?
Rb3 H2D 3.0002 . ?
Rb3 H3C 3.2527 . ?
Rb3 H3D 3.1773 . ?
Rb4 N4A 3.033(10) . ?
Rb4 N2 3.043(4) 5_566 ?
Rb4 N4B 3.119(12) . ?
Rb4 N5 3.123(10) . ?
Rb4 N3 3.222(4) 5_566 ?
Rb4 Ge8 3.6317(7) 5_556 ?
Rb4 Ge9 3.6457(6) 5_556 ?
Rb4 Ge5 3.7171(6) 5_556 ?
N2 K4 3.043(4) 5_566 ?
N2 Rb4 3.043(4) 5_566 ?
N2 H2C 0.9100 . ?
N2 H2D 0.9100 . ?
N2 H2E 0.9100 . ?
N3 K4 3.222(4) 5_566 ?
N3 Rb4 3.222(4) 5_566 ?
N3 H3C 0.9100 . ?
N3 H3D 0.9100 . ?
N3 H3E 0.9100 . ?
N4A H4AA 0.9100 . ?
N4A H4AB 0.9100 . ?
N4A H4AC 0.9100 . ?
N4B H4BA 0.9100 . ?
N4B H4BB 0.9100 . ?
N4B H4BC 0.9100 . ?
N5 H5C 0.9100 . ?
N5 H5D 0.9100 . ?
N5 H5E 0.9100 . ?

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
Ge4 Ge1 Ge5 60.561(17) . . ?
Ge4 Ge1 Ge6 105.91(2) . . ?
Ge5 Ge1 Ge6 65.278(17) . . ?
Ge4 Ge1 Ge2 90.96(2) . . ?
Ge5 Ge1 Ge2 105.40(2) . . ?
Ge6 Ge1 Ge2 59.551(16) . . ?
Ge4 Ge1 Rb1 158.28(2) . . ?
Ge5 Ge1 Rb1 135.23(2) . . ?
Ge6 Ge1 Rb1 76.395(16) . . ?
Ge2 Ge1 Rb1 71.333(16) . . ?
Ge4 Ge1 Ge3 45.541(14) . . ?
Ge5 Ge1 Ge3 81.788(17) . . ?
Ge6 Ge1 Ge3 81.441(17) . . ?
Ge2 Ge1 Ge3 45.442(14) . . ?
Rb1 Ge1 Ge3 115.396(16) . . ?
Ge4 Ge1 Rb2 121.996(19) . . ?
Ge5 Ge1 Rb2 64.456(16) . . ?
Ge6 Ge1 Rb2 64.239(16) . . ?
Ge2 Ge1 Rb2 120.672(19) . . ?
Rb1 Ge1 Rb2 78.867(14) . . ?
Ge3 Ge1 Rb2 139.087(16) . . ?
Ge3 Ge2 Ge6 105.84(2) . . ?
Ge3 Ge2 Ge7 60.218(17) . . ?
Ge6 Ge2 Ge7 67.400(17) . . ?
Ge3 Ge2 Ge1 87.99(2) . . ?
Ge6 Ge2 Ge1 59.759(17) . . ?
Ge7 Ge2 Ge1 105.56(2) . . ?
Ge3 Ge2 Rb1 150.12(2) . . ?
Ge6 Ge2 Rb1 73.868(16) . . ?
Ge7 Ge2 Rb1 138.13(2) . . ?
Ge1 Ge2 Rb1 65.673(16) . . ?
Ge3 Ge2 Rb3 127.602(19) . . ?
Ge6 Ge2 Rb3 70.470(15) . . ?
Ge7 Ge2 Rb3 71.577(15) . . ?
Ge1 Ge2 Rb3 125.55(2) . . ?
Rb1 Ge2 Rb3 81.202(13) . . ?
Ge6 Ge2 Ge4 79.893(16) . . ?
Ge7 Ge2 Ge4 79.775(16) . . ?
Rb1 Ge2 Ge4 108.901(15) . . ?
Rb3 Ge2 Ge4 144.733(16) . . ?
Ge2 Ge3 Ge4 92.42(2) . . ?
Ge2 Ge3 Ge7 60.520(17) . . ?
Ge4 Ge3 Ge7 106.40(2) . . ?
Ge2 Ge3 Ge8 105.83(2) . . ?
Ge4 Ge3 Ge8 59.561(17) . . ?
Ge7 Ge3 Ge8 65.128(18) . . ?
Ge2 Ge3 K2 171.98(2) . 6_556 ?
Ge4 Ge3 K2 81.940(17) . 6_556 ?
Ge7 Ge3 K2 126.52(2) . 6_556 ?
Ge8 Ge3 K2 76.262(17) . 6_556 ?
Ge2 Ge3 Rb2 171.98(2) . 6_556 ?
Ge4 Ge3 Rb2 81.940(17) . 6_556 ?
Ge7 Ge3 Rb2 126.52(2) . 6_556 ?
Ge8 Ge3 Rb2 76.262(17) . 6_556 ?
Ge2 Ge3 Ge1 46.564(14) . . ?
Ge4 Ge3 Ge1 45.880(15) . . ?
Ge7 Ge3 Ge1 82.521(17) . . ?
Ge8 Ge3 Ge1 81.136(17) . . ?
K2 Ge3 Ge1 127.384(17) 6_556 . ?
Rb2 Ge3 Ge1 127.384(17) 6_556 . ?
Ge8 Ge4 Ge3 60.834(17) . . ?
Ge8 Ge4 Ge1 105.55(2) . . ?
Ge3 Ge4 Ge1 88.58(2) . . ?
Ge8 Ge4 Ge5 66.229(18) . . ?
Ge3 Ge4 Ge5 105.51(2) . . ?
Ge1 Ge4 Ge5 59.803(17) . . ?
Ge8 Ge4 K3 94.125(18) . 1_545 ?
Ge3 Ge4 K3 151.11(2) . 1_545 ?
Ge1 Ge4 K3 113.56(2) . 1_545 ?
Ge5 Ge4 K3 73.297(16) . 1_545 ?
Ge8 Ge4 Rb3 94.125(18) . 1_545 ?
Ge3 Ge4 Rb3 151.11(2) . 1_545 ?
Ge1 Ge4 Rb3 113.56(2) . 1_545 ?
Ge5 Ge4 Rb3 73.297(16) . 1_545 ?
Ge8 Ge4 Ge2 79.877(16) . . ?
Ge5 Ge4 Ge2 79.842(16) . . ?
K3 Ge4 Ge2 152.554(18) 1_545 . ?
Rb3 Ge4 Ge2 152.554(18) 1_545 . ?
Ge8 Ge4 K2 66.735(17) . 6_556 ?
Ge3 Ge4 K2 59.338(15) . 6_556 ?
Ge1 Ge4 K2 147.14(2) . 6_556 ?
Ge5 Ge4 K2 131.501(19) . 6_556 ?
K3 Ge4 K2 99.070(15) 1_545 6_556 ?
Rb3 Ge4 K2 99.070(15) 1_545 6_556 ?
Ge2 Ge4 K2 102.916(14) . 6_556 ?
Ge8 Ge4 Rb2 66.735(17) . 6_556 ?
Ge3 Ge4 Rb2 59.338(15) . 6_556 ?
Ge1 Ge4 Rb2 147.14(2) . 6_556 ?
Ge5 Ge4 Rb2 131.501(19) . 6_556 ?
K3 Ge4 Rb2 99.070(15) 1_545 6_556 ?
Rb3 Ge4 Rb2 99.070(15) 1_545 6_556 ?
Ge2 Ge4 Rb2 102.916(14) . 6_556 ?
Ge1 Ge5 Ge9 108.23(2) . . ?
Ge1 Ge5 Ge4 59.636(18) . . ?
Ge9 Ge5 Ge4 107.91(2) . . ?
Ge1 Ge5 Ge6 57.394(16) . . ?
Ge9 Ge5 Ge6 56.945(16) . . ?
Ge4 Ge5 Ge6 99.69(2) . . ?
Ge1 Ge5 Ge8 98.37(2) . . ?
Ge9 Ge5 Ge8 57.119(16) . . ?
Ge4 Ge5 Ge8 56.204(17) . . ?
Ge6 Ge5 Ge8 90.230(18) . . ?
Ge1 Ge5 K4 163.50(2) . 5_556 ?
Ge9 Ge5 K4 67.955(15) . 5_556 ?
Ge4 Ge5 K4 105.417(19) . 5_556 ?
Ge6 Ge5 K4 124.100(18) . 5_556 ?
Ge8 Ge5 K4 65.792(15) . 5_556 ?
Ge1 Ge5 Rb4 163.50(2) . 5_556 ?
Ge9 Ge5 Rb4 67.955(15) . 5_556 ?
Ge4 Ge5 Rb4 105.417(19) . 5_556 ?
Ge6 Ge5 Rb4 124.100(18) . 5_556 ?
Ge8 Ge5 Rb4 65.792(15) . 5_556 ?
Ge1 Ge5 Rb2 76.887(18) . . ?
Ge9 Ge5 Rb2 102.228(19) . . ?
Ge4 Ge5 Rb2 132.74(2) . . ?
Ge6 Ge5 Rb2 67.864(15) . . ?
Ge8 Ge5 Rb2 156.732(19) . . ?
K4 Ge5 Rb2 119.457(17) 5_556 . ?
Rb4 Ge5 Rb2 119.457(17) 5_556 . ?
Ge1 Ge5 Rb3 107.758(18) . 1_545 ?
Ge9 Ge5 Rb3 131.209(19) . 1_545 ?
Ge4 Ge5 Rb3 65.370(15) . 1_545 ?
Ge6 Ge5 Rb3 163.979(19) . 1_545 ?
Ge8 Ge5 Rb3 85.987(16) . 1_545 ?
K4 Ge5 Rb3 68.115(12) 5_556 1_545 ?
Rb4 Ge5 Rb3 68.115(12) 5_556 1_545 ?
Rb2 Ge5 Rb3 117.232(15) . 1_545 ?
Ge1 Ge5 K3 107.758(18) . 1_545 ?
Ge9 Ge5 K3 131.209(19) . 1_545 ?
Ge4 Ge5 K3 65.370(15) . 1_545 ?
Ge6 Ge5 K3 163.979(19) . 1_545 ?
Ge8 Ge5 K3 85.987(16) . 1_545 ?
K4 Ge5 K3 68.115(12) 5_556 1_545 ?
Rb4 Ge5 K3 68.115(12) 5_556 1_545 ?
Rb2 Ge5 K3 117.232(15) . 1_545 ?
Ge9 Ge6 Ge2 107.88(2) . . ?
Ge9 Ge6 Ge1 108.68(2) . . ?
Ge2 Ge6 Ge1 60.690(17) . . ?
Ge9 Ge6 Ge5 57.523(16) . . ?
Ge2 Ge6 Ge5 100.57(2) . . ?
Ge1 Ge6 Ge5 57.328(16) . . ?
Ge9 Ge6 Ge7 56.064(16) . . ?
Ge2 Ge6 Ge7 56.525(16) . . ?
Ge1 Ge6 Ge7 98.70(2) . . ?
Ge5 Ge6 Ge7 89.785(18) . . ?
Ge9 Ge6 Rb3 106.432(18) . . ?
Ge2 Ge6 Rb3 68.601(15) . . ?
Ge1 Ge6 Rb3 124.685(19) . . ?
Ge5 Ge6 Rb3 158.14(2) . . ?
Ge7 Ge6 Rb3 68.367(14) . . ?
Ge9 Ge6 Rb2 102.813(19) . . ?
Ge2 Ge6 Rb2 133.601(19) . . ?
Ge1 Ge6 Rb2 77.042(17) . . ?
Ge5 Ge6 Rb2 68.212(15) . . ?
Ge7 Ge6 Rb2 156.404(19) . . ?
Rb3 Ge6 Rb2 133.168(16) . . ?
Ge9 Ge6 Rb1 170.64(2) . . ?
Ge2 Ge6 Rb1 65.699(15) . . ?
Ge1 Ge6 Rb1 62.487(15) . . ?
Ge5 Ge6 Rb1 115.734(17) . . ?
Ge7 Ge6 Rb1 120.189(18) . . ?
Rb3 Ge6 Rb1 78.086(13) . . ?
Rb2 Ge6 Rb1 78.855(14) . . ?
Ge9 Ge7 Ge3 108.78(2) . . ?
Ge9 Ge7 Ge2 107.40(2) . . ?
Ge3 Ge7 Ge2 59.262(17) . . ?
Ge9 Ge7 Ge8 57.712(17) . . ?
Ge3 Ge7 Ge8 57.613(16) . . ?
Ge2 Ge7 Ge8 99.623(19) . . ?
Ge9 Ge7 Ge6 55.988(16) . . ?
Ge3 Ge7 Ge6 97.331(19) . . ?
Ge2 Ge7 Ge6 56.075(16) . . ?
Ge8 Ge7 Ge6 89.229(18) . . ?
Ge9 Ge7 Rb3 104.968(19) . . ?
Ge3 Ge7 Rb3 123.051(19) . . ?
Ge2 Ge7 Rb3 67.587(15) . . ?
Ge8 Ge7 Rb3 155.70(2) . . ?
Ge6 Ge7 Rb3 66.472(14) . . ?
Ge9 Ge7 Rb4 72.842(16) . . ?
Ge3 Ge7 Rb4 98.679(18) . . ?
Ge2 Ge7 Rb4 157.30(2) . . ?
Ge8 Ge7 Rb4 60.645(14) . . ?
Ge6 Ge7 Rb4 128.829(18) . . ?
Rb3 Ge7 Rb4 134.935(15) . . ?
Ge4 Ge8 Ge9 108.85(2) . . ?
Ge4 Ge8 Ge3 59.605(17) . . ?
Ge9 Ge8 Ge3 107.74(2) . . ?
Ge4 Ge8 Ge7 100.714(19) . . ?
Ge9 Ge8 Ge7 56.892(16) . . ?
Ge3 Ge8 Ge7 57.259(16) . . ?
Ge4 Ge8 Ge5 57.567(17) . . ?
Ge9 Ge8 Ge5 56.802(17) . . ?
Ge3 Ge8 Ge5 98.700(19) . . ?
Ge7 Ge8 Ge5 90.748(19) . . ?
Ge4 Ge8 Rb4 166.61(2) . . ?
Ge9 Ge8 Rb4 79.795(17) . . ?
Ge3 Ge8 Rb4 108.49(2) . . ?
Ge7 Ge8 Rb4 75.068(16) . . ?
Ge5 Ge8 Rb4 134.25(2) . . ?
Ge4 Ge8 K4 108.73(2) . 5_556 ?
Ge9 Ge8 K4 69.386(16) . 5_556 ?
Ge3 Ge8 K4 167.08(2) . 5_556 ?
Ge7 Ge8 K4 124.587(19) . 5_556 ?
Ge5 Ge8 K4 68.989(15) . 5_556 ?
Rb4 Ge8 K4 83.7 . 5_556 ?
Ge4 Ge8 Rb4 108.73(2) . 5_556 ?
Ge9 Ge8 Rb4 69.386(16) . 5_556 ?
Ge3 Ge8 Rb4 167.08(2) . 5_556 ?
Ge7 Ge8 Rb4 124.587(19) . 5_556 ?
Ge5 Ge8 Rb4 68.989(15) . 5_556 ?
Rb4 Ge8 Rb4 83.680(15) . 5_556 ?
Ge4 Ge8 Rb2 75.563(17) . 6_556 ?
Ge9 Ge8 Rb2 166.48(2) . 6_556 ?
Ge3 Ge8 Rb2 62.824(16) . 6_556 ?
Ge7 Ge8 Rb2 110.066(19) . 6_556 ?
Ge5 Ge8 Rb2 131.703(19) . 6_556 ?
Rb4 Ge8 Rb2 93.764(16) . 6_556 ?
K4 Ge8 Rb2 122.059(16) 5_556 6_556 ?
Rb4 Ge8 Rb2 122.059(16) 5_556 6_556 ?
Ge4 Ge8 K2 75.563(17) . 6_556 ?
Ge9 Ge8 K2 166.48(2) . 6_556 ?
Ge3 Ge8 K2 62.824(16) . 6_556 ?
Ge7 Ge8 K2 110.066(19) . 6_556 ?
Ge5 Ge8 K2 131.703(19) . 6_556 ?
Rb4 Ge8 K2 93.764(16) . 6_556 ?
K4 Ge8 K2 122.059(16) 5_556 6_556 ?
Rb4 Ge8 K2 122.059(16) 5_556 6_556 ?
Ge6 Ge9 Ge7 67.948(18) . . ?
Ge6 Ge9 Ge5 65.532(17) . . ?
Ge7 Ge9 Ge5 101.61(2) . . ?
Ge6 Ge9 Ge8 100.77(2) . . ?
Ge7 Ge9 Ge8 65.396(18) . . ?
Ge5 Ge9 Ge8 66.079(18) . . ?
Ge6 Ge9 K4 135.40(2) . 5_556 ?
Ge7 Ge9 K4 132.16(2) . 5_556 ?
Ge5 Ge9 K4 70.915(15) . 5_556 ?
Ge8 Ge9 K4 68.807(16) . 5_556 ?
Ge6 Ge9 Rb4 135.40(2) . 5_556 ?
Ge7 Ge9 Rb4 132.16(2) . 5_556 ?
Ge5 Ge9 Rb4 70.915(15) . 5_556 ?
Ge8 Ge9 Rb4 68.807(16) . 5_556 ?
Ge6 Ge9 Rb4 136.739(19) . . ?
Ge7 Ge9 Rb4 68.793(16) . . ?
Ge5 Ge9 Rb4 124.163(19) . . ?
Ge8 Ge9 Rb4 60.022(15) . . ?
K4 Ge9 Rb4 77.1 5_556 . ?
Rb4 Ge9 Rb4 77.146(15) 5_556 . ?
O3 Rb1 O5 115.77(8) . . ?
O3 Rb1 O6 146.84(8) . . ?
O5 Rb1 O6 58.61(8) . . ?
O3 Rb1 O2 58.66(7) . . ?
O5 Rb1 O2 147.13(8) . . ?
O6 Rb1 O2 106.70(8) . . ?
O3 Rb1 O1 116.28(8) . . ?
O5 Rb1 O1 115.95(8) . . ?
O6 Rb1 O1 57.36(7) . . ?
O2 Rb1 O1 57.64(7) . . ?
O3 Rb1 O4 57.40(7) . . ?
O5 Rb1 O4 58.47(7) . . ?
O6 Rb1 O4 109.45(8) . . ?
O2 Rb1 O4 108.74(7) . . ?
O1 Rb1 O4 149.06(7) . . ?
O3 Rb1 Ge1 88.54(5) . . ?
O5 Rb1 Ge1 124.91(6) . . ?
O6 Rb1 Ge1 122.36(6) . . ?
O2 Rb1 Ge1 87.95(6) . . ?
O1 Rb1 Ge1 90.76(5) . . ?
O4 Rb1 Ge1 117.85(5) . . ?
O3 Rb1 C6 40.90(8) . . ?
O5 Rb1 C6 77.79(8) . . ?
O6 Rb1 C6 131.64(8) . . ?
O2 Rb1 C6 98.67(8) . . ?
O1 Rb1 C6 154.37(8) . . ?
O4 Rb1 C6 22.20(7) . . ?
Ge1 Rb1 C6 98.58(6) . . ?
O3 Rb1 Ge2 92.71(6) . . ?
O5 Rb1 Ge2 85.01(6) . . ?
O6 Rb1 Ge2 117.65(6) . . ?
O2 Rb1 Ge2 125.99(6) . . ?
O1 Rb1 Ge2 126.09(5) . . ?
O4 Rb1 Ge2 84.75(5) . . ?
Ge1 Rb1 Ge2 42.994(12) . . ?
C6 Rb1 Ge2 74.33(7) . . ?
O3 Rb1 C10 151.10(9) . . ?
O5 Rb1 C10 40.55(9) . . ?
O6 Rb1 C10 21.69(9) . . ?
O2 Rb1 C10 128.34(9) . . ?
O1 Rb1 C10 76.95(9) . . ?
O4 Rb1 C10 97.51(9) . . ?
Ge1 Rb1 C10 118.04(8) . . ?
C6 Rb1 C10 118.13(10) . . ?
Ge2 Rb1 C10 99.42(7) . . ?
O3 Rb1 C3 40.43(8) . . ?
O5 Rb1 C3 151.08(9) . . ?
O6 Rb1 C3 128.37(9) . . ?
O2 Rb1 C3 21.75(8) . . ?
O1 Rb1 C3 77.43(8) . . ?
O4 Rb1 C3 96.38(8) . . ?
Ge1 Rb1 C3 77.73(7) . . ?
C6 Rb1 C3 81.31(9) . . ?
Ge2 Rb1 C3 108.33(7) . . ?
C10 Rb1 C3 149.92(10) . . ?
O3 Rb1 C7 77.58(8) . . ?
O5 Rb1 C7 40.34(8) . . ?
O6 Rb1 C7 97.55(9) . . ?
O2 Rb1 C7 130.68(8) . . ?
O1 Rb1 C7 152.45(9) . . ?
O4 Rb1 C7 22.01(7) . . ?
Ge1 Rb1 C7 114.23(7) . . ?
C6 Rb1 C7 37.66(9) . . ?
Ge2 Rb1 C7 73.47(7) . . ?
C10 Rb1 C7 80.89(10) . . ?
C3 Rb1 C7 117.63(9) . . ?
C12 O1 C1 111.6(3) . . ?
C12 O1 Rb1 116.6(2) . . ?
C1 O1 Rb1 116.5(2) . . ?
C12 O1 Rb2 100.3(2) . . ?
C1 O1 Rb2 106.6(2) . . ?
Rb1 O1 Rb2 102.76(8) . . ?
C3 O2 C2 112.6(3) . . ?
C3 O2 Rb1 107.7(2) . . ?
C2 O2 Rb1 108.6(2) . . ?
C4 O3 C5 112.0(3) . . ?
C4 O3 Rb1 119.0(2) . . ?
C5 O3 Rb1 121.1(2) . . ?
C6 O4 C7 112.6(3) . . ?
C6 O4 Rb1 103.4(2) . . ?
C7 O4 Rb1 104.7(2) . . ?
C9 O5 C8 111.0(3) . . ?
C9 O5 Rb1 116.5(2) . . ?
C8 O5 Rb1 117.2(2) . . ?
C9 O5 Rb3 97.1(2) . . ?
C8 O5 Rb3 110.4(2) . . ?
Rb1 O5 Rb3 102.07(8) . . ?
C10 O6 C11 111.6(3) . . ?
C10 O6 Rb1 109.2(2) . . ?
C11 O6 Rb1 112.7(2) . . ?
O1 C1 C2 109.0(3) . . ?
O1 C1 H1A 109.9 . . ?
C2 C1 H1A 109.9 . . ?
O1 C1 H1B 109.9 . . ?
C2 C1 H1B 109.9 . . ?
H1A C1 H1B 108.3 . . ?
O2 C2 C1 109.4(4) . . ?
O2 C2 Rb1 49.80(17) . . ?
C1 C2 Rb1 85.2(2) . . ?
O2 C2 H2A 109.8 . . ?
C1 C2 H2A 109.8 . . ?
Rb1 C2 H2A 78.9 . . ?
O2 C2 H2B 109.8 . . ?
C1 C2 H2B 109.8 . . ?
Rb1 C2 H2B 159.0 . . ?
H2A C2 H2B 108.2 . . ?
O2 C3 C4 109.6(3) . . ?
O2 C3 Rb1 50.52(18) . . ?
C4 C3 Rb1 82.5(2) . . ?
O2 C3 H3A 109.8 . . ?
C4 C3 H3A 109.8 . . ?
Rb1 C3 H3A 160.2 . . ?
O2 C3 H3B 109.8 . . ?
C4 C3 H3B 109.8 . . ?
Rb1 C3 H3B 80.8 . . ?
H3A C3 H3B 108.2 . . ?
O3 C4 C3 108.0(3) . . ?
O3 C4 H4A 110.1 . . ?
C3 C4 H4A 110.1 . . ?
O3 C4 H4B 110.1 . . ?
C3 C4 H4B 110.1 . . ?
H4A C4 H4B 108.4 . . ?
O3 C5 C6 109.1(3) . . ?
O3 C5 H5A 109.9 . . ?
C6 C5 H5A 109.9 . . ?
O3 C5 H5B 109.9 . . ?
C6 C5 H5B 109.9 . . ?
H5A C5 H5B 108.3 . . ?
O4 C6 C5 109.4(3) . . ?
O4 C6 Rb1 54.40(18) . . ?
C5 C6 Rb1 84.4(2) . . ?
O4 C6 H6A 109.8 . . ?
C5 C6 H6A 109.8 . . ?
Rb1 C6 H6A 74.6 . . ?
O4 C6 H6B 109.8 . . ?
C5 C6 H6B 109.8 . . ?
Rb1 C6 H6B 162.6 . . ?
H6A C6 H6B 108.2 . . ?
O4 C7 C8 108.9(3) . . ?
O4 C7 Rb1 53.30(18) . . ?
C8 C7 Rb1 82.8(2) . . ?
O4 C7 H7A 109.9 . . ?
C8 C7 H7A 109.9 . . ?
Rb1 C7 H7A 162.5 . . ?
O4 C7 H7B 109.9 . . ?
C8 C7 H7B 109.9 . . ?
Rb1 C7 H7B 76.9 . . ?
H7A C7 H7B 108.3 . . ?
O5 C8 C7 107.9(3) . . ?
O5 C8 H8A 110.1 . . ?
C7 C8 H8A 110.1 . . ?
O5 C8 H8B 110.1 . . ?
C7 C8 H8B 110.1 . . ?
H8A C8 H8B 108.4 . . ?
O5 C9 C10 109.2(4) . . ?
O5 C9 Rb3 60.3(2) . . ?
C10 C9 Rb3 82.9(3) . . ?
O5 C9 H9A 109.8 . . ?
C10 C9 H9A 109.8 . . ?
Rb3 C9 H9A 166.6 . . ?
O5 C9 H9B 109.8 . . ?
C10 C9 H9B 109.8 . . ?
Rb3 C9 H9B 69.8 . . ?
H9A C9 H9B 108.3 . . ?
O6 C10 C9 108.7(4) . . ?
O6 C10 Rb1 49.14(18) . . ?
C9 C10 Rb1 83.0(2) . . ?
O6 C10 H10A 110.0 . . ?
C9 C10 H10A 110.0 . . ?
Rb1 C10 H10A 81.1 . . ?
O6 C10 H10B 110.0 . . ?
C9 C10 H10B 110.0 . . ?
Rb1 C10 H10B 159.0 . . ?
H10A C10 H10B 108.3 . . ?
O6 C11 C12 109.0(3) . . ?
O6 C11 Rb1 46.39(18) . . ?
C12 C11 Rb1 83.4(2) . . ?
O6 C11 H11A 109.9 . . ?
C12 C11 H11A 109.9 . . ?
Rb1 C11 H11A 156.3 . . ?
O6 C11 H11B 109.9 . . ?
C12 C11 H11B 109.9 . . ?
Rb1 C11 H11B 84.0 . . ?
H11A C11 H11B 108.3 . . ?
O1 C12 C11 109.7(4) . . ?
O1 C12 Rb2 57.40(19) . . ?
C11 C12 Rb2 86.6(3) . . ?
O1 C12 H12A 109.7 . . ?
C11 C12 H12A 109.7 . . ?
Rb2 C12 H12A 69.8 . . ?
O1 C12 H12B 109.7 . . ?
C11 C12 H12B 109.7 . . ?
Rb2 C12 H12B 162.7 . . ?
H12A C12 H12B 108.2 . . ?
N1 Rb2 O1 109.05(12) . . ?
N1 Rb2 Ge3 127.02(9) . 6 ?
O1 Rb2 Ge3 99.27(5) . 6 ?
N1 Rb2 C12 91.91(13) . . ?
O1 Rb2 C12 22.25(8) . . ?
Ge3 Rb2 C12 99.79(7) 6 . ?
N1 Rb2 Ge6 66.65(9) . . ?
O1 Rb2 Ge6 87.21(5) . . ?
Ge3 Rb2 Ge6 160.328(18) 6 . ?
C12 Rb2 Ge6 93.20(7) . . ?
N1 Rb2 Ge5 87.60(10) . . ?
O1 Rb2 Ge5 117.27(5) . . ?
Ge3 Rb2 Ge5 117.848(16) 6 . ?
C12 Rb2 Ge5 132.60(7) . . ?
Ge6 Rb2 Ge5 43.924(11) . . ?
N1 Rb2 Ge8 86.50(9) . 6 ?
O1 Rb2 Ge8 112.15(5) . 6 ?
Ge3 Rb2 Ge8 40.913(11) 6 6 ?
C12 Rb2 Ge8 97.84(7) . 6 ?
Ge6 Rb2 Ge8 151.300(17) . 6 ?
Ge5 Rb2 Ge8 129.369(17) . 6 ?
N1 Rb2 Ge1 105.05(9) . . ?
O1 Rb2 Ge1 78.90(5) . . ?
Ge3 Rb2 Ge1 124.118(16) 6 . ?
C12 Rb2 Ge1 96.95(7) . . ?
Ge6 Rb2 Ge1 38.719(10) . . ?
Ge5 Rb2 Ge1 38.656(10) . . ?
Ge8 Rb2 Ge1 160.884(17) 6 . ?
N1 Rb2 Ge4 107.28(9) . 6 ?
O1 Rb2 Ge4 75.64(5) . 6 ?
Ge3 Rb2 Ge4 38.723(11) 6 6 ?
C12 Rb2 Ge4 66.41(7) . 6 ?
Ge6 Rb2 Ge4 158.993(17) . 6 ?
Ge5 Rb2 Ge4 156.569(16) . 6 ?
Ge8 Rb2 Ge4 37.700(10) 6 6 ?
Ge1 Rb2 Ge4 143.841(16) . 6 ?
N1 Rb2 Rb1 98.78(10) . . ?
O1 Rb2 Rb1 37.28(5) . . ?
Ge3 Rb2 Rb1 128.678(16) 6 . ?
C12 Rb2 Rb1 51.70(6) . . ?
Ge6 Rb2 Rb1 51.484(11) . . ?
Ge5 Rb2 Rb1 81.541(12) . . ?
Ge8 Rb2 Rb1 148.994(16) 6 . ?
Ge1 Rb2 Rb1 45.562(10) . . ?
Ge4 Rb2 Rb1 112.868(14) 6 . ?
N1 Rb2 Rb4 70.56(10) . 6 ?
O1 Rb2 Rb4 152.00(5) . 6 ?
Ge3 Rb2 Rb4 64.027(12) 6 6 ?
C12 Rb2 Rb4 133.39(6) . 6 ?
Ge6 Rb2 Rb4 116.237(14) . 6 ?
Ge5 Rb2 Rb4 90.725(13) . 6 ?
Ge8 Rb2 Rb4 40.421(10) 6 6 ?
Ge1 Rb2 Rb4 128.880(14) . 6 ?
Ge4 Rb2 Rb4 77.884(11) 6 6 ?
Rb1 Rb2 Rb4 167.199(13) . 6 ?
Rb2 N1 H1C 109.5 . . ?
Rb2 N1 H1D 109.5 . . ?
H1C N1 H1D 109.5 . . ?
Rb2 N1 H1E 109.5 . . ?
H1C N1 H1E 109.5 . . ?
H1D N1 H1E 109.5 . . ?
N3 Rb3 O5 126.84(10) . . ?
N3 Rb3 N2 64.74(11) . . ?
O5 Rb3 N2 167.15(9) . . ?
N3 Rb3 Ge4 129.79(7) . 1_565 ?
O5 Rb3 Ge4 78.96(5) . 1_565 ?
N2 Rb3 Ge4 88.98(7) . 1_565 ?
N3 Rb3 C9 109.56(11) . . ?
O5 Rb3 C9 22.59(8) . . ?
N2 Rb3 C9 157.86(10) . . ?
Ge4 Rb3 C9 78.78(7) 1_565 . ?
N3 Rb3 Ge2 105.50(7) . . ?
O5 Rb3 Ge2 80.38(5) . . ?
N2 Rb3 Ge2 102.76(7) . . ?
Ge4 Rb3 Ge2 122.292(16) 1_565 . ?
C9 Rb3 Ge2 99.38(7) . . ?
N3 Rb3 Ge6 69.23(7) . . ?
O5 Rb3 Ge6 87.64(5) . . ?
N2 Rb3 Ge6 102.94(7) . . ?
Ge4 Rb3 Ge6 160.926(16) 1_565 . ?
C9 Rb3 Ge6 94.02(7) . . ?
Ge2 Rb3 Ge6 40.929(10) . . ?
N3 Rb3 Ge7 75.32(7) . . ?
O5 Rb3 Ge7 120.48(5) . . ?
N2 Rb3 Ge7 65.25(7) . . ?
Ge4 Rb3 Ge7 133.065(17) 1_565 . ?
C9 Rb3 Ge7 135.87(7) . . ?
Ge2 Rb3 Ge7 40.836(10) . . ?
Ge6 Rb3 Ge7 45.161(11) . . ?
N3 Rb3 Ge5 94.18(7) . 1_565 ?
O5 Rb3 Ge5 83.49(5) . 1_565 ?
N2 Rb3 Ge5 90.41(7) . 1_565 ?
Ge4 Rb3 Ge5 41.333(11) 1_565 1_565 ?
C9 Rb3 Ge5 68.20(7) . 1_565 ?
Ge2 Rb3 Ge5 159.569(16) . 1_565 ?
Ge6 Rb3 Ge5 150.715(17) . 1_565 ?
Ge7 Rb3 Ge5 155.648(16) . 1_565 ?
N3 Rb3 K4 49.65(7) . 5_566 ?
O5 Rb3 K4 134.35(5) . 5_566 ?
N2 Rb3 K4 46.15(7) . 5_566 ?
Ge4 Rb3 K4 80.946(12) 1_565 5_566 ?
C9 Rb3 K4 112.98(7) . 5_566 ?
Ge2 Rb3 K4 143.917(15) . 5_566 ?
Ge6 Rb3 K4 118.050(14) . 5_566 ?
Ge7 Rb3 K4 103.115(14) . 5_566 ?
Ge5 Rb3 K4 55.227(11) 1_565 5_566 ?
N3 Rb3 Rb4 49.65(7) . 5_566 ?
O5 Rb3 Rb4 134.35(5) . 5_566 ?
N2 Rb3 Rb4 46.15(7) . 5_566 ?
Ge4 Rb3 Rb4 80.946(12) 1_565 5_566 ?
C9 Rb3 Rb4 112.98(7) . 5_566 ?
Ge2 Rb3 Rb4 143.917(15) . 5_566 ?
Ge6 Rb3 Rb4 118.050(14) . 5_566 ?
Ge7 Rb3 Rb4 103.115(14) . 5_566 ?
Ge5 Rb3 Rb4 55.227(11) 1_565 5_566 ?
K4 Rb3 Rb4 0.0 5_566 5_566 ?
N3 Rb3 Rb1 110.62(8) . . ?
O5 Rb3 Rb1 36.74(5) . . ?
N2 Rb3 Rb1 150.71(7) . . ?
Ge4 Rb3 Rb1 111.860(13) 1_565 . ?
C9 Rb3 Rb1 51.09(7) . . ?
Ge2 Rb3 Rb1 49.022(10) . . ?
Ge6 Rb3 Rb1 51.987(10) . . ?
Ge7 Rb3 Rb1 85.491(12) . . ?
Ge5 Rb3 Rb1 118.860(13) 1_565 . ?
K4 Rb3 Rb1 153.167(15) 5_566 . ?
Rb4 Rb3 Rb1 153.167(15) 5_566 . ?
N3 Rb3 H2D 62.4 . . ?
O5 Rb3 H2D 166.5 . . ?
N2 Rb3 H2D 16.4 . . ?
Ge4 Rb3 H2D 102.6 1_565 . ?
C9 Rb3 H2D 170.8 . . ?
Ge2 Rb3 H2D 87.6 . . ?
Ge6 Rb3 H2D 87.3 . . ?
Ge7 Rb3 H2D 49.0 . . ?
Ge5 Rb3 H2D 106.7 1_565 . ?
K4 Rb3 H2D 58.7 5_566 . ?
Rb4 Rb3 H2D 58.7 5_566 . ?
Rb1 Rb3 H2D 134.4 . . ?
N3 Rb3 H3C 16.2 . . ?
O5 Rb3 H3C 130.8 . . ?
N2 Rb3 H3C 61.9 . . ?
Ge4 Rb3 H3C 141.5 1_565 . ?
C9 Rb3 H3C 118.7 . . ?
Ge2 Rb3 H3C 90.3 . . ?
Ge6 Rb3 H3C 57.3 . . ?
Ge7 Rb3 H3C 59.2 . . ?
Ge5 Rb3 H3C 109.8 1_565 . ?
K4 Rb3 H3C 60.8 5_566 . ?
Rb4 Rb3 H3C 60.8 5_566 . ?
Rb1 Rb3 H3C 105.0 . . ?
H2D Rb3 H3C 54.8 . . ?
N3 Rb3 H3D 16.6 . . ?
O5 Rb3 H3D 110.2 . . ?
N2 Rb3 H3D 81.3 . . ?
Ge4 Rb3 H3D 133.3 1_565 . ?
C9 Rb3 H3D 93.7 . . ?
Ge2 Rb3 H3D 104.4 . . ?
Ge6 Rb3 H3D 64.2 . . ?
Ge7 Rb3 H3D 83.1 . . ?
Ge5 Rb3 H3D 92.9 1_565 . ?
K4 Rb3 H3D 59.6 5_566 . ?
Rb4 Rb3 H3D 59.6 5_566 . ?
Rb1 Rb3 H3D 97.1 . . ?
H2D Rb3 H3D 78.7 . . ?
H3C Rb3 H3D 26.7 . . ?
N4A Rb4 N2 128.9(2) . 5_566 ?
N4A Rb4 N4B 19.1(2) . . ?
N2 Rb4 N4B 109.8(2) 5_566 . ?
N4A Rb4 N5 47.1(3) . . ?
N2 Rb4 N5 166.48(19) 5_566 . ?
N4B Rb4 N5 65.3(3) . . ?
N4A Rb4 N3 75.1(2) . 5_566 ?
N2 Rb4 N3 65.13(10) 5_566 5_566 ?
N4B Rb4 N3 60.3(2) . 5_566 ?
N5 Rb4 N3 102.5(2) . 5_566 ?
N4A Rb4 Ge8 82.9(2) . . ?
N2 Rb4 Ge8 104.78(7) 5_566 . ?
N4B Rb4 Ge8 88.4(2) . . ?
N5 Rb4 Ge8 87.94(17) . . ?
N3 Rb4 Ge8 137.03(7) 5_566 . ?
N4A Rb4 Ge8 157.2(2) . 5_556 ?
N2 Rb4 Ge8 73.47(8) 5_566 5_556 ?
N4B Rb4 Ge8 173.4(3) . 5_556 ?
N5 Rb4 Ge8 110.21(17) . 5_556 ?
N3 Rb4 Ge8 117.76(7) 5_566 5_556 ?
Ge8 Rb4 Ge8 96.322(15) . 5_556 ?
N4A Rb4 Ge9 115.5(2) . 5_556 ?
N2 Rb4 Ge9 115.12(8) 5_566 5_556 ?
N4B Rb4 Ge9 134.1(2) . 5_556 ?
N5 Rb4 Ge9 68.85(18) . 5_556 ?
N3 Rb4 Ge9 133.71(7) 5_566 5_556 ?
Ge8 Rb4 Ge9 89.055(15) . 5_556 ?
Ge8 Rb4 Ge9 41.805(11) 5_556 5_556 ?
N4A Rb4 Ge5 119.7(2) . 5_556 ?
N2 Rb4 Ge5 94.25(8) 5_566 5_556 ?
N4B Rb4 Ge5 128.3(3) . 5_556 ?
N5 Rb4 Ge5 80.66(16) . 5_556 ?
N3 Rb4 Ge5 93.30(7) 5_566 5_556 ?
Ge8 Rb4 Ge5 129.651(16) . 5_556 ?
Ge8 Rb4 Ge5 45.217(12) 5_556 5_556 ?
Ge9 Rb4 Ge5 41.129(11) 5_556 5_556 ?
N4A Rb4 Ge7 74.2(2) . . ?
N2 Rb4 Ge7 77.54(8) 5_566 . ?
N4B Rb4 Ge7 65.9(3) . . ?
N5 Rb4 Ge7 109.82(16) . . ?
N3 Rb4 Ge7 93.72(7) 5_566 . ?
Ge8 Rb4 Ge7 44.287(11) . . ?
Ge8 Rb4 Ge7 120.634(17) 5_556 . ?
Ge9 Rb4 Ge7 132.445(17) 5_556 . ?
Ge5 Rb4 Ge7 165.752(18) 5_556 . ?
N4A Rb4 Ge9 109.9(2) . . ?
N2 Rb4 Ge9 64.72(7) 5_566 . ?
N4B Rb4 Ge9 104.2(3) . . ?
N5 Rb4 Ge9 128.12(17) . . ?
N3 Rb4 Ge9 115.78(8) 5_566 . ?
Ge8 Rb4 Ge9 40.182(11) . . ?
Ge8 Rb4 Ge9 82.305(14) 5_556 . ?
Ge9 Rb4 Ge9 102.853(14) 5_556 . ?
Ge5 Rb4 Ge9 127.521(16) 5_556 . ?
Ge7 Rb4 Ge9 38.366(10) . . ?
N4A Rb4 Rb3 118.2(2) . 5_566 ?
N2 Rb4 Rb3 49.48(7) 5_566 5_566 ?
N4B Rb4 Rb3 106.7(2) . 5_566 ?
N5 Rb4 Rb3 118.47(17) . 5_566 ?
N3 Rb4 Rb3 47.06(7) 5_566 5_566 ?
Ge8 Rb4 Rb3 153.069(18) . 5_566 ?
Ge8 Rb4 Rb3 70.782(12) 5_556 5_566 ?
Ge9 Rb4 Rb3 95.523(13) 5_556 5_566 ?
Ge5 Rb4 Rb3 56.656(11) 5_556 5_566 ?
Ge7 Rb4 Rb3 121.743(15) . 5_566 ?
Ge9 Rb4 Rb3 113.221(15) . 5_566 ?
K4 N2 Rb3 84.37(10) 5_566 . ?
Rb4 N2 Rb3 84.37(10) 5_566 . ?
K4 N2 H2C 117.0 5_566 . ?
Rb4 N2 H2C 117.0 5_566 . ?
Rb3 N2 H2C 97.1 . . ?
K4 N2 H2D 128.6 5_566 . ?
Rb4 N2 H2D 128.6 5_566 . ?
Rb3 N2 H2D 68.8 . . ?
H2C N2 H2D 109.5 . . ?
K4 N2 H2E 75.2 5_566 . ?
Rb4 N2 H2E 75.2 5_566 . ?
Rb3 N2 H2E 151.7 . . ?
H2C N2 H2E 109.5 . . ?
H2D N2 H2E 109.5 . . ?
Rb3 N3 K4 83.30(9) . 5_566 ?
Rb3 N3 Rb4 83.30(9) . 5_566 ?
Rb3 N3 H3C 91.8 . . ?
K4 N3 H3C 128.8 5_566 . ?
Rb4 N3 H3C 128.8 5_566 . ?
Rb3 N3 H3D 86.8 . . ?
K4 N3 H3D 121.0 5_566 . ?
Rb4 N3 H3D 121.0 5_566 . ?
H3C N3 H3D 109.5 . . ?
Rb3 N3 H3E 145.8 . . ?
K4 N3 H3E 62.6 5_566 . ?
Rb4 N3 H3E 62.6 5_566 . ?
H3C N3 H3E 109.5 . . ?
H3D N3 H3E 109.5 . . ?
Rb4 N4A H4AA 109.5 . . ?
Rb4 N4A H4AB 109.5 . . ?
H4AA N4A H4AB 109.5 . . ?
Rb4 N4A H4AC 109.5 . . ?
H4AA N4A H4AC 109.5 . . ?
H4AB N4A H4AC 109.5 . . ?
Rb4 N4B H4BA 109.5 . . ?
Rb4 N4B H4BB 109.5 . . ?
H4BA N4B H4BB 109.5 . . ?
Rb4 N4B H4BC 109.5 . . ?
H4BA N4B H4BC 109.5 . . ?
H4BB N4B H4BC 109.5 . . ?
Rb4 N5 H5C 109.5 . . ?
Rb4 N5 H5D 109.5 . . ?
H5C N5 H5D 109.5 . . ?
Rb4 N5 H5E 109.5 . . ?
H5C N5 H5E 109.5 . . ?
H5D N5 H5E 109.5 . . ?

_refine_diff_density_max         0.953
_refine_diff_density_min         -1.253
_refine_diff_density_rms         0.160


#============================================================================== 
# END of CIF  
#============================================================================== 
_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: Ammonia'
_chemical_properties_physical    Air-sensitive,Moisture-sensitive
