# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2022

####################################################################### 
# 
# 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_xhl
_database_code_depnum_ccdc_archive 'CCDC 2111631'
loop_
_audit_author_name
_audit_author_address
'Hong-Lei Xu xhl'
;nankai university
China
;
_audit_update_record             
;
2021-09-24 deposited with the CCDC.	2022-02-09 downloaded from the CCDC.
;
_audit_creation_date             2020-11-29
_audit_creation_method           
;
Olex2 1.2-beta
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelxl_version_number           2013-2
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'Co2 Ge17 Ni, 4(C18 H36 K N2 O6)'
_chemical_formula_sum            'C72 H144 Co2 Ge17 K4 N8 Ni O24'
_chemical_formula_weight         3072.94
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 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'
Co Co -2.3653 3.6143 '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'
K K 0.3868 1.0657 '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'
Ni Ni -3.0029 0.5091 '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'

_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.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_H-M_alt        'P b c a'
_space_group_name_Hall           '-P 2ac 2ab'
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'
'-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                   16.6463(3)
_cell_length_b                   25.7355(5)
_cell_length_c                   28.7503(6)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     12316.7(4)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9626
_cell_measurement_temperature    100.00(10)
_cell_measurement_theta_max      75.3190
_cell_measurement_theta_min      4.3280
_shelx_estimated_absorpt_T_max   0.258
_shelx_estimated_absorpt_T_min   0.218
_exptl_absorpt_coefficient_mu    8.432
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.43350
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.84a (Rigaku Oxford Diffraction, 2020)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            'metallic blackish black'
_exptl_crystal_colour_lustre     metallic
_exptl_crystal_colour_modifier   blackish
_exptl_crystal_colour_primary    black
_exptl_crystal_density_diffrn    1.657
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             6104
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.22
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0880
_diffrn_reflns_av_unetI/netI     0.0587
_diffrn_reflns_Laue_measured_fraction_full 0.985
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       30
_diffrn_reflns_limit_k_min       -27
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            68568
_diffrn_reflns_point_group_measured_fraction_full 0.985
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         66.999
_diffrn_reflns_theta_min         3.763
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100.00(10)
_diffrn_detector                 'Hybrid Pixel Array Detector'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -29.00  32.00   0.50    0.50    --    0.00 -82.00 150.00  122
  2  ω    -29.00  -3.00   0.50    0.50    --    0.00 -82.00-180.00   52
  3  ω     19.00  79.00   0.50    0.50    --    0.00  38.00 -30.00  120
  4  ω     -9.00  17.00   0.50    0.50    --    0.00  38.00 -30.00   52
  5  ω    -38.00  18.00   0.50    0.50    --    0.00 -82.00 -90.00  112
  6  ω     15.00 105.00   0.50    0.50    --  101.60 -57.00  60.00  180
  7  ω     32.00  68.00   0.50    0.50    --  101.60 -82.00   0.00   72
  8  ω     14.00 134.00   0.50    0.50    --  101.60 -82.00  60.00  240
  9  ω     89.00 114.00   0.50    0.50    --  101.60 -82.00 120.00   50
 10  ω     77.00 127.00   0.50    0.50    --  101.60 -82.00 -90.00  100
 11  ω     22.00  48.00   0.50    0.50    --  101.60 -82.00 -90.00   52
 12  ω     73.00 184.00   0.50    0.50    --  101.60  19.00 -30.00  222
 13  ω    100.00 126.00   0.50    0.50    --  101.60 -82.00-150.00   52
 14  ω    111.00 136.00   0.50    0.50    --  101.60  82.00-150.00   50
 15  ω     45.00 125.00   0.50    0.50    --  101.60 -26.00  99.00  160
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB AFC12 (RINC): Kappa single'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0053995000
_diffrn_orient_matrix_UB_12      -0.0563239000
_diffrn_orient_matrix_UB_13      0.0178787000
_diffrn_orient_matrix_UB_21      0.0924406000
_diffrn_orient_matrix_UB_22      -0.0036170000
_diffrn_orient_matrix_UB_23      0.0002163000
_diffrn_orient_matrix_UB_31      0.0013833000
_diffrn_orient_matrix_UB_32      0.0199073000
_diffrn_orient_matrix_UB_33      0.0504875000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'Rotating-anode X-ray tube (dual wavelength)'
_diffrn_source_type              'Rigaku (Cu) X-ray DW Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                7407
_reflns_number_total             10979
_reflns_odcompleteness_completeness 99.87
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.40.84a (Rigaku OD, 2020)'
_computing_data_collection       'CrysAlisPro 1.171.40.84a (Rigaku OD, 2020)'
_computing_data_reduction        'CrysAlisPro 1.171.40.84a (Rigaku OD, 2020)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         2.210
_refine_diff_density_min         -1.163
_refine_diff_density_rms         0.153
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     649
_refine_ls_number_reflns         10979
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.1038
_refine_ls_R_factor_gt           0.0771
_refine_ls_restrained_S_all      1.088
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
;
 w=1/[σ²(Fo²)+(0.1416P)²+18.0175P]
 where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2221
_refine_ls_wR_factor_ref         0.2433
_refine_special_details          
;
 ?
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H,H) groups
2. Shared sites
{Ni1, Ge}
3. Uiso/Uaniso restraints and constraints
Uanis(Ni1) = Uanis(Ge)
4. Others
 Fixed Sof: Ge01(0.5) Ge02(0.5) Ge00(0.5) Ge2A(0.5) Ge2(0.5) Ge3(0.5) Ge4(0.5)
 Ge5(0.5) Ge6(0.5) Ge7(0.5) Ge8(0.5) Ge1A(0.5) Ge0A(0.5) Ge3A(0.5) Ge10(0.5)
 Ge9(0.5) Ge(0.5) Ni1(0.5)
5.a Secondary CH2 refined with riding coordinates:
 C00W(H00A,H00B), C00X(H00G,H00H), C00Y(H00C,H00D), C00Z(H00E,H00F), C010(H01A,
 H01B), C011(H01C,H01D), C012(H01E,H01F), C013(H01G,H01H), C014(H01I,H01J),
 C015(H0AA,H), C016(H01K,H01L), C017(H01M,H01N), C018(H01O,H01P), C019(H01Q,
 H01R), C01A(H01S,H01T), C01B(H01U,H01V), C01C(H01W,H01X), C01D(H01Y,HA),
 C01E(H1AA,HB), C01F(H2AA,HC), C01G(H01Z,HD), C01H(H3AA,HE), C01I(H01,HF),
 C01J(H4AA,HG), C01K(H5AA,HH), C01L(H6AA,HI), C01M(H7AA,HJ), C01N(H8AA,HK),
 C01O(H9AA,HL), C01P(H0BA,HM), C01Q(H1BA,HN), C01R(H2BA,HO), C01S(H3BA,HP),
 C01T(H4BA,HQ), C01U(H5BA,HR), C01V(H6BA,HS)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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
Ge01 Ge 0.3832(5) 0.4385(2) 0.0396(3) 0.0592(18) Uani 0.5 1 d . . P A 1
Ge02 Ge 0.5738(3) 0.4989(3) 0.0928(2) 0.0589(18) Uani 0.5 1 d . . P A 1
Ge00 Ge 0.53450(15) 0.58403(10) 0.04799(9) 0.0426(6) Uani 0.5 1 d . . P A 1
K006 K 0.47447(9) 0.36178(5) 0.36093(5) 0.0302(3) Uani 1 1 d . . . . .
K007 K 0.55282(8) 0.32212(6) 0.60259(5) 0.0324(3) Uani 1 1 d . . . . .
Ge2A Ge 0.31088(13) 0.51651(9) 0.09281(10) 0.0496(6) Uani 0.5 1 d . . P A 1
Ge2 Ge 0.37022(10) 0.59822(6) 0.09045(7) 0.0395(4) Uani 0.5 1 d . . P . .
Ge3 Ge 0.43042(17) 0.46145(12) 0.12857(9) 0.0572(6) Uani 0.5 1 d . . P A 1
Ge4 Ge 0.37671(11) 0.59392(7) 0.04017(8) 0.0513(5) Uani 0.5 1 d . . P A 1
Ge5 Ge 0.33834(11) 0.50442(8) -0.00194(7) 0.0470(5) Uani 0.5 1 d . . P . .
Ge6 Ge 0.46132(15) 0.54575(10) 0.14910(8) 0.0577(6) Uani 0.5 1 d . . P A .
Ge7 Ge 0.43651(15) 0.56669(10) 0.12532(9) 0.0577(6) Uani 0.5 1 d . . P A .
Ge8 Ge 0.32298(12) 0.53380(10) 0.02422(8) 0.0634(6) Uani 0.5 1 d . . P A .
O00G O 0.3704(3) 0.27390(18) 0.35764(18) 0.0400(12) Uani 1 1 d . . . . .
O00H O 0.6993(3) 0.3763(2) 0.59800(17) 0.0404(12) Uani 1 1 d . . . . .
O00I O 0.5368(3) 0.26136(19) 0.37416(18) 0.0403(12) Uani 1 1 d . . . . .
O00J O 0.5547(3) 0.3867(2) 0.27688(17) 0.0393(12) Uani 1 1 d . . . . .
O00K O 0.5756(3) 0.4138(2) 0.42355(17) 0.0416(12) Uani 1 1 d . . . . .
O00L O 0.3977(3) 0.42395(19) 0.29360(17) 0.0389(11) Uani 1 1 d . . . . .
O00M O 0.6621(3) 0.30740(18) 0.52545(16) 0.0368(11) Uani 1 1 d . . . . .
O00N O 0.4107(3) 0.40949(19) 0.44025(17) 0.0404(12) Uani 1 1 d . . . . .
O00O O 0.5585(3) 0.2222(2) 0.6417(2) 0.0490(14) Uani 1 1 d . . . . .
O00P O 0.4049(3) 0.3066(2) 0.5567(2) 0.0506(14) Uani 1 1 d . . . . .
O00Q O 0.5423(3) 0.3089(2) 0.70135(19) 0.0516(14) Uani 1 1 d . . . . .
O00R O 0.4435(3) 0.4046(2) 0.5963(2) 0.0500(14) Uani 1 1 d . . . . .
N00S N 0.2986(3) 0.3783(2) 0.3674(2) 0.0334(13) Uani 1 1 d . . . . .
N00T N 0.6496(4) 0.3454(2) 0.3535(2) 0.0380(14) Uani 1 1 d . . . . .
N00U N 0.5333(4) 0.2308(2) 0.5393(2) 0.0447(16) Uani 1 1 d . . . . .
N00V N 0.5772(4) 0.4118(3) 0.6645(2) 0.0462(16) Uani 1 1 d . . . . .
C00W C 0.4028(5) 0.2289(3) 0.3797(3) 0.0397(17) Uani 1 1 d . . . . .
H00A H 0.3694 0.1989 0.3730 0.048 Uiso 1 1 calc R . . . .
H00B H 0.4044 0.2339 0.4131 0.048 Uiso 1 1 calc R . . . .
C00X C 0.7356(4) 0.3799(3) 0.5528(2) 0.0387(17) Uani 1 1 d . . . . .
H00G H 0.7891 0.3945 0.5555 0.046 Uiso 1 1 calc R . . . .
H00H H 0.7039 0.4026 0.5331 0.046 Uiso 1 1 calc R . . . .
C00Y C 0.2573(4) 0.3305(3) 0.3505(3) 0.0418(18) Uani 1 1 d . . . . .
H00C H 0.2629 0.3285 0.3170 0.050 Uiso 1 1 calc R . . . .
H00D H 0.2005 0.3332 0.3575 0.050 Uiso 1 1 calc R . . . .
C00Z C 0.2771(5) 0.3889(3) 0.4166(3) 0.0420(18) Uani 1 1 d . . . . .
H00E H 0.2796 0.3567 0.4340 0.050 Uiso 1 1 calc R . . . .
H00F H 0.2223 0.4015 0.4179 0.050 Uiso 1 1 calc R . . . .
C010 C 0.6172(4) 0.2508(3) 0.3619(3) 0.0448(18) Uani 1 1 d . . . . .
H01A H 0.6213 0.2454 0.3286 0.054 Uiso 1 1 calc R . . . .
H01B H 0.6351 0.2193 0.3774 0.054 Uiso 1 1 calc R . . . .
C011 C 0.4862(5) 0.2200(3) 0.3614(3) 0.0458(19) Uani 1 1 d . . . . .
H01C H 0.5072 0.1878 0.3739 0.055 Uiso 1 1 calc R . . . .
H01D H 0.4846 0.2171 0.3278 0.055 Uiso 1 1 calc R . . . .
C012 C 0.6582(5) 0.3984(4) 0.4259(3) 0.049(2) Uani 1 1 d . . . . .
H01E H 0.6629 0.3672 0.4446 0.058 Uiso 1 1 calc R . . . .
H01F H 0.6894 0.4256 0.4407 0.058 Uiso 1 1 calc R . . . .
C013 C 0.3138(4) 0.4208(3) 0.2896(3) 0.0408(17) Uani 1 1 d . . . . .
H01G H 0.2991 0.3887 0.2741 0.049 Uiso 1 1 calc R . . . .
H01H H 0.2940 0.4496 0.2711 0.049 Uiso 1 1 calc R . . . .
C014 C 0.5451(5) 0.4214(3) 0.4680(3) 0.048(2) Uani 1 1 d . . . . .
H01I H 0.5798 0.4448 0.4851 0.058 Uiso 1 1 calc R . . . .
H01J H 0.5434 0.3885 0.4844 0.058 Uiso 1 1 calc R . . . .
C015 C 0.7400(5) 0.3277(3) 0.5319(3) 0.0445(18) Uani 1 1 d . . . . .
H0AA H 0.7674 0.3296 0.5021 0.053 Uiso 1 1 calc R . . . .
H H 0.7706 0.3048 0.5520 0.053 Uiso 1 1 calc R . . . .
C016 C 0.2892(5) 0.2815(3) 0.3715(3) 0.0465(19) Uani 1 1 d . . . . .
H01K H 0.2861 0.2836 0.4052 0.056 Uiso 1 1 calc R . . . .
H01L H 0.2568 0.2522 0.3615 0.056 Uiso 1 1 calc R . . . .
C017 C 0.6910(5) 0.3882(3) 0.3779(3) 0.050(2) Uani 1 1 d . . . . .
H01M H 0.6861 0.4196 0.3595 0.060 Uiso 1 1 calc R . . . .
H01N H 0.7476 0.3799 0.3803 0.060 Uiso 1 1 calc R . . . .
C018 C 0.3316(5) 0.4282(3) 0.4391(3) 0.048(2) Uani 1 1 d . . . . .
H01O H 0.3297 0.4605 0.4218 0.057 Uiso 1 1 calc R . . . .
H01P H 0.3133 0.4351 0.4706 0.057 Uiso 1 1 calc R . . . .
C019 C 0.6390(5) 0.3876(3) 0.2764(3) 0.048(2) Uani 1 1 d . . . . .
H01Q H 0.6577 0.4207 0.2884 0.058 Uiso 1 1 calc R . . . .
H01R H 0.6580 0.3842 0.2447 0.058 Uiso 1 1 calc R . . . .
C01A C 0.2759(5) 0.4224(3) 0.3377(3) 0.0410(17) Uani 1 1 d . . . . .
H01S H 0.2916 0.4544 0.3530 0.049 Uiso 1 1 calc R . . . .
H01T H 0.2179 0.4228 0.3343 0.049 Uiso 1 1 calc R . . . .
C01B C 0.6695(5) 0.2958(3) 0.3763(3) 0.050(2) Uani 1 1 d . . . . .
H01U H 0.6651 0.3003 0.4097 0.060 Uiso 1 1 calc R . . . .
H01V H 0.7250 0.2872 0.3694 0.060 Uiso 1 1 calc R . . . .
C01C C 0.5203(5) 0.4294(3) 0.2525(3) 0.049(2) Uani 1 1 d . . . . .
H01W H 0.5443 0.4318 0.2219 0.059 Uiso 1 1 calc R . . . .
H01X H 0.5320 0.4613 0.2691 0.059 Uiso 1 1 calc R . . . .
C01D C 0.6728(5) 0.3447(3) 0.3051(3) 0.0467(19) Uani 1 1 d . . . . .
H01Y H 0.6561 0.3119 0.2917 0.056 Uiso 1 1 calc R . . . .
HA H 0.7309 0.3463 0.3034 0.056 Uiso 1 1 calc R . . . .
C01E C 0.4075(5) 0.2758(3) 0.5158(3) 0.051(2) Uani 1 1 d . . . . .
H1AA H 0.4370 0.2940 0.4917 0.062 Uiso 1 1 calc R . . . .
HB H 0.3534 0.2695 0.5047 0.062 Uiso 1 1 calc R . . . .
C01F C 0.6645(5) 0.2574(3) 0.5063(3) 0.048(2) Uani 1 1 d . . . . .
H2AA H 0.6920 0.2340 0.5274 0.058 Uiso 1 1 calc R . . . .
HC H 0.6941 0.2581 0.4772 0.058 Uiso 1 1 calc R . . . .
C01G C 0.4337(5) 0.4234(4) 0.2480(3) 0.050(2) Uani 1 1 d . . . . .
H01Z H 0.4121 0.4516 0.2294 0.060 Uiso 1 1 calc R . . . .
HD H 0.4215 0.3909 0.2324 0.060 Uiso 1 1 calc R . . . .
C01H C 0.5606(6) 0.1850(3) 0.5656(3) 0.053(2) Uani 1 1 d . . . . .
H3AA H 0.6188 0.1855 0.5668 0.064 Uiso 1 1 calc R . . . .
HE H 0.5448 0.1541 0.5486 0.064 Uiso 1 1 calc R . . . .
C01I C 0.4627(5) 0.4437(3) 0.4648(3) 0.053(2) Uani 1 1 d . . . . .
H01 H 0.4418 0.4496 0.4959 0.063 Uiso 1 1 calc R . . . .
HF H 0.4649 0.4769 0.4489 0.063 Uiso 1 1 calc R . . . .
C01J C 0.4484(5) 0.2247(3) 0.5267(4) 0.059(2) Uani 1 1 d . . . . .
H4AA H 0.4203 0.2080 0.5522 0.070 Uiso 1 1 calc R . . . .
HG H 0.4445 0.2022 0.4998 0.070 Uiso 1 1 calc R . . . .
C01K C 0.5292(6) 0.1809(3) 0.6140(3) 0.059(3) Uani 1 1 d . . . . .
H5AA H 0.4709 0.1820 0.6134 0.071 Uiso 1 1 calc R . . . .
HH H 0.5455 0.1480 0.6274 0.071 Uiso 1 1 calc R . . . .
C01L C 0.5804(5) 0.2379(3) 0.4976(3) 0.048(2) Uani 1 1 d . . . . .
H6AA H 0.5529 0.2623 0.4775 0.057 Uiso 1 1 calc R . . . .
HI H 0.5835 0.2050 0.4813 0.057 Uiso 1 1 calc R . . . .
C01M C 0.7060(5) 0.4254(3) 0.6210(3) 0.049(2) Uani 1 1 d . . . . .
H7AA H 0.6827 0.4525 0.6018 0.058 Uiso 1 1 calc R . . . .
HJ H 0.7621 0.4337 0.6262 0.058 Uiso 1 1 calc R . . . .
C01N C 0.6624(6) 0.4228(3) 0.6669(3) 0.054(2) Uani 1 1 d . . . . .
H8AA H 0.6876 0.3961 0.6858 0.065 Uiso 1 1 calc R . . . .
HK H 0.6696 0.4557 0.6829 0.065 Uiso 1 1 calc R . . . .
C01O C 0.5345(6) 0.4557(4) 0.6433(4) 0.063(3) Uani 1 1 d . . . . .
H9AA H 0.5629 0.4663 0.6155 0.075 Uiso 1 1 calc R . . . .
HL H 0.5352 0.4847 0.6648 0.075 Uiso 1 1 calc R . . . .
C01P C 0.3608(5) 0.3525(4) 0.5493(3) 0.052(2) Uani 1 1 d . . . . .
H0BA H 0.3053 0.3437 0.5425 0.062 Uiso 1 1 calc R . . . .
HM H 0.3826 0.3708 0.5227 0.062 Uiso 1 1 calc R . . . .
C01Q C 0.4479(6) 0.4436(4) 0.6307(3) 0.063(3) Uani 1 1 d . . . . .
H1BA H 0.4193 0.4323 0.6582 0.075 Uiso 1 1 calc R . . . .
HN H 0.4221 0.4749 0.6192 0.075 Uiso 1 1 calc R . . . .
C01R C 0.3638(5) 0.3863(4) 0.5903(3) 0.062(3) Uani 1 1 d . . . . .
H2BA H 0.3276 0.4154 0.5862 0.074 Uiso 1 1 calc R . . . .
HO H 0.3471 0.3671 0.6177 0.074 Uiso 1 1 calc R . . . .
C01S C 0.5457(7) 0.4008(4) 0.7116(3) 0.065(3) Uani 1 1 d . . . . .
H3BA H 0.4875 0.4021 0.7106 0.078 Uiso 1 1 calc R . . . .
HP H 0.5637 0.4280 0.7326 0.078 Uiso 1 1 calc R . . . .
C01T C 0.5299(6) 0.2192(4) 0.6885(3) 0.063(3) Uani 1 1 d . . . . .
H4BA H 0.5422 0.1852 0.7012 0.076 Uiso 1 1 calc R . . . .
HQ H 0.4720 0.2235 0.6887 0.076 Uiso 1 1 calc R . . . .
C01U C 0.5662(6) 0.2588(4) 0.7174(3) 0.064(3) Uani 1 1 d . . . . .
H5BA H 0.5494 0.2542 0.7494 0.076 Uiso 1 1 calc R . . . .
HR H 0.6242 0.2558 0.7161 0.076 Uiso 1 1 calc R . . . .
C01V C 0.5707(6) 0.3499(4) 0.7306(3) 0.064(3) Uani 1 1 d . . . . .
H6BA H 0.6289 0.3484 0.7326 0.077 Uiso 1 1 calc R . . . .
HS H 0.5491 0.3456 0.7617 0.077 Uiso 1 1 calc R . . . .
Ge1A Ge 0.32879(19) 0.50302(10) 0.11816(10) 0.0617(8) Uani 0.5 1 d . . P A 2
Ge0A Ge 0.52147(17) 0.59733(11) 0.06653(11) 0.0554(8) Uani 0.5 1 d . . P A 2
Ge3A Ge 0.4650(3) 0.44595(11) 0.11719(11) 0.0881(12) Uani 0.5 1 d . . P A 2
Ge10 Ge 0.3890(5) 0.4286(3) 0.0491(3) 0.0570(17) Uani 0.5 1 d . . P A 2
Co Co 0.44417(7) 0.51598(5) 0.06145(5) 0.0426(4) Uani 1 1 d . . . A 2
Ge9 Ge 0.5737(5) 0.5031(4) 0.0936(3) 0.102(3) Uani 0.5 1 d . . P A 2
Ge Ge 0.47281(7) 0.54143(4) -0.01539(5) 0.0557(4) Uani 0.5 1 d . . P A 2
Ni1 Ni 0.47281(7) 0.54143(4) -0.01539(5) 0.0557(4) Uani 0.5 1 d . . P A .


_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
Ge01 Ge00 2.925(8) 5_665 ?
Ge01 Ge2A 2.796(7) . ?
Ge01 Ge3 2.741(7) . ?
Ge01 Ge5 2.204(8) . ?
Ge01 Ge8 2.685(7) . ?
Ge01 Ni1 2.549(8) 5_665 ?
Ge02 Ge00 2.624(7) . ?
Ge02 Ge3 2.772(6) . ?
Ge02 Ge6 2.752(6) . ?
Ge02 Ni1 2.577(7) 5_665 ?
Ge00 Ge01 2.925(8) 5_665 ?
Ge00 Ge4 2.648(3) . ?
Ge00 Ge7 2.793(3) . ?
K006 O00G 2.850(5) . ?
K006 O00I 2.811(5) . ?
K006 O00J 2.835(5) . ?
K006 O00K 2.806(5) . ?
K006 O00L 2.818(5) . ?
K006 O00N 2.799(5) . ?
K006 N00S 2.965(6) . ?
K006 N00T 2.954(6) . ?
K007 O00H 2.812(5) . ?
K007 O00M 2.893(5) . ?
K007 O00O 2.809(5) . ?
K007 O00P 2.823(6) . ?
K007 O00Q 2.865(6) . ?
K007 O00R 2.801(6) . ?
K007 N00U 2.988(7) . ?
K007 N00V 2.943(7) . ?
Ge2A Ge2 2.324(3) . ?
Ge2A Ge3 2.650(4) . ?
Ge2A Ge4 2.731(3) . ?
Ge2A Ge5 2.780(4) . ?
Ge2A Ge7 2.629(3) . ?
Ge2A Ge8 2.031(4) . ?
Ge2 Ge4 1.454(3) . ?
Ge2 Ge6 2.639(3) . ?
Ge2 Ge7 1.697(4) . ?
Ge2 Ge8 2.644(3) . ?
Ge2 Ge1A 2.667(3) . ?
Ge2 Ge0A 2.610(3) . ?
Ge2 Co 2.587(2) . ?
Ge3 Ge6 2.306(4) . ?
Ge3 Ge7 2.712(4) . ?
Ge4 Ge5 2.680(3) . ?
Ge4 Ge7 2.734(4) . ?
Ge4 Ge8 1.845(3) . ?
Ge5 Ge8 1.097(3) . ?
Ge5 Ge10 2.582(7) . ?
Ge5 Co 2.552(2) . ?
Ge5 Ge 2.463(2) . ?
Ge6 Ge7 0.964(3) . ?
Ge6 Ge1A 2.621(4) . ?
Ge6 Ge0A 2.898(4) . ?
Ge6 Ge3A 2.728(4) . ?
Ge6 Co 2.649(3) . ?
Ge6 Ge9 2.693(8) . ?
Ge7 Ge1A 2.438(3) . ?
Ge7 Ge0A 2.341(4) . ?
Ge7 Co 2.257(2) . ?
Ge8 Ge1A 2.816(4) . ?
Ge8 Co 2.329(2) . ?
Ge8 Ge 2.749(3) . ?
O00G C00W 1.426(9) . ?
O00G C016 1.424(9) . ?
O00H C00X 1.437(8) . ?
O00H C01M 1.433(9) . ?
O00I C010 1.411(9) . ?
O00I C011 1.405(9) . ?
O00J C019 1.403(8) . ?
O00J C01C 1.422(9) . ?
O00K C012 1.432(9) . ?
O00K C014 1.388(10) . ?
O00L C013 1.405(8) . ?
O00L C01G 1.443(9) . ?
O00M C015 1.411(9) . ?
O00M C01F 1.401(9) . ?
O00N C018 1.403(9) . ?
O00N C01I 1.423(9) . ?
O00O C01K 1.414(10) . ?
O00O C01T 1.428(11) . ?
O00P C01E 1.416(10) . ?
O00P C01P 1.407(10) . ?
O00Q C01U 1.424(10) . ?
O00Q C01V 1.431(11) . ?
O00R C01Q 1.410(10) . ?
O00R C01R 1.417(10) . ?
N00S C00Y 1.490(9) . ?
N00S C00Z 1.485(9) . ?
N00S C01A 1.469(9) . ?
N00T C017 1.477(9) . ?
N00T C01B 1.472(10) . ?
N00T C01D 1.442(10) . ?
N00U C01H 1.472(9) . ?
N00U C01J 1.468(10) . ?
N00U C01L 1.445(11) . ?
N00V C01N 1.448(11) . ?
N00V C01O 1.466(11) . ?
N00V C01S 1.480(11) . ?
C00W C011 1.500(11) . ?
C00X C015 1.474(11) . ?
C00Y C016 1.496(11) . ?
C00Z C018 1.504(11) . ?
C010 C01B 1.507(11) . ?
C012 C017 1.508(11) . ?
C013 C01A 1.519(10) . ?
C014 C01I 1.490(11) . ?
C019 C01D 1.489(11) . ?
C01C C01G 1.455(11) . ?
C01E C01J 1.514(12) . ?
C01F C01L 1.507(11) . ?
C01H C01K 1.491(13) . ?
C01M C01N 1.508(11) . ?
C01O C01Q 1.518(14) . ?
C01P C01R 1.466(12) . ?
C01S C01V 1.481(14) . ?
C01T C01U 1.446(14) . ?
Ge1A Ge3A 2.702(5) . ?
Ge1A Ge10 2.936(8) . ?
Ge1A Co 2.541(3) . ?
Ge0A Co 2.462(3) . ?
Ge0A Ge9 2.691(10) . ?
Ge0A Ge 2.876(3) . ?
Ge3A Ge10 2.374(9) . ?
Ge3A Co 2.436(3) . ?
Ge3A Ge9 2.428(10) . ?
Ge10 Co 2.455(7) . ?
Ge10 Ge 2.613(8) 5_665 ?
Ge10 Ni1 2.613(8) 5_665 ?
Co Ge9 2.369(8) . ?
Co Ge 2.4180(18) 5_665 ?
Co Ge 2.3529(19) . ?
Co Ni1 2.4180(18) 5_665 ?
Ge9 Ge 2.639(7) 5_665 ?
Ge9 Ni1 2.639(7) 5_665 ?
Ge Ge10 2.613(8) 5_665 ?
Ge Co 2.4179(18) 5_665 ?
Ge Ge9 2.639(7) 5_665 ?
Ge Ge 2.480(2) 5_665 ?
Ge Ni1 2.480(2) 5_665 ?

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
Ge2A Ge01 Ge00 144.6(3) . 5_665 ?
Ge3 Ge01 Ge00 135.4(3) . 5_665 ?
Ge3 Ge01 Ge2A 57.19(15) . . ?
Ge5 Ge01 Ge00 81.1(2) . 5_665 ?
Ge5 Ge01 Ge2A 66.33(19) . . ?
Ge5 Ge01 Ge3 115.9(2) . . ?
Ge5 Ge01 Ge8 23.38(10) . . ?
Ge5 Ge01 Ni1 90.9(3) . 5_665 ?
Ge8 Ge01 Ge00 102.4(3) . 5_665 ?
Ge8 Ge01 Ge2A 43.45(13) . . ?
Ge8 Ge01 Ge3 93.68(19) . . ?
Ni1 Ge01 Ge00 50.55(15) 5_665 5_665 ?
Ni1 Ge01 Ge2A 114.2(2) 5_665 . ?
Ni1 Ge01 Ge3 86.6(2) 5_665 . ?
Ni1 Ge01 Ge8 97.0(2) 5_665 . ?
Ge00 Ge02 Ge3 104.9(2) . . ?
Ge00 Ge02 Ge6 75.7(2) . . ?
Ge6 Ge02 Ge3 49.35(12) . . ?
Ni1 Ge02 Ge00 80.60(18) 5_665 . ?
Ni1 Ge02 Ge3 85.4(2) 5_665 . ?
Ni1 Ge02 Ge6 118.6(2) 5_665 . ?
Ge02 Ge00 Ge01 98.1(2) . 5_665 ?
Ge02 Ge00 Ge4 111.67(16) . . ?
Ge02 Ge00 Ge7 67.75(14) . . ?
Ge4 Ge00 Ge01 114.25(17) . 5_665 ?
Ge4 Ge00 Ge7 60.25(9) . . ?
Ge7 Ge00 Ge01 157.97(16) . 5_665 ?
O00G K006 N00S 61.02(15) . . ?
O00G K006 N00T 118.94(16) . . ?
O00I K006 O00G 59.94(15) . . ?
O00I K006 O00J 98.61(15) . . ?
O00I K006 O00L 141.48(15) . . ?
O00I K006 N00S 119.19(15) . . ?
O00I K006 N00T 60.93(16) . . ?
O00J K006 O00G 115.97(15) . . ?
O00J K006 N00S 119.10(16) . . ?
O00J K006 N00T 60.34(15) . . ?
O00K K006 O00G 139.89(16) . . ?
O00K K006 O00I 97.50(16) . . ?
O00K K006 O00J 98.97(15) . . ?
O00K K006 O00L 116.23(15) . . ?
O00K K006 N00S 118.99(16) . . ?
O00K K006 N00T 61.47(17) . . ?
O00L K006 O00G 98.76(15) . . ?
O00L K006 O00J 59.97(14) . . ?
O00L K006 N00S 60.90(15) . . ?
O00L K006 N00T 118.61(16) . . ?
O00N K006 O00G 98.31(15) . . ?
O00N K006 O00I 115.66(15) . . ?
O00N K006 O00J 140.70(16) . . ?
O00N K006 O00K 59.70(16) . . ?
O00N K006 O00L 97.97(15) . . ?
O00N K006 N00S 60.78(16) . . ?
O00N K006 N00T 119.75(16) . . ?
N00T K006 N00S 179.41(17) . . ?
O00H K007 O00M 58.92(14) . . ?
O00H K007 O00P 143.60(16) . . ?
O00H K007 O00Q 99.12(16) . . ?
O00H K007 N00U 117.08(18) . . ?
O00H K007 N00V 61.32(17) . . ?
O00M K007 N00U 59.93(17) . . ?
O00M K007 N00V 118.66(17) . . ?
O00O K007 O00H 116.31(16) . . ?
O00O K007 O00M 99.53(16) . . ?
O00O K007 O00P 95.00(17) . . ?
O00O K007 O00Q 59.76(17) . . ?
O00O K007 N00U 61.79(17) . . ?
O00O K007 N00V 118.15(18) . . ?
O00P K007 O00M 99.86(16) . . ?
O00P K007 O00Q 113.18(17) . . ?
O00P K007 N00U 60.61(18) . . ?
O00P K007 N00V 120.95(19) . . ?
O00Q K007 O00M 141.49(16) . . ?
O00Q K007 N00U 120.17(18) . . ?
O00Q K007 N00V 60.18(18) . . ?
O00R K007 O00H 100.67(16) . . ?
O00R K007 O00M 117.29(15) . . ?
O00R K007 O00O 137.85(17) . . ?
O00R K007 O00P 60.69(17) . . ?
O00R K007 O00Q 96.55(17) . . ?
O00R K007 N00U 119.07(18) . . ?
O00R K007 N00V 62.24(19) . . ?
N00V K007 N00U 178.3(2) . . ?
Ge2 Ge2A Ge01 116.77(18) . . ?
Ge2 Ge2A Ge3 100.13(12) . . ?
Ge2 Ge2A Ge4 32.16(7) . . ?
Ge2 Ge2A Ge5 90.16(10) . . ?
Ge2 Ge2A Ge7 39.47(9) . . ?
Ge3 Ge2A Ge01 60.36(17) . . ?
Ge3 Ge2A Ge4 107.68(10) . . ?
Ge3 Ge2A Ge5 101.35(10) . . ?
Ge4 Ge2A Ge01 92.73(18) . . ?
Ge4 Ge2A Ge5 58.18(8) . . ?
Ge5 Ge2A Ge01 46.56(17) . . ?
Ge7 Ge2A Ge01 101.81(16) . . ?
Ge7 Ge2A Ge3 61.81(11) . . ?
Ge7 Ge2A Ge4 61.29(9) . . ?
Ge7 Ge2A Ge5 105.82(10) . . ?
Ge8 Ge2A Ge01 65.37(18) . . ?
Ge8 Ge2A Ge2 74.42(12) . . ?
Ge8 Ge2A Ge3 114.79(12) . . ?
Ge8 Ge2A Ge4 42.50(10) . . ?
Ge8 Ge2A Ge5 19.43(8) . . ?
Ge8 Ge2A Ge7 99.14(12) . . ?
Ge2A Ge2 Ge6 76.27(10) . . ?
Ge2A Ge2 Ge8 47.73(10) . . ?
Ge4 Ge2 Ge2A 89.53(13) . . ?
Ge4 Ge2 Ge6 123.62(12) . . ?
Ge4 Ge2 Ge7 120.17(14) . . ?
Ge4 Ge2 Ge8 42.14(10) . . ?
Ge6 Ge2 Ge8 108.07(9) . . ?
Ge6 Ge2 Ge1A 59.19(10) . . ?
Ge7 Ge2 Ge2A 80.01(12) . . ?
Ge7 Ge2 Ge6 5.48(10) . . ?
Ge7 Ge2 Ge8 108.60(11) . . ?
Ge7 Ge2 Ge1A 63.42(12) . . ?
Ge7 Ge2 Ge0A 61.60(12) . . ?
Ge7 Ge2 Co 59.33(9) . . ?
Ge8 Ge2 Ge1A 64.04(9) . . ?
Ge0A Ge2 Ge6 67.02(10) . . ?
Ge0A Ge2 Ge8 95.26(9) . . ?
Ge0A Ge2 Ge1A 108.67(11) . . ?
Co Ge2 Ge6 60.91(6) . . ?
Co Ge2 Ge8 52.87(6) . . ?
Co Ge2 Ge1A 57.84(7) . . ?
Co Ge2 Ge0A 56.55(7) . . ?
Ge01 Ge3 Ge02 88.6(2) . . ?
Ge2A Ge3 Ge01 62.45(17) . . ?
Ge2A Ge3 Ge02 108.47(17) . . ?
Ge2A Ge3 Ge7 58.72(10) . . ?
Ge6 Ge3 Ge01 120.35(18) . . ?
Ge6 Ge3 Ge02 64.88(18) . . ?
Ge6 Ge3 Ge2A 76.34(12) . . ?
Ge6 Ge3 Ge7 20.13(7) . . ?
Ge7 Ge3 Ge01 101.15(17) . . ?
Ge7 Ge3 Ge02 66.90(17) . . ?
Ge00 Ge4 Ge2A 106.31(10) . . ?
Ge00 Ge4 Ge5 101.08(9) . . ?
Ge00 Ge4 Ge7 62.51(9) . . ?
Ge2A Ge4 Ge7 57.52(9) . . ?
Ge2 Ge4 Ge00 89.81(13) . . ?
Ge2 Ge4 Ge2A 58.32(10) . . ?
Ge2 Ge4 Ge5 119.80(12) . . ?
Ge2 Ge4 Ge7 32.46(9) . . ?
Ge2 Ge4 Ge8 105.96(14) . . ?
Ge5 Ge4 Ge2A 61.81(8) . . ?
Ge5 Ge4 Ge7 105.72(9) . . ?
Ge8 Ge4 Ge00 114.91(11) . . ?
Ge8 Ge4 Ge2A 48.05(11) . . ?
Ge8 Ge4 Ge5 18.42(8) . . ?
Ge8 Ge4 Ge7 100.61(12) . . ?
Ge01 Ge5 Ge2A 67.10(19) . . ?
Ge01 Ge5 Ge4 109.62(17) . . ?
Ge4 Ge5 Ge2A 60.01(8) . . ?
Ge8 Ge5 Ge01 103.8(2) . . ?
Ge8 Ge5 Ge2A 38.03(17) . . ?
Ge8 Ge5 Ge4 32.12(15) . . ?
Ge8 Ge5 Ge10 102.0(2) . . ?
Ge8 Ge5 Co 65.85(14) . . ?
Ge8 Ge5 Ge 93.04(17) . . ?
Co Ge5 Ge10 57.13(17) . . ?
Ge Ge5 Ge10 94.86(19) . . ?
Ge Ge5 Co 55.92(6) . . ?
Ge2 Ge6 Ge02 103.85(15) . . ?
Ge2 Ge6 Ge0A 56.00(9) . . ?
Ge2 Ge6 Ge3A 106.24(11) . . ?
Ge2 Ge6 Co 58.56(7) . . ?
Ge2 Ge6 Ge9 103.23(19) . . ?
Ge3 Ge6 Ge02 65.77(17) . . ?
Ge3 Ge6 Ge2 100.93(11) . . ?
Ge7 Ge6 Ge02 96.9(2) . . ?
Ge7 Ge6 Ge2 9.69(18) . . ?
Ge7 Ge6 Ge3 104.4(2) . . ?
Ge7 Ge6 Ge1A 68.5(2) . . ?
Ge7 Ge6 Ge0A 46.4(2) . . ?
Ge7 Ge6 Ge3A 107.3(2) . . ?
Ge7 Ge6 Co 55.99(17) . . ?
Ge7 Ge6 Ge9 96.0(3) . . ?
Ge1A Ge6 Ge2 60.93(9) . . ?
Ge1A Ge6 Ge0A 101.82(11) . . ?
Ge1A Ge6 Ge3A 60.63(12) . . ?
Ge1A Ge6 Co 57.66(8) . . ?
Ge1A Ge6 Ge9 102.26(19) . . ?
Ge3A Ge6 Ge0A 98.51(11) . . ?
Co Ge6 Ge0A 52.45(7) . . ?
Co Ge6 Ge3A 53.86(8) . . ?
Co Ge6 Ge9 52.63(16) . . ?
Ge9 Ge6 Ge0A 57.4(2) . . ?
Ge9 Ge6 Ge3A 53.2(2) . . ?
Ge2A Ge7 Ge00 105.06(11) . . ?
Ge2A Ge7 Ge3 59.48(9) . . ?
Ge2A Ge7 Ge4 61.19(9) . . ?
Ge2 Ge7 Ge00 80.39(13) . . ?
Ge2 Ge7 Ge2A 60.52(11) . . ?
Ge2 Ge7 Ge3 118.26(13) . . ?
Ge2 Ge7 Ge4 27.37(8) . . ?
Ge2 Ge7 Ge1A 78.07(13) . . ?
Ge2 Ge7 Ge0A 78.77(15) . . ?
Ge2 Ge7 Co 80.36(12) . . ?
Ge3 Ge7 Ge00 102.05(10) . . ?
Ge3 Ge7 Ge4 105.86(10) . . ?
Ge4 Ge7 Ge00 57.25(9) . . ?
Ge6 Ge7 Ge00 113.8(2) . . ?
Ge6 Ge7 Ge2A 108.6(2) . . ?
Ge6 Ge7 Ge2 164.8(3) . . ?
Ge6 Ge7 Ge3 55.5(2) . . ?
Ge6 Ge7 Ge4 159.2(2) . . ?
Ge6 Ge7 Ge1A 90.0(2) . . ?
Ge6 Ge7 Ge0A 116.2(3) . . ?
Ge6 Ge7 Co 103.3(2) . . ?
Ge0A Ge7 Ge1A 127.58(13) . . ?
Co Ge7 Ge1A 65.42(8) . . ?
Co Ge7 Ge0A 64.72(9) . . ?
Ge2A Ge8 Ge01 71.18(18) . . ?
Ge2A Ge8 Ge2 57.85(9) . . ?
Ge2 Ge8 Ge01 110.06(15) . . ?
Ge2 Ge8 Ge1A 58.37(8) . . ?
Ge2 Ge8 Ge 89.06(8) . . ?
Ge4 Ge8 Ge01 122.94(17) . . ?
Ge4 Ge8 Ge2A 89.45(13) . . ?
Ge4 Ge8 Ge2 31.91(9) . . ?
Ge5 Ge8 Ge01 52.9(2) . . ?
Ge5 Ge8 Ge2A 122.5(2) . . ?
Ge5 Ge8 Ge2 148.94(18) . . ?
Ge5 Ge8 Ge4 129.5(2) . . ?
Ge5 Ge8 Ge1A 117.1(2) . . ?
Ge5 Ge8 Co 88.70(15) . . ?
Ge5 Ge8 Ge 63.48(15) . . ?
Co Ge8 Ge2 62.29(7) . . ?
Co Ge8 Ge1A 58.28(9) . . ?
Co Ge8 Ge 54.45(6) . . ?
Ge Ge8 Ge1A 112.72(10) . . ?
C00W O00G K006 113.6(4) . . ?
C016 O00G K006 117.3(4) . . ?
C016 O00G C00W 110.3(5) . . ?
C00X O00H K007 116.0(4) . . ?
C01M O00H K007 118.9(4) . . ?
C01M O00H C00X 109.2(6) . . ?
C010 O00I K006 119.6(4) . . ?
C011 O00I K006 116.1(4) . . ?
C011 O00I C010 111.0(6) . . ?
C019 O00J K006 118.9(4) . . ?
C019 O00J C01C 112.7(6) . . ?
C01C O00J K006 113.9(4) . . ?
C012 O00K K006 118.3(4) . . ?
C014 O00K K006 116.0(4) . . ?
C014 O00K C012 110.2(6) . . ?
C013 O00L K006 118.3(4) . . ?
C013 O00L C01G 109.8(6) . . ?
C01G O00L K006 115.5(4) . . ?
C015 O00M K007 115.5(4) . . ?
C01F O00M K007 116.1(4) . . ?
C01F O00M C015 111.4(6) . . ?
C018 O00N K006 119.2(4) . . ?
C018 O00N C01I 111.7(6) . . ?
C01I O00N K006 116.4(5) . . ?
C01K O00O K007 116.7(4) . . ?
C01K O00O C01T 112.1(7) . . ?
C01T O00O K007 114.4(5) . . ?
C01E O00P K007 116.1(5) . . ?
C01P O00P K007 114.0(5) . . ?
C01P O00P C01E 111.1(6) . . ?
C01U O00Q K007 114.3(5) . . ?
C01U O00Q C01V 112.6(7) . . ?
C01V O00Q K007 118.4(5) . . ?
C01Q O00R K007 117.4(5) . . ?
C01Q O00R C01R 111.8(7) . . ?
C01R O00R K007 111.3(5) . . ?
C00Y N00S K006 108.5(4) . . ?
C00Z N00S K006 108.8(4) . . ?
C00Z N00S C00Y 110.6(6) . . ?
C01A N00S K006 109.2(4) . . ?
C01A N00S C00Y 109.3(6) . . ?
C01A N00S C00Z 110.5(6) . . ?
C017 N00T K006 108.6(5) . . ?
C01B N00T K006 108.3(4) . . ?
C01B N00T C017 109.2(6) . . ?
C01D N00T K006 109.6(4) . . ?
C01D N00T C017 110.0(6) . . ?
C01D N00T C01B 111.0(6) . . ?
C01H N00U K007 106.6(5) . . ?
C01J N00U K007 109.8(5) . . ?
C01J N00U C01H 109.8(6) . . ?
C01L N00U K007 110.3(4) . . ?
C01L N00U C01H 111.0(7) . . ?
C01L N00U C01J 109.3(7) . . ?
C01N N00V K007 108.5(5) . . ?
C01N N00V C01O 110.2(7) . . ?
C01N N00V C01S 109.9(7) . . ?
C01O N00V K007 106.6(5) . . ?
C01O N00V C01S 110.8(7) . . ?
C01S N00V K007 110.8(5) . . ?
O00G C00W C011 108.6(6) . . ?
O00H C00X C015 109.3(6) . . ?
N00S C00Y C016 113.6(6) . . ?
N00S C00Z C018 113.0(6) . . ?
O00I C010 C01B 109.4(6) . . ?
O00I C011 C00W 110.4(6) . . ?
O00K C012 C017 110.6(6) . . ?
O00L C013 C01A 109.7(6) . . ?
O00K C014 C01I 109.6(7) . . ?
O00M C015 C00X 110.1(6) . . ?
O00G C016 C00Y 109.8(6) . . ?
N00T C017 C012 113.4(6) . . ?
O00N C018 C00Z 110.2(6) . . ?
O00J C019 C01D 111.1(6) . . ?
N00S C01A C013 113.6(6) . . ?
N00T C01B C010 114.5(6) . . ?
O00J C01C C01G 111.3(7) . . ?
N00T C01D C019 115.1(7) . . ?
O00P C01E C01J 109.1(7) . . ?
O00M C01F C01L 110.1(7) . . ?
O00L C01G C01C 109.2(7) . . ?
N00U C01H C01K 115.2(7) . . ?
O00N C01I C014 110.6(6) . . ?
N00U C01J C01E 113.0(7) . . ?
O00O C01K C01H 110.6(7) . . ?
N00U C01L C01F 114.1(7) . . ?
O00H C01M C01N 109.1(6) . . ?
N00V C01N C01M 116.0(7) . . ?
N00V C01O C01Q 113.7(8) . . ?
O00P C01P C01R 111.1(7) . . ?
O00R C01Q C01O 111.3(8) . . ?
O00R C01R C01P 109.1(7) . . ?
N00V C01S C01V 114.1(8) . . ?
O00O C01T C01U 111.4(8) . . ?
O00Q C01U C01T 109.6(7) . . ?
O00Q C01V C01S 110.1(8) . . ?
Ge2 Ge1A Ge8 57.59(9) . . ?
Ge2 Ge1A Ge3A 106.22(12) . . ?
Ge2 Ge1A Ge10 108.00(17) . . ?
Ge6 Ge1A Ge2 59.88(9) . . ?
Ge6 Ge1A Ge8 103.68(11) . . ?
Ge6 Ge1A Ge3A 61.65(12) . . ?
Ge6 Ge1A Ge10 102.48(19) . . ?
Ge7 Ge1A Ge2 38.51(9) . . ?
Ge7 Ge1A Ge6 21.57(8) . . ?
Ge7 Ge1A Ge8 85.25(11) . . ?
Ge7 Ge1A Ge3A 75.46(14) . . ?
Ge7 Ge1A Ge10 104.16(18) . . ?
Ge7 Ge1A Co 53.85(8) . . ?
Ge8 Ge1A Ge10 63.02(16) . . ?
Ge3A Ge1A Ge8 99.89(11) . . ?
Ge3A Ge1A Ge10 49.60(17) . . ?
Co Ge1A Ge2 59.49(7) . . ?
Co Ge1A Ge6 61.74(9) . . ?
Co Ge1A Ge8 51.23(7) . . ?
Co Ge1A Ge3A 55.28(9) . . ?
Co Ge1A Ge10 52.67(16) . . ?
Ge2 Ge0A Ge6 56.98(9) . . ?
Ge2 Ge0A Ge9 104.1(2) . . ?
Ge2 Ge0A Ge 87.05(9) . . ?
Ge7 Ge0A Ge2 39.63(9) . . ?
Ge7 Ge0A Ge6 17.35(8) . . ?
Ge7 Ge0A Co 55.98(8) . . ?
Ge7 Ge0A Ge9 71.5(2) . . ?
Ge7 Ge0A Ge 104.64(11) . . ?
Co Ge0A Ge2 61.25(7) . . ?
Co Ge0A Ge6 58.57(8) . . ?
Co Ge0A Ge9 54.52(19) . . ?
Co Ge0A Ge 51.60(7) . . ?
Ge9 Ge0A Ge6 57.5(2) . . ?
Ge9 Ge0A Ge 82.93(17) . . ?
Ge Ge0A Ge6 110.14(10) . . ?
Ge1A Ge3A Ge6 57.72(10) . . ?
Ge10 Ge3A Ge6 116.3(2) . . ?
Ge10 Ge3A Ge1A 70.3(2) . . ?
Ge10 Ge3A Co 61.36(19) . . ?
Ge10 Ge3A Ge9 106.3(3) . . ?
Co Ge3A Ge6 61.42(9) . . ?
Co Ge3A Ge1A 59.02(9) . . ?
Ge9 Ge3A Ge6 62.6(2) . . ?
Ge9 Ge3A Ge1A 107.4(2) . . ?
Ge9 Ge3A Co 58.3(2) . . ?
Ge5 Ge10 Ge1A 77.3(2) . . ?
Ge5 Ge10 Ge 81.6(2) . 5_665 ?
Ge5 Ge10 Ni1 81.6(2) . 5_665 ?
Ge3A Ge10 Ge5 120.0(3) . . ?
Ge3A Ge10 Ge1A 60.1(2) . . ?
Ge3A Ge10 Co 60.57(19) . . ?
Ge3A Ge10 Ge 77.3(2) . 5_665 ?
Ge3A Ge10 Ni1 77.3(2) . 5_665 ?
Co Ge10 Ge5 60.81(17) . . ?
Co Ge10 Ge1A 55.39(16) . . ?
Co Ge10 Ge 56.89(17) . 5_665 ?
Co Ge10 Ni1 56.89(17) . 5_665 ?
Ge Ge10 Ge1A 111.0(3) 5_665 . ?
Ni1 Ge10 Ge1A 111.0(3) 5_665 . ?
Ni1 Ge10 Ge 0.00(7) 5_665 5_665 ?
Ge7 Co Ge5 127.56(10) . . ?
Ge7 Co Ge8 102.19(11) . . ?
Ge7 Co Ge1A 60.73(9) . . ?
Ge7 Co Ge0A 59.29(10) . . ?
Ge7 Co Ge3A 84.29(11) . . ?
Ge7 Co Ge10 128.8(2) . . ?
Ge7 Co Ge9 79.3(2) . . ?
Ge7 Co Ge 146.25(10) . 5_665 ?
Ge7 Co Ge 127.92(9) . . ?
Ge7 Co Ni1 146.25(10) . 5_665 ?
Ge8 Co Ge5 25.45(7) . . ?
Ge8 Co Ge1A 70.49(11) . . ?
Ge8 Co Ge0A 108.21(11) . . ?
Ge8 Co Ge3A 124.82(14) . . ?
Ge8 Co Ge10 77.85(19) . . ?
Ge8 Co Ge9 174.3(2) . . ?
Ge8 Co Ge 111.33(9) . 5_665 ?
Ge8 Co Ge 71.90(8) . . ?
Ge8 Co Ni1 111.33(9) . 5_665 ?
Ge1A Co Ge5 85.48(10) . . ?
Ge0A Co Ge5 120.16(10) . . ?
Ge0A Co Ge1A 117.94(10) . . ?
Ge3A Co Ge5 118.79(12) . . ?
Ge3A Co Ge1A 65.70(13) . . ?
Ge3A Co Ge0A 121.04(14) . . ?
Ge3A Co Ge10 58.1(2) . . ?
Ge10 Co Ge5 62.06(18) . . ?
Ge10 Co Ge1A 71.9(2) . . ?
Ge10 Co Ge0A 169.5(2) . . ?
Ge9 Co Ge5 152.9(2) . . ?
Ge9 Co Ge1A 114.8(2) . . ?
Ge9 Co Ge0A 67.7(2) . . ?
Ge9 Co Ge3A 60.7(3) . . ?
Ge9 Co Ge10 105.6(3) . . ?
Ge9 Co Ge 66.91(19) . 5_665 ?
Ge9 Co Ni1 66.91(19) . 5_665 ?
Ge Co Ge5 86.11(7) 5_665 . ?
Ge Co Ge5 60.12(6) . . ?
Ge Co Ge1A 134.68(8) 5_665 . ?
Ge Co Ge1A 142.37(10) . . ?
Ge Co Ge0A 73.33(9) . . ?
Ge Co Ge0A 104.68(8) 5_665 . ?
Ge Co Ge3A 80.04(9) 5_665 . ?
Ge Co Ge3A 142.62(10) . . ?
Ge Co Ge10 101.2(2) . . ?
Ge Co Ge10 64.8(2) 5_665 . ?
Ge Co Ge9 102.7(2) . . ?
Ge Co Ge 62.62(6) . 5_665 ?
Ge Co Ni1 62.62(6) . 5_665 ?
Ni1 Co Ge5 86.11(7) 5_665 . ?
Ni1 Co Ge1A 134.68(8) 5_665 . ?
Ni1 Co Ge0A 104.68(8) 5_665 . ?
Ni1 Co Ge3A 80.04(9) 5_665 . ?
Ni1 Co Ge10 64.8(2) 5_665 . ?
Ni1 Co Ge 0.00(7) 5_665 5_665 ?
Ge0A Ge9 Ge6 65.1(2) . . ?
Ge3A Ge9 Ge6 64.1(2) . . ?
Ge3A Ge9 Ge0A 112.7(3) . . ?
Ge3A Ge9 Ge 75.9(2) . 5_665 ?
Ge3A Ge9 Ni1 75.9(2) . 5_665 ?
Co Ge9 Ge6 62.7(2) . . ?
Co Ge9 Ge0A 57.8(2) . . ?
Co Ge9 Ge3A 61.0(2) . . ?
Co Ge9 Ge 57.44(17) . 5_665 ?
Co Ge9 Ni1 57.44(17) . 5_665 ?
Ge Ge9 Ge6 118.6(3) 5_665 . ?
Ge Ge9 Ge0A 92.9(3) 5_665 . ?
Ni1 Ge9 Ge6 118.6(3) 5_665 . ?
Ni1 Ge9 Ge0A 92.9(3) 5_665 . ?
Ni1 Ge9 Ge 0.00(8) 5_665 5_665 ?
Ge5 Ge Ge8 23.48(6) . . ?
Ge5 Ge Ge0A 108.71(9) . . ?
Ge5 Ge Ge10 166.55(19) . 5_665 ?
Ge5 Ge Ge9 72.5(2) . 5_665 ?
Ge5 Ge Ge 86.74(8) . 5_665 ?
Ge5 Ge Ni1 86.74(8) . 5_665 ?
Ge8 Ge Ge0A 87.25(8) . . ?
Ge10 Ge Ge8 166.82(17) 5_665 . ?
Ge10 Ge Ge0A 84.71(18) 5_665 . ?
Ge10 Ge Ge9 94.0(3) 5_665 5_665 ?
Co Ge Ge5 63.95(6) . . ?
Co Ge Ge5 111.66(8) 5_665 . ?
Co Ge Ge8 53.65(6) . . ?
Co Ge Ge8 134.57(8) 5_665 . ?
Co Ge Ge0A 55.08(7) . . ?
Co Ge Ge0A 126.38(8) 5_665 . ?
Co Ge Ge10 127.49(18) . 5_665 ?
Co Ge Ge10 58.27(16) 5_665 5_665 ?
Co Ge Co 117.38(6) . 5_665 ?
Co Ge Ge9 128.3(2) . 5_665 ?
Co Ge Ge9 55.65(18) 5_665 5_665 ?
Co Ge Ge 59.98(6) . 5_665 ?
Co Ge Ge 57.40(5) 5_665 5_665 ?
Co Ge Ni1 57.40(5) 5_665 5_665 ?
Co Ge Ni1 59.98(6) . 5_665 ?
Ge9 Ge Ge8 93.2(2) 5_665 . ?
Ge9 Ge Ge0A 175.7(2) 5_665 . ?
Ge Ge Ge8 97.01(9) 5_665 . ?
Ge Ge Ge0A 92.01(10) 5_665 . ?
Ge Ge Ge10 93.70(16) 5_665 5_665 ?
Ge Ge Ge9 92.1(2) 5_665 5_665 ?
Ni1 Ge Ge8 97.01(9) 5_665 . ?
Ni1 Ge Ge0A 92.01(10) 5_665 . ?
Ni1 Ge Ge10 93.70(16) 5_665 5_665 ?
Ni1 Ge Ge9 92.1(2) 5_665 5_665 ?
Ni1 Ge Ge 0.00(7) 5_665 5_665 ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 -0.018 -0.843 -0.853 3348.1 293.8 ?
2 0.065 0.176 0.534 3.4 0.0 ?
3 0.065 0.324 0.034 3.4 0.0 ?
4 -0.065 0.676 0.966 3.4 0.0 ?
5 -0.065 0.824 0.466 3.4 0.0 ?
6 0.033 0.646 0.000 0.5 0.0 ?
7 0.033 0.854 0.500 0.5 0.0 ?
8 0.126 0.518 0.861 1.6 0.0 ?
9 0.126 0.982 0.361 1.6 0.0 ?
10 0.374 0.018 0.861 1.6 0.0 ?
11 0.374 0.482 0.361 1.6 0.0 ?
12 0.435 0.676 0.534 3.4 0.0 ?
13 0.435 0.824 0.034 3.4 0.0 ?
14 0.467 0.146 0.000 0.5 0.0 ?
15 0.467 0.354 0.500 0.5 0.0 ?
16 0.565 0.176 0.966 3.4 0.0 ?
17 0.565 0.324 0.466 3.4 0.0 ?
18 0.533 0.646 0.500 0.5 0.0 ?
19 0.533 0.854 0.000 0.5 0.0 ?
20 0.626 0.518 0.639 1.6 0.0 ?
21 0.626 0.982 0.139 1.6 0.0 ?
22 0.874 0.018 0.639 1.6 0.0 ?
23 0.874 0.482 0.139 1.6 0.0 ?
24 0.967 0.146 0.500 0.5 0.0 ?
25 0.967 0.354 0.000 0.5 0.0 ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.332
_oxdiff_exptl_absorpt_empirical_full_min 0.662
