#------------------------------------------------------------------------------
#$Date: 2016-03-21 01:21:50 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178377 $
#$URL: svn://www.crystallography.net/cod/cif/4/00/21/4002195.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_4002195
loop_
_publ_author_name
'Rai, Binod K.'
'Oswald, Iain W. H.'
'Wang, Jiakui K.'
'McCandless, Gregory T.'
'Chan, Julia Y.'
'Morosan, E.'
_publ_section_title
;
 Superconductivity in Single Crystals of Lu3T4Ge13--x(T= Co, Rh, Os) and
 Y3T4Ge13--x(T= Ir, Rh, Os)
;
_publ_section_keywords
;
crystal structure
;
_journal_issue                   7
_journal_name_full               'Chemistry of Materials'
_journal_page_first              2488
_journal_paper_doi               10.1021/cm504658h
_journal_volume                  27
_journal_year                    2015
_chemical_formula_sum            'Co4 Ge13 Lu3'
_chemical_formula_weight         1704.30
_space_group_crystal_system      cubic
_space_group_IT_number           223
_space_group_name_Hall           '-P 4n 2 3'
_space_group_name_H-M_alt        'P m -3 n'
_symmetry_space_group_name_Hall  '-P 4n 2 3'
_symmetry_space_group_name_H-M   'P m -3 n'
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2014-10-31 # Formatted by publCIF

;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.6997(6)
_cell_length_b                   8.6997(6)
_cell_length_c                   8.6997(6)
_cell_measurement_reflns_used    1514
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      30.46
_cell_measurement_theta_min      3.31
_cell_volume                     658.43(8)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    CrystalMaker
_computing_publication_material  'PublCIF (Westrip, 2010)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS Direct Methods (Sheldrick, 2013)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker Kappa D8 Quest CMOS'
_diffrn_measurement_method       'φ scan'
_diffrn_radiation_monochromator  'HELIOS optics'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0346
_diffrn_reflns_av_unetI/netI     0.0176
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       7
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            2291
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.458
_diffrn_reflns_theta_min         3.312
_diffrn_source                   'I\mS microfocus tube'
_exptl_absorpt_coefficient_mu    56.249
_exptl_absorpt_correction_T_max  0.7461
_exptl_absorpt_correction_T_min  0.2731
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS(2014)
_exptl_crystal_colour            Silver
_exptl_crystal_density_diffrn    8.596
_exptl_crystal_description       Fragment
_exptl_crystal_F_000             1474
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.02
_refine_diff_density_max         4.351
_refine_diff_density_min         -5.445
_refine_diff_density_rms         0.468
_refine_ls_extinction_coef       0.0016(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.257
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     16
_refine_ls_number_reflns         205
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.257
_refine_ls_R_factor_all          0.0326
_refine_ls_R_factor_gt           0.0305
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0260P)²+19.6147P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0713
_refine_ls_wR_factor_ref         0.0718
_reflns_Friedel_coverage         0.000
_reflns_number_gt                193
_reflns_number_total             205
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            Lu3Co4Ge13_CIF.cif
_cod_data_source_block           shelx
_cod_depositor_comments
'Adding full bibliography for 4002190--4002195.cif.'
_cod_original_cell_volume        658.43(15)
_cod_database_code               4002195
#BEGIN Tags that were not found in dictionaries:
_publcif_datablock.id            {821cb711-b20a-43c1-a945-8f5035b3a925}
_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.
;
_shelxl_version_number           2014-3
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'-x, y, -z'
'x, -y, -z'
'z, x, y'
'z, -x, -y'
'-z, -x, y'
'-z, x, -y'
'y, z, x'
'-y, z, -x'
'y, -z, -x'
'-y, -z, x'
'y+1/2, x+1/2, -z+1/2'
'-y+1/2, -x+1/2, -z+1/2'
'y+1/2, -x+1/2, z+1/2'
'-y+1/2, x+1/2, z+1/2'
'x+1/2, z+1/2, -y+1/2'
'-x+1/2, z+1/2, y+1/2'
'-x+1/2, -z+1/2, -y+1/2'
'x+1/2, -z+1/2, y+1/2'
'z+1/2, y+1/2, -x+1/2'
'z+1/2, -y+1/2, x+1/2'
'-z+1/2, y+1/2, x+1/2'
'-z+1/2, -y+1/2, -x+1/2'
'-x, -y, -z'
'x, y, -z'
'x, -y, z'
'-x, y, z'
'-z, -x, -y'
'-z, x, y'
'z, x, -y'
'z, -x, y'
'-y, -z, -x'
'y, -z, x'
'-y, z, x'
'y, z, -x'
'-y-1/2, -x-1/2, z-1/2'
'y-1/2, x-1/2, z-1/2'
'-y-1/2, x-1/2, -z-1/2'
'y-1/2, -x-1/2, -z-1/2'
'-x-1/2, -z-1/2, y-1/2'
'x-1/2, -z-1/2, -y-1/2'
'x-1/2, z-1/2, y-1/2'
'-x-1/2, z-1/2, -y-1/2'
'-z-1/2, -y-1/2, x-1/2'
'-z-1/2, y-1/2, -x-1/2'
'z-1/2, -y-1/2, -x-1/2'
'z-1/2, y-1/2, x-1/2'
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
Lu1 Lu 0.2500 0.5000 0.0000 0.0083(3) Uani 1 8 d S T P
Co1 Co 0.2500 0.2500 0.2500 0.0050(4) Uani 1 6 d S T P
Ge1 Ge 0.0000 0.0000 0.0000 0.0225(9) Uani 1 24 d S T P
Ge2A Ge 0.0000 0.2704(7) 0.1431(7) 0.0129(6) Uani 0.355(7) 2 d S T P
Ge2B Ge 0.0000 0.3251(5) 0.1590(4) 0.0129(6) Uani 0.645(7) 2 d S T P
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Co Co 0.3494 0.9721 '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'
Lu Lu -0.4720 5.8584 '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
Ge2B Lu1 Ge2B 121.86(5) . 17
Ge2B Lu1 Ge2B 55.06(12) . 26
Ge2B Lu1 Ge2B 176.26(15) 17 26
Ge2B Lu1 Ge2B 93.32(9) . 42_666
Ge2B Lu1 Ge2B 55.06(12) 17 42_666
Ge2B Lu1 Ge2B 121.86(5) 26 42_666
Ge2B Lu1 Ge2B 176.26(15) . 18_554
Ge2B Lu1 Ge2B 61.11(15) 17 18_554
Ge2B Lu1 Ge2B 121.86(5) 26 18_554
Ge2B Lu1 Ge2B 86.80(9) 42_666 18_554
Ge2B Lu1 Ge2B 86.80(9) . 25_565
Ge2B Lu1 Ge2B 121.86(5) 17 25_565
Ge2B Lu1 Ge2B 61.11(15) 26 25_565
Ge2B Lu1 Ge2B 176.26(15) 42_666 25_565
Ge2B Lu1 Ge2B 93.32(9) 18_554 25_565
Ge2B Lu1 Ge2B 121.86(5) . 41_665
Ge2B Lu1 Ge2B 86.80(9) 17 41_665
Ge2B Lu1 Ge2B 93.32(9) 26 41_665
Ge2B Lu1 Ge2B 61.11(15) 42_666 41_665
Ge2B Lu1 Ge2B 55.06(12) 18_554 41_665
Ge2B Lu1 Ge2B 121.86(5) 25_565 41_665
Ge2B Lu1 Ge2B 61.11(15) . 2_565
Ge2B Lu1 Ge2B 93.32(9) 17 2_565
Ge2B Lu1 Ge2B 86.80(9) 26 2_565
Ge2B Lu1 Ge2B 121.86(5) 42_666 2_565
Ge2B Lu1 Ge2B 121.86(5) 18_554 2_565
Ge2B Lu1 Ge2B 55.06(12) 25_565 2_565
Ge2B Lu1 Ge2B 176.26(15) 41_665 2_565
Ge2B Lu1 Ge2B 107.17(6) . 37_665
Ge2B Lu1 Ge2B 130.747(17) 17 37_665
Ge2B Lu1 Ge2B 52.58(12) 26 37_665
Ge2B Lu1 Ge2B 130.747(17) 42_666 37_665
Ge2B Lu1 Ge2B 70.11(14) 18_554 37_665
Ge2B Lu1 Ge2B 52.58(12) 25_565 37_665
Ge2B Lu1 Ge2B 70.11(14) 41_665 37_665
Ge2B Lu1 Ge2B 107.17(6) 2_565 37_665
Ge2B Lu1 Ge2B 130.748(17) . 34_565
Ge2B Lu1 Ge2B 52.58(12) 17 34_565
Ge2B Lu1 Ge2B 130.747(17) 26 34_565
Ge2B Lu1 Ge2B 107.17(6) 42_666 34_565
Ge2B Lu1 Ge2B 52.58(12) 18_554 34_565
Ge2B Lu1 Ge2B 70.11(14) 25_565 34_565
Ge2B Lu1 Ge2B 107.17(6) 41_665 34_565
Ge2B Lu1 Ge2B 70.11(14) 2_565 34_565
Ge2B Lu1 Ge2B 92.65(3) 37_665 34_565
Ge2B Lu1 Ge2B 52.58(12) . 14
Ge2B Lu1 Ge2B 70.11(14) 17 14
Ge2B Lu1 Ge2B 107.17(6) 26 14
Ge2B Lu1 Ge2B 70.11(14) 42_666 14
Ge2B Lu1 Ge2B 130.747(17) 18_554 14
Ge2B Lu1 Ge2B 107.17(6) 25_565 14
Ge2B Lu1 Ge2B 130.747(17) 41_665 14
Ge2B Lu1 Ge2B 52.58(12) 2_565 14
Ge2B Lu1 Ge2B 155.16(16) 37_665 14
Ge2B Lu1 Ge2B 92.65(3) 34_565 14
Ge2B Lu1 Ge2B 70.11(14) . 9
Ge2B Lu1 Ge2B 107.17(6) 17 9
Ge2B Lu1 Ge2B 70.11(14) 26 9
Ge2B Lu1 Ge2B 52.58(12) 42_666 9
Ge2B Lu1 Ge2B 107.17(6) 18_554 9
Ge2B Lu1 Ge2B 130.747(17) 25_565 9
Ge2B Lu1 Ge2B 52.58(12) 41_665 9
Ge2B Lu1 Ge2B 130.747(17) 2_565 9
Ge2B Lu1 Ge2B 92.65(3) 37_665 9
Ge2B Lu1 Ge2B 155.16(16) 34_565 9
Ge2B Lu1 Ge2B 92.65(3) 14 9
Ge2A Co1 Ge2A 136.4(3) . 45_666
Ge2A Co1 Ge2A 141.4(3) . 42_666
Ge2A Co1 Ge2A 74.8(2) 45_666 42_666
Ge2A Co1 Ge2A 91.0(3) . 14
Ge2A Co1 Ge2A 74.8(2) 45_666 14
Ge2A Co1 Ge2A 74.8(2) 42_666 14
Ge2A Co1 Ge2A 74.8(2) . 9
Ge2A Co1 Ge2A 141.4(3) 45_666 9
Ge2A Co1 Ge2A 91.0(3) 42_666 9
Ge2A Co1 Ge2A 136.5(3) 14 9
Ge2A Co1 Ge2A 74.8(2) . 5
Ge2A Co1 Ge2A 91.0(3) 45_666 5
Ge2A Co1 Ge2A 136.5(3) 42_666 5
Ge2A Co1 Ge2A 141.4(3) 14 5
Ge2A Co1 Ge2A 74.8(2) 9 5
Ge2A Co1 Ge2B 132.59(10) . 45_666
Ge2A Co1 Ge2B 11.89(10) 45_666 45_666
Ge2A Co1 Ge2B 82.7(2) 42_666 45_666
Ge2A Co1 Ge2B 85.3(2) 14 45_666
Ge2A Co1 Ge2B 134.27(15) 9 45_666
Ge2A Co1 Ge2B 79.2(2) 5 45_666
Ge2A Co1 Ge2B 134.27(15) . 42_666
Ge2A Co1 Ge2B 85.3(2) 45_666 42_666
Ge2A Co1 Ge2B 11.89(10) 42_666 42_666
Ge2A Co1 Ge2B 82.7(2) 14 42_666
Ge2A Co1 Ge2B 79.2(2) 9 42_666
Ge2A Co1 Ge2B 132.59(10) 5 42_666
Ge2B Co1 Ge2B 92.14(14) 45_666 42_666
Ge2A Co1 Ge2B 79.2(2) . 14
Ge2A Co1 Ge2B 82.7(2) 45_666 14
Ge2A Co1 Ge2B 85.3(2) 42_666 14
Ge2A Co1 Ge2B 11.89(10) 14 14
Ge2A Co1 Ge2B 132.59(10) 9 14
Ge2A Co1 Ge2B 134.27(14) 5 14
Ge2B Co1 Ge2B 92.14(14) 45_666 14
Ge2B Co1 Ge2B 92.14(14) 42_666 14
Ge2A Co1 Ge2B 85.3(2) . 9
Ge2A Co1 Ge2B 134.27(15) 45_666 9
Ge2A Co1 Ge2B 79.2(2) 42_666 9
Ge2A Co1 Ge2B 132.59(10) 14 9
Ge2A Co1 Ge2B 11.89(10) 9 9
Ge2A Co1 Ge2B 82.7(2) 5 9
Ge2B Co1 Ge2B 129.74(13) 45_666 9
Ge2B Co1 Ge2B 67.5(2) 42_666 9
Ge2B Co1 Ge2B 131.98(13) 14 9
Ge2A Co1 Ge2B 82.7(2) . 5
Ge2A Co1 Ge2B 79.2(2) 45_666 5
Ge2A Co1 Ge2B 132.59(10) 42_666 5
Ge2A Co1 Ge2B 134.27(15) 14 5
Ge2A Co1 Ge2B 85.3(2) 9 5
Ge2A Co1 Ge2B 11.89(10) 5 5
Ge2B Co1 Ge2B 67.5(2) 45_666 5
Ge2B Co1 Ge2B 131.98(13) 42_666 5
Ge2B Co1 Ge2B 129.74(14) 14 5
Ge2B Co1 Ge2B 92.14(14) 9 5
Ge2A Co1 Ge2B 11.89(10) . .
Ge2A Co1 Ge2B 132.59(10) 45_666 .
Ge2A Co1 Ge2B 134.27(15) 42_666 .
Ge2A Co1 Ge2B 79.2(2) 14 .
Ge2A Co1 Ge2B 82.7(2) 9 .
Ge2A Co1 Ge2B 85.3(2) 5 .
Ge2B Co1 Ge2B 131.98(13) 45_666 .
Ge2B Co1 Ge2B 129.74(13) 42_666 .
Ge2B Co1 Ge2B 67.5(2) 14 .
Ge2B Co1 Ge2B 92.14(14) 9 .
Ge2B Co1 Ge2B 92.14(14) 5 .
Ge2A Ge1 Ge2A 114.42(8) . 33
Ge2A Ge1 Ge2A 180.0 . 25
Ge2A Ge1 Ge2A 65.58(8) 33 25
Ge2A Ge1 Ge2A 65.58(8) . 9
Ge2A Ge1 Ge2A 180.0 33 9
Ge2A Ge1 Ge2A 114.42(8) 25 9
Ge2A Ge1 Ge2A 114.42(8) . 29
Ge2A Ge1 Ge2A 65.58(8) 33 29
Ge2A Ge1 Ge2A 65.58(8) 25 29
Ge2A Ge1 Ge2A 114.42(8) 9 29
Ge2A Ge1 Ge2A 65.58(8) . 5
Ge2A Ge1 Ge2A 114.42(8) 33 5
Ge2A Ge1 Ge2A 114.42(8) 25 5
Ge2A Ge1 Ge2A 65.58(8) 9 5
Ge2A Ge1 Ge2A 180.0 29 5
Ge2A Ge1 Ge2A 114.42(8) . 34
Ge2A Ge1 Ge2A 124.2(3) 33 34
Ge2A Ge1 Ge2A 65.58(8) 25 34
Ge2A Ge1 Ge2A 55.8(3) 9 34
Ge2A Ge1 Ge2A 114.42(8) 29 34
Ge2A Ge1 Ge2A 65.58(8) 5 34
Ge2A Ge1 Ge2A 114.42(8) . 6
Ge2A Ge1 Ge2A 114.42(8) 33 6
Ge2A Ge1 Ge2A 65.58(8) 25 6
Ge2A Ge1 Ge2A 65.58(8) 9 6
Ge2A Ge1 Ge2A 55.8(3) 29 6
Ge2A Ge1 Ge2A 124.2(3) 5 6
Ge2A Ge1 Ge2A 65.58(8) 34 6
Ge2A Ge1 Ge2A 65.58(8) . 30
Ge2A Ge1 Ge2A 65.58(8) 33 30
Ge2A Ge1 Ge2A 114.42(8) 25 30
Ge2A Ge1 Ge2A 114.42(8) 9 30
Ge2A Ge1 Ge2A 124.2(3) 29 30
Ge2A Ge1 Ge2A 55.8(3) 5 30
Ge2A Ge1 Ge2A 114.42(8) 34 30
Ge2A Ge1 Ge2A 180.0(3) 6 30
Ge2A Ge1 Ge2A 55.8(3) . 26
Ge2A Ge1 Ge2A 114.42(8) 33 26
Ge2A Ge1 Ge2A 124.2(3) 25 26
Ge2A Ge1 Ge2A 65.58(8) 9 26
Ge2A Ge1 Ge2A 65.58(8) 29 26
Ge2A Ge1 Ge2A 114.42(8) 5 26
Ge2A Ge1 Ge2A 114.42(8) 34 26
Ge2A Ge1 Ge2A 65.58(8) 6 26
Ge2A Ge1 Ge2A 114.42(8) 30 26
Ge2A Ge1 Ge2A 124.2(3) . 2
Ge2A Ge1 Ge2A 65.58(8) 33 2
Ge2A Ge1 Ge2A 55.8(3) 25 2
Ge2A Ge1 Ge2A 114.42(8) 9 2
Ge2A Ge1 Ge2A 114.42(8) 29 2
Ge2A Ge1 Ge2A 65.58(8) 5 2
Ge2A Ge1 Ge2A 65.58(8) 34 2
Ge2A Ge1 Ge2A 114.42(8) 6 2
Ge2A Ge1 Ge2A 65.58(8) 30 2
Ge2A Ge1 Ge2A 180.00(13) 26 2
Ge2A Ge1 Ge2A 65.58(8) . 10
Ge2A Ge1 Ge2A 55.8(3) 33 10
Ge2A Ge1 Ge2A 114.42(8) 25 10
Ge2A Ge1 Ge2A 124.2(3) 9 10
Ge2A Ge1 Ge2A 65.58(8) 29 10
Ge2A Ge1 Ge2A 114.42(8) 5 10
Ge2A Ge1 Ge2A 180.00(13) 34 10
Ge2A Ge1 Ge2A 114.42(8) 6 10
Ge2A Ge1 Ge2A 65.58(8) 30 10
Ge2A Ge1 Ge2A 65.58(8) 26 10
Ge2A Ge1 Ge2A 114.42(8) 2 10
Co1 Ge2A Co1 132.9(3) . 28
Co1 Ge2A Ge2A 113.09(14) . 26
Co1 Ge2A Ge2A 113.09(14) 28 26
Co1 Ge2A Ge1 96.74(16) . .
Co1 Ge2A Ge1 96.74(16) 28 .
Ge2A Ge2A Ge1 62.12(13) 26 .
Co1 Ge2A Ge2B 113.53(13) . 26
Co1 Ge2A Ge2B 113.53(13) 28 26
Ge2A Ge2A Ge2B 10.26(9) 26 26
Ge1 Ge2A Ge2B 72.38(13) . 26
Co1 Ge2A Ge2A 100.6(3) . 30
Co1 Ge2A Ge2A 52.59(12) 28 30
Ge2A Ge2A Ge2A 112.60(15) 26 30
Ge1 Ge2A Ge2A 57.21(4) . 30
Ge2B Ge2A Ge2A 121.57(15) 26 30
Co1 Ge2A Ge2A 52.59(12) . 5
Co1 Ge2A Ge2A 100.6(3) 28 5
Ge2A Ge2A Ge2A 112.60(15) 26 5
Ge1 Ge2A Ge2A 57.21(4) . 5
Ge2B Ge2A Ge2A 121.57(15) 26 5
Ge2A Ge2A Ge2A 51.2(3) 30 5
Co1 Ge2A Ge2A 152.7(2) . 10
Co1 Ge2A Ge2A 52.59(12) 28 10
Ge2A Ge2A Ge2A 64.42(15) 26 10
Ge1 Ge2A Ge2A 57.21(4) . 10
Ge2B Ge2A Ge2A 69.12(15) 26 10
Ge2A Ge2A Ge2A 60.0 30 10
Ge2A Ge2A Ge2A 101.8(2) 5 10
Co1 Ge2A Ge2A 52.59(12) . 9
Co1 Ge2A Ge2A 152.7(2) 28 9
Ge2A Ge2A Ge2A 64.42(15) 26 9
Ge1 Ge2A Ge2A 57.21(4) . 9
Ge2B Ge2A Ge2A 69.12(15) 26 9
Ge2A Ge2A Ge2A 101.8(2) 30 9
Ge2A Ge2A Ge2A 60.0 5 9
Ge2A Ge2A Ge2A 109.380(18) 10 9
Co1 Ge2A Lu1 66.68(14) . 5
Co1 Ge2A Lu1 66.68(14) 28 5
Ge2A Ge2A Lu1 176.73(12) 26 5
Ge1 Ge2A Lu1 114.6(2) . 5
Ge2B Ge2A Lu1 173.0(2) 26 5
Ge2A Ge2A Lu1 64.5(2) 30 5
Ge2A Ge2A Lu1 64.5(2) 5 5
Ge2A Ge2A Lu1 114.15(18) 10 5
Ge2A Ge2A Lu1 114.15(18) 9 5
Co1 Ge2A Lu1 64.95(7) . .
Co1 Ge2A Lu1 145.2(2) 28 .
Ge2A Ge2A Lu1 67.15(11) 26 .
Ge1 Ge2A Lu1 111.68(16) . .
Ge2B Ge2A Lu1 60.45(11) 26 .
Ge2A Ge2A Lu1 161.98(16) 30 .
Ge2A Ge2A Lu1 111.40(11) 5 .
Ge2A Ge2A Lu1 128.7(3) 10 .
Ge2A Ge2A Lu1 61.19(17) 9 .
Lu1 Ge2A Lu1 115.04(15) 5 .
Co1 Ge2A Lu1 145.2(2) . 25_565
Co1 Ge2A Lu1 64.95(7) 28 25_565
Ge2A Ge2A Lu1 67.15(11) 26 25_565
Ge1 Ge2A Lu1 111.68(16) . 25_565
Ge2B Ge2A Lu1 60.45(11) 26 25_565
Ge2A Ge2A Lu1 111.40(11) 30 25_565
Ge2A Ge2A Lu1 161.98(16) 5 25_565
Ge2A Ge2A Lu1 61.19(17) 10 25_565
Ge2A Ge2A Lu1 128.7(3) 9 25_565
Lu1 Ge2A Lu1 115.04(15) 5 25_565
Lu1 Ge2A Lu1 85.48(14) . 25_565
Co1 Ge2B Co1 129.49(13) . 28
Co1 Ge2B Ge2A 105.99(7) . 26
Co1 Ge2B Ge2A 105.99(7) 28 26
Co1 Ge2B Ge2B 56.26(10) . 14
Co1 Ge2B Ge2B 118.36(15) 28 14
Ge2A Ge2B Ge2B 133.19(13) 26 14
Co1 Ge2B Ge2B 118.36(15) . 13_455
Co1 Ge2B Ge2B 56.26(10) 28 13_455
Ge2A Ge2B Ge2B 133.19(13) 26 13_455
Ge2B Ge2B Ge2B 69.46(11) 14 13_455
Co1 Ge2B Ge2B 109.21(7) . 26
Co1 Ge2B Ge2B 109.21(7) 28 26
Ge2A Ge2B Ge2B 10.26(9) 26 26
Ge2B Ge2B Ge2B 126.33(11) 14 26
Ge2B Ge2B Ge2B 126.33(11) 13_455 26
Co1 Ge2B Lu1 68.47(3) . .
Co1 Ge2B Lu1 161.31(12) 28 .
Ge2A Ge2B Lu1 68.64(10) 26 .
Ge2B Ge2B Lu1 64.55(10) 14 .
Ge2B Ge2B Lu1 113.46(9) 13_455 .
Ge2B Ge2B Lu1 62.47(6) 26 .
Co1 Ge2B Lu1 161.31(12) . 25_565
Co1 Ge2B Lu1 68.47(3) 28 25_565
Ge2A Ge2B Lu1 68.64(10) 26 25_565
Ge2B Ge2B Lu1 113.46(9) 14 25_565
Ge2B Ge2B Lu1 64.55(10) 13_455 25_565
Ge2B Ge2B Lu1 62.47(6) 26 25_565
Lu1 Ge2B Lu1 93.20(9) . 25_565
Co1 Ge2B Lu1 67.68(6) . 5
Co1 Ge2B Lu1 67.68(6) 28 5
Ge2A Ge2B Lu1 157.32(10) 26 5
Ge2B Ge2B Lu1 62.87(11) 14 5
Ge2B Ge2B Lu1 62.87(11) 13_455 5
Ge2B Ge2B Lu1 167.58(8) 26 5
Lu1 Ge2B Lu1 124.11(8) . 5
Lu1 Ge2B Lu1 124.11(8) 25_565 5
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Lu1 Ge2B 2.993(2) .
Lu1 Ge2B 2.993(2) 17
Lu1 Ge2B 2.993(2) 26
Lu1 Ge2B 2.993(2) 42_666
Lu1 Ge2B 2.993(2) 18_554
Lu1 Ge2B 2.993(2) 25_565
Lu1 Ge2B 2.993(2) 41_665
Lu1 Ge2B 2.993(2) 2_565
Lu1 Ge2B 3.037(3) 37_665
Lu1 Ge2B 3.037(3) 34_565
Lu1 Ge2B 3.037(3) 14
Lu1 Ge2B 3.037(3) 9
Co1 Ge2A 2.372(2) .
Co1 Ge2A 2.372(2) 45_666
Co1 Ge2A 2.372(2) 42_666
Co1 Ge2A 2.372(2) 14
Co1 Ge2A 2.372(2) 9
Co1 Ge2A 2.372(2) 5
Co1 Ge2B 2.4048(13) 45_666
Co1 Ge2B 2.4048(13) 42_666
Co1 Ge2B 2.4048(13) 14
Co1 Ge2B 2.4048(13) 9
Co1 Ge2B 2.4048(13) 5
Co1 Ge2B 2.4048(13) .
Ge1 Ge2A 2.661(6) .
Ge1 Ge2A 2.661(6) 33
Ge1 Ge2A 2.661(6) 25
Ge1 Ge2A 2.661(6) 9
Ge1 Ge2A 2.661(6) 29
Ge1 Ge2A 2.661(6) 5
Ge1 Ge2A 2.661(6) 34
Ge1 Ge2A 2.661(6) 6
Ge1 Ge2A 2.661(6) 30
Ge1 Ge2A 2.661(6) 26
Ge1 Ge2A 2.661(6) 2
Ge1 Ge2A 2.661(6) 10
Ge2A Co1 2.372(2) 28
Ge2A Ge2A 2.489(12) 26
Ge2A Ge2B 2.671(5) 26
Ge2A Ge2A 2.883(8) 30
Ge2A Ge2A 2.883(8) 5
Ge2A Ge2A 2.883(8) 10
Ge2A Ge2A 2.883(8) 9
Ge2A Lu1 3.110(6) 5
Ge2A Lu1 3.205(4) 25_565
Ge2B Co1 2.4048(13) 28
Ge2B Ge2A 2.671(5) 26
Ge2B Ge2B 2.671(7) 14
Ge2B Ge2B 2.671(7) 13_455
Ge2B Ge2B 2.767(6) 26
Ge2B Lu1 2.993(2) 25_565
Ge2B Lu1 3.037(3) 5
#BEGIN Loops that were not found in dictionaries:
loop_
_publcif_info_datablock.id
_publcif_info_datablock.publ_exptl
_publcif_info_datablock.publ_geom
_publcif_info_datablock.structure
{821cb711-b20a-43c1-a945-8f5035b3a925} y y y
#END Loops that were not found in dictionaries
