# 1. SUBMISSION DETAILS
data_publication_text
_ccdc_journal_manuscript_code    'Inorg. Chem.'
_publ_requested_journal          'Inorganic Chemistry'
_publ_requested_category         FA
_publ_requested_coeditor_name    ?
_publ_contact_author_name        'Dr. Pavlo Solokha'
_publ_contact_author_address     
;Dipartimento di Chimica e Chimica IYustriale
Sezione di Chimica Inorganica e Metallurgia
Università di Genova
Via Dodecaneso 31
I-16146 Genova
Italy
;
_publ_contact_author_email       'pavlo.solokha@unige.it'
_publ_contact_author_phone       '+39 010 3536159'
#
#=============================================================================

# 2. TITLE AY AUTHOR LIST

_publ_section_title              
;
A new glance on the R₂MGe₆ (R = rare earth metal, M=another metal)
compouYs. An experimental aY theoretical study of R₂PdGe₆ germanides.
;
# --------------------------------------------------------------------------
loop_
	_publ_author_name
        _publ_author_footnote
	_publ_author_address
'De Negri, Serena'
;
Dipartimento di Chimica e Chimica IYustriale
Sezione di Chimica Inorganica e Metallurgia
Università di Genova
Via Dodecaneso 31
I-16146 Genova
Italy
;
'Freccero, Riccardo'
;
Dipartimento di Chimica e Chimica IYustriale
Sezione di Chimica Inorganica e Metallurgia
Università di Genova
Via Dodecaneso 31
I-16146 Genova
Italy
;
'Proserpio, Davide Maria'
;
Università degli studi di Milano
Dipartimento di Chimica
Via Golgi 19
I-20133 Milano
Italy
;
;
Also at Samara Center for Theoretical Materials Science (SCTMS)
Samara State University
443011 Samara
Russian Federation
;
'Saccone, Adriana'
;
Dipartimento di Chimica e Chimica IYustriale
Sezione di Chimica Inorganica e Metallurgia
Università di Genova
Via Dodecaneso 31
I-16146 Genova
Italy
;
#============================================================================= 
data_shelx
 
_audit_creation_method            'SHELXL-2014/7'
_chemical_name_systematic         ?
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          'Ge6 Pd Yb2'
_chemical_formula_sum             'Ge6 Pd Yb2' 
_chemical_formula_weight          888.02

loop_
 _atom_type_symbol
 _atom_type_description
 _atom_type_scat_dispersion_real
 _atom_type_scat_dispersion_imag
 _atom_type_scat_source
 'Ge'  'Ge'   0.1547   1.8001
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Pd'  'Pd'  -0.9988   1.0072
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Yb'  'Yb'  -0.3850   5.5486
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 
_space_group_crystal_system       orthorhombic
_space_group_IT_number            64
_space_group_name_H-M_alt         'C m c a'
_space_group_name_Hall            '-C 2bc 2'
 
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
 
loop_
 _space_group_symop_operation_xyz
 'x, y, z'
 '-x, -y+1/2, z+1/2'
 '-x, y+1/2, -z+1/2'
 'x, -y, -z'
 'x+1/2, y+1/2, z'
 '-x+1/2, -y+1, z+1/2'
 '-x+1/2, y+1, -z+1/2'
 'x+1/2, -y+1/2, -z'
 '-x, -y, -z'
 'x, y-1/2, -z-1/2'
 'x, -y-1/2, z-1/2'
 '-x, y, z'
 '-x+1/2, -y+1/2, -z'
 'x+1/2, y, -z-1/2'
 'x+1/2, -y, z-1/2'
 '-x+1/2, y+1/2, z'
 
_cell_length_a                    8.1428(3)
_cell_length_b                    7.9807(3)
_cell_length_c                    21.8331(9)
_cell_angle_alpha                 90
_cell_angle_beta                  90
_cell_angle_gamma                 90
_cell_volume                      1418.83(9)
_cell_formula_units_Z             8
_cell_measurement_temperature     295(2)
_cell_measurement_reflns_used     1144
_cell_measurement_theta_min       3.695
_cell_measurement_theta_max       31.585
 
_exptl_crystal_description        'irregularly shaped' 
_exptl_crystal_colour             'metallic grey'
_exptl_crystal_density_meas       ? 
_exptl_crystal_density_method     'not measured'
_exptl_crystal_density_diffrn     8.314          
_exptl_crystal_F_000              3024
_exptl_transmission_factor_min    0.3874
_exptl_transmission_factor_max    0.7463
_exptl_crystal_size_max           0.5
_exptl_crystal_size_mid           0.3
_exptl_crystal_size_min           0.2
_exptl_absorpt_coefficient_mu     53.475
_shelx_estimated_absorpt_T_min    ?
_shelx_estimated_absorpt_T_max    ?
_exptl_absorpt_correction_type    'multi-scan'
_exptl_absorpt_correction_T_min   ?
_exptl_absorpt_correction_T_max   ?
_exptl_absorpt_process_details    'Bruker SADABS'
_diffrn_ambient_temperature       295(2)
_diffrn_radiation_wavelength      0.71073
_diffrn_radiation_type            MoK\a
_diffrn_radiation_source          'fine-focus sealed tube' 
_diffrn_radiation_monochromator   graphite 
_diffrn_measurement_device_type   'Bruker APEXII'
_diffrn_measurement_method        'ω scans'
_diffrn_detector_area_resol_mean  ?
_diffrn_reflns_number             19224
_diffrn_reflns_av_unetI/netI      0.0149
_diffrn_reflns_av_R_equivalents   0.0370
_diffrn_standards_number          0
_diffrn_standards_interval_count  0 
_diffrn_standards_interval_time   0
_diffrn_standards_decay_%         0
_diffrn_reflns_limit_h_min        -11
_diffrn_reflns_limit_h_max        11
_diffrn_reflns_limit_k_min        -11
_diffrn_reflns_limit_k_max        11
_diffrn_reflns_limit_l_min        -32
_diffrn_reflns_limit_l_max        31
_diffrn_reflns_theta_min          1.865
_diffrn_reflns_theta_max          31.586
_diffrn_reflns_theta_full         25.242
_diffrn_measured_fraction_theta_max   0.979
_diffrn_measured_fraction_theta_full  0.996
_diffrn_reflns_Laue_measured_fraction_max    0.979
_diffrn_reflns_Laue_measured_fraction_full   0.996
_diffrn_reflns_point_group_measured_fraction_max   0.979
_diffrn_reflns_point_group_measured_fraction_full  0.996
_reflns_number_total              1242
_reflns_number_gt                 1144
_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        ?
_computing_cell_refinement        ?
_computing_data_reduction         ?
_computing_structure_solution     ?
_computing_structure_refinement 'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics     ?
_computing_publication_material   ?
_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)+(0.0028P)²+41.9473P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      ?
_atom_sites_solution_secondary    ?
_atom_sites_solution_hydrogens    .
_refine_ls_hydrogen_treatment     undef
_refine_ls_extinction_method      'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_extinction_coef        0.000345(11)
_refine_ls_extinction_expression
 'Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^'
_refine_ls_number_reflns          1242
_refine_ls_number_parameters      50
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0255
_refine_ls_R_factor_gt            0.0231
_refine_ls_wR_factor_ref          0.0506
_refine_ls_wR_factor_gt           0.0496
_refine_ls_goodness_of_fit_ref    1.428
_refine_ls_restrained_S_all       1.428
_refine_ls_shift/su_max           0.023
_refine_ls_shift/su_mean          0.004
 
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
Yb1 Yb 0.24952(3) 0.37604(3) 0.08257(2) 0.00529(8) Uani 1 1 d . . . . .
Pd1 Pd 0.0000 0.12666(7) 0.14132(2) 0.00392(11) Uani 1 2 d S T P . .
Ge1 Ge 0.27568(7) 0.12614(7) 0.19379(2) 0.00545(11) Uani 1 1 d . . . . .
Ge2 Ge 0.0000 0.40468(10) 0.19403(4) 0.00484(14) Uani 1 2 d S T P . .
Ge3 Ge 0.0000 0.34759(10) 0.30685(4) 0.00603(15) Uani 1 2 d S T P . .
Ge4 Ge 0.0000 0.12048(10) 0.46051(4) 0.00818(15) Uani 1 2 d S T P . .
Ge5 Ge 0.0000 0.13038(10) 0.02917(4) 0.00624(14) Uani 1 2 d S T P . .
 
 
_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
 
loop_
 _geom_bond_atom_site_label_1
 _geom_bond_atom_site_label_2
 _geom_bond_distance
 _geom_bond_site_symmetry_2
 _geom_bond_publ_flag
Yb1 Ge4 2.9696(6) 10_566 ?
Yb1 Ge4 3.0338(7) 14_556 ?
Yb1 Ge5 3.0546(7) . ?
Yb1 Ge5 3.1048(6) 5 ?
Yb1 Pd1 3.1201(5) . ?
Yb1 Pd1 3.1315(5) 5 ?
Yb1 Ge1 3.1495(6) . ?
Yb1 Ge1 3.1500(6) 16 ?
Yb1 Ge3 3.1688(6) 14_556 ?
Yb1 Ge2 3.1784(6) . ?
Yb1 Ge5 3.1803(6) 13 ?
Yb1 Ge4 3.3513(7) 2_554 ?
Pd1 Ge5 2.4488(9) . ?
Pd1 Ge3 2.4982(10) 10_556 ?
Pd1 Ge2 2.4995(9) . ?
Pd1 Ge1 2.5202(6) 12 ?
Pd1 Ge1 2.5202(6) . ?
Pd1 Yb1 3.1200(5) 12 ?
Pd1 Yb1 3.1314(5) 5_445 ?
Pd1 Yb1 3.1314(5) 16_545 ?
Ge1 Ge1 2.4900(11) 7_545 ?
Ge1 Ge3 2.5417(8) 14_556 ?
Ge1 Ge2 2.5417(8) 5_545 ?
Ge1 Yb1 3.1500(6) 16_545 ?
Ge2 Ge3 2.5050(11) . ?
Ge2 Ge1 2.5417(8) 16 ?
Ge2 Ge1 2.5417(8) 5_455 ?
Ge2 Yb1 3.1784(6) 12 ?
Ge3 Pd1 2.4982(10) 10_566 ?
Ge3 Ge1 2.5417(8) 14_456 ?
Ge3 Ge1 2.5417(8) 7_545 ?
Ge3 Yb1 3.1687(6) 7_545 ?
Ge3 Yb1 3.1687(6) 14_456 ?
Ge4 Ge5 2.4901(12) 2 ?
Ge4 Ge4 2.5831(17) 9_556 ?
Ge4 Yb1 2.9696(6) 3_545 ?
Ge4 Yb1 2.9696(6) 10_556 ?
Ge4 Yb1 3.0338(7) 7_545 ?
Ge4 Yb1 3.0338(7) 14_456 ?
Ge4 Yb1 3.3513(7) 11_566 ?
Ge4 Yb1 3.3513(7) 2 ?
Ge5 Ge5 2.4400(16) 9 ?
Ge5 Ge4 2.4901(12) 2_554 ?
Ge5 Yb1 3.0546(6) 12 ?
Ge5 Yb1 3.1048(6) 5_445 ?
Ge5 Yb1 3.1048(6) 16_545 ?
Ge5 Yb1 3.1804(6) 8_455 ?
Ge5 Yb1 3.1804(6) 13 ?
 
loop_
 _geom_angle_atom_site_label_1
 _geom_angle_atom_site_label_2
 _geom_angle_atom_site_label_3
 _geom_angle
 _geom_angle_site_symmetry_1
 _geom_angle_site_symmetry_3
 _geom_angle_publ_flag
Ge4 Yb1 Ge4 143.46(3) 10_566 14_556 ?
Ge4 Yb1 Ge5 81.122(18) 10_566 . ?
Ge4 Yb1 Ge5 84.112(17) 14_556 . ?
Ge4 Yb1 Ge5 84.321(17) 10_566 5 ?
Ge4 Yb1 Ge5 83.192(18) 14_556 5 ?
Ge5 Yb1 Ge5 135.50(3) . 5 ?
Ge4 Yb1 Pd1 95.953(15) 10_566 . ?
Ge4 Yb1 Pd1 97.841(17) 14_556 . ?
Ge5 Yb1 Pd1 46.715(17) . . ?
Ge5 Yb1 Pd1 177.740(19) 5 . ?
Ge4 Yb1 Pd1 98.961(17) 10_566 5 ?
Ge4 Yb1 Pd1 96.805(15) 14_556 5 ?
Ge5 Yb1 Pd1 178.202(18) . 5 ?
Ge5 Yb1 Pd1 46.240(17) 5 5 ?
Pd1 Yb1 Pd1 131.541(19) . 5 ?
Ge4 Yb1 Ge1 134.946(18) 10_566 . ?
Ge4 Yb1 Ge1 76.58(2) 14_556 . ?
Ge5 Yb1 Ge1 86.149(19) . . ?
Ge5 Yb1 Ge1 131.230(16) 5 . ?
Pd1 Yb1 Ge1 47.400(13) . . ?
Pd1 Yb1 Ge1 92.554(15) 5 . ?
Ge4 Yb1 Ge1 77.48(2) 10_566 16 ?
Ge4 Yb1 Ge1 135.132(18) 14_556 16 ?
Ge5 Yb1 Ge1 131.113(16) . 16 ?
Ge5 Yb1 Ge1 85.296(19) 5 16 ?
Pd1 Yb1 Ge1 92.569(15) . 16 ?
Pd1 Yb1 Ge1 47.306(13) 5 16 ?
Ge1 Yb1 Ge1 79.123(14) . 16 ?
Ge4 Yb1 Ge3 136.78(2) 10_566 14_556 ?
Ge4 Yb1 Ge3 75.84(2) 14_556 14_556 ?
Ge5 Yb1 Ge3 132.29(2) . 14_556 ?
Ge5 Yb1 Ge3 84.844(17) 5 14_556 ?
Pd1 Yb1 Ge3 93.449(15) . 14_556 ?
Pd1 Yb1 Ge3 46.718(17) 5 14_556 ?
Ge1 Yb1 Ge3 47.439(16) . 14_556 ?
Ge1 Yb1 Ge3 59.997(17) 16 14_556 ?
Ge4 Yb1 Ge2 75.99(2) 10_566 . ?
Ge4 Yb1 Ge2 135.68(2) 14_556 . ?
Ge5 Yb1 Ge2 85.019(17) . . ?
Ge5 Yb1 Ge2 131.33(2) 5 . ?
Pd1 Yb1 Ge2 46.750(17) . . ?
Pd1 Yb1 Ge2 93.255(15) 5 . ?
Ge1 Yb1 Ge2 59.898(17) . . ?
Ge1 Yb1 Ge2 47.357(16) 16 . ?
Ge3 Yb1 Ge2 80.399(14) 14_556 . ?
Ge4 Yb1 Ge5 101.914(19) 10_566 13 ?
Ge4 Yb1 Ge5 47.17(2) 14_556 13 ?
Ge5 Yb1 Ge5 97.093(11) . 13 ?
Ge5 Yb1 Ge5 45.67(3) 5 13 ?
Pd1 Yb1 Ge5 136.282(19) . 13 ?
Pd1 Yb1 Ge5 84.653(15) 5 13 ?
Ge1 Yb1 Ge5 122.538(17) . 13 ?
Ge1 Yb1 Ge5 130.040(18) 16 13 ?
Ge3 Yb1 Ge5 99.820(14) 14_556 13 ?
Ge2 Yb1 Ge5 176.80(2) . 13 ?
Ge4 Yb1 Ge4 47.77(3) 10_566 2_554 ?
Ge4 Yb1 Ge4 99.593(12) 14_556 2_554 ?
Ge5 Yb1 Ge4 45.46(2) . 2_554 ?
Ge5 Yb1 Ge4 95.409(17) 5 2_554 ?
Pd1 Yb1 Ge4 86.412(15) . 2_554 ?
Pd1 Yb1 Ge4 135.672(19) 5 2_554 ?
Ge1 Yb1 Ge4 131.251(18) . 2_554 ?
Ge1 Yb1 Ge4 124.629(17) 16 2_554 ?
Ge3 Yb1 Ge4 175.37(2) 14_556 2_554 ?
Ge2 Yb1 Ge4 102.749(14) . 2_554 ?
Ge5 Yb1 Ge4 77.230(14) 13 2_554 ?
Ge5 Pd1 Ge3 117.63(4) . 10_556 ?
Ge5 Pd1 Ge2 116.72(3) . . ?
Ge3 Pd1 Ge2 125.65(3) 10_556 . ?
Ge5 Pd1 Ge1 117.032(16) . 12 ?
Ge3 Pd1 Ge1 78.033(19) 10_556 12 ?
Ge2 Pd1 Ge1 78.007(19) . 12 ?
Ge5 Pd1 Ge1 117.034(16) . . ?
Ge3 Pd1 Ge1 78.032(19) 10_556 . ?
Ge2 Pd1 Ge1 78.006(19) . . ?
Ge1 Pd1 Ge1 125.93(3) 12 . ?
Ge5 Pd1 Yb1 65.238(18) . 12 ?
Ge3 Pd1 Yb1 139.019(9) 10_556 12 ?
Ge2 Pd1 Yb1 67.853(18) . 12 ?
Ge1 Pd1 Yb1 66.912(14) 12 12 ?
Ge1 Pd1 Yb1 140.17(2) . 12 ?
Ge5 Pd1 Yb1 65.237(18) . . ?
Ge3 Pd1 Yb1 139.019(9) 10_556 . ?
Ge2 Pd1 Yb1 67.853(18) . . ?
Ge1 Pd1 Yb1 140.17(2) 12 . ?
Ge1 Pd1 Yb1 66.913(14) . . ?
Yb1 Pd1 Yb1 81.265(16) 12 . ?
Ge5 Pd1 Yb1 66.307(18) . 5_445 ?
Ge3 Pd1 Yb1 67.427(18) 10_556 5_445 ?
Ge2 Pd1 Yb1 139.078(9) . 5_445 ?
Ge1 Pd1 Yb1 66.732(14) 12 5_445 ?
Ge1 Pd1 Yb1 139.93(2) . 5_445 ?
Yb1 Pd1 Yb1 79.331(8) 12 5_445 ?
Yb1 Pd1 Yb1 131.541(19) . 5_445 ?
Ge5 Pd1 Yb1 66.307(18) . 16_545 ?
Ge3 Pd1 Yb1 67.427(18) 10_556 16_545 ?
Ge2 Pd1 Yb1 139.078(9) . 16_545 ?
Ge1 Pd1 Yb1 139.93(2) 12 16_545 ?
Ge1 Pd1 Yb1 66.733(14) . 16_545 ?
Yb1 Pd1 Yb1 131.542(19) 12 16_545 ?
Yb1 Pd1 Yb1 79.331(8) . 16_545 ?
Yb1 Pd1 Yb1 81.284(16) 5_445 16_545 ?
Ge1 Ge1 Pd1 107.37(3) 7_545 . ?
Ge1 Ge1 Ge3 97.24(3) 7_545 14_556 ?
Pd1 Ge1 Ge3 129.53(3) . 14_556 ?
Ge1 Ge1 Ge2 96.82(3) 7_545 5_545 ?
Pd1 Ge1 Ge2 129.96(3) . 5_545 ?
Ge3 Ge1 Ge2 88.11(2) 14_556 5_545 ?
Ge1 Ge1 Yb1 138.478(14) 7_545 . ?
Pd1 Ge1 Yb1 65.687(17) . . ?
Ge3 Ge1 Yb1 66.68(2) 14_556 . ?
Ge2 Ge1 Yb1 119.37(3) 5_545 . ?
Ge1 Ge1 Yb1 138.501(14) 7_545 16_545 ?
Pd1 Ge1 Yb1 65.960(17) . 16_545 ?
Ge3 Ge1 Yb1 118.90(3) 14_556 16_545 ?
Ge2 Ge1 Yb1 66.91(2) 5_545 16_545 ?
Yb1 Ge1 Yb1 78.609(13) . 16_545 ?
Pd1 Ge2 Ge3 106.93(4) . . ?
Pd1 Ge2 Ge1 128.05(2) . 16 ?
Ge3 Ge2 Ge1 97.38(3) . 16 ?
Pd1 Ge2 Ge1 128.05(2) . 5_455 ?
Ge3 Ge2 Ge1 97.38(3) . 5_455 ?
Ge1 Ge2 Ge1 91.89(3) 16 5_455 ?
Pd1 Ge2 Yb1 65.397(18) . 12 ?
Ge3 Ge2 Yb1 137.712(15) . 12 ?
Ge1 Ge2 Yb1 120.52(3) 16 12 ?
Ge1 Ge2 Yb1 65.734(17) 5_455 12 ?
Pd1 Ge2 Yb1 65.397(18) . . ?
Ge3 Ge2 Yb1 137.713(15) . . ?
Ge1 Ge2 Yb1 65.734(17) 16 . ?
Ge1 Ge2 Yb1 120.52(3) 5_455 . ?
Yb1 Ge2 Yb1 79.47(2) 12 . ?
Pd1 Ge3 Ge2 106.46(4) 10_566 . ?
Pd1 Ge3 Ge1 128.49(2) 10_566 14_456 ?
Ge2 Ge3 Ge1 96.96(3) . 14_456 ?
Pd1 Ge3 Ge1 128.49(2) 10_566 7_545 ?
Ge2 Ge3 Ge1 96.96(3) . 7_545 ?
Ge1 Ge3 Ge1 91.89(4) 14_456 7_545 ?
Pd1 Ge3 Yb1 65.857(19) 10_566 7_545 ?
Ge2 Ge3 Yb1 137.409(15) . 7_545 ?
Ge1 Ge3 Yb1 121.10(3) 14_456 7_545 ?
Ge1 Ge3 Yb1 65.881(17) 7_545 7_545 ?
Pd1 Ge3 Yb1 65.857(19) 10_566 14_456 ?
Ge2 Ge3 Yb1 137.409(15) . 14_456 ?
Ge1 Ge3 Yb1 65.881(17) 14_456 14_456 ?
Ge1 Ge3 Yb1 121.10(3) 7_545 14_456 ?
Yb1 Ge3 Yb1 80.13(2) 7_545 14_456 ?
Ge5 Ge4 Ge4 101.10(5) 2 9_556 ?
Ge5 Ge4 Yb1 135.661(14) 2 3_545 ?
Ge4 Ge4 Yb1 73.88(3) 9_556 3_545 ?
Ge5 Ge4 Yb1 135.661(14) 2 10_556 ?
Ge4 Ge4 Yb1 73.88(3) 9_556 10_556 ?
Yb1 Ge4 Yb1 86.34(2) 3_545 10_556 ?
Ge5 Ge4 Yb1 69.50(2) 2 7_545 ?
Ge4 Ge4 Yb1 135.03(2) 9_556 7_545 ?
Yb1 Ge4 Yb1 143.46(3) 3_545 7_545 ?
Yb1 Ge4 Yb1 83.308(10) 10_556 7_545 ?
Ge5 Ge4 Yb1 69.50(2) 2 14_456 ?
Ge4 Ge4 Yb1 135.03(2) 9_556 14_456 ?
Yb1 Ge4 Yb1 83.308(10) 3_545 14_456 ?
Yb1 Ge4 Yb1 143.46(3) 10_556 14_456 ?
Yb1 Ge4 Yb1 84.49(2) 7_545 14_456 ?
Ge5 Ge4 Yb1 60.96(2) 2 11_566 ?
Ge4 Ge4 Yb1 58.35(3) 9_556 11_566 ?
Yb1 Ge4 Yb1 132.23(3) 3_545 11_566 ?
Yb1 Ge4 Yb1 80.938(13) 10_556 11_566 ?
Yb1 Ge4 Yb1 80.408(12) 7_545 11_566 ?
Yb1 Ge4 Yb1 130.43(3) 14_456 11_566 ?
Ge5 Ge4 Yb1 60.96(2) 2 2 ?
Ge4 Ge4 Yb1 58.35(2) 9_556 2 ?
Yb1 Ge4 Yb1 80.938(13) 3_545 2 ?
Yb1 Ge4 Yb1 132.23(3) 10_556 2 ?
Yb1 Ge4 Yb1 130.43(3) 7_545 2 ?
Yb1 Ge4 Yb1 80.408(12) 14_456 2 ?
Yb1 Ge4 Yb1 74.640(19) 11_566 2 ?
Ge5 Ge5 Pd1 120.77(5) 9 . ?
Ge5 Ge5 Ge4 111.51(5) 9 2_554 ?
Pd1 Ge5 Ge4 127.71(4) . 2_554 ?
Ge5 Ge5 Yb1 138.301(11) 9 . ?
Pd1 Ge5 Yb1 68.049(19) . . ?
Ge4 Ge5 Yb1 73.58(2) 2_554 . ?
Ge5 Ge5 Yb1 138.301(11) 9 12 ?
Pd1 Ge5 Yb1 68.047(19) . 12 ?
Ge4 Ge5 Yb1 73.58(2) 2_554 12 ?
Yb1 Ge5 Yb1 83.39(2) . 12 ?
Ge5 Ge5 Yb1 68.80(3) 9 5_445 ?
Pd1 Ge5 Yb1 67.454(19) . 5_445 ?
Ge4 Ge5 Yb1 138.426(12) 2_554 5_445 ?
Yb1 Ge5 Yb1 135.50(3) . 5_445 ?
Yb1 Ge5 Yb1 80.754(10) 12 5_445 ?
Ge5 Ge5 Yb1 68.80(3) 9 16_545 ?
Pd1 Ge5 Yb1 67.454(19) . 16_545 ?
Ge4 Ge5 Yb1 138.426(12) 2_554 16_545 ?
Yb1 Ge5 Yb1 80.755(10) . 16_545 ?
Yb1 Ge5 Yb1 135.50(3) 12 16_545 ?
Yb1 Ge5 Yb1 82.13(2) 5_445 16_545 ?
Ge5 Ge5 Yb1 65.53(3) 9 8_455 ?
Pd1 Ge5 Yb1 140.073(10) . 8_455 ?
Ge4 Ge5 Yb1 63.32(2) 2_554 8_455 ?
Yb1 Ge5 Yb1 136.86(3) . 8_455 ?
Yb1 Ge5 Yb1 82.909(11) 12 8_455 ?
Yb1 Ge5 Yb1 81.734(12) 5_445 8_455 ?
Yb1 Ge5 Yb1 134.33(3) 16_545 8_455 ?
Ge5 Ge5 Yb1 65.53(3) 9 13 ?
Pd1 Ge5 Yb1 140.073(10) . 13 ?
Ge4 Ge5 Yb1 63.32(2) 2_554 13 ?
Yb1 Ge5 Yb1 82.908(11) . 13 ?
Yb1 Ge5 Yb1 136.86(3) 12 13 ?
Yb1 Ge5 Yb1 134.33(3) 5_445 13 ?
Yb1 Ge5 Yb1 81.734(12) 16_545 13 ?
Yb1 Ge5 Yb1 79.78(2) 8_455 13 ?
 
_refine_diff_density_max    1.921
_refine_diff_density_min   -1.779
_refine_diff_density_rms    0.285



