#------------------------------------------------------------------------------
#$Date: 2016-10-14 09:18:43 +0300 (Fri, 14 Oct 2016) $
#$Revision: 187333 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/67/7226799.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_7226799
loop_
_publ_author_name
'Wu, Xiaowen'
'Hu, Yi'
'Pan, Hui'
'Su, Zhi'
_publ_section_title
;
 Na9Sb(Ge2Q6)2 (Q = S, Se): two new antimony (III) quaternary
 chalcogenides with ethane-like [Ge2Q6]6− ligands
;
_journal_name_full               'RSC Adv.'
_journal_paper_doi               10.1039/C6RA22000B
_journal_year                    2016
_chemical_formula_sum            'Ge4 Na9 Sb Se12'
_chemical_formula_weight         1566.54
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2016-06-06 deposited with the CCDC.
2016-10-13 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 122.103(11)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.950(10)
_cell_length_b                   24.33(3)
_cell_length_c                   7.066(8)
_cell_measurement_reflns_used    287
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      24.32
_cell_measurement_theta_min      2.81
_cell_volume                     1303(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0754
_diffrn_reflns_av_sigmaI/netI    0.0927
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       9
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_number            4036
_diffrn_reflns_theta_full        27.63
_diffrn_reflns_theta_max         27.63
_diffrn_reflns_theta_min         2.81
_exptl_absorpt_coefficient_mu    22.481
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.4358
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    3.992
_exptl_crystal_description       block
_exptl_crystal_F_000             1372
_exptl_crystal_size_max          0.085
_exptl_crystal_size_mid          0.064
_exptl_crystal_size_min          0.053
_refine_diff_density_max         1.168
_refine_diff_density_min         -1.658
_refine_diff_density_rms         0.302
_refine_ls_extinction_coef       0.00099(10)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.010
_refine_ls_matrix_type           full
_refine_ls_number_parameters     63
_refine_ls_number_reflns         1518
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.010
_refine_ls_R_factor_all          0.1208
_refine_ls_R_factor_gt           0.0534
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0423P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1193
_refine_ls_wR_factor_ref         0.1462
_reflns_number_gt                747
_reflns_number_total             1518
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6ra22000b1.cif
_cod_data_source_block           53
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4268 2015-11-12 08:31:59Z antanas 
;
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7226799
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Ge1 Ge 0.15863(15) 0.12484(6) 0.35440(18) 0.0166(4) Uani 1 1 d .
Se1 Se 0.25542(16) 0.12544(15) -0.26558(18) 0.0285(4) Uani 1 1 d .
Se2 Se 0.24537(16) 0.04475(10) 0.25382(19) 0.0249(6) Uani 1 1 d .
Se3 Se 0.25181(16) 0.20396(10) 0.25340(19) 0.0256(6) Uani 1 1 d .
Na1 Na 0.0000 -0.0419(2) 0.2500 0.0426(16) Uani 0.75 2 d SP
Sb1 Sb 0.0000 -0.0419(2) 0.2500 0.0426(16) Uani 0.25 2 d SP
Na3 Na 0.5000 0.1231(4) 0.2500 0.0351(18) Uani 1 2 d S
Na4 Na 0.0000 0.1995(4) -0.2500 0.031(3) Uani 1 2 d S
Na5 Na 0.5000 0.0384(4) 0.7500 0.017(2) Uani 1 2 d S
Na2 Na 0.5000 0.21542(17) 0.7500 0.0188(10) Uani 0.75 2 d SP
Sb2 Sb 0.5000 0.21542(17) 0.7500 0.0188(10) Uani 0.25 2 d SP
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'
Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Se Se -0.0929 2.2259 '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
Se1 Ge1 Se2 111.87(11) 1_556 .
Se1 Ge1 Se3 111.57(12) 1_556 .
Se2 Ge1 Se3 111.11(10) . .
Se1 Ge1 Ge1 107.45(8) 1_556 2
Se2 Ge1 Ge1 106.70(7) . 2
Se3 Ge1 Ge1 107.87(7) . 2
Ge1 Se1 Na4 102.95(9) 1_554 .
Ge1 Se1 Na5 81.73(8) 1_554 1_554
Na4 Se1 Na5 171.9(3) . 1_554
Ge1 Se1 Sb2 82.37(8) 1_554 1_554
Na4 Se1 Sb2 96.6(2) . 1_554
Na5 Se1 Sb2 90.55(15) 1_554 1_554
Ge1 Se1 Na2 82.37(8) 1_554 1_554
Na4 Se1 Na2 96.6(2) . 1_554
Na5 Se1 Na2 90.55(15) 1_554 1_554
Sb2 Se1 Na2 0.00(11) 1_554 1_554
Ge1 Se1 Na3 161.41(7) 1_554 .
Na4 Se1 Na3 92.54(13) . .
Na5 Se1 Na3 84.17(14) 1_554 .
Sb2 Se1 Na3 85.73(15) 1_554 .
Na2 Se1 Na3 85.73(15) 1_554 .
Ge1 Se1 Na1 101.88(9) 1_554 5
Na4 Se1 Na1 78.44(18) . 5
Na5 Se1 Na1 94.2(2) 1_554 5
Sb2 Se1 Na1 174.04(14) 1_554 5
Na2 Se1 Na1 174.04(14) 1_554 5
Na3 Se1 Na1 91.14(14) . 5
Ge1 Se2 Na3 81.31(19) . .
Ge1 Se2 Na5 81.77(15) . .
Na3 Se2 Na5 86.22(12) . .
Ge1 Se2 Sb1 103.03(11) . 5
Na3 Se2 Sb1 94.84(9) . 5
Na5 Se2 Sb1 175.2(2) . 5
Ge1 Se2 Na1 103.03(11) . 5
Na3 Se2 Na1 94.84(9) . 5
Na5 Se2 Na1 175.2(2) . 5
Sb1 Se2 Na1 0.0 5 5
Ge1 Se2 Na1 103.03(12) . .
Na3 Se2 Na1 175.65(19) . .
Na5 Se2 Na1 94.09(12) . .
Sb1 Se2 Na1 84.51(9) 5 .
Na1 Se2 Na1 84.51(9) 5 .
Ge1 Se2 Na5 157.12(13) . 5_656
Na3 Se2 Na5 81.2(2) . 5_656
Na5 Se2 Na5 82.50(13) . 5_656
Sb1 Se2 Na5 93.01(9) 5 5_656
Na1 Se2 Na5 93.01(9) 5 5_656
Na1 Se2 Na5 94.6(2) . 5_656
Ge1 Se3 Na3 81.28(19) . .
Ge1 Se3 Sb2 98.77(11) . 7_556
Na3 Se3 Sb2 179.20(6) . 7_556
Ge1 Se3 Na2 98.77(11) . 7_556
Na3 Se3 Na2 179.20(6) . 7_556
Sb2 Se3 Na2 0.0 7_556 7_556
Ge1 Se3 Na2 83.28(10) . .
Na3 Se3 Na2 88.80(8) . .
Sb2 Se3 Na2 92.00(8) 7_556 .
Na2 Se3 Na2 92.00(8) 7_556 .
Ge1 Se3 Na4 99.44(18) . .
Na3 Se3 Na4 93.41(15) . .
Sb2 Se3 Na4 85.79(15) 7_556 .
Na2 Se3 Na4 85.79(15) 7_556 .
Na2 Se3 Na4 176.7(2) . .
Ge1 Se3 Na4 161.65(10) . 7
Na3 Se3 Na4 87.8(2) . 7
Sb2 Se3 Na4 92.37(19) 7_556 7
Na2 Se3 Na4 92.37(19) 7_556 7
Na2 Se3 Na4 81.80(8) . 7
Na4 Se3 Na4 95.85(15) . 7
Se2 Na1 Se2 177.3(2) 6_556 5
Se2 Na1 Se2 86.36(9) 6_556 .
Se2 Na1 Se2 95.49(9) 5 .
Se2 Na1 Se2 95.49(9) 6_556 2
Se2 Na1 Se2 86.36(9) 5 2
Se2 Na1 Se2 92.0(2) . 2
Se2 Na1 Se1 91.76(9) 6_556 5
Se2 Na1 Se1 86.50(9) 5 5
Se2 Na1 Se1 176.25(15) . 5
Se2 Na1 Se1 84.96(12) 2 5
Se2 Na1 Se1 86.50(9) 6_556 6_556
Se2 Na1 Se1 91.76(9) 5 6_556
Se2 Na1 Se1 84.96(12) . 6_556
Se2 Na1 Se1 176.25(15) 2 6_556
Se1 Na1 Se1 98.2(2) 5 6_556
Se2 Na1 Na4 88.67(10) 6_556 5
Se2 Na1 Na4 88.67(10) 5 5
Se2 Na1 Na4 134.01(10) . 5
Se2 Na1 Na4 134.01(10) 2 5
Se1 Na1 Na4 49.09(11) 5 5
Se1 Na1 Na4 49.09(11) 6_556 5
Se2 Na1 Na1 47.76(7) 6_556 5_556
Se2 Na1 Na1 134.05(15) 5 5_556
Se2 Na1 Na1 88.77(17) . 5_556
Se2 Na1 Na1 47.73(9) 2 5_556
Se1 Na1 Na1 87.56(8) 5 5_556
Se1 Na1 Na1 134.17(7) 6_556 5_556
Na4 Na1 Na1 119.97(14) 5 5_556
Se2 Na1 Na1 134.05(15) 6_556 5
Se2 Na1 Na1 47.76(7) 5 5
Se2 Na1 Na1 47.73(9) . 5
Se2 Na1 Na1 88.77(17) 2 5
Se1 Na1 Na1 134.17(7) 5 5
Se1 Na1 Na1 87.56(8) 6_556 5
Na4 Na1 Na1 119.97(14) 5 5
Na1 Na1 Na1 120.1(3) 5_556 5
Se3 Na3 Se3 97.3(3) 2_655 .
Se3 Na3 Se2 178.4(3) 2_655 .
Se3 Na3 Se2 81.10(10) . .
Se3 Na3 Se2 81.10(10) 2_655 2_655
Se3 Na3 Se2 178.4(3) . 2_655
Se2 Na3 Se2 100.5(3) . 2_655
Se3 Na3 Se1 86.19(14) 2_655 2_655
Se3 Na3 Se1 92.44(15) . 2_655
Se2 Na3 Se1 93.83(14) . 2_655
Se2 Na3 Se1 87.50(13) 2_655 2_655
Se3 Na3 Se1 92.44(15) 2_655 .
Se3 Na3 Se1 86.19(14) . .
Se2 Na3 Se1 87.50(13) . .
Se2 Na3 Se1 93.83(14) 2_655 .
Se1 Na3 Se1 177.9(4) 2_655 .
Se3 Na3 Ge1 41.62(7) 2_655 2_655
Se3 Na3 Ge1 137.0(3) . 2_655
Se2 Na3 Ge1 139.9(3) . 2_655
Se2 Na3 Ge1 41.39(7) 2_655 2_655
Se1 Na3 Ge1 95.57(8) 2_655 2_655
Se1 Na3 Ge1 84.40(8) . 2_655
Se3 Na3 Na5 131.35(16) 2_655 5_656
Se3 Na3 Na5 131.35(16) . 5_656
Se2 Na3 Na5 50.25(16) . 5_656
Se2 Na3 Na5 50.25(16) 2_655 5_656
Se1 Na3 Na5 91.04(19) 2_655 5_656
Se1 Na3 Na5 91.04(19) . 5_656
Ge1 Na3 Na5 90.68(16) 2_655 5_656
Se3 Na3 Na5 89.05(10) 2_655 1_554
Se3 Na3 Na5 133.04(7) . 1_554
Se2 Na3 Na5 92.1(2) . 1_554
Se2 Na3 Na5 47.10(9) 2_655 1_554
Se1 Na3 Na5 134.5(2) 2_655 1_554
Se1 Na3 Na5 46.96(12) . 1_554
Ge1 Na3 Na5 54.82(8) 2_655 1_554
Na5 Na3 Na5 59.74(16) 5_656 1_554
Se3 Na3 Na2 45.90(9) 2_655 1_554
Se3 Na3 Na2 89.3(2) . 1_554
Se2 Na3 Na2 133.89(5) . 1_554
Se2 Na3 Na2 89.58(8) 2_655 1_554
Se1 Na3 Na2 131.8(2) 2_655 1_554
Se1 Na3 Na2 46.73(11) . 1_554
Ge1 Na3 Na2 54.89(7) 2_655 1_554
Na5 Na3 Na2 122.44(13) 5_656 1_554
Na5 Na3 Na2 62.70(13) 1_554 1_554
Se1 Na4 Se1 104.9(4) . 2_554
Se1 Na4 Se3 87.60(13) . .
Se1 Na4 Se3 94.89(14) 2_554 .
Se1 Na4 Se3 94.89(14) . 2_554
Se1 Na4 Se3 87.60(13) 2_554 2_554
Se3 Na4 Se3 175.9(4) . 2_554
Se1 Na4 Se3 83.97(13) . 7
Se1 Na4 Se3 171.0(3) 2_554 7
Se3 Na4 Se3 84.15(15) . 7
Se3 Na4 Se3 92.89(17) 2_554 7
Se1 Na4 Se3 171.0(3) . 8_455
Se1 Na4 Se3 83.97(13) 2_554 8_455
Se3 Na4 Se3 92.89(17) . 8_455
Se3 Na4 Se3 84.15(15) 2_554 8_455
Se3 Na4 Se3 87.1(3) 7 8_455
Se1 Na4 Na1 52.47(19) . 5
Se1 Na4 Na1 52.47(19) 2_554 5
Se3 Na4 Na1 92.0(2) . 5
Se3 Na4 Na1 92.0(2) 2_554 5
Se3 Na4 Na1 136.43(14) 7 5
Se3 Na4 Na1 136.43(14) 8_455 5
Se1 Na4 Na2 133.97(5) . 7_556
Se1 Na4 Na2 85.50(9) 2_554 7_556
Se3 Na4 Na2 46.50(10) . 7_556
Se3 Na4 Na2 130.7(2) 2_554 7_556
Se3 Na4 Na2 87.4(2) 7 7_556
Se3 Na4 Na2 46.62(9) 8_455 7_556
Na1 Na4 Na2 120.36(15) 5 7_556
Se1 Na4 Na2 85.50(9) . 7
Se1 Na4 Na2 133.97(5) 2_554 7
Se3 Na4 Na2 130.7(2) . 7
Se3 Na4 Na2 46.50(10) 2_554 7
Se3 Na4 Na2 46.62(9) 7 7
Se3 Na4 Na2 87.4(2) 8_455 7
Na1 Na4 Na2 120.36(15) 5 7
Na2 Na4 Na2 119.3(3) 7_556 7
Se2 Na5 Se2 174.1(3) 2_656 .
Se2 Na5 Se1 80.50(12) 2_656 2_655
Se2 Na5 Se1 95.31(14) . 2_655
Se2 Na5 Se1 95.31(14) 2_656 1_556
Se2 Na5 Se1 80.50(12) . 1_556
Se1 Na5 Se1 90.4(3) 2_655 1_556
Se2 Na5 Se2 97.50(13) 2_656 6_556
Se2 Na5 Se2 86.42(11) . 6_556
Se1 Na5 Se2 175.9(2) 2_655 6_556
Se1 Na5 Se2 86.26(12) 1_556 6_556
Se2 Na5 Se2 86.42(11) 2_656 5_656
Se2 Na5 Se2 97.50(13) . 5_656
Se1 Na5 Se2 86.26(12) 2_655 5_656
Se1 Na5 Se2 175.9(2) 1_556 5_656
Se2 Na5 Se2 97.2(3) 6_556 5_656
Se2 Na5 Ge1 41.01(7) 2_656 2_656
Se2 Na5 Ge1 133.9(2) . 2_656
Se1 Na5 Ge1 40.99(10) 2_655 2_656
Se1 Na5 Ge1 85.2(2) 1_556 2_656
Se2 Na5 Ge1 136.19(7) 6_556 2_656
Se2 Na5 Ge1 93.76(10) 5_656 2_656
Se2 Na5 Na3 92.95(16) 2_656 5_656
Se2 Na5 Na3 92.95(16) . 5_656
Se1 Na5 Na3 134.80(14) 2_655 5_656
Se1 Na5 Na3 134.80(14) 1_556 5_656
Se2 Na5 Na3 48.58(15) 6_556 5_656
Se2 Na5 Na3 48.58(15) 5_656 5_656
Ge1 Na5 Na3 126.51(12) 2_656 5_656
Se2 Na5 Na5 134.4(2) 2_656 5_656
Se2 Na5 Na5 49.34(8) . 5_656
Se1 Na5 Na5 91.12(12) 2_655 5_656
Se1 Na5 Na5 129.73(13) 1_556 5_656
Se2 Na5 Na5 92.8(3) 6_556 5_656
Se2 Na5 Na5 48.15(13) 5_656 5_656
Ge1 Na5 Na5 124.83(10) 2_656 5_656
Na3 Na5 Na5 62.1(2) 5_656 5_656
Se2 Na5 Na5 49.34(8) 2_656 5_657
Se2 Na5 Na5 134.4(2) . 5_657
Se1 Na5 Na5 129.73(13) 2_655 5_657
Se1 Na5 Na5 91.12(12) 1_556 5_657
Se2 Na5 Na5 48.15(13) 6_556 5_657
Se2 Na5 Na5 92.8(3) 5_656 5_657
Ge1 Na5 Na5 89.15(12) 2_656 5_657
Na3 Na5 Na5 62.1(2) 5_656 5_657
Na5 Na5 Na5 124.3(4) 5_656 5_657
Se2 Na5 Na3 46.68(11) 2_656 1_556
Se2 Na5 Na3 129.36(19) . 1_556
Se1 Na5 Na3 87.0(2) 2_655 1_556
Se1 Na5 Na3 48.87(10) 1_556 1_556
Se2 Na5 Na3 89.07(11) 6_556 1_556
Se2 Na5 Na3 133.08(8) 5_656 1_556
Ge1 Na5 Na3 54.11(11) 2_656 1_556
Na3 Na5 Na3 120.26(16) 5_656 1_556
Na5 Na5 Na3 177.6(3) 5_656 1_556
Na5 Na5 Na3 58.14(19) 5_657 1_556
Se3 Na2 Se3 97.61(18) 8_556 7_556
Se3 Na2 Se3 99.04(8) 8_556 .
Se3 Na2 Se3 88.00(8) 7_556 .
Se3 Na2 Se3 88.00(8) 8_556 2_656
Se3 Na2 Se3 99.04(8) 7_556 2_656
Se3 Na2 Se3 169.36(16) . 2_656
Se3 Na2 Se1 175.22(13) 8_556 1_556
Se3 Na2 Se1 86.97(12) 7_556 1_556
Se3 Na2 Se1 79.67(8) . 1_556
Se3 Na2 Se1 92.66(9) 2_656 1_556
Se3 Na2 Se1 86.97(12) 8_556 2_655
Se3 Na2 Se1 175.22(13) 7_556 2_655
Se3 Na2 Se1 92.66(9) . 2_655
Se3 Na2 Se1 79.67(8) 2_656 2_655
Se1 Na2 Se1 88.50(18) 1_556 2_655
Se3 Na2 Na4 90.41(15) 8_556 7_556
Se3 Na2 Na4 47.71(8) 7_556 7_556
Se3 Na2 Na4 135.65(11) . 7_556
Se3 Na2 Na4 51.58(11) 2_656 7_556
Se1 Na2 Na4 93.71(11) 1_556 7_556
Se1 Na2 Na4 131.26(9) 2_655 7_556
Se3 Na2 Na4 47.71(8) 8_556 7
Se3 Na2 Na4 90.41(15) 7_556 7
Se3 Na2 Na4 51.58(11) . 7
Se3 Na2 Na4 135.65(11) 2_656 7
Se1 Na2 Na4 131.26(9) 1_556 7
Se1 Na2 Na4 93.71(11) 2_655 7
Na4 Na2 Na4 119.3(3) 7_556 7
Se3 Na2 Na3 133.30(6) 8_556 1_556
Se3 Na2 Na3 91.18(11) 7_556 1_556
Se3 Na2 Na3 127.15(13) . 1_556
Se3 Na2 Na3 45.30(9) 2_656 1_556
Se1 Na2 Na3 47.54(8) 1_556 1_556
Se1 Na2 Na3 84.64(14) 2_655 1_556
Na4 Na2 Na3 62.8(2) 7_556 1_556
Na4 Na2 Na3 177.93(19) 7 1_556
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ge1 Se1 2.343(3) 1_556
Ge1 Se2 2.343(3) .
Ge1 Se3 2.354(3) .
Ge1 Ge1 2.406(4) 2
Se1 Ge1 2.343(3) 1_554
Se1 Na4 2.959(8) .
Se1 Na5 3.005(7) 1_554
Se1 Sb2 3.056(5) 1_554
Se1 Na2 3.056(5) 1_554
Se1 Na3 3.097(4) .
Se1 Na1 3.105(5) 5
Se2 Na3 2.983(7) .
Se2 Na5 3.003(3) .
Se2 Sb1 3.032(3) 5
Se2 Na1 3.032(3) 5
Se2 Na1 3.033(5) .
Se2 Na5 3.058(7) 5_656
Se3 Na3 2.976(7) .
Se3 Sb2 2.978(4) 7_556
Se3 Na2 2.978(4) 7_556
Se3 Na2 3.007(3) .
Se3 Na4 3.037(3) .
Se3 Na4 3.241(8) 7
Na1 Se2 3.032(3) 6_556
Na1 Se2 3.032(3) 5
Na1 Se2 3.033(5) 2
Na1 Se1 3.105(5) 5
Na1 Se1 3.105(5) 6_556
Na1 Na4 3.836(11) 5
Na1 Na1 4.078(7) 5_556
Na1 Na1 4.078(7) 5
Na3 Se3 2.976(7) 2_655
Na3 Se2 2.983(7) 2_655
Na3 Se1 3.097(4) 2_655
Na3 Ge1 3.504(4) 2_655
Na3 Na5 3.930(15) 5_656
Na3 Na5 4.091(7) 1_554
Na3 Na2 4.186(7) 1_554
Na4 Se1 2.959(8) 2_554
Na4 Se3 3.037(3) 2_554
Na4 Se3 3.241(8) 7
Na4 Se3 3.241(8) 8_455
Na4 Na1 3.836(11) 5
Na4 Na2 4.095(7) 7_556
Na4 Na2 4.095(7) 7
Na5 Se2 3.003(3) 2_656
Na5 Se1 3.005(7) 2_655
Na5 Se1 3.005(7) 1_556
Na5 Se2 3.058(7) 6_556
Na5 Se2 3.058(7) 5_656
Na5 Ge1 3.535(6) 2_656
Na5 Na3 3.930(15) 5_656
Na5 Na5 3.997(9) 5_656
Na5 Na5 3.997(9) 5_657
Na5 Na3 4.091(7) 1_556
Na2 Se3 2.978(4) 8_556
Na2 Se3 2.978(4) 7_556
Na2 Se3 3.007(3) 2_656
Na2 Se1 3.056(5) 1_556
Na2 Se1 3.056(5) 2_655
Na2 Na4 4.095(7) 7_556
Na2 Na4 4.095(7) 7
Na2 Na3 4.186(7) 1_556
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
Se1 Ge1 Se2 Na3 -105.41(10) 1_556 .
Se3 Ge1 Se2 Na3 20.01(7) . .
Ge1 Ge1 Se2 Na3 137.35(9) 2 .
Se1 Ge1 Se2 Na5 -18.01(12) 1_556 .
Se3 Ge1 Se2 Na5 107.41(13) . .
Ge1 Ge1 Se2 Na5 -135.25(11) 2 .
Se1 Ge1 Se2 Sb1 161.60(8) 1_556 5
Se3 Ge1 Se2 Sb1 -72.99(12) . 5
Ge1 Ge1 Se2 Sb1 44.36(9) 2 5
Se1 Ge1 Se2 Na1 161.60(8) 1_556 5
Se3 Ge1 Se2 Na1 -72.99(12) . 5
Ge1 Ge1 Se2 Na1 44.36(9) 2 5
Se1 Ge1 Se2 Na1 74.31(10) 1_556 .
Se3 Ge1 Se2 Na1 -160.27(6) . .
Ge1 Ge1 Se2 Na1 -42.93(10) 2 .
Se1 Ge1 Se2 Na5 -65.0(3) 1_556 5_656
Se3 Ge1 Se2 Na5 60.4(3) . 5_656
Ge1 Ge1 Se2 Na5 177.7(3) 2 5_656
Se1 Ge1 Se3 Na3 105.53(10) 1_556 .
Se2 Ge1 Se3 Na3 -20.05(7) . .
Ge1 Ge1 Se3 Na3 -136.67(9) 2 .
Se1 Ge1 Se3 Sb2 -75.28(9) 1_556 7_556
Se2 Ge1 Se3 Sb2 159.14(6) . 7_556
Ge1 Ge1 Se3 Sb2 42.52(10) 2 7_556
Se1 Ge1 Se3 Na2 -75.28(9) 1_556 7_556
Se2 Ge1 Se3 Na2 159.14(6) . 7_556
Ge1 Ge1 Se3 Na2 42.52(10) 2 7_556
Se1 Ge1 Se3 Na2 15.72(10) 1_556 .
Se2 Ge1 Se3 Na2 -109.86(10) . .
Ge1 Ge1 Se3 Na2 133.51(8) 2 .
Se1 Ge1 Se3 Na4 -162.43(12) 1_556 .
Se2 Ge1 Se3 Na4 71.98(15) . .
Ge1 Ge1 Se3 Na4 -44.64(14) 2 .
Se1 Ge1 Se3 Na4 51.5(4) 1_556 7
Se2 Ge1 Se3 Na4 -74.1(4) . 7
Ge1 Ge1 Se3 Na4 169.3(4) 2 7
Ge1 Se2 Na1 Se2 -79.78(10) . 6_556
Na3 Se2 Na1 Se2 96.6(8) . 6_556
Na5 Se2 Na1 Se2 2.71(11) . 6_556
Sb1 Se2 Na1 Se2 178.09(15) 5 6_556
Na1 Se2 Na1 Se2 178.09(15) 5 6_556
Na5 Se2 Na1 Se2 85.50(9) 5_656 6_556
Ge1 Se2 Na1 Se2 102.13(11) . 5
Na3 Se2 Na1 Se2 -81.5(8) . 5
Na5 Se2 Na1 Se2 -175.38(17) . 5
Sb1 Se2 Na1 Se2 0.0 5 5
Na1 Se2 Na1 Se2 0.0 5 5
Na5 Se2 Na1 Se2 -92.59(10) 5_656 5
Ge1 Se2 Na1 Se2 15.60(4) . 2
Na3 Se2 Na1 Se2 -168.0(8) . 2
Na5 Se2 Na1 Se2 98.09(13) . 2
Sb1 Se2 Na1 Se2 -86.53(9) 5 2
Na1 Se2 Na1 Se2 -86.53(9) 5 2
Na5 Se2 Na1 Se2 -179.12(4) 5_656 2
Ge1 Se2 Na1 Se1 -19.8(16) . 5
Na3 Se2 Na1 Se1 156.5(14) . 5
Na5 Se2 Na1 Se1 62.7(16) . 5
Sb1 Se2 Na1 Se1 -122.0(17) 5 5
Na1 Se2 Na1 Se1 -122.0(17) 5 5
Na5 Se2 Na1 Se1 145.4(16) 5_656 5
Ge1 Se2 Na1 Se1 -166.58(5) . 6_556
Na3 Se2 Na1 Se1 9.8(8) . 6_556
Na5 Se2 Na1 Se1 -84.09(13) . 6_556
Sb1 Se2 Na1 Se1 91.29(9) 5 6_556
Na1 Se2 Na1 Se1 91.29(9) 5 6_556
Na5 Se2 Na1 Se1 -1.30(3) 5_656 6_556
Ge1 Se2 Na1 Na4 -164.40(4) . 5
Na3 Se2 Na1 Na4 12.0(8) . 5
Na5 Se2 Na1 Na4 -81.91(13) . 5
Sb1 Se2 Na1 Na4 93.47(9) 5 5
Na1 Se2 Na1 Na4 93.47(9) 5 5
Na5 Se2 Na1 Na4 0.88(4) 5_656 5
Ge1 Se2 Na1 Na1 -32.03(10) . 5_556
Na3 Se2 Na1 Na1 144.3(7) . 5_556
Na5 Se2 Na1 Na1 50.46(13) . 5_556
Sb1 Se2 Na1 Na1 -134.16(17) 5 5_556
Na1 Se2 Na1 Na1 -134.16(17) 5 5_556
Na5 Se2 Na1 Na1 133.25(9) 5_656 5_556
Ge1 Se2 Na1 Na1 102.13(11) . 5
Na3 Se2 Na1 Na1 -81.5(8) . 5
Na5 Se2 Na1 Na1 -175.38(17) . 5
Sb1 Se2 Na1 Na1 0.0 5 5
Na5 Se2 Na1 Na1 -92.59(10) 5_656 5
Ge1 Se3 Na3 Se3 -165.23(6) . 2_655
Sb2 Se3 Na3 Se3 101(13) 7_556 2_655
Na2 Se3 Na3 Se3 101(13) 7_556 2_655
Na2 Se3 Na3 Se3 -81.84(8) . 2_655
Na4 Se3 Na3 Se3 95.73(16) . 2_655
Na4 Se3 Na3 Se3 0.0 7 2_655
Ge1 Se3 Na3 Se2 14.74(5) . .
Sb2 Se3 Na3 Se2 -79(13) 7_556 .
Na2 Se3 Na3 Se2 -79(13) 7_556 .
Na2 Se3 Na3 Se2 98.13(8) . .
Na4 Se3 Na3 Se2 -84.30(16) . .
Na4 Se3 Na3 Se2 179.96(3) 7 .
Ge1 Se3 Na3 Se2 -166.5(12) . 2_655
Sb2 Se3 Na3 Se2 100(13) 7_556 2_655
Na2 Se3 Na3 Se2 100(13) 7_556 2_655
Na2 Se3 Na3 Se2 -83.2(12) . 2_655
Na4 Se3 Na3 Se2 94.4(12) . 2_655
Na4 Se3 Na3 Se2 -1.3(12) 7 2_655
Ge1 Se3 Na3 Se1 -78.76(16) . 2_655
Sb2 Se3 Na3 Se1 -173(100) 7_556 2_655
Na2 Se3 Na3 Se1 -173(100) 7_556 2_655
Na2 Se3 Na3 Se1 4.63(17) . 2_655
Na4 Se3 Na3 Se1 -177.80(18) . 2_655
Na4 Se3 Na3 Se1 86.47(16) 7 2_655
Ge1 Se3 Na3 Se1 102.80(16) . .
Sb2 Se3 Na3 Se1 9(13) 7_556 .
Na2 Se3 Na3 Se1 9(13) 7_556 .
Na2 Se3 Na3 Se1 -173.81(14) . .
Na4 Se3 Na3 Se1 3.8(2) . .
Na4 Se3 Na3 Se1 -91.98(15) 7 .
Ge1 Se3 Na3 Ge1 -179.62(9) . 2_655
Sb2 Se3 Na3 Ge1 86(13) 7_556 2_655
Na2 Se3 Na3 Ge1 86(13) 7_556 2_655
Na2 Se3 Na3 Ge1 -96.23(12) . 2_655
Na4 Se3 Na3 Ge1 81.3(2) . 2_655
Na4 Se3 Na3 Ge1 -14.39(10) 7 2_655
Ge1 Se3 Na3 Na5 14.77(6) . 5_656
Sb2 Se3 Na3 Na5 -79(13) 7_556 5_656
Na2 Se3 Na3 Na5 -79(13) 7_556 5_656
Na2 Se3 Na3 Na5 98.16(8) . 5_656
Na4 Se3 Na3 Na5 -84.27(16) . 5_656
Na4 Se3 Na3 Na5 180.0 7 5_656
Ge1 Se3 Na3 Na5 99.2(3) . 1_554
Sb2 Se3 Na3 Na5 5(13) 7_556 1_554
Na2 Se3 Na3 Na5 5(13) 7_556 1_554
Na2 Se3 Na3 Na5 -177.4(3) . 1_554
Na4 Se3 Na3 Na5 0.2(4) . 1_554
Na4 Se3 Na3 Na5 -95.5(3) 7 1_554
Ge1 Se3 Na3 Na2 149.47(9) . 1_554
Sb2 Se3 Na3 Na2 56(13) 7_556 1_554
Na2 Se3 Na3 Na2 56(13) 7_556 1_554
Na2 Se3 Na3 Na2 -127.14(13) . 1_554
Na4 Se3 Na3 Na2 50.43(19) . 1_554
Na4 Se3 Na3 Na2 -45.31(8) 7 1_554
Ge1 Se2 Na3 Se3 -13.5(12) . 2_655
Na5 Se2 Na3 Se3 -95.7(12) . 2_655
Sb1 Se2 Na3 Se3 89.0(12) 5 2_655
Na1 Se2 Na3 Se3 89.0(12) 5 2_655
Na1 Se2 Na3 Se3 170.1(9) . 2_655
Na5 Se2 Na3 Se3 -178.7(12) 5_656 2_655
Ge1 Se2 Na3 Se3 -14.81(5) . .
Na5 Se2 Na3 Se3 -97.05(13) . .
Sb1 Se2 Na3 Se3 87.66(10) 5 .
Na1 Se2 Na3 Se3 87.66(10) 5 .
Na1 Se2 Na3 Se3 168.8(8) . .
Na5 Se2 Na3 Se3 179.96(3) 5_656 .
Ge1 Se2 Na3 Se2 165.23(6) . 2_655
Na5 Se2 Na3 Se2 82.99(13) . 2_655
Sb1 Se2 Na3 Se2 -92.30(10) 5 2_655
Na1 Se2 Na3 Se2 -92.30(10) 5 2_655
Na1 Se2 Na3 Se2 -11.2(7) . 2_655
Na5 Se2 Na3 Se2 0.0 5_656 2_655
Ge1 Se2 Na3 Se1 77.07(17) . 2_655
Na5 Se2 Na3 Se1 -5.2(2) . 2_655
Sb1 Se2 Na3 Se1 179.54(15) 5 2_655
Na1 Se2 Na3 Se1 179.54(15) 5 2_655
Na1 Se2 Na3 Se1 -99.3(7) . 2_655
Na5 Se2 Na3 Se1 -88.16(17) 5_656 2_655
Ge1 Se2 Na3 Se1 -101.34(16) . .
Na5 Se2 Na3 Se1 176.42(17) . .
Sb1 Se2 Na3 Se1 1.13(19) 5 .
Na1 Se2 Na3 Se1 1.13(19) 5 .
Na1 Se2 Na3 Se1 82.3(8) . .
Na5 Se2 Na3 Se1 93.43(15) 5_656 .
Ge1 Se2 Na3 Ge1 -179.59(10) . 2_655
Na5 Se2 Na3 Ge1 98.17(17) . 2_655
Sb1 Se2 Na3 Ge1 -77.12(16) 5 2_655
Na1 Se2 Na3 Ge1 -77.12(16) 5 2_655
Na1 Se2 Na3 Ge1 4.0(8) . 2_655
Na5 Se2 Na3 Ge1 15.18(11) 5_656 2_655
Ge1 Se2 Na3 Na5 165.23(6) . 5_656
Na5 Se2 Na3 Na5 82.99(13) . 5_656
Sb1 Se2 Na3 Na5 -92.30(10) 5 5_656
Na1 Se2 Na3 Na5 -92.30(10) 5 5_656
Na1 Se2 Na3 Na5 -11.2(7) . 5_656
Ge1 Se2 Na3 Na5 -148.09(11) . 1_554
Na5 Se2 Na3 Na5 129.7(2) . 1_554
Sb1 Se2 Na3 Na5 -45.62(14) 5 1_554
Na1 Se2 Na3 Na5 -45.62(14) 5 1_554
Na1 Se2 Na3 Na5 35.5(8) . 1_554
Na5 Se2 Na3 Na5 46.68(11) 5_656 1_554
Ge1 Se2 Na3 Na2 -95.1(3) . 1_554
Na5 Se2 Na3 Na2 -177.3(3) . 1_554
Sb1 Se2 Na3 Na2 7.4(3) 5 1_554
Na1 Se2 Na3 Na2 7.4(3) 5 1_554
Na1 Se2 Na3 Na2 88.5(10) . 1_554
Na5 Se2 Na3 Na2 99.7(3) 5_656 1_554
Ge1 Se1 Na3 Se3 45.7(9) 1_554 2_655
Na4 Se1 Na3 Se3 -101.0(3) . 2_655
Na5 Se1 Na3 Se3 86.4(2) 1_554 2_655
Sb2 Se1 Na3 Se3 -4.57(17) 1_554 2_655
Na2 Se1 Na3 Se3 -4.57(17) 1_554 2_655
Na1 Se1 Na3 Se3 -179.49(18) 5 2_655
Ge1 Se1 Na3 Se3 142.8(6) 1_554 .
Na4 Se1 Na3 Se3 -3.9(3) . .
Na5 Se1 Na3 Se3 -176.4(2) 1_554 .
Sb2 Se1 Na3 Se3 92.58(19) 1_554 .
Na2 Se1 Na3 Se3 92.58(19) 1_554 .
Na1 Se1 Na3 Se3 -82.3(2) 5 .
Ge1 Se1 Na3 Se2 -136.0(6) 1_554 .
Na4 Se1 Na3 Se2 77.4(3) . .
Na5 Se1 Na3 Se2 -95.2(2) 1_554 .
Sb2 Se1 Na3 Se2 173.82(18) 1_554 .
Na2 Se1 Na3 Se2 173.82(18) 1_554 .
Na1 Se1 Na3 Se2 -1.10(19) 5 .
Ge1 Se1 Na3 Se2 -35.6(9) 1_554 2_655
Na4 Se1 Na3 Se2 177.8(2) . 2_655
Na5 Se1 Na3 Se2 5.2(2) 1_554 2_655
Sb2 Se1 Na3 Se2 -85.8(2) 1_554 2_655
Na2 Se1 Na3 Se2 -85.8(2) 1_554 2_655
Na1 Se1 Na3 Se2 99.3(2) 5 2_655
Ge1 Se1 Na3 Se1 94.2(7) 1_554 2_655
Na4 Se1 Na3 Se1 -52.5(2) . 2_655
Na5 Se1 Na3 Se1 134.95(14) 1_554 2_655
Sb2 Se1 Na3 Se1 43.97(9) 1_554 2_655
Na2 Se1 Na3 Se1 43.97(9) 1_554 2_655
Na1 Se1 Na3 Se1 -130.96(11) 5 2_655
Ge1 Se1 Na3 Ge1 4.8(8) 1_554 2_655
Na4 Se1 Na3 Ge1 -141.9(2) . 2_655
Na5 Se1 Na3 Ge1 45.5(2) 1_554 2_655
Sb2 Se1 Na3 Ge1 -45.45(16) 1_554 2_655
Na2 Se1 Na3 Ge1 -45.45(16) 1_554 2_655
Na1 Se1 Na3 Ge1 139.62(18) 5 2_655
Ge1 Se1 Na3 Na5 -85.8(7) 1_554 5_656
Na4 Se1 Na3 Na5 127.5(2) . 5_656
Na5 Se1 Na3 Na5 -45.05(14) 1_554 5_656
Sb2 Se1 Na3 Na5 -136.04(9) 1_554 5_656
Na2 Se1 Na3 Na5 -136.04(9) 1_554 5_656
Na1 Se1 Na3 Na5 49.04(11) 5 5_656
Ge1 Se1 Na3 Na5 -40.8(7) 1_554 1_554
Na4 Se1 Na3 Na5 172.6(3) . 1_554
Sb2 Se1 Na3 Na5 -90.99(14) 1_554 1_554
Na2 Se1 Na3 Na5 -90.99(14) 1_554 1_554
Na1 Se1 Na3 Na5 94.1(2) 5 1_554
Ge1 Se1 Na3 Na2 50.2(7) 1_554 1_554
Na4 Se1 Na3 Na2 -96.4(2) . 1_554
Na5 Se1 Na3 Na2 90.99(14) 1_554 1_554
Sb2 Se1 Na3 Na2 0.0 1_554 1_554
Na1 Se1 Na3 Na2 -174.92(16) 5 1_554
Ge1 Se1 Na4 Se1 99.71(12) 1_554 2_554
Na5 Se1 Na4 Se1 -24.8(9) 1_554 2_554
Sb2 Se1 Na4 Se1 -176.64(4) 1_554 2_554
Na2 Se1 Na4 Se1 -176.64(4) 1_554 2_554
Na3 Se1 Na4 Se1 -90.65(16) . 2_554
Na1 Se1 Na4 Se1 0.0 5 2_554
Ge1 Se1 Na4 Se3 -165.87(13) 1_554 .
Na5 Se1 Na4 Se3 69.6(10) 1_554 .
Sb2 Se1 Na4 Se3 -82.22(16) 1_554 .
Na2 Se1 Na4 Se3 -82.22(16) 1_554 .
Na3 Se1 Na4 Se3 3.8(3) . .
Na1 Se1 Na4 Se3 94.42(16) 5 .
Ge1 Se1 Na4 Se3 10.9(3) 1_554 2_554
Na5 Se1 Na4 Se3 -113.6(8) 1_554 2_554
Sb2 Se1 Na4 Se3 94.54(18) 1_554 2_554
Na2 Se1 Na4 Se3 94.54(18) 1_554 2_554
Na3 Se1 Na4 Se3 -179.5(2) . 2_554
Na1 Se1 Na4 Se3 -88.81(18) 5 2_554
Ge1 Se1 Na4 Se3 -81.51(12) 1_554 7
Na5 Se1 Na4 Se3 154.0(9) 1_554 7
Sb2 Se1 Na4 Se3 2.14(3) 1_554 7
Na2 Se1 Na4 Se3 2.14(3) 1_554 7
Na3 Se1 Na4 Se3 88.14(16) . 7
Na1 Se1 Na4 Se3 178.78(3) 5 7
Ge1 Se1 Na4 Se3 -72.5(4) 1_554 8_455
Na5 Se1 Na4 Se3 163.0(7) 1_554 8_455
Sb2 Se1 Na4 Se3 11.1(4) 1_554 8_455
Na2 Se1 Na4 Se3 11.1(4) 1_554 8_455
Na3 Se1 Na4 Se3 97.1(3) . 8_455
Na1 Se1 Na4 Se3 -172.2(3) 5 8_455
Ge1 Se1 Na4 Na1 99.71(12) 1_554 5
Na5 Se1 Na4 Na1 -24.8(9) 1_554 5
Sb2 Se1 Na4 Na1 -176.64(4) 1_554 5
Na2 Se1 Na4 Na1 -176.64(4) 1_554 5
Na3 Se1 Na4 Na1 -90.65(16) . 5
Ge1 Se1 Na4 Na2 -162.0(3) 1_554 7_556
Na5 Se1 Na4 Na2 73.5(12) 1_554 7_556
Sb2 Se1 Na4 Na2 -78.3(4) 1_554 7_556
Na2 Se1 Na4 Na2 -78.3(4) 1_554 7_556
Na3 Se1 Na4 Na2 7.7(4) . 7_556
Na1 Se1 Na4 Na2 98.3(4) 5 7_556
Ge1 Se1 Na4 Na2 -34.70(17) 1_554 7
Na5 Se1 Na4 Na2 -159.2(9) 1_554 7
Sb2 Se1 Na4 Na2 48.95(9) 1_554 7
Na2 Se1 Na4 Na2 48.95(9) 1_554 7
Na3 Se1 Na4 Na2 134.94(17) . 7
Na1 Se1 Na4 Na2 -134.41(9) 5 7
Ge1 Se3 Na4 Se1 -85.65(19) . .
Na3 Se3 Na4 Se1 -3.9(3) . .
Sb2 Se3 Na4 Se1 176.1(2) 7_556 .
Na2 Se3 Na4 Se1 176.1(2) 7_556 .
Na2 Se3 Na4 Se1 128.3(8) . .
Na4 Se3 Na4 Se1 84.19(13) 7 .
Ge1 Se3 Na4 Se1 19.1(2) . 2_554
Na3 Se3 Na4 Se1 100.9(3) . 2_554
Sb2 Se3 Na4 Se1 -79.1(2) 7_556 2_554
Na2 Se3 Na4 Se1 -79.1(2) 7_556 2_554
Na2 Se3 Na4 Se1 -126.9(9) . 2_554
Na4 Se3 Na4 Se1 -171.0(3) 7 2_554
Ge1 Se3 Na4 Se3 146.64(7) . 2_554
Na3 Se3 Na4 Se3 -131.64(16) . 2_554
Sb2 Se3 Na4 Se3 48.44(9) 7_556 2_554
Na2 Se3 Na4 Se3 48.44(9) 7_556 2_554
Na2 Se3 Na4 Se3 0.6(8) . 2_554
Na4 Se3 Na4 Se3 -43.52(13) 7 2_554
Ge1 Se3 Na4 Se3 -169.83(14) . 7
Na3 Se3 Na4 Se3 -88.1(2) . 7
Sb2 Se3 Na4 Se3 91.96(19) 7_556 7
Na2 Se3 Na4 Se3 91.96(19) 7_556 7
Na2 Se3 Na4 Se3 44.2(8) . 7
Na4 Se3 Na4 Se3 0.0 7 7
Ge1 Se3 Na4 Se3 103.34(18) . 8_455
Na3 Se3 Na4 Se3 -174.9(2) . 8_455
Sb2 Se3 Na4 Se3 5.13(14) 7_556 8_455
Na2 Se3 Na4 Se3 5.13(14) 7_556 8_455
Na2 Se3 Na4 Se3 -42.7(9) . 8_455
Na4 Se3 Na4 Se3 -86.8(3) 7 8_455
Ge1 Se3 Na4 Na1 -33.36(7) . 5
Na3 Se3 Na4 Na1 48.36(16) . 5
Sb2 Se3 Na4 Na1 -131.56(9) 7_556 5
Na2 Se3 Na4 Na1 -131.56(9) 7_556 5
Na2 Se3 Na4 Na1 -179(100) . 5
Na4 Se3 Na4 Na1 136.48(13) 7 5
Ge1 Se3 Na4 Na2 98.21(12) . 7_556
Na3 Se3 Na4 Na2 179.93(18) . 7_556
Sb2 Se3 Na4 Na2 0.0 7_556 7_556
Na2 Se3 Na4 Na2 -47.8(8) . 7_556
Na4 Se3 Na4 Na2 -91.96(19) 7 7_556
Ge1 Se3 Na4 Na2 -167.6(3) . 7
Na3 Se3 Na4 Na2 -85.9(3) . 7
Sb2 Se3 Na4 Na2 94.2(3) 7_556 7
Na2 Se3 Na4 Na2 94.2(3) 7_556 7
Na2 Se3 Na4 Na2 46.4(9) . 7
Na4 Se3 Na4 Na2 2.22(17) 7 7
Ge1 Se2 Na5 Se2 -31.92(7) . 2_656
Na3 Se2 Na5 Se2 49.83(16) . 2_656
Sb1 Se2 Na5 Se2 152.7(13) 5 2_656
Na1 Se2 Na5 Se2 152.7(13) 5 2_656
Na1 Se2 Na5 Se2 -134.52(10) . 2_656
Na5 Se2 Na5 Se2 131.40(16) 5_656 2_656
Ge1 Se2 Na5 Se1 -76.41(19) . 2_655
Na3 Se2 Na5 Se1 5.3(2) . 2_655
Sb1 Se2 Na5 Se1 108.2(15) 5 2_655
Na1 Se2 Na5 Se1 108.2(15) 5 2_655
Na1 Se2 Na5 Se1 -179.0(2) . 2_655
Na5 Se2 Na5 Se1 86.91(12) 5_656 2_655
Ge1 Se2 Na5 Se1 13.11(12) . 1_556
Na3 Se2 Na5 Se1 94.9(2) . 1_556
Sb1 Se2 Na5 Se1 -162.3(13) 5 1_556
Na1 Se2 Na5 Se1 -162.3(13) 5 1_556
Na1 Se2 Na5 Se1 -89.49(15) . 1_556
Na5 Se2 Na5 Se1 176.4(3) 5_656 1_556
Ge1 Se2 Na5 Se2 99.91(14) . 6_556
Na3 Se2 Na5 Se2 -178.3(2) . 6_556
Sb1 Se2 Na5 Se2 -75.5(13) 5 6_556
Na1 Se2 Na5 Se2 -75.5(13) 5 6_556
Na1 Se2 Na5 Se2 -2.69(11) . 6_556
Na5 Se2 Na5 Se2 -96.8(3) 5_656 6_556
Ge1 Se2 Na5 Se2 -163.32(19) . 5_656
Na3 Se2 Na5 Se2 -81.6(2) . 5_656
Sb1 Se2 Na5 Se2 21.3(14) 5 5_656
Na1 Se2 Na5 Se2 21.3(14) 5 5_656
Na1 Se2 Na5 Se2 94.1(2) . 5_656
Na5 Se2 Na5 Se2 0.0 5_656 5_656
Ge1 Se2 Na5 Ge1 -60.7(2) . 2_656
Na3 Se2 Na5 Ge1 21.0(2) . 2_656
Sb1 Se2 Na5 Ge1 123.9(15) 5 2_656
Na1 Se2 Na5 Ge1 123.9(15) 5 2_656
Na1 Se2 Na5 Ge1 -163.3(2) . 2_656
Na5 Se2 Na5 Ge1 102.62(10) 5_656 2_656
Ge1 Se2 Na5 Na3 148.08(7) . 5_656
Na3 Se2 Na5 Na3 -130.17(16) . 5_656
Sb1 Se2 Na5 Na3 -27.3(13) 5 5_656
Na1 Se2 Na5 Na3 -27.3(13) 5 5_656
Na1 Se2 Na5 Na3 45.48(10) . 5_656
Na5 Se2 Na5 Na3 -48.60(16) 5_656 5_656
Ge1 Se2 Na5 Na5 -163.32(19) . 5_656
Na3 Se2 Na5 Na5 -81.6(2) . 5_656
Sb1 Se2 Na5 Na5 21.3(15) 5 5_656
Na1 Se2 Na5 Na5 21.3(15) 5 5_656
Na1 Se2 Na5 Na5 94.1(2) . 5_656
Ge1 Se2 Na5 Na5 95.3(4) . 5_657
Na3 Se2 Na5 Na5 177.0(4) . 5_657
Sb1 Se2 Na5 Na5 -80.1(11) 5 5_657
Na1 Se2 Na5 Na5 -80.1(11) 5 5_657
Na1 Se2 Na5 Na5 -7.3(4) . 5_657
Na5 Se2 Na5 Na5 -101.4(6) 5_656 5_657
Ge1 Se2 Na5 Na3 14.1(2) . 1_556
Na3 Se2 Na5 Na3 95.8(4) . 1_556
Sb1 Se2 Na5 Na3 -161.3(12) 5 1_556
Na1 Se2 Na5 Na3 -161.3(12) 5 1_556
Na1 Se2 Na5 Na3 -88.5(2) . 1_556
Na5 Se2 Na5 Na3 177.4(4) 5_656 1_556
Ge1 Se3 Na2 Se3 164.01(11) . 8_556
Na3 Se3 Na2 Se3 82.65(19) . 8_556
Sb2 Se3 Na2 Se3 -97.39(19) 7_556 8_556
Na2 Se3 Na2 Se3 -97.39(19) 7_556 8_556
Na4 Se3 Na2 Se3 -49.7(8) . 8_556
Na4 Se3 Na2 Se3 -5.28(14) 7 8_556
Ge1 Se3 Na2 Se3 -98.60(11) . 7_556
Na3 Se3 Na2 Se3 -179.96(18) . 7_556
Sb2 Se3 Na2 Se3 0.0 7_556 7_556
Na2 Se3 Na2 Se3 0.0 7_556 7_556
Na4 Se3 Na2 Se3 47.7(8) . 7_556
Na4 Se3 Na2 Se3 92.11(19) 7 7_556
Ge1 Se3 Na2 Se3 33.09(7) . 2_656
Na3 Se3 Na2 Se3 -48.27(16) . 2_656
Sb2 Se3 Na2 Se3 131.69(9) 7_556 2_656
Na2 Se3 Na2 Se3 131.69(9) 7_556 2_656
Na4 Se3 Na2 Se3 179(100) . 2_656
Na4 Se3 Na2 Se3 -136.20(14) 7 2_656
Ge1 Se3 Na2 Se1 -11.32(8) . 1_556
Na3 Se3 Na2 Se1 -92.68(19) . 1_556
Sb2 Se3 Na2 Se1 87.28(12) 7_556 1_556
Na2 Se3 Na2 Se1 87.28(12) 7_556 1_556
Na4 Se3 Na2 Se1 134.9(8) . 1_556
Na4 Se3 Na2 Se1 179.39(17) 7 1_556
Ge1 Se3 Na2 Se1 76.66(13) . 2_655
Na3 Se3 Na2 Se1 -4.70(17) . 2_655
Sb2 Se3 Na2 Se1 175.27(14) 7_556 2_655
Na2 Se3 Na2 Se1 175.27(14) 7_556 2_655
Na4 Se3 Na2 Se1 -137.1(8) . 2_655
Na4 Se3 Na2 Se1 -92.63(17) 7 2_655
Ge1 Se3 Na2 Na4 -96.0(2) . 7_556
Na3 Se3 Na2 Na4 -177.4(2) . 7_556
Sb2 Se3 Na2 Na4 2.58(19) 7_556 7_556
Na2 Se3 Na2 Na4 2.58(19) 7_556 7_556
Na4 Se3 Na2 Na4 50.2(9) . 7_556
Na4 Se3 Na2 Na4 94.7(3) 7 7_556
Ge1 Se3 Na2 Na4 169.29(16) . 7
Na3 Se3 Na2 Na4 87.9(2) . 7
Sb2 Se3 Na2 Na4 -92.11(19) 7_556 7
Na2 Se3 Na2 Na4 -92.11(19) 7_556 7
Na4 Se3 Na2 Na4 -44.4(8) . 7
Ge1 Se3 Na2 Na3 -8.63(14) . 1_556
Na3 Se3 Na2 Na3 -90.0(3) . 1_556
Sb2 Se3 Na2 Na3 89.97(15) 7_556 1_556
Na2 Se3 Na2 Na3 89.97(15) 7_556 1_556
Na4 Se3 Na2 Na3 137.6(8) . 1_556
Na4 Se3 Na2 Na3 -177.92(19) 7 1_556
