# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# 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_riv2071
_database_code_depnum_ccdc_archive 'CCDC 2094825'
loop_
_audit_author_name
_audit_author_address
'Michael J. Ferguson'
;University of Alberta
Canada
;
_audit_update_record             
;
2021-07-06 deposited with the CCDC.	2021-11-15 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ImMe2-Ge(OtBu)2
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C13 H26 Ge N2 O2'
_chemical_formula_sum            'C13 H26 Ge N2 O2'
_chemical_formula_weight         314.95

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge -1.0885 0.8855 '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, y, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y-1/2, -z-1/2'
'x, -y, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   17.4359(6)
_cell_length_b                   16.6515(6)
_cell_length_c                   24.2090(8)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     7028.7(4)
_cell_formula_units_Z            16
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9877
_cell_measurement_theta_min      3.67
_cell_measurement_theta_max      69.82

_exptl_crystal_description       fragment
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.191
_exptl_crystal_F_000             2656
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.159
_exptl_crystal_size_mid          0.139
_exptl_crystal_size_min          0.117
_exptl_absorpt_coefficient_mu    2.351
_shelx_estimated_absorpt_T_min   0.706
_shelx_estimated_absorpt_T_max   0.770
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.7163
_exptl_absorpt_correction_T_max  0.8921
_exptl_absorpt_process_details   
; 
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D., 
 J. Appl. Cryst. 48 (2015) 3-10 
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            70160
_diffrn_reflns_av_unetI/netI     0.0278
_diffrn_reflns_av_R_equivalents  0.0593
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_theta_min         3.651
_diffrn_reflns_theta_max         70.162
_diffrn_reflns_theta_full        67.679
_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             6690
_reflns_number_gt                5102
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _reflns_Friedel_fraction is defined as the number of unique 
 Friedel pairs measured divided by the number that would be 
 possible theoretically, ignoring centric projections and 
 systematic absences. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_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)+(0.0411P)²+5.9602P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6690
_refine_ls_number_parameters     329
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0541
_refine_ls_R_factor_gt           0.0358
_refine_ls_wR_factor_ref         0.0992
_refine_ls_wR_factor_gt          0.0869
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_restrained_S_all      1.031
_refine_ls_shift/su_max          0.002
_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
Ge1A Ge 0.68991(2) 0.47939(2) 0.59909(2) 0.03697(10) Uani 1 1 d . . . . .
O1A O 0.78357(11) 0.53127(12) 0.60298(8) 0.0484(5) Uani 1 1 d . . . . .
O2A O 0.64262(11) 0.57612(12) 0.61228(8) 0.0483(5) Uani 1 1 d . . . . .
N1A N 0.68062(12) 0.42557(13) 0.47711(9) 0.0353(5) Uani 1 1 d . . . . .
N2A N 0.70248(13) 0.55147(13) 0.47893(9) 0.0372(5) Uani 1 1 d . . . . .
C1A C 0.68849(15) 0.48797(15) 0.51201(10) 0.0350(5) Uani 1 1 d . . . . .
C2A C 0.68916(16) 0.44974(18) 0.42311(11) 0.0427(6) Uani 1 1 d . . . . .
H2A H 0.685932 0.416677 0.391216 0.051 Uiso 1 1 calc R U . . .
C3A C 0.70287(17) 0.52876(18) 0.42418(12) 0.0457(7) Uani 1 1 d . . . . .
H3A H 0.711261 0.562659 0.393199 0.055 Uiso 1 1 calc R U . . .
C4A C 0.66456(19) 0.34268(17) 0.49401(13) 0.0503(7) Uani 1 1 d . . . . .
H4A H 0.691815 0.305497 0.469537 0.060 Uiso 1 1 calc R U . . .
H4B H 0.609283 0.332573 0.491666 0.060 Uiso 1 1 calc R U . . .
H4C H 0.681839 0.334596 0.532128 0.060 Uiso 1 1 calc R U . . .
C5A C 0.7190(2) 0.63298(17) 0.49833(13) 0.0533(8) Uani 1 1 d . . . . .
H5A H 0.705744 0.671686 0.469374 0.064 Uiso 1 1 calc R U . . .
H5B H 0.773735 0.637581 0.507078 0.064 Uiso 1 1 calc R U . . .
H5C H 0.688690 0.644214 0.531518 0.064 Uiso 1 1 calc R U . . .
C11A C 0.85460(17) 0.4893(2) 0.60365(14) 0.0543(8) Uani 1 1 d . . . . .
C12A C 0.8591(3) 0.4284(3) 0.5579(2) 0.121(2) Uani 1 1 d . . . . .
H12A H 0.908673 0.400679 0.559566 0.145 Uiso 1 1 calc R U . . .
H12B H 0.817616 0.389194 0.562119 0.145 Uiso 1 1 calc R U . . .
H12C H 0.854079 0.455568 0.522170 0.145 Uiso 1 1 calc R U . . .
C13A C 0.8667(3) 0.4514(4) 0.6579(2) 0.153(3) Uani 1 1 d . . . . .
H13A H 0.915737 0.422657 0.657902 0.184 Uiso 1 1 calc R U . . .
H13B H 0.867319 0.492761 0.686690 0.184 Uiso 1 1 calc R U . . .
H13C H 0.824960 0.413377 0.665296 0.184 Uiso 1 1 calc R U . . .
C14A C 0.9161(3) 0.5506(3) 0.5924(3) 0.135(2) Uani 1 1 d . . . . .
H14A H 0.966348 0.524194 0.592499 0.162 Uiso 1 1 calc R U . . .
H14B H 0.907124 0.575391 0.556299 0.162 Uiso 1 1 calc R U . . .
H14C H 0.914882 0.591978 0.621172 0.162 Uiso 1 1 calc R U . . .
C21A C 0.5609(2) 0.5834(3) 0.61596(15) 0.0688(11) Uani 1 1 d . . . . .
C22A C 0.5300(2) 0.5382(3) 0.66520(17) 0.0957(15) Uani 1 1 d . . . . .
H22A H 0.474157 0.544127 0.666720 0.115 Uiso 1 1 calc R U . . .
H22B H 0.543140 0.481142 0.661762 0.115 Uiso 1 1 calc R U . . .
H22C H 0.552769 0.559820 0.699088 0.115 Uiso 1 1 calc R U . . .
C23A C 0.5236(2) 0.5493(3) 0.56352(17) 0.1036(18) Uani 1 1 d . . . . .
H23A H 0.467728 0.554429 0.566240 0.124 Uiso 1 1 calc R U . . .
H23B H 0.541912 0.579237 0.531253 0.124 Uiso 1 1 calc R U . . .
H23C H 0.537338 0.492539 0.559590 0.124 Uiso 1 1 calc R U . . .
C24A C 0.5448(3) 0.6714(3) 0.6217(3) 0.151(3) Uani 1 1 d . . . . .
H24A H 0.489304 0.679958 0.624394 0.181 Uiso 1 1 calc R U . . .
H24B H 0.569794 0.691878 0.655087 0.181 Uiso 1 1 calc R U . . .
H24C H 0.564730 0.699906 0.589314 0.181 Uiso 1 1 calc R U . . .
Ge1B Ge 0.75239(2) 0.75095(2) 0.34616(2) 0.03746(10) Uani 1 1 d . . . . .
O1B O 0.65779(11) 0.71035(11) 0.36629(8) 0.0421(4) Uani 1 1 d . . . . .
O2B O 0.78851(10) 0.64666(11) 0.34144(8) 0.0407(4) Uani 1 1 d . . . . .
N1B N 0.74386(15) 0.81723(14) 0.22701(9) 0.0452(6) Uani 1 1 d . . . . .
N2B N 0.69213(14) 0.70138(14) 0.22862(9) 0.0431(5) Uani 1 1 d . . . . .
C1B C 0.72687(17) 0.75569(16) 0.26114(11) 0.0407(6) Uani 1 1 d . . . . .
C2B C 0.7191(2) 0.8019(2) 0.17398(12) 0.0596(9) Uani 1 1 d . . . . .
H2B H 0.724232 0.836197 0.142821 0.071 Uiso 1 1 calc R U . . .
C3B C 0.6862(2) 0.72882(19) 0.17512(12) 0.0567(8) Uani 1 1 d . . . . .
H3B H 0.663328 0.701455 0.144878 0.068 Uiso 1 1 calc R U . . .
C4B C 0.7816(2) 0.89196(18) 0.24392(14) 0.0630(9) Uani 1 1 d . . . . .
H4D H 0.796405 0.922611 0.211047 0.076 Uiso 1 1 calc R U . . .
H4E H 0.827477 0.879284 0.265644 0.076 Uiso 1 1 calc R U . . .
H4F H 0.746214 0.923948 0.266384 0.076 Uiso 1 1 calc R U . . .
C5B C 0.6627(2) 0.62380(17) 0.24735(13) 0.0543(8) Uani 1 1 d . . . . .
H5D H 0.606645 0.623267 0.244128 0.065 Uiso 1 1 calc R U . . .
H5E H 0.677248 0.615250 0.286005 0.065 Uiso 1 1 calc R U . . .
H5F H 0.684374 0.580880 0.224486 0.065 Uiso 1 1 calc R U . . .
C11B C 0.59292(18) 0.75959(19) 0.37803(13) 0.0504(7) Uani 1 1 d . . . . .
C12B C 0.5672(2) 0.8041(3) 0.32640(16) 0.0795(12) Uani 1 1 d . . . . .
H12D H 0.522617 0.837613 0.335168 0.095 Uiso 1 1 calc R U . . .
H12E H 0.609102 0.838162 0.313036 0.095 Uiso 1 1 calc R U . . .
H12F H 0.553263 0.765211 0.297716 0.095 Uiso 1 1 calc R U . . .
C13B C 0.6108(2) 0.8201(2) 0.42385(16) 0.0713(10) Uani 1 1 d . . . . .
H13D H 0.565341 0.853046 0.431075 0.086 Uiso 1 1 calc R U . . .
H13E H 0.625190 0.791200 0.457575 0.086 Uiso 1 1 calc R U . . .
H13F H 0.653313 0.854668 0.412256 0.086 Uiso 1 1 calc R U . . .
C14B C 0.5305(2) 0.7026(3) 0.39731(19) 0.0864(13) Uani 1 1 d . . . . .
H14D H 0.484121 0.733263 0.406058 0.104 Uiso 1 1 calc R U . . .
H14E H 0.519233 0.663858 0.367961 0.104 Uiso 1 1 calc R U . . .
H14F H 0.547990 0.673962 0.430352 0.104 Uiso 1 1 calc R U . . .
C21B C 0.86848(16) 0.62919(18) 0.34110(12) 0.0458(7) Uani 1 1 d . . . . .
C22B C 0.9027(2) 0.6450(2) 0.39803(14) 0.0651(10) Uani 1 1 d . . . . .
H22D H 0.957715 0.632790 0.397396 0.078 Uiso 1 1 calc R U . . .
H22E H 0.895217 0.701499 0.407893 0.078 Uiso 1 1 calc R U . . .
H22F H 0.877279 0.610743 0.425392 0.078 Uiso 1 1 calc R U . . .
C23B C 0.9099(2) 0.6793(2) 0.29768(14) 0.0659(10) Uani 1 1 d . . . . .
H23D H 0.964706 0.666331 0.298159 0.079 Uiso 1 1 calc R U . . .
H23E H 0.888710 0.667282 0.261097 0.079 Uiso 1 1 calc R U . . .
H23F H 0.902855 0.736455 0.305844 0.079 Uiso 1 1 calc R U . . .
C24B C 0.8753(2) 0.5400(2) 0.32698(16) 0.0662(10) Uani 1 1 d . . . . .
H24D H 0.929533 0.524597 0.326181 0.079 Uiso 1 1 calc R U . . .
H24E H 0.848441 0.508159 0.355007 0.079 Uiso 1 1 calc R U . . .
H24F H 0.852269 0.530007 0.290692 0.079 Uiso 1 1 calc 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
Ge1A O2A 1.837(2) . ?
Ge1A O1A 1.850(2) . ?
Ge1A C1A 2.113(3) . ?
O1A C11A 1.422(4) . ?
O2A C21A 1.433(4) . ?
N1A C1A 1.346(3) . ?
N1A C2A 1.376(3) . ?
N1A C4A 1.467(3) . ?
N2A C1A 1.349(3) . ?
N2A C3A 1.378(3) . ?
N2A C5A 1.465(3) . ?
C2A C3A 1.338(4) . ?
C11A C13A 1.473(5) . ?
C11A C14A 1.504(6) . ?
C11A C12A 1.504(5) . ?
C21A C24A 1.498(6) . ?
C21A C22A 1.509(5) . ?
C21A C23A 1.535(5) . ?
Ge1B O1B 1.8480(19) . ?
Ge1B O2B 1.8508(19) . ?
Ge1B C1B 2.107(3) . ?
O1B C11B 1.426(3) . ?
O2B C21B 1.424(3) . ?
N1B C1B 1.349(3) . ?
N1B C2B 1.378(4) . ?
N1B C4B 1.466(4) . ?
N2B C1B 1.343(3) . ?
N2B C3B 1.377(3) . ?
N2B C5B 1.462(3) . ?
C2B C3B 1.346(4) . ?
C11B C14B 1.517(5) . ?
C11B C12B 1.521(5) . ?
C11B C13B 1.530(5) . ?
C21B C23B 1.524(4) . ?
C21B C22B 1.525(4) . ?
C21B C24B 1.529(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
O2A Ge1A O1A 88.73(9) . . ?
O2A Ge1A C1A 96.25(9) . . ?
O1A Ge1A C1A 91.70(10) . . ?
C11A O1A Ge1A 122.69(19) . . ?
C21A O2A Ge1A 122.1(2) . . ?
C1A N1A C2A 111.1(2) . . ?
C1A N1A C4A 124.8(2) . . ?
C2A N1A C4A 124.1(2) . . ?
C1A N2A C3A 110.9(2) . . ?
C1A N2A C5A 124.9(2) . . ?
C3A N2A C5A 124.2(2) . . ?
N1A C1A N2A 104.5(2) . . ?
N1A C1A Ge1A 125.10(18) . . ?
N2A C1A Ge1A 130.04(19) . . ?
C3A C2A N1A 106.8(2) . . ?
C2A C3A N2A 106.7(2) . . ?
O1A C11A C13A 110.2(3) . . ?
O1A C11A C14A 106.6(3) . . ?
C13A C11A C14A 110.5(4) . . ?
O1A C11A C12A 111.6(3) . . ?
C13A C11A C12A 111.1(4) . . ?
C14A C11A C12A 106.7(4) . . ?
O2A C21A C24A 105.9(4) . . ?
O2A C21A C22A 111.2(3) . . ?
C24A C21A C22A 110.4(4) . . ?
O2A C21A C23A 109.8(3) . . ?
C24A C21A C23A 111.0(4) . . ?
C22A C21A C23A 108.5(4) . . ?
O1B Ge1B O2B 88.67(8) . . ?
O1B Ge1B C1B 94.75(10) . . ?
O2B Ge1B C1B 92.68(9) . . ?
C11B O1B Ge1B 123.40(18) . . ?
C21B O2B Ge1B 121.67(17) . . ?
C1B N1B C2B 111.2(3) . . ?
C1B N1B C4B 124.9(2) . . ?
C2B N1B C4B 123.9(3) . . ?
C1B N2B C3B 111.2(2) . . ?
C1B N2B C5B 124.8(2) . . ?
C3B N2B C5B 123.9(2) . . ?
N2B C1B N1B 104.6(2) . . ?
N2B C1B Ge1B 130.0(2) . . ?
N1B C1B Ge1B 125.5(2) . . ?
C3B C2B N1B 106.4(3) . . ?
C2B C3B N2B 106.7(3) . . ?
O1B C11B C14B 105.7(3) . . ?
O1B C11B C12B 110.5(3) . . ?
C14B C11B C12B 110.3(3) . . ?
O1B C11B C13B 111.2(3) . . ?
C14B C11B C13B 109.5(3) . . ?
C12B C11B C13B 109.6(3) . . ?
O2B C21B C23B 110.8(3) . . ?
O2B C21B C22B 110.1(2) . . ?
C23B C21B C22B 110.1(3) . . ?
O2B C21B C24B 106.0(2) . . ?
C23B C21B C24B 109.9(3) . . ?
C22B C21B C24B 109.8(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O2A Ge1A O1A C11A 171.1(2) . . . . ?
C1A Ge1A O1A C11A -92.6(2) . . . . ?
O1A Ge1A O2A C21A -179.3(2) . . . . ?
C1A Ge1A O2A C21A 89.1(2) . . . . ?
C2A N1A C1A N2A -0.3(3) . . . . ?
C4A N1A C1A N2A -179.9(2) . . . . ?
C2A N1A C1A Ge1A -174.33(19) . . . . ?
C4A N1A C1A Ge1A 6.1(4) . . . . ?
C3A N2A C1A N1A 0.3(3) . . . . ?
C5A N2A C1A N1A -176.7(3) . . . . ?
C3A N2A C1A Ge1A 173.9(2) . . . . ?
C5A N2A C1A Ge1A -3.1(4) . . . . ?
O2A Ge1A C1A N1A -146.4(2) . . . . ?
O1A Ge1A C1A N1A 124.7(2) . . . . ?
O2A Ge1A C1A N2A 41.2(3) . . . . ?
O1A Ge1A C1A N2A -47.7(3) . . . . ?
C1A N1A C2A C3A 0.2(3) . . . . ?
C4A N1A C2A C3A 179.8(3) . . . . ?
N1A C2A C3A N2A 0.0(3) . . . . ?
C1A N2A C3A C2A -0.2(3) . . . . ?
C5A N2A C3A C2A 176.9(3) . . . . ?
Ge1A O1A C11A C13A -74.2(4) . . . . ?
Ge1A O1A C11A C14A 165.9(3) . . . . ?
Ge1A O1A C11A C12A 49.8(4) . . . . ?
Ge1A O2A C21A C24A -174.9(3) . . . . ?
Ge1A O2A C21A C22A 65.1(4) . . . . ?
Ge1A O2A C21A C23A -55.0(4) . . . . ?
O2B Ge1B O1B C11B -179.8(2) . . . . ?
C1B Ge1B O1B C11B -87.2(2) . . . . ?
O1B Ge1B O2B C21B -162.8(2) . . . . ?
C1B Ge1B O2B C21B 102.5(2) . . . . ?
C3B N2B C1B N1B -1.0(3) . . . . ?
C5B N2B C1B N1B -179.7(3) . . . . ?
C3B N2B C1B Ge1B 179.5(2) . . . . ?
C5B N2B C1B Ge1B 0.8(5) . . . . ?
C2B N1B C1B N2B 0.8(3) . . . . ?
C4B N1B C1B N2B 179.1(3) . . . . ?
C2B N1B C1B Ge1B -179.7(2) . . . . ?
C4B N1B C1B Ge1B -1.4(4) . . . . ?
O1B Ge1B C1B N2B -44.2(3) . . . . ?
O2B Ge1B C1B N2B 44.7(3) . . . . ?
O1B Ge1B C1B N1B 136.3(3) . . . . ?
O2B Ge1B C1B N1B -134.8(3) . . . . ?
C1B N1B C2B C3B -0.3(4) . . . . ?
C4B N1B C2B C3B -178.6(3) . . . . ?
N1B C2B C3B N2B -0.3(4) . . . . ?
C1B N2B C3B C2B 0.8(4) . . . . ?
C5B N2B C3B C2B 179.6(3) . . . . ?
Ge1B O1B C11B C14B -175.2(2) . . . . ?
Ge1B O1B C11B C12B 65.5(3) . . . . ?
Ge1B O1B C11B C13B -56.5(3) . . . . ?
Ge1B O2B C21B C23B -51.3(3) . . . . ?
Ge1B O2B C21B C22B 70.7(3) . . . . ?
Ge1B O2B C21B C24B -170.6(2) . . . . ?

_refine_diff_density_max         0.388
_refine_diff_density_min         -0.352
_refine_diff_density_rms         0.054



####################################################################### 
# 
# 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_riv2036
_database_code_depnum_ccdc_archive 'CCDC 2094826'
loop_
_audit_author_name
_audit_author_address
'Michael J. Ferguson'
;University of Alberta
Canada
;
_audit_update_record             
;
2021-07-06 deposited with the CCDC.	2021-11-15 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        (Tri-tert-butoxygermyl)potassium
_chemical_name_common            K[Ge(OtBu)3]
_chemical_melting_point          ?
_chemical_formula_moiety         'C12 H27 Ge K O3'
_chemical_formula_sum            'C12 H27 Ge K O3'
_chemical_formula_weight         331.02

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.3868 1.0657 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge -1.0885 0.8855 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           19
_space_group_name_H-M_alt        'P 21 21 21'
_space_group_name_Hall           'P 2ac 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, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'

_cell_length_a                   8.8817(5)
_cell_length_b                   10.4187(6)
_cell_length_c                   18.1622(10)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     1680.65(16)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    2957
_cell_measurement_theta_min      4.87
_cell_measurement_theta_max      70.27

_exptl_crystal_description       plate
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.308
_exptl_crystal_F_000             696
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.075
_exptl_crystal_size_mid          0.065
_exptl_crystal_size_min          0.017
_exptl_absorpt_coefficient_mu    4.664
_shelx_estimated_absorpt_T_min   0.721
_shelx_estimated_absorpt_T_max   0.925
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.6637
_exptl_absorpt_correction_T_max  0.8419
_exptl_absorpt_process_details   
; 
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D., 
 J. Appl. Cryst. 48 (2015) 3-10 
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            23475
_diffrn_reflns_av_unetI/netI     0.0518
_diffrn_reflns_av_R_equivalents  0.0822
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         4.870
_diffrn_reflns_theta_max         74.601
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.982
_diffrn_reflns_point_group_measured_fraction_full 0.997
_reflns_number_total             3381
_reflns_number_gt                3025
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.717
_reflns_Friedel_fraction_max     0.966
_reflns_Friedel_fraction_full    0.992

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _reflns_Friedel_fraction is defined as the number of unique 
 Friedel pairs measured divided by the number that would be 
 possible theoretically, ignoring centric projections and 
 systematic absences. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_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)+(0.0361P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
; 
 Flack x determined using 1180 quotients [(I+)-(I-)]/[(I+)+(I-)] 
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). 
;
_refine_ls_abs_structure_Flack   0.031(14)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         3381
_refine_ls_number_parameters     182
_refine_ls_number_restraints     18
_refine_ls_R_factor_all          0.0404
_refine_ls_R_factor_gt           0.0342
_refine_ls_wR_factor_ref         0.0820
_refine_ls_wR_factor_gt          0.0794
_refine_ls_goodness_of_fit_ref   1.008
_refine_ls_restrained_S_all      1.006
_refine_ls_shift/su_max          0.003
_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 0.37342(5) 0.40327(5) 0.37345(3) 0.04032(13) Uani 1 1 d . . . . .
K1 K 0.15831(11) 0.24727(10) 0.50681(6) 0.0510(2) Uani 1 1 d . . . . .
O1 O 0.4258(4) 0.4263(3) 0.47305(18) 0.0478(8) Uani 1 1 d . . . . .
O2 O 0.1661(3) 0.3917(3) 0.39375(18) 0.0505(8) Uani 1 1 d . . . . .
O3 O 0.4098(4) 0.2282(3) 0.39275(18) 0.0477(8) Uani 1 1 d . . . . .
C11 C 0.4487(5) 0.5500(5) 0.5051(3) 0.0493(11) Uani 1 1 d . . . . .
C12A C 0.5856(12) 0.5532(11) 0.5542(6) 0.068(3) Uani 0.575(8) 1 d . . P A 1
H12A H 0.597221 0.639359 0.575056 0.081 Uiso 0.575(8) 1 calc R U P A 1
H12B H 0.573262 0.490815 0.594180 0.081 Uiso 0.575(8) 1 calc R U P A 1
H12C H 0.675218 0.531355 0.525352 0.081 Uiso 0.575(8) 1 calc R U P A 1
C13A C 0.3063(11) 0.5782(10) 0.5499(6) 0.061(3) Uani 0.575(8) 1 d . . P A 1
H13A H 0.315573 0.662519 0.573413 0.074 Uiso 0.575(8) 1 calc R U P A 1
H13B H 0.218580 0.577956 0.517190 0.074 Uiso 0.575(8) 1 calc R U P A 1
H13C H 0.293597 0.512157 0.587854 0.074 Uiso 0.575(8) 1 calc R U P A 1
C14A C 0.4649(14) 0.6626(9) 0.4474(6) 0.064(3) Uani 0.575(8) 1 d . . P A 1
H14A H 0.480223 0.743913 0.473477 0.077 Uiso 0.575(8) 1 calc R U P A 1
H14B H 0.551377 0.645814 0.415284 0.077 Uiso 0.575(8) 1 calc R U P A 1
H14C H 0.373143 0.667990 0.417574 0.077 Uiso 0.575(8) 1 calc R U P A 1
C12B C 0.3309(16) 0.6410(13) 0.4913(10) 0.070(4) Uani 0.425(8) 1 d . . P A 2
H12D H 0.355579 0.722733 0.515130 0.084 Uiso 0.425(8) 1 calc R U P A 2
H12E H 0.320771 0.654353 0.438087 0.084 Uiso 0.425(8) 1 calc R U P A 2
H12F H 0.235789 0.608203 0.511135 0.084 Uiso 0.425(8) 1 calc R U P A 2
C13B C 0.6026(15) 0.5913(15) 0.4764(8) 0.068(4) Uani 0.425(8) 1 d . . P A 2
H13D H 0.627539 0.676335 0.495937 0.082 Uiso 0.425(8) 1 calc R U P A 2
H13E H 0.678949 0.529262 0.492204 0.082 Uiso 0.425(8) 1 calc R U P A 2
H13F H 0.600190 0.594844 0.422453 0.082 Uiso 0.425(8) 1 calc R U P A 2
C14B C 0.4623(18) 0.5214(15) 0.5894(8) 0.068(4) Uani 0.425(8) 1 d . . P A 2
H14D H 0.478444 0.601943 0.616172 0.082 Uiso 0.425(8) 1 calc R U P A 2
H14E H 0.369447 0.480715 0.606852 0.082 Uiso 0.425(8) 1 calc R U P A 2
H14F H 0.547614 0.463663 0.598073 0.082 Uiso 0.425(8) 1 calc R U P A 2
C21 C 0.0461(6) 0.4480(5) 0.3528(3) 0.0531(12) Uani 1 1 d . . . . .
C22 C 0.0527(8) 0.5935(7) 0.3568(5) 0.085(2) Uani 1 1 d . . . . .
H22A H -0.030667 0.630058 0.328351 0.102 Uiso 1 1 calc R U . . .
H22B H 0.044294 0.620798 0.408301 0.102 Uiso 1 1 calc R U . . .
H22C H 0.148585 0.623473 0.336464 0.102 Uiso 1 1 calc R U . . .
C23 C -0.0963(7) 0.4025(9) 0.3893(5) 0.109(3) Uani 1 1 d . . . . .
H23A H -0.183587 0.438292 0.363459 0.131 Uiso 1 1 calc R U . . .
H23B H -0.100658 0.308581 0.387600 0.131 Uiso 1 1 calc R U . . .
H23C H -0.097431 0.431079 0.440736 0.131 Uiso 1 1 calc R U . . .
C24 C 0.0495(10) 0.4086(10) 0.2736(4) 0.103(3) Uani 1 1 d . . . . .
H24A H -0.034400 0.449135 0.247367 0.124 Uiso 1 1 calc R U . . .
H24B H 0.144915 0.435826 0.251412 0.124 Uiso 1 1 calc R U . . .
H24C H 0.040294 0.315080 0.270086 0.124 Uiso 1 1 calc R U . . .
C31 C 0.4452(7) 0.1425(5) 0.3332(3) 0.0566(13) Uani 1 1 d . . . . .
C32 C 0.5981(7) 0.1787(6) 0.2990(4) 0.0722(17) Uani 1 1 d . . . . .
H32A H 0.621136 0.119744 0.258525 0.087 Uiso 1 1 calc R U . . .
H32B H 0.593492 0.266746 0.280209 0.087 Uiso 1 1 calc R U . . .
H32C H 0.676900 0.172602 0.336634 0.087 Uiso 1 1 calc R U . . .
C33 C 0.4537(9) 0.0080(5) 0.3654(5) 0.088(2) Uani 1 1 d . . . . .
H33A H 0.477773 -0.053381 0.326239 0.105 Uiso 1 1 calc R U . . .
H33B H 0.532341 0.005131 0.403215 0.105 Uiso 1 1 calc R U . . .
H33C H 0.356543 -0.014398 0.387471 0.105 Uiso 1 1 calc R U . . .
C34 C 0.3257(8) 0.1457(7) 0.2736(4) 0.0745(18) Uani 1 1 d . . . . .
H34A H 0.353536 0.086303 0.234046 0.089 Uiso 1 1 calc R U . . .
H34B H 0.228632 0.119944 0.294550 0.089 Uiso 1 1 calc R U . . .
H34C H 0.317836 0.232884 0.253764 0.089 Uiso 1 1 calc 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
Ge1 O2 1.882(3) . ?
Ge1 O1 1.883(3) . ?
Ge1 O3 1.886(3) . ?
Ge1 K1 3.4868(11) . ?
Ge1 K1 3.6867(11) 4_556 ?
K1 O2 2.546(3) . ?
K1 O1 2.769(3) 4_456 ?
K1 O3 2.875(3) 4_456 ?
K1 O3 3.053(3) . ?
K1 O1 3.082(4) . ?
K1 C23 3.278(7) 4_556 ?
K1 C12A 3.383(11) 4_456 ?
K1 C23 3.505(7) . ?
O1 C11 1.429(5) . ?
O2 C21 1.427(5) . ?
O3 C31 1.437(6) . ?
C11 C12B 1.435(14) . ?
C11 C12A 1.508(11) . ?
C11 C13B 1.525(13) . ?
C11 C13A 1.533(10) . ?
C11 C14B 1.564(16) . ?
C11 C14A 1.580(10) . ?
C21 C24 1.496(9) . ?
C21 C23 1.505(8) . ?
C21 C22 1.519(8) . ?
C31 C34 1.516(8) . ?
C31 C33 1.520(8) . ?
C31 C32 1.540(9) . ?

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
O2 Ge1 O1 93.54(15) . . ?
O2 Ge1 O3 93.97(14) . . ?
O1 Ge1 O3 84.40(13) . . ?
O2 Ge1 K1 45.39(10) . . ?
O1 Ge1 K1 61.81(11) . . ?
O3 Ge1 K1 60.91(10) . . ?
O2 Ge1 K1 121.91(10) . 4_556 ?
O1 Ge1 K1 47.00(10) . 4_556 ?
O3 Ge1 K1 50.29(10) . 4_556 ?
K1 Ge1 K1 76.586(12) . 4_556 ?
O2 K1 O1 120.85(11) . 4_456 ?
O2 K1 O3 118.69(11) . 4_456 ?
O1 K1 O3 53.26(9) 4_456 4_456 ?
O2 K1 O3 58.09(10) . . ?
O1 K1 O3 126.34(10) 4_456 . ?
O3 K1 O3 176.47(9) 4_456 . ?
O2 K1 O1 57.39(9) . . ?
O1 K1 O1 175.07(6) 4_456 . ?
O3 K1 O1 131.61(9) 4_456 . ?
O3 K1 O1 48.74(8) . . ?
O2 K1 C23 136.66(14) . 4_556 ?
O1 K1 C23 96.24(15) 4_456 4_556 ?
O3 K1 C23 100.81(15) 4_456 4_556 ?
O3 K1 C23 82.70(15) . 4_556 ?
O1 K1 C23 83.69(14) . 4_556 ?
O2 K1 C12A 106.7(2) . 4_456 ?
O1 K1 C12A 45.30(18) 4_456 4_456 ?
O3 K1 C12A 98.26(18) 4_456 4_456 ?
O3 K1 C12A 81.78(18) . 4_456 ?
O1 K1 C12A 129.94(18) . 4_456 ?
C23 K1 C12A 82.8(3) 4_556 4_456 ?
O2 K1 Ge1 31.74(7) . . ?
O1 K1 Ge1 143.59(8) 4_456 . ?
O3 K1 Ge1 145.08(7) 4_456 . ?
O3 K1 Ge1 32.67(6) . . ?
O1 K1 Ge1 32.58(6) . . ?
C23 K1 Ge1 104.92(12) 4_556 . ?
C12A K1 Ge1 107.96(18) 4_456 . ?
O2 K1 C23 41.76(13) . . ?
O1 K1 C23 84.30(14) 4_456 . ?
O3 K1 C23 81.37(15) 4_456 . ?
O3 K1 C23 95.12(15) . . ?
O1 K1 C23 95.57(13) . . ?
C23 K1 C23 177.63(10) 4_556 . ?
C12A K1 C23 96.0(3) 4_456 . ?
Ge1 K1 C23 73.48(11) . . ?
O2 K1 Ge1 138.22(8) . 4_456 ?
O1 K1 Ge1 29.83(7) 4_456 4_456 ?
O3 K1 Ge1 30.30(6) 4_456 4_456 ?
O3 K1 Ge1 151.01(7) . 4_456 ?
O1 K1 Ge1 154.67(7) . 4_456 ?
C23 K1 Ge1 85.08(12) 4_556 4_456 ?
C12A K1 Ge1 70.65(18) 4_456 4_456 ?
Ge1 K1 Ge1 169.77(3) . 4_456 ?
C23 K1 Ge1 96.46(11) . 4_456 ?
C11 O1 Ge1 122.8(3) . . ?
C11 O1 K1 115.4(3) . 4_556 ?
Ge1 O1 K1 103.17(13) . 4_556 ?
C11 O1 K1 125.1(3) . . ?
Ge1 O1 K1 85.60(12) . . ?
K1 O1 K1 98.81(10) 4_556 . ?
C21 O2 Ge1 127.1(3) . . ?
C21 O2 K1 130.0(3) . . ?
Ge1 O2 K1 102.86(13) . . ?
C31 O3 Ge1 119.9(3) . . ?
C31 O3 K1 111.4(3) . 4_556 ?
Ge1 O3 K1 99.41(13) . 4_556 ?
C31 O3 K1 135.3(3) . . ?
Ge1 O3 K1 86.42(11) . . ?
K1 O3 K1 97.20(9) 4_556 . ?
O1 C11 C12B 114.9(7) . . ?
O1 C11 C12A 112.1(5) . . ?
O1 C11 C13B 104.0(7) . . ?
C12B C11 C13B 114.0(10) . . ?
O1 C11 C13A 105.8(5) . . ?
C12A C11 C13A 110.3(7) . . ?
O1 C11 C14B 103.8(7) . . ?
C12B C11 C14B 110.7(10) . . ?
C13B C11 C14B 108.7(8) . . ?
O1 C11 C14A 114.3(5) . . ?
C12A C11 C14A 107.6(7) . . ?
C13A C11 C14A 106.6(7) . . ?
C11 C12A K1 86.6(5) . 4_556 ?
O2 C21 C24 111.9(5) . . ?
O2 C21 C23 105.6(5) . . ?
C24 C21 C23 110.8(6) . . ?
O2 C21 C22 110.9(5) . . ?
C24 C21 C22 108.6(6) . . ?
C23 C21 C22 109.0(6) . . ?
C21 C23 K1 164.3(4) . 4_456 ?
C21 C23 K1 82.6(3) . . ?
K1 C23 K1 81.89(17) 4_456 . ?
O3 C31 C34 111.7(5) . . ?
O3 C31 C33 107.1(5) . . ?
C34 C31 C33 109.2(6) . . ?
O3 C31 C32 110.1(4) . . ?
C34 C31 C32 108.9(6) . . ?
C33 C31 C32 109.7(5) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O2 Ge1 O1 C11 -95.7(4) . . . . ?
O3 Ge1 O1 C11 170.6(4) . . . . ?
K1 Ge1 O1 C11 -129.5(4) . . . . ?
K1 Ge1 O1 C11 132.5(4) 4_556 . . . ?
O2 Ge1 O1 K1 131.79(15) . . . 4_556 ?
O3 Ge1 O1 K1 38.15(14) . . . 4_556 ?
K1 Ge1 O1 K1 98.04(11) . . . 4_556 ?
O2 Ge1 O1 K1 33.76(12) . . . . ?
O3 Ge1 O1 K1 -59.89(11) . . . . ?
K1 Ge1 O1 K1 -98.04(11) 4_556 . . . ?
O1 Ge1 O2 C21 138.5(4) . . . . ?
O3 Ge1 O2 C21 -136.9(4) . . . . ?
K1 Ge1 O2 C21 -178.1(5) . . . . ?
K1 Ge1 O2 C21 178.4(4) 4_556 . . . ?
O1 Ge1 O2 K1 -43.47(15) . . . . ?
O3 Ge1 O2 K1 41.16(16) . . . . ?
K1 Ge1 O2 K1 -3.50(19) 4_556 . . . ?
O2 Ge1 O3 C31 109.4(4) . . . . ?
O1 Ge1 O3 C31 -157.4(4) . . . . ?
K1 Ge1 O3 C31 141.8(4) . . . . ?
K1 Ge1 O3 C31 -121.5(4) 4_556 . . . ?
O2 Ge1 O3 K1 -129.14(13) . . . 4_556 ?
O1 Ge1 O3 K1 -35.96(13) . . . 4_556 ?
K1 Ge1 O3 K1 -96.72(10) . . . 4_556 ?
O2 Ge1 O3 K1 -32.43(12) . . . . ?
O1 Ge1 O3 K1 60.75(12) . . . . ?
K1 Ge1 O3 K1 96.72(10) 4_556 . . . ?
Ge1 O1 C11 C12B 49.8(10) . . . . ?
K1 O1 C11 C12B 177.1(8) 4_556 . . . ?
K1 O1 C11 C12B -60.2(9) . . . . ?
Ge1 O1 C11 C12A -136.7(6) . . . . ?
K1 O1 C11 C12A -9.3(7) 4_556 . . . ?
K1 O1 C11 C12A 113.4(6) . . . . ?
Ge1 O1 C11 C13B -75.6(7) . . . . ?
K1 O1 C11 C13B 51.7(7) 4_556 . . . ?
K1 O1 C11 C13B 174.5(6) . . . . ?
Ge1 O1 C11 C13A 103.1(6) . . . . ?
K1 O1 C11 C13A -129.6(5) 4_556 . . . ?
K1 O1 C11 C13A -6.9(7) . . . . ?
Ge1 O1 C11 C14B 170.8(6) . . . . ?
K1 O1 C11 C14B -61.9(7) 4_556 . . . ?
K1 O1 C11 C14B 60.8(7) . . . . ?
Ge1 O1 C11 C14A -13.8(7) . . . . ?
K1 O1 C11 C14A 113.5(6) 4_556 . . . ?
K1 O1 C11 C14A -123.8(6) . . . . ?
O1 C11 C12A K1 6.9(5) . . . 4_556 ?
C13A C11 C12A K1 124.5(5) . . . 4_556 ?
C14A C11 C12A K1 -119.6(5) . . . 4_556 ?
Ge1 O2 C21 C24 55.8(7) . . . . ?
K1 O2 C21 C24 -121.7(6) . . . . ?
Ge1 O2 C21 C23 176.5(5) . . . . ?
K1 O2 C21 C23 -1.1(7) . . . . ?
Ge1 O2 C21 C22 -65.7(6) . . . . ?
K1 O2 C21 C22 116.8(5) . . . . ?
O2 C21 C23 K1 -9(2) . . . 4_456 ?
C24 C21 C23 K1 112(2) . . . 4_456 ?
C22 C21 C23 K1 -129(2) . . . 4_456 ?
O2 C21 C23 K1 0.6(4) . . . . ?
C24 C21 C23 K1 122.0(5) . . . . ?
C22 C21 C23 K1 -118.5(4) . . . . ?
Ge1 O3 C31 C34 -55.3(6) . . . . ?
K1 O3 C31 C34 -170.6(4) 4_556 . . . ?
K1 O3 C31 C34 63.4(7) . . . . ?
Ge1 O3 C31 C33 -174.9(4) . . . . ?
K1 O3 C31 C33 69.8(5) 4_556 . . . ?
K1 O3 C31 C33 -56.2(6) . . . . ?
Ge1 O3 C31 C32 65.9(6) . . . . ?
K1 O3 C31 C32 -49.4(5) 4_556 . . . ?
K1 O3 C31 C32 -175.4(3) . . . . ?

_refine_diff_density_max         0.272
_refine_diff_density_min         -0.400
_refine_diff_density_rms         0.057



_chemical_properties_physical    Moisture-sensitive
