#------------------------------------------------------------------------------
#$Date: 2016-03-23 14:44:38 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179304 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/01/4320141.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4320141
loop_
_publ_author_name
'Craig Downie'
'Jiang-Gao Mao'
'Arnold M. Guloy'
_publ_section_title
;
 Synthesis and Structure of
 [K+-(2,2)diaza-[18]-crown-6][K3Ge9].2Ethylenediamine: Stabilization of
 the Two-Dimensional Layer 2∞[K3Ge91-]
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4721
_journal_page_last               4725
_journal_paper_doi               10.1021/ic001107q
_journal_volume                  40
_journal_year                    2001
_chemical_formula_sum            'C16 H42 Ge9 K4 N6 O4'
_chemical_formula_weight         1192.27
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 114.7380(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   10.7398(9)
_cell_length_b                   15.8121(13)
_cell_length_c                   12.3259(10)
_cell_measurement_temperature    293(2)
_cell_volume                     1901.1(3)
_computing_structure_refinement  'SHELXL-93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0320
_diffrn_reflns_av_sigmaI/netI    0.0265
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            10813
_diffrn_reflns_theta_max         26.04
_diffrn_reflns_theta_min         1.82
_exptl_absorpt_coefficient_mu    7.478
_exptl_crystal_density_diffrn    2.083
_exptl_crystal_F_000             1152
_refine_diff_density_max         0.880
_refine_diff_density_min         -0.648
_refine_diff_density_rms         0.119
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.024
_refine_ls_goodness_of_fit_obs   1.053
_refine_ls_matrix_type           full
_refine_ls_number_parameters     184
_refine_ls_number_reflns         3888
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.027
_refine_ls_restrained_S_obs      1.053
_refine_ls_R_factor_all          0.0410
_refine_ls_R_factor_obs          0.0318
_refine_ls_shift/esd_max         0.001
_refine_ls_shift/esd_mean        0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0597P)²+0.5836P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.0898
_refine_ls_wR_factor_obs         0.0842
_reflns_number_observed          3279
_reflns_number_total             3889
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            ic001107q.cif
_cod_data_source_block           IC001107Q
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0597P)^2^+0.5836P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0597P)^2^+0.5836P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_sg_symbol_H-M      'P 1 21/c 1'
_cod_database_code               4320141
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
K1 K 0.72794(12) 0.2500 0.83180(11) 0.0316(3) Uani 1 d S .
K2 K 0.43388(9) 0.05393(5) 0.61820(8) 0.0341(2) Uani 1 d . .
K3 K 0.14085(15) 0.2500 0.45152(14) 0.0574(4) Uani 1 d S .
Ge1 Ge 0.43419(7) 0.2500 0.18645(5) 0.0392(2) Uani 1 d S .
Ge2 Ge 0.64894(5) 0.15802(3) 0.30433(4) 0.03611(13) Uani 1 d . .
Ge3 Ge 0.42349(4) 0.15519(2) 0.35189(4) 0.03000(12) Uani 1 d . .
Ge4 Ge 0.82192(6) 0.2500 0.47691(6) 0.0354(2) Uani 1 d S .
Ge5 Ge 0.66993(4) 0.14344(2) 0.52361(3) 0.02879(12) Uani 1 d . .
Ge6 Ge 0.49481(6) 0.2500 0.53799(5) 0.02610(14) Uani 1 d S .
N1 N 0.5249(5) 0.2500 0.9277(4) 0.0392(11) Uani 1 d S .
N2 N 0.9831(5) 0.2500 0.8219(5) 0.0489(14) Uani 1 d S .
O1 O 0.6165(3) 0.0887(2) 0.8663(2) 0.0414(7) Uani 1 d . .
O2 O 0.8900(3) 0.0935(2) 0.8862(3) 0.0505(8) Uani 1 d . .
C1 C 0.4418(5) 0.1736(3) 0.8846(4) 0.0516(12) Uani 1 d . .
H1A H 0.3974(5) 0.1748(3) 0.7980(4) 0.062 Uiso 1 calc R .
H1B H 0.3707(5) 0.1731(3) 0.9137(4) 0.062 Uiso 1 calc R .
C2 C 0.5231(5) 0.0959(3) 0.9234(4) 0.0556(13) Uani 1 d . .
H2A H 0.5749(5) 0.0967(3) 1.0095(4) 0.067 Uiso 1 calc R .
H2B H 0.4625(5) 0.0472(3) 0.9028(4) 0.067 Uiso 1 calc R .
C3 C 0.7111(6) 0.0216(3) 0.9151(4) 0.0612(15) Uani 1 d . .
H3A H 0.6620(6) -0.0316(3) 0.9027(4) 0.073 Uiso 1 calc R .
H3B H 0.7620(6) 0.0300(3) 1.0004(4) 0.073 Uiso 1 calc R .
C4 C 0.8083(6) 0.0185(3) 0.8564(4) 0.0605(15) Uani 1 d . .
H4A H 0.8668(6) -0.0309(3) 0.8836(4) 0.073 Uiso 1 calc R .
H4B H 0.7573(6) 0.0146(3) 0.7704(4) 0.073 Uiso 1 calc R .
C5 C 0.9798(5) 0.0953(4) 0.8279(4) 0.066(2) Uani 1 d . .
H5A H 0.9266(5) 0.0943(4) 0.7420(4) 0.079 Uiso 1 calc R .
H5B H 1.0382(5) 0.0456(4) 0.8501(4) 0.079 Uiso 1 calc R .
C6 C 1.0660(5) 0.1732(4) 0.8625(5) 0.069(2) Uani 1 d . .
H6A H 1.1162(5) 0.1750(4) 0.9487(5) 0.083 Uiso 1 calc R .
H6B H 1.1323(5) 0.1713(4) 0.8280(5) 0.083 Uiso 1 calc R .
N3 N 0.1459(5) 0.0689(3) 0.6037(5) 0.078(2) Uani 1 d . .
C7 C 0.0530(5) 0.0299(3) 0.4949(5) 0.0512(12) Uani 1 d . .
H7A H 0.1064(5) -0.0013(3) 0.4615(5) 0.061 Uiso 1 calc R .
H7B H 0.0047(5) 0.0743(3) 0.4386(5) 0.061 Uiso 1 calc R .
N4 N -0.0289(11) 0.1554(5) 0.2409(8) 0.063(2) Uiso 0.567(7) d P 1
C8 C -0.0853(12) 0.2077(7) 0.1407(10) 0.069(2) Uiso 0.567(7) d P 1
N4' N 0.0454(14) 0.1608(7) 0.2459(10) 0.063(2) Uiso 0.433(7) d P 2
C8' C -0.0006(16) 0.2098(8) 0.1458(13) 0.069(2) Uiso 0.433(7) d P 2
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'
Ge Ge 0.1547 1.8001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N2 K1 N1 160.4(2) . . ?
N2 K1 O1 118.37(6) . . ?
N1 K1 O1 60.94(6) . . ?
N2 K1 O1 118.37(7) . 4_565 ?
N1 K1 O1 60.94(6) . 4_565 ?
O1 K1 O1 121.51(12) . 4_565 ?
N2 K1 O2 60.76(8) . 4_565 ?
N1 K1 O2 112.59(8) . 4_565 ?
O1 K1 O2 160.33(9) . 4_565 ?
O1 K1 O2 58.08(9) 4_565 4_565 ?
N2 K1 O2 60.76(8) . . ?
N1 K1 O2 112.59(8) . . ?
O1 K1 O2 58.08(9) . . ?
O1 K1 O2 160.33(9) 4_565 . ?
O2 K1 O2 114.84(14) 4_565 . ?
N2 K1 Ge6 104.45(11) . . ?
N1 K1 Ge6 95.14(10) . . ?
O1 K1 Ge6 89.49(6) . . ?
O1 K1 Ge6 89.49(6) 4_565 . ?
O2 K1 Ge6 109.97(6) 4_565 . ?
O2 K1 Ge6 109.97(6) . . ?
N2 K1 Ge5 73.83(10) . . ?
N1 K1 Ge5 123.44(9) . . ?
O1 K1 Ge5 81.87(6) . . ?
O1 K1 Ge5 126.96(6) 4_565 . ?
O2 K1 Ge5 114.69(7) 4_565 . ?
O2 K1 Ge5 72.58(6) . . ?
Ge6 K1 Ge5 40.16(2) . . ?
N2 K1 Ge5 73.83(10) . 4_565 ?
N1 K1 Ge5 123.44(9) . 4_565 ?
O1 K1 Ge5 126.96(6) . 4_565 ?
O1 K1 Ge5 81.87(6) 4_565 4_565 ?
O2 K1 Ge5 72.58(6) 4_565 4_565 ?
O2 K1 Ge5 114.69(7) . 4_565 ?
Ge6 K1 Ge5 40.16(2) . 4_565 ?
Ge5 K1 Ge5 50.37(2) . 4_565 ?
N2 K1 K2 116.31(7) . . ?
N1 K1 K2 76.69(7) . . ?
O1 K1 K2 40.63(6) . . ?
O1 K1 K2 117.67(7) 4_565 . ?
O2 K1 K2 159.04(7) 4_565 . ?
O2 K1 K2 75.67(6) . . ?
Ge6 K1 K2 49.34(2) . . ?
Ge5 K1 K2 49.01(2) . . ?
Ge5 K1 K2 86.60(3) 4_565 . ?
N2 K1 K2 116.31(7) . 4_565 ?
N1 K1 K2 76.69(7) . 4_565 ?
O1 K1 K2 117.67(7) . 4_565 ?
O1 K1 K2 40.63(6) 4_565 4_565 ?
O2 K1 K2 75.67(6) 4_565 4_565 ?
O2 K1 K2 159.04(7) . 4_565 ?
Ge6 K1 K2 49.34(2) . 4_565 ?
Ge5 K1 K2 86.60(3) . 4_565 ?
Ge5 K1 K2 49.01(2) 4_565 4_565 ?
K2 K1 K2 89.02(3) . 4_565 ?
O1 K2 N3 105.63(11) . . ?
O1 K2 Ge6 90.35(6) . . ?
N3 K2 Ge6 103.14(11) . . ?
O1 K2 Ge5 90.57(6) . . ?
N3 K2 Ge5 144.25(11) . . ?
Ge6 K2 Ge5 43.976(14) . . ?
O1 K2 Ge5 128.51(6) . 3_656 ?
N3 K2 Ge5 86.37(9) . 3_656 ?
Ge6 K2 Ge5 136.31(3) . 3_656 ?
Ge5 K2 Ge5 108.41(2) . 3_656 ?
O1 K2 C2 23.57(10) . . ?
N3 K2 C2 82.17(13) . . ?
Ge6 K2 C2 97.99(8) . . ?
Ge5 K2 C2 111.52(8) . . ?
Ge5 K2 C2 125.65(8) 3_656 . ?
O1 K2 Ge3 89.73(6) . 3_656 ?
N3 K2 Ge3 117.26(10) . 3_656 ?
Ge6 K2 Ge3 137.94(3) . 3_656 ?
Ge5 K2 Ge3 93.96(2) . 3_656 ?
Ge5 K2 Ge3 43.055(13) 3_656 3_656 ?
C2 K2 Ge3 98.58(9) . 3_656 ?
O1 K2 Ge3 128.44(6) . . ?
N3 K2 Ge3 105.60(11) . . ?
Ge6 K2 Ge3 42.942(14) . . ?
Ge5 K2 Ge3 43.078(13) . . ?
Ge5 K2 Ge3 93.37(2) 3_656 . ?
C2 K2 Ge3 140.87(8) . . ?
Ge3 K2 Ge3 110.52(2) 3_656 . ?
O1 K2 Ge2 91.67(6) . 3_656 ?
N3 K2 Ge2 74.70(11) . 3_656 ?
Ge6 K2 Ge2 177.38(3) . 3_656 ?
Ge5 K2 Ge2 137.64(3) . 3_656 ?
Ge5 K2 Ge2 42.607(13) 3_656 3_656 ?
C2 K2 Ge2 83.25(8) . 3_656 ?
Ge3 K2 Ge2 43.774(13) 3_656 3_656 ?
Ge3 K2 Ge2 135.88(3) . 3_656 ?
O1 K2 K2 122.84(7) . 3_656 ?
N3 K2 K2 129.60(10) . 3_656 ?
Ge6 K2 K2 90.38(3) . 3_656 ?
Ge5 K2 K2 54.44(2) . 3_656 ?
Ge5 K2 K2 53.97(2) 3_656 3_656 ?
C2 K2 K2 144.34(10) . 3_656 ?
Ge3 K2 K2 55.42(2) 3_656 3_656 ?
Ge3 K2 K2 55.10(2) . 3_656 ?
Ge2 K2 K2 89.93(3) 3_656 3_656 ?
O1 K2 K3 113.82(6) . . ?
N3 K2 K3 52.27(11) . . ?
Ge6 K2 K3 52.58(2) . . ?
Ge5 K2 K3 92.11(3) . . ?
Ge5 K2 K3 112.77(3) 3_656 . ?
C2 K2 K3 101.09(10) . . ?
Ge3 K2 K3 155.61(3) 3_656 . ?
Ge3 K2 K3 60.39(3) . . ?
Ge2 K2 K3 124.95(3) 3_656 . ?
K2 K2 K3 111.30(4) 3_656 . ?
O1 K2 K1 40.80(6) . . ?
N3 K2 K1 115.92(9) . . ?
Ge6 K2 K1 50.02(2) . . ?
Ge5 K2 K1 58.59(2) . . ?
Ge5 K2 K1 156.27(3) 3_656 . ?
C2 K2 K1 55.03(7) . . ?
Ge3 K2 K1 114.58(3) 3_656 . ?
Ge3 K2 K1 88.46(2) . . ?
Ge2 K2 K1 132.17(3) 3_656 . ?
K2 K2 K1 109.91(3) 3_656 . ?
K3 K2 K1 88.65(2) . . ?
N4' K3 N4' 63.0(5) . 4_565 ?
N4 K3 N4 62.4(3) . 4_565 ?
N4' K3 N3 150.1(3) . 4_565 ?
N4' K3 N3 89.4(3) 4_565 4_565 ?
N4 K3 N3 142.0(2) . 4_565 ?
N4 K3 N3 85.3(2) 4_565 4_565 ?
N4' K3 N3 89.4(3) . . ?
N4' K3 N3 150.1(3) 4_565 . ?
N4 K3 N3 85.3(2) . . ?
N4 K3 N3 142.0(2) 4_565 . ?
N3 K3 N3 114.2(2) 4_565 . ?
N4' K3 C8' 21.0(3) . . ?
N4' K3 C8' 42.0(3) 4_565 . ?
N3 K3 C8' 130.4(2) 4_565 . ?
N3 K3 C8' 109.9(2) . . ?
N4' K3 C8' 42.0(3) . 4_565 ?
N4' K3 C8' 21.0(3) 4_565 4_565 ?
N3 K3 C8' 109.9(2) 4_565 4_565 ?
N3 K3 C8' 130.4(2) . 4_565 ?
C8' K3 C8' 21.0(4) . 4_565 ?
N4' K3 Ge6 102.9(3) . . ?
N4' K3 Ge6 102.9(3) 4_565 . ?
N4 K3 Ge6 118.1(2) . . ?
N4 K3 Ge6 118.1(2) 4_565 . ?
N3 K3 Ge6 93.87(9) 4_565 . ?
N3 K3 Ge6 93.87(9) . . ?
C8' K3 Ge6 104.9(3) . . ?
C8' K3 Ge6 104.9(3) 4_565 . ?
N4' K3 Ge4 94.7(3) . 1_455 ?
N4' K3 Ge4 94.7(3) 4_565 1_455 ?
N4 K3 Ge4 79.1(2) . 1_455 ?
N4 K3 Ge4 79.1(2) 4_565 1_455 ?
N3 K3 Ge4 75.32(8) 4_565 1_455 ?
N3 K3 Ge4 75.32(8) . 1_455 ?
C8' K3 Ge4 95.5(3) . 1_455 ?
C8' K3 Ge4 95.5(3) 4_565 1_455 ?
Ge6 K3 Ge4 159.34(5) . 1_455 ?
N4' K3 K2 138.0(3) . 4_565 ?
N4' K3 K2 89.2(3) 4_565 4_565 ?
N4 K3 K2 150.1(2) . 4_565 ?
N4 K3 K2 96.7(2) 4_565 4_565 ?
N3 K3 K2 44.67(8) 4_565 4_565 ?
N3 K3 K2 120.31(9) . 4_565 ?
C8' K3 K2 123.5(2) . 4_565 ?
C8' K3 K2 106.7(2) 4_565 4_565 ?
Ge6 K3 K2 50.64(2) . 4_565 ?
Ge4 K3 K2 119.86(3) 1_455 4_565 ?
N4' K3 K2 89.2(3) . . ?
N4' K3 K2 138.0(3) 4_565 . ?
N4 K3 K2 96.7(2) . . ?
N4 K3 K2 150.1(2) 4_565 . ?
N3 K3 K2 120.31(9) 4_565 . ?
N3 K3 K2 44.67(8) . . ?
C8' K3 K2 106.7(2) . . ?
C8' K3 K2 123.5(2) 4_565 . ?
Ge6 K3 K2 50.64(2) . . ?
Ge4 K3 K2 119.86(3) 1_455 . ?
K2 K3 K2 92.81(4) 4_565 . ?
Ge3 Ge1 Ge3 71.31(2) 4_565 . ?
Ge3 Ge1 Ge2 63.50(2) 4_565 4_565 ?
Ge3 Ge1 Ge2 101.93(2) . 4_565 ?
Ge3 Ge1 Ge2 101.93(2) 4_565 . ?
Ge3 Ge1 Ge2 63.50(2) . . ?
Ge2 Ge1 Ge2 68.13(3) 4_565 . ?
Ge1 Ge2 Ge4 107.89(2) . . ?
Ge1 Ge2 Ge5 107.37(2) . . ?
Ge4 Ge2 Ge5 58.93(2) . . ?
Ge1 Ge2 Ge3 57.81(2) . . ?
Ge4 Ge2 Ge3 103.19(2) . . ?
Ge5 Ge2 Ge3 58.501(14) . . ?
Ge1 Ge2 Ge2 55.934(13) . 4_565 ?
Ge4 Ge2 Ge2 56.056(13) . 4_565 ?
Ge5 Ge2 Ge2 95.035(12) . 4_565 ?
Ge3 Ge2 Ge2 90.945(11) . 4_565 ?
Ge1 Ge2 K2 113.53(2) . 3_656 ?
Ge4 Ge2 K2 117.52(2) . 3_656 ?
Ge5 Ge2 K2 65.21(2) . 3_656 ?
Ge3 Ge2 K2 66.23(2) . 3_656 ?
Ge2 Ge2 K2 155.127(14) 4_565 3_656 ?
Ge1 Ge3 Ge6 105.76(2) . . ?
Ge1 Ge3 Ge5 108.51(2) . . ?
Ge6 Ge3 Ge5 59.79(2) . . ?
Ge1 Ge3 Ge2 58.69(2) . . ?
Ge6 Ge3 Ge2 102.87(2) . . ?
Ge5 Ge3 Ge2 58.97(2) . . ?
Ge1 Ge3 K2 117.30(2) . 3_656 ?
Ge6 Ge3 K2 119.26(2) . 3_656 ?
Ge5 Ge3 K2 66.94(2) . 3_656 ?
Ge2 Ge3 K2 70.00(2) . 3_656 ?
Ge1 Ge3 K2 169.85(2) . . ?
Ge6 Ge3 K2 64.14(2) . . ?
Ge5 Ge3 K2 66.22(2) . . ?
Ge2 Ge3 K2 120.77(2) . . ?
K2 Ge3 K2 69.48(2) 3_656 . ?
Ge5 Ge4 Ge5 81.81(2) . 4_565 ?
Ge5 Ge4 Ge2 60.96(2) . . ?
Ge5 Ge4 Ge2 104.24(2) 4_565 . ?
Ge5 Ge4 Ge2 104.24(2) . 4_565 ?
Ge5 Ge4 Ge2 60.96(2) 4_565 4_565 ?
Ge2 Ge4 Ge2 67.89(3) . 4_565 ?
Ge5 Ge4 K3 137.890(14) . 1_655 ?
Ge5 Ge4 K3 137.890(14) 4_565 1_655 ?
Ge2 Ge4 K3 108.13(3) . 1_655 ?
Ge2 Ge4 K3 108.13(3) 4_565 1_655 ?
Ge4 Ge5 Ge6 97.84(2) . . ?
Ge4 Ge5 Ge3 107.13(2) . . ?
Ge6 Ge5 Ge3 59.34(2) . . ?
Ge4 Ge5 Ge2 60.11(2) . . ?
Ge6 Ge5 Ge2 105.17(2) . . ?
Ge3 Ge5 Ge2 62.53(2) . . ?
Ge4 Ge5 K2 162.65(2) . . ?
Ge6 Ge5 K2 65.91(2) . . ?
Ge3 Ge5 K2 70.70(2) . . ?
Ge2 Ge5 K2 128.00(2) . . ?
Ge4 Ge5 K2 124.60(2) . 3_656 ?
Ge6 Ge5 K2 121.54(2) . 3_656 ?
Ge3 Ge5 K2 70.01(2) . 3_656 ?
Ge2 Ge5 K2 72.19(2) . 3_656 ?
K2 Ge5 K2 71.59(2) . 3_656 ?
Ge4 Ge5 K1 94.37(2) . . ?
Ge6 Ge5 K1 58.93(2) . . ?
Ge3 Ge5 K1 116.50(2) . . ?
Ge2 Ge5 K1 149.45(2) . . ?
K2 Ge5 K1 72.41(2) . . ?
K2 Ge5 K1 138.00(2) 3_656 . ?
Ge3 Ge6 Ge3 71.25(2) . 4_565 ?
Ge3 Ge6 Ge5 105.79(2) . 4_565 ?
Ge3 Ge6 Ge5 60.87(2) 4_565 4_565 ?
Ge3 Ge6 Ge5 60.87(2) . . ?
Ge3 Ge6 Ge5 105.79(2) 4_565 . ?
Ge5 Ge6 Ge5 81.32(2) 4_565 . ?
Ge3 Ge6 K2 140.23(2) . 4_565 ?
Ge3 Ge6 K2 72.92(2) 4_565 4_565 ?
Ge5 Ge6 K2 70.11(2) 4_565 4_565 ?
Ge5 Ge6 K2 148.01(3) . 4_565 ?
Ge3 Ge6 K2 72.92(2) . . ?
Ge3 Ge6 K2 140.23(2) 4_565 . ?
Ge5 Ge6 K2 148.01(3) 4_565 . ?
Ge5 Ge6 K2 70.11(2) . . ?
K2 Ge6 K2 131.54(3) 4_565 . ?
Ge3 Ge6 K1 138.89(2) . . ?
Ge3 Ge6 K1 138.89(2) 4_565 . ?
Ge5 Ge6 K1 80.91(2) 4_565 . ?
Ge5 Ge6 K1 80.91(2) . . ?
K2 Ge6 K1 80.65(2) 4_565 . ?
K2 Ge6 K1 80.65(2) . . ?
Ge3 Ge6 K3 81.26(3) . . ?
Ge3 Ge6 K3 81.26(3) 4_565 . ?
Ge5 Ge6 K3 135.16(2) 4_565 . ?
Ge5 Ge6 K3 135.16(2) . . ?
K2 Ge6 K3 76.78(2) 4_565 . ?
K2 Ge6 K3 76.78(2) . . ?
K1 Ge6 K3 122.81(3) . . ?
C1 N1 C1 111.3(5) . 4_565 ?
C1 N1 K1 107.6(2) . . ?
C1 N1 K1 107.6(2) 4_565 . ?
C6 N2 C6 112.0(6) 4_565 . ?
C6 N2 K1 116.9(3) 4_565 . ?
C6 N2 K1 116.9(3) . . ?
C3 O1 C2 111.7(4) . . ?
C3 O1 K2 110.6(3) . . ?
C2 O1 K2 103.0(3) . . ?
C3 O1 K1 116.8(3) . . ?
C2 O1 K1 114.3(2) . . ?
K2 O1 K1 98.57(8) . . ?
C5 O2 C4 111.1(4) . . ?
C5 O2 K1 109.3(3) . . ?
C4 O2 K1 113.5(3) . . ?
N1 C1 C2 112.6(4) . . ?
O1 C2 C1 110.2(3) . . ?
O1 C2 K2 53.4(2) . . ?
C1 C2 K2 87.2(3) . . ?
O1 C3 C4 109.9(4) . . ?
O2 C4 C3 109.0(4) . . ?
O2 C5 C6 110.0(4) . . ?
N2 C6 C5 111.8(4) . . ?
C7 N3 K2 108.4(3) . . ?
C7 N3 K3 90.1(3) . . ?
K2 N3 K3 83.06(11) . . ?
N3 C7 C7 116.2(5) . 3_556 ?
C8 N4 K3 111.4(6) . . ?
C8 C8 N4 126.3(6) 4_565 . ?
C8' N4' K3 113.9(8) . . ?
C8' C8' N4' 124.6(7) 4_565 . ?
C8' C8' K3 79.5(2) 4_565 . ?
N4' C8' K3 45.1(6) . . ?
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
K1 N2 2.793(5) . ?
K1 N1 2.882(4) . ?
K1 O1 2.923(3) . ?
K1 O1 2.923(3) 4_565 ?
K1 O2 2.938(3) 4_565 ?
K1 O2 2.938(3) . ?
K1 Ge6 3.4345(14) . ?
K1 Ge5 3.9594(12) . ?
K1 Ge5 3.9594(12) 4_565 ?
K1 K2 4.4225(12) . ?
K1 K2 4.4225(12) 4_565 ?
K2 O1 2.912(3) . ?
K2 N3 3.032(5) . ?
K2 Ge6 3.3998(8) . ?
K2 Ge5 3.5019(9) . ?
K2 Ge5 3.5224(9) 3_656 ?
K2 C2 3.535(5) . ?
K2 Ge3 3.5977(9) 3_656 ?
K2 Ge3 3.6117(9) . ?
K2 Ge2 3.6941(9) 3_656 ?
K2 K2 4.108(2) 3_656 ?
K2 K3 4.2808(13) . ?
K3 N4' 2.699(11) . ?
K3 N4' 2.699(11) 4_565 ?
K3 N4 2.888(9) . ?
K3 N4 2.888(9) 4_565 ?
K3 N3 3.411(6) 4_565 ?
K3 N3 3.411(6) . ?
K3 C8' 3.482(14) . ?
K3 C8' 3.482(14) 4_565 ?
K3 Ge6 3.492(2) . ?
K3 Ge4 3.568(2) 1_455 ?
K3 K2 4.2808(13) 4_565 ?
Ge1 Ge3 2.5720(6) 4_565 ?
Ge1 Ge3 2.5720(6) . ?
Ge1 Ge2 2.5964(7) 4_565 ?
Ge1 Ge2 2.5964(7) . ?
Ge2 Ge4 2.6046(7) . ?
Ge2 Ge5 2.6267(6) . ?
Ge2 Ge3 2.7197(6) . ?
Ge2 Ge2 2.9087(9) 4_565 ?
Ge2 K2 3.6941(9) 3_656 ?
Ge3 Ge6 2.5740(6) . ?
Ge3 Ge5 2.6136(6) . ?
Ge3 K2 3.5977(9) 3_656 ?
Ge4 Ge5 2.5731(6) . ?
Ge4 Ge5 2.5731(6) 4_565 ?
Ge4 Ge2 2.6046(7) 4_565 ?
Ge4 K3 3.568(2) 1_655 ?
Ge5 Ge6 2.5858(6) . ?
Ge5 K2 3.5224(9) 3_656 ?
Ge6 Ge3 2.5740(6) 4_565 ?
Ge6 Ge5 2.5858(6) 4_565 ?
Ge6 K2 3.3998(8) 4_565 ?
N1 C1 1.464(5) . ?
N1 C1 1.464(5) 4_565 ?
N2 C6 1.464(7) 4_565 ?
N2 C6 1.464(6) . ?
O1 C3 1.417(6) . ?
O1 C2 1.451(5) . ?
O2 C5 1.423(6) . ?
O2 C4 1.427(6) . ?
C1 C2 1.467(7) . ?
C3 C4 1.500(8) . ?
C5 C6 1.493(8) . ?
N3 C7 1.433(7) . ?
C7 C7 1.526(9) 3_556 ?
N4 C8 1.396(13) . ?
C8 C8 1.34(2) 4_565 ?
N4' C8' 1.36(2) . ?
C8' C8' 1.27(3) 4_565 ?
