#------------------------------------------------------------------------------
#$Date: 2016-02-20 02:53:41 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176768 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/43/2104306.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2104306
loop_
_publ_author_name
'Daszkiewicz, Marek'
'Gulay, Lubomir D.'
'Lychmanyuk, Olga S.'
_publ_section_title
;
 Ln₃M~1{-~δ}TX₇ -- quasi-isostructural compounds:
 stereochemistry and silver-ion motion in the Ln₃Ag~1{-~δ}GeS₇ (Ln
 = La--Nd, Sm, Gd--Er and Y; δ = 0.11--0.50) compounds
;
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              126
_journal_page_last               133
_journal_paper_doi               10.1107/S010876810900144X
_journal_volume                  65
_journal_year                    2009
_chemical_formula_moiety         'Ag0.84 Ge Nd3 S7'
_chemical_formula_sum            'Ag0.84 Ge Nd3 S7'
_chemical_formula_weight         819.80
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           173
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            2
_cell_length_a                   10.1930(14)
_cell_length_b                   10.1930(14)
_cell_length_c                   5.7693(12)
_cell_measurement_reflns_used    700
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      26.37
_cell_measurement_theta_min      4.22
_cell_volume                     519.11(15)
_computing_cell_refinement       'CrysAlis RED'
_computing_data_collection       'CrysAlis CCD (Oxford Diffraction, 2007)'
_computing_data_reduction        'CrysAlis RED'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      295(2)
_diffrn_detector_area_resol_mean '1024x1024 with blocks 2x2, 33.133pixel/mm'
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'KUMA KM-4 with area CCD detector'
_diffrn_measurement_method       ω-scan
_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  0.0380
_diffrn_reflns_av_sigmaI/netI    0.0216
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       7
_diffrn_reflns_limit_l_min       -7
_diffrn_reflns_number            5463
_diffrn_reflns_theta_full        26.37
_diffrn_reflns_theta_max         26.37
_diffrn_reflns_theta_min         4.22
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    20.488
_exptl_absorpt_correction_T_max  0.261
_exptl_absorpt_correction_T_min  0.093
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'CrysAlis (Oxford Diffraction, 2007)'
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    5.245
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             726
_exptl_crystal_size_max          0.11
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.716
_refine_diff_density_min         -0.745
_refine_ls_abs_structure_details
'Flack H D (1983), Acta Cryst. A39, 876-881, 320 Friedel pairs'
_refine_ls_abs_structure_Flack   -0.027(19)
_refine_ls_extinction_coef       0.0335(7)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.078
_refine_ls_hydrogen_treatment    none
_refine_ls_matrix_type           full
_refine_ls_number_parameters     43
_refine_ls_number_reflns         713
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.078
_refine_ls_R_factor_all          0.0161
_refine_ls_R_factor_gt           0.0156
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         <0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0193P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0345
_refine_ls_wR_factor_ref         0.0346
_reflns_number_gt                700
_reflns_number_total             713
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            bp5017.cif
_cod_data_source_block           nd
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Hexagonal' changed to 'hexagonal'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Hexagonal' changed to 'hexagonal'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_database_code               2104306
_cod_database_fobs_code          2104306
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x, -y, z+1/2'
'y, -x+y, z+1/2'
'x-y, x, z+1/2'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Nd Nd 0.87317(3) 0.64140(3) 0.24353(16) 0.01001(11) Uani d . 1 . .
Ag Ag1 0.0000 0.0000 0.159(2) 0.053(4) Uani d SP 0.69(2) . .
Ag Ag2 0.0000 0.0000 0.971(7) 0.029(9) Uani d SP 0.15(2) . .
Ge Ge1 0.3333 0.6667 0.3272(2) 0.0087(2) Uani d S 1 . .
S S1 0.3333 0.6667 0.9504(4) 0.0110(5) Uani d S 1 . .
S S2 0.90545(14) 0.73476(15) 0.7252(3) 0.0140(3) Uani d . 1 . .
S S3 0.58466(16) 0.47936(16) 0.9818(3) 0.0103(3) Uani d . 1 . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
S S 0.1246 0.1234 '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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Nd Nd -0.1943 3.0179 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
S3 Nd S2 3_664 6_654 105.37(4) ?
S3 Nd S2 3_664 5_564 140.80(5) ?
S2 Nd S2 6_654 5_564 90.81(5) ?
S3 Nd S2 3_664 . 136.85(4) ?
S2 Nd S2 6_654 . 80.49(4) ?
S2 Nd S2 5_564 . 80.26(4) ?
S3 Nd S3 3_664 1_554 74.70(6) ?
S2 Nd S3 6_654 1_554 142.13(5) ?
S2 Nd S3 5_564 1_554 70.99(4) ?
S2 Nd S3 . 1_554 126.04(4) ?
S3 Nd S1 3_664 4_664 70.38(4) ?
S2 Nd S1 6_654 4_664 147.99(4) ?
S2 Nd S1 5_564 4_664 112.70(3) ?
S2 Nd S1 . 4_664 82.43(5) ?
S3 Nd S1 1_554 4_664 68.92(4) ?
S3 Nd S3 3_664 6_654 72.75(3) ?
S2 Nd S3 6_654 6_654 68.73(4) ?
S2 Nd S3 5_564 6_654 145.91(5) ?
S2 Nd S3 . 6_654 69.95(4) ?
S3 Nd S3 1_554 6_654 140.86(4) ?
S1 Nd S3 4_664 6_654 80.04(3) ?
S3 Nd S2 3_664 1_554 72.46(4) ?
S2 Nd S2 6_654 1_554 77.15(4) ?
S2 Nd S2 5_564 1_554 76.94(4) ?
S2 Nd S2 . 1_554 147.60(5) ?
S3 Nd S2 1_554 1_554 66.67(4) ?
S1 Nd S2 4_664 1_554 127.71(5) ?
S3 Nd S2 6_654 1_554 121.46(4) ?
S3 Nd Ag1 3_664 1_665 132.9(2) ?
S2 Nd Ag1 6_654 1_665 45.72(3) ?
S2 Nd Ag1 5_564 1_665 45.64(3) ?
S2 Nd Ag1 . 1_665 81.9(2) ?
S3 Nd Ag1 1_554 1_665 106.03(13) ?
S1 Nd Ag1 4_664 1_665 155.33(14) ?
S3 Nd Ag1 6_654 1_665 111.93(10) ?
S2 Nd Ag1 1_554 1_665 65.7(2) ?
S3 Nd Ag2 3_664 4_664 155.8(3) ?
S2 Nd Ag2 6_654 4_664 50.6(2) ?
S2 Nd Ag2 5_564 4_664 50.5(2) ?
S2 Nd Ag2 . 4_664 51.0(6) ?
S3 Nd Ag2 1_554 4_664 121.5(2) ?
S1 Nd Ag2 4_664 4_664 130.2(5) ?
S3 Nd Ag2 6_654 4_664 96.6(3) ?
S2 Nd Ag2 1_554 4_664 96.6(6) ?
Ag1 Nd Ag2 1_665 4_664 30.8(4) ?
S3 Nd Ag2 3_664 1_664 117.2(5) ?
S2 Nd Ag2 6_654 1_664 49.8(2) ?
S2 Nd Ag2 5_564 1_664 49.8(2) ?
S2 Nd Ag2 . 1_664 99.4(6) ?
S3 Nd Ag2 1_554 1_664 95.5(3) ?
S1 Nd Ag2 4_664 1_664 160.99(5) ?
S3 Nd Ag2 6_654 1_664 118.49(18) ?
S2 Nd Ag2 1_554 1_664 48.2(6) ?
Ag1 Nd Ag2 1_665 1_664 17.5(3) ?
Ag2 Nd Ag2 4_664 1_664 48.32(4) ?
Ag2 Ag1 Ag2 1_554 4_554 180.000(4) ?
Ag2 Ag1 S2 1_554 4_664 99.1(3) ?
Ag2 Ag1 S2 4_554 4_664 80.9(3) ?
Ag2 Ag1 S2 1_554 5_454 99.1(3) ?
Ag2 Ag1 S2 4_554 5_454 80.9(3) ?
S2 Ag1 S2 4_664 5_454 117.52(16) ?
Ag2 Ag1 S2 1_554 6_544 99.1(3) ?
Ag2 Ag1 S2 4_554 6_544 80.9(3) ?
S2 Ag1 S2 4_664 6_544 117.52(16) ?
S2 Ag1 S2 5_454 6_544 117.52(16) ?
Ag2 Ag1 Ag1 1_554 4_554 0.0000(10) ?
Ag2 Ag1 Ag1 4_554 4_554 180.000(5) ?
S2 Ag1 Ag1 4_664 4_554 99.1(3) ?
S2 Ag1 Ag1 5_454 4_554 99.1(3) ?
S2 Ag1 Ag1 6_544 4_554 99.1(3) ?
Ag2 Ag1 Ag1 1_554 4 180.0000(10) ?
Ag2 Ag1 Ag1 4_554 4 0.000(4) ?
S2 Ag1 Ag1 4_664 4 80.9(3) ?
S2 Ag1 Ag1 5_454 4 80.9(3) ?
S2 Ag1 Ag1 6_544 4 80.9(3) ?
Ag1 Ag1 Ag1 4_554 4 180.0000(10) ?
Ag2 Ag1 Nd 1_554 2_655 98.6(2) ?
Ag2 Ag1 Nd 4_554 2_655 81.4(2) ?
S2 Ag1 Nd 4_664 2_655 59.03(5) ?
S2 Ag1 Nd 5_454 2_655 162.2(5) ?
S2 Ag1 Nd 6_544 2_655 59.39(5) ?
Ag1 Ag1 Nd 4_554 2_655 98.6(2) ?
Ag1 Ag1 Nd 4 2_655 81.4(2) ?
Ag2 Ag1 Nd 1_554 1_445 98.6(2) ?
Ag2 Ag1 Nd 4_554 1_445 81.4(2) ?
S2 Ag1 Nd 4_664 1_445 162.2(5) ?
S2 Ag1 Nd 5_454 1_445 59.39(5) ?
S2 Ag1 Nd 6_544 1_445 59.03(5) ?
Ag1 Ag1 Nd 4_554 1_445 98.6(2) ?
Ag1 Ag1 Nd 4 1_445 81.4(2) ?
Nd Ag1 Nd 2_655 1_445 117.79(11) ?
Ag2 Ag1 Nd 1_554 3_565 98.6(2) ?
Ag2 Ag1 Nd 4_554 3_565 81.4(2) ?
S2 Ag1 Nd 4_664 3_565 59.39(5) ?
S2 Ag1 Nd 5_454 3_565 59.03(5) ?
S2 Ag1 Nd 6_544 3_565 162.2(5) ?
Ag1 Ag1 Nd 4_554 3_565 98.6(2) ?
Ag1 Ag1 Nd 4 3_565 81.4(2) ?
Nd Ag1 Nd 2_655 3_565 117.79(11) ?
Nd Ag1 Nd 1_445 3_565 117.79(11) ?
Ag1 Ag2 Ag1 1_556 4 180.000(12) ?
Ag1 Ag2 S2 1_556 1_445 120.8(7) ?
Ag1 Ag2 S2 4 1_445 59.2(7) ?
Ag1 Ag2 S2 1_556 3_565 120.8(7) ?
Ag1 Ag2 S2 4 3_565 59.2(7) ?
S2 Ag2 S2 1_445 3_565 96.1(9) ?
Ag1 Ag2 S2 1_556 2_655 120.8(7) ?
Ag1 Ag2 S2 4 2_655 59.2(7) ?
S2 Ag2 S2 1_445 2_655 96.1(9) ?
S2 Ag2 S2 3_565 2_655 96.1(9) ?
Ag1 Ag2 S2 1_556 4_665 58.2(7) ?
Ag1 Ag2 S2 4 4_665 121.8(7) ?
S2 Ag2 S2 1_445 4_665 179.0(14) ?
S2 Ag2 S2 3_565 4_665 84.52(3) ?
S2 Ag2 S2 2_655 4_665 84.52(3) ?
Ag1 Ag2 S2 1_556 6_545 58.2(7) ?
Ag1 Ag2 S2 4 6_545 121.8(7) ?
S2 Ag2 S2 1_445 6_545 84.52(3) ?
S2 Ag2 S2 3_565 6_545 179.0(14) ?
S2 Ag2 S2 2_655 6_545 84.52(3) ?
S2 Ag2 S2 4_665 6_545 94.8(9) ?
Ag1 Ag2 S2 1_556 5_455 58.2(7) ?
Ag1 Ag2 S2 4 5_455 121.8(7) ?
S2 Ag2 S2 1_445 5_455 84.52(3) ?
S2 Ag2 S2 3_565 5_455 84.52(3) ?
S2 Ag2 S2 2_655 5_455 179.0(14) ?
S2 Ag2 S2 4_665 5_455 94.8(9) ?
S2 Ag2 S2 6_545 5_455 94.8(9) ?
Ag1 Ag2 Ag2 1_556 4_554 180.00(2) ?
Ag1 Ag2 Ag2 4 4_554 0.0000(10) ?
S2 Ag2 Ag2 1_445 4_554 59.2(7) ?
S2 Ag2 Ag2 3_565 4_554 59.2(7) ?
S2 Ag2 Ag2 2_655 4_554 59.2(7) ?
S2 Ag2 Ag2 4_665 4_554 121.8(7) ?
S2 Ag2 Ag2 6_545 4_554 121.8(7) ?
S2 Ag2 Ag2 5_455 4_554 121.8(7) ?
Ag1 Ag2 Ag2 1_556 4 0.000(4) ?
Ag1 Ag2 Ag2 4 4 180.000(15) ?
S2 Ag2 Ag2 1_445 4 120.8(7) ?
S2 Ag2 Ag2 3_565 4 120.8(7) ?
S2 Ag2 Ag2 2_655 4 120.8(7) ?
S2 Ag2 Ag2 4_665 4 58.2(7) ?
S2 Ag2 Ag2 6_545 4 58.2(7) ?
S2 Ag2 Ag2 5_455 4 58.2(7) ?
Ag2 Ag2 Ag2 4_554 4 180.000(13) ?
Ag1 Ag2 Nd 1_556 5_455 112.2(6) ?
Ag1 Ag2 Nd 4 5_455 67.8(6) ?
S2 Ag2 Nd 1_445 5_455 53.6(3) ?
S2 Ag2 Nd 3_565 5_455 53.9(3) ?
S2 Ag2 Nd 2_655 5_455 127.0(13) ?
S2 Ag2 Nd 4_665 5_455 126.48(18) ?
S2 Ag2 Nd 6_545 5_455 126.18(18) ?
S2 Ag2 Nd 5_455 5_455 53.96(9) ?
Ag2 Ag2 Nd 4_554 5_455 67.8(6) ?
Ag2 Ag2 Nd 4 5_455 112.2(6) ?
Ag1 Ag2 Nd 1_556 4_665 112.2(6) ?
Ag1 Ag2 Nd 4 4_665 67.8(6) ?
S2 Ag2 Nd 1_445 4_665 127.0(13) ?
S2 Ag2 Nd 3_565 4_665 53.6(3) ?
S2 Ag2 Nd 2_655 4_665 53.9(3) ?
S2 Ag2 Nd 4_665 4_665 53.96(9) ?
S2 Ag2 Nd 6_545 4_665 126.48(18) ?
S2 Ag2 Nd 5_455 4_665 126.18(18) ?
Ag2 Ag2 Nd 4_554 4_665 67.8(6) ?
Ag2 Ag2 Nd 4 4_665 112.2(6) ?
Nd Ag2 Nd 5_455 4_665 106.6(6) ?
S1 Ge1 S3 1_554 5_564 113.61(4) ?
S1 Ge1 S3 1_554 6_554 113.61(4) ?
S3 Ge1 S3 5_564 6_554 105.03(5) ?
S1 Ge1 S3 1_554 4_664 113.61(4) ?
S3 Ge1 S3 5_564 4_664 105.03(5) ?
S3 Ge1 S3 6_554 4_664 105.03(5) ?
Ge1 S1 Nd 1_556 6 113.29(4) ?
Ge1 S1 Nd 1_556 4_665 113.29(4) ?
Nd S1 Nd 6 4_665 105.39(5) ?
Ge1 S1 Nd 1_556 5_565 113.29(4) ?
Nd S1 Nd 6 5_565 105.39(5) ?
Nd S1 Nd 4_665 5_565 105.39(5) ?
Ag2 S2 Ag2 1_665 4_664 62.57(3) ?
Ag1 S2 Nd 4_665 5_565 75.25(5) ?
Ag2 S2 Nd 1_665 5_565 75.80(9) ?
Ag2 S2 Nd 4_664 5_565 78.17(13) ?
Ag1 S2 Nd 4_665 6_655 74.97(4) ?
Ag2 S2 Nd 1_665 6_655 75.57(9) ?
Ag2 S2 Nd 4_664 6_655 77.93(13) ?
Nd S2 Nd 5_565 6_655 148.84(5) ?
Ag1 S2 Nd 4_665 . 97.6(3) ?
Ag2 S2 Nd 1_665 . 137.6(7) ?
Ag2 S2 Nd 4_664 . 75.0(7) ?
Nd S2 Nd 5_565 . 96.58(5) ?
Nd S2 Nd 6_655 . 96.26(5) ?
Ag1 S2 Nd 4_665 1_556 114.8(3) ?
Ag2 S2 Nd 1_665 1_556 74.8(7) ?
Ag2 S2 Nd 4_664 1_556 137.4(7) ?
Nd S2 Nd 5_565 1_556 92.23(4) ?
Nd S2 Nd 6_655 1_556 91.96(4) ?
Nd S2 Nd . 1_556 147.60(5) ?
Ge1 S3 Nd 4_665 2_656 91.59(5) ?
Ge1 S3 Nd 4_665 1_556 88.68(5) ?
Nd S3 Nd 2_656 1_556 111.12(5) ?
Ge1 S3 Nd 4_665 5_565 120.99(6) ?
Nd S3 Nd 2_656 5_565 140.93(6) ?
Nd S3 Nd 1_556 5_565 92.03(4) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Nd S3 3_664 2.8538(14) ?
Nd S2 6_654 2.8792(13) ?
Nd S2 5_564 2.8935(13) ?
Nd S2 . 2.9025(19) ?
Nd S3 1_554 2.9664(15) ?
Nd S1 4_664 3.0174(11) ?
Nd S3 6_654 3.0316(15) ?
Nd S2 1_554 3.1051(19) ?
Nd Ag1 1_665 3.247(2) ?
Nd Ag2 4_664 3.467(15) ?
Nd Ag2 1_664 3.576(17) ?
Ag1 Ag2 1_554 1.09(3) ?
Ag1 Ag2 4_554 1.80(3) ?
Ag1 S2 4_664 2.404(2) ?
Ag1 S2 5_454 2.404(2) ?
Ag1 S2 6_544 2.404(2) ?
Ag1 Ag1 4_554 2.8846(6) ?
Ag1 Ag1 4 2.8846(6) ?
Ag1 Nd 2_655 3.247(2) ?
Ag1 Nd 1_445 3.247(2) ?
Ag1 Nd 3_565 3.247(2) ?
Ag2 Ag1 1_556 1.09(3) ?
Ag2 Ag1 4 1.80(3) ?
Ag2 S2 1_445 2.76(2) ?
Ag2 S2 3_565 2.76(2) ?
Ag2 S2 2_655 2.76(2) ?
Ag2 S2 4_665 2.79(2) ?
Ag2 S2 6_545 2.79(2) ?
Ag2 S2 5_455 2.79(2) ?
Ag2 Ag2 4_554 2.8846(6) ?
Ag2 Ag2 4 2.8846(6) ?
Ag2 Nd 5_455 3.467(15) ?
Ag2 Nd 4_665 3.467(15) ?
Ge1 S1 1_554 2.174(3) ?
Ge1 S3 5_564 2.2256(16) ?
Ge1 S3 6_554 2.2256(16) ?
Ge1 S3 4_664 2.2256(16) ?
S1 Ge1 1_556 2.174(3) ?
S1 Nd 6 3.0174(11) ?
S1 Nd 4_665 3.0174(11) ?
S1 Nd 5_565 3.0174(11) ?
S2 Ag1 4_665 2.404(2) ?
S2 Ag2 1_665 2.76(2) ?
S2 Ag2 4_664 2.79(2) ?
S2 Nd 5_565 2.8792(13) ?
S2 Nd 6_655 2.8935(13) ?
S2 Nd 1_556 3.1051(19) ?
S3 Ge1 4_665 2.2256(16) ?
S3 Nd 2_656 2.8538(14) ?
S3 Nd 1_556 2.9664(15) ?
S3 Nd 5_565 3.0316(15) ?
