#------------------------------------------------------------------------------
#$Date: 2022-12-21 14:58:37 +0200 (Wed, 21 Dec 2022) $
#$Revision: 279963 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/81/1568137.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_1568137
loop_
_publ_author_name
'Zhou, Xiuquan'
'Kolluru, Venkata Surya Chaitanya'
'Xu, Wenqian'
'Wang, Luqing'
'Chang, Tieyan'
'Chen, Yu-Sheng'
'Yu, Lei'
'Wen, Jianguo'
'Chan, Maria K. Y.'
'Chung, Duck Young'
'Kanatzidis, Mercouri G.'
_publ_section_title
;
 Discovery of chalcogenides structures and compositions using mixed fluxes
;
_journal_issue                   7938
_journal_name_full               Nature
_journal_page_first              72
_journal_page_last               77
_journal_paper_doi               10.1038/s41586-022-05307-7
_journal_volume                  612
_journal_year                    2022
_chemical_formula_moiety         '0.5(Cu22.38 Na20.42 O4 Se20)'
_chemical_formula_sum            'Cu11.19 Na10.21 O2 Se10'
_chemical_formula_weight         1767.34
_space_group_crystal_system      monoclinic
_space_group_IT_number           12
_space_group_name_Hall           '-C 2y'
_space_group_name_H-M_alt        'C 1 2/m 1'
_atom_sites_solution_hydrogens   .
_atom_sites_solution_primary     dual
_audit_contact_author_name
;
;
_audit_creation_date             2021-08-09
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_cell_angle_alpha                90
_cell_angle_beta                 110.33(3)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   15.772(3)
_cell_length_b                   4.0654(8)
_cell_length_c                   20.828(4)
_cell_measurement_reflns_used    6815
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      58.3
_cell_measurement_theta_min      6.8
_cell_volume                     1252.3(5)
_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)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1045
_diffrn_reflns_av_unetI/netI     0.2718
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_k_max       4
_diffrn_reflns_limit_k_min       -5
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            1909
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.165
_diffrn_reflns_theta_min         3.375
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    24.007
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    4.687
_exptl_crystal_description       needle
_exptl_crystal_F_000             1586
_refine_diff_density_max         1.245
_refine_diff_density_min         -0.850
_refine_diff_density_rms         0.253
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.492
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     110
_refine_ls_number_reflns         1909
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.492
_refine_ls_R_factor_all          0.1279
_refine_ls_R_factor_gt           0.0308
_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)+(0.0137P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0496
_refine_ls_wR_factor_ref         0.0594
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                581
_reflns_number_total             1909
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            II_Cu11.19Na10.21O2Se10.cif
_cod_data_source_block           II
_cod_database_code               1568137
_shelx_shelxl_version_number     2018/3
_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.
;
_olex2_refinement_description
;
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
'-x, -y, -z'
'x, -y, z'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z'
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
Se01 Se 0.70459(13) 1.000000 0.28715(10) 0.0148(4) Uani 1 2 d S T P . .
Se02 Se -0.02284(15) 1.000000 0.11726(11) 0.0156(5) Uani 1 2 d S T P . .
Se03 Se 0.17017(15) 0.500000 0.06066(11) 0.0142(5) Uani 1 2 d S T P . .
Se04 Se 0.51501(15) 0.500000 0.35288(11) 0.0215(5) Uani 1 2 d S T P . .
Se05 Se 0.65470(17) 0.000000 0.53140(12) 0.0163(5) Uani 1 2 d S T P . .
Cu06 Cu 0.65511(18) 0.500000 0.32963(14) 0.0237(6) Uani 1 2 d S T P . .
Cu07 Cu -0.0910(2) 1.000000 -0.00693(16) 0.0229(7) Uani 1 2 d S T P . .
Cu08 Cu 0.0214(2) 0.500000 0.07125(16) 0.0229(7) Uani 1 2 d S T P . .
Cu09 Cu 0.76631(18) 1.000000 0.40795(14) 0.0258(7) Uani 1 2 d S T P . .
Cu0A Cu 0.58668(19) 0.000000 0.40561(15) 0.0261(10) Uani 0.922(9) 2 d S T P . .
Cu0B Cu 0.8129(3) 0.000000 0.5387(2) 0.0219(13) Uani 0.674(9) 2 d S T P . .
Na0C Na 0.3208(6) 1.000000 0.0813(5) 0.018(2) Uani 1 2 d S T P . .
Na0D Na 0.1791(5) 1.000000 0.1735(4) 0.026(2) Uani 1 2 d S T P . .
Na0E Na 0.3591(5) 1.000000 0.3225(4) 0.033(2) Uani 1 2 d S T P . .
Na0F Na 0.500000 -0.500000 0.500000 0.024(3) Uani 1 4 d S T P . .
Na0G Na 0.5022(5) 1.000000 0.2316(4) 0.026(2) Uani 1 2 d S T P . .
O00H O 0.3439(10) 1.000000 0.2060(8) 0.020(2) Uani 1 2 d S T P . .
Na00 Na 0.3401(14) 0.500000 0.1987(11) 0.047(5) Uani 0.60(2) 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
Cu Cu 0.3201 1.2651 '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'
O O 0.0106 0.0060 '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
Cu06 Se01 Cu06 112.12(14) 1_565 .
Cu06 Se01 Na0D 149.72(17) . 3
Cu06 Se01 Na0D 75.74(14) 1_565 3
Cu06 Se01 Na0D 75.74(14) . 3_545
Cu06 Se01 Na0D 149.72(17) 1_565 3_545
Cu06 Se01 Na0E 71.87(13) 1_565 3
Cu06 Se01 Na0E 142.27(18) . 3
Cu06 Se01 Na0E 142.27(18) 1_565 3_545
Cu06 Se01 Na0E 71.87(13) . 3_545
Cu06 Se01 Na0G 73.08(12) 1_565 .
Cu06 Se01 Na0G 73.08(12) . .
Cu06 Se01 Na00 123.77(7) . 3
Cu06 Se01 Na00 123.77(7) 1_565 3
Cu09 Se01 Cu06 71.36(8) . .
Cu09 Se01 Cu06 71.36(8) . 1_565
Cu09 Se01 Na0D 136.38(12) . 3
Cu09 Se01 Na0D 136.38(12) . 3_545
Cu09 Se01 Na0E 75.19(18) . 3
Cu09 Se01 Na0E 75.19(18) . 3_545
Cu09 Se01 Na0G 113.65(19) . .
Cu09 Se01 Na00 119.5(4) . 3
Na0D Se01 Na0D 84.0(2) 3_545 3
Na0D Se01 Na0E 120.7(2) 3 3_545
Na0D Se01 Na0E 67.8(2) 3_545 3_545
Na0D Se01 Na0E 120.7(2) 3_545 3
Na0D Se01 Na0E 67.8(2) 3 3
Na0D Se01 Na00 59.8(3) 3 3
Na0D Se01 Na00 59.8(3) 3_545 3
Na0E Se01 Na0E 83.2(2) 3 3_545
Na0E Se01 Na00 60.9(3) 3 3
Na0E Se01 Na00 60.9(3) 3_545 3
Na0G Se01 Na0D 82.19(19) . 3_545
Na0G Se01 Na0D 82.19(19) . 3
Na0G Se01 Na0E 138.25(11) . 3
Na0G Se01 Na0E 138.25(11) . 3_545
Na0G Se01 Na00 126.9(4) . 3
Cu07 Se02 Cu08 70.40(9) . .
Cu07 Se02 Cu08 70.40(9) . 1_565
Cu07 Se02 Na0C 73.80(18) . 3_455
Cu07 Se02 Na0C 73.80(18) . 3_445
Cu07 Se02 Na0D 115.7(2) . .
Cu07 Se02 Na0G 136.05(11) . 3_445
Cu07 Se02 Na0G 136.05(11) . 3_455
Cu07 Se02 Na00 115.9(4) . 3_455
Cu08 Se02 Cu08 112.15(16) 1_565 .
Cu08 Se02 Na0C 139.92(18) . 3_455
Cu08 Se02 Na0C 70.74(14) 1_565 3_455
Cu08 Se02 Na0C 70.74(14) . 3_445
Cu08 Se02 Na0C 139.92(18) 1_565 3_445
Cu08 Se02 Na0D 75.15(13) 1_565 .
Cu08 Se02 Na0D 75.15(13) . .
Cu08 Se02 Na0G 151.77(17) . 3_455
Cu08 Se02 Na0G 77.01(13) 1_565 3_455
Cu08 Se02 Na0G 151.77(17) 1_565 3_445
Cu08 Se02 Na0G 77.01(13) . 3_445
Cu08 Se02 Na00 123.21(9) 1_565 3_455
Cu08 Se02 Na00 123.21(9) . 3_455
Na0C Se02 Na0C 82.6(2) 3_445 3_455
Na0C Se02 Na00 59.6(3) 3_455 3_455
Na0C Se02 Na00 59.6(3) 3_445 3_455
Na0D Se02 Na0C 138.56(11) . 3_455
Na0D Se02 Na0C 138.56(11) . 3_445
Na0D Se02 Na0G 82.10(18) . 3_455
Na0D Se02 Na0G 82.10(18) . 3_445
Na0D Se02 Na00 128.4(4) . 3_455
Na0G Se02 Na0C 68.02(18) 3_445 3_445
Na0G Se02 Na0C 120.3(2) 3_455 3_445
Na0G Se02 Na0C 120.3(2) 3_445 3_455
Na0G Se02 Na0C 68.02(18) 3_455 3_455
Na0G Se02 Na0G 83.6(2) 3_455 3_445
Na0G Se02 Na00 60.7(3) 3_455 3_455
Na0G Se02 Na00 60.7(3) 3_445 3_455
Cu07 Se03 Cu07 112.56(15) 5_565 5_575
Cu07 Se03 Na0C 76.03(13) 5_565 1_545
Cu07 Se03 Na0C 150.5(2) 5_575 1_545
Cu07 Se03 Na0C 75.00(13) 5_565 7_565
Cu07 Se03 Na0C 150.5(2) 5_565 .
Cu07 Se03 Na0C 75.00(13) 5_575 7_565
Cu07 Se03 Na0C 76.03(13) 5_575 .
Cu07 Se03 Na0D 71.36(13) 5_565 1_545
Cu07 Se03 Na0D 141.31(19) 5_565 .
Cu07 Se03 Na0D 71.36(13) 5_575 .
Cu07 Se03 Na0D 141.31(19) 5_575 1_545
Cu07 Se03 Na00 123.40(8) 5_575 .
Cu07 Se03 Na00 123.40(8) 5_565 .
Cu08 Se03 Cu07 71.70(10) . 5_565
Cu08 Se03 Cu07 71.70(10) . 5_575
Cu08 Se03 Na0C 135.88(13) . .
Cu08 Se03 Na0C 117.8(2) . 7_565
Cu08 Se03 Na0C 135.89(13) . 1_545
Cu08 Se03 Na0D 73.72(17) . .
Cu08 Se03 Na0D 73.72(17) . 1_545
Cu08 Se03 Na00 117.1(4) . .
Na0C Se03 Na0C 83.9(2) . 1_545
Na0C Se03 Na0C 80.7(2) 7_565 .
Na0C Se03 Na0C 80.7(2) 7_565 1_545
Na0C Se03 Na0D 67.90(19) 1_545 1_545
Na0C Se03 Na0D 138.26(11) 7_565 1_545
Na0C Se03 Na0D 138.27(11) 7_565 .
Na0C Se03 Na0D 120.5(2) . 1_545
Na0C Se03 Na0D 67.9(2) . .
Na0C Se03 Na0D 120.5(2) 1_545 .
Na0C Se03 Na00 125.2(4) 7_565 .
Na0C Se03 Na00 60.0(3) . .
Na0C Se03 Na00 60.0(3) 1_545 .
Na0D Se03 Na0D 82.8(2) 1_545 .
Na0D Se03 Na00 60.5(3) 1_545 .
Na0D Se03 Na00 60.5(3) . .
Cu06 Se04 Cu0B 58.46(12) . 7_656
Cu06 Se04 Na0E 132.66(14) . .
Cu06 Se04 Na0E 132.66(14) . 1_545
Cu06 Se04 Na0F 125.18(11) . 1_565
Cu06 Se04 Na0G 69.70(14) . 1_545
Cu06 Se04 Na0G 69.70(15) . .
Cu06 Se04 Na00 107.8(4) . .
Cu0A Se04 Cu06 76.93(10) 1_565 .
Cu0A Se04 Cu06 76.93(10) . .
Cu0A Se04 Cu0A 115.87(15) 1_565 .
Cu0A Se04 Cu0B 58.16(7) 1_565 7_656
Cu0A Se04 Cu0B 58.16(7) . 7_656
Cu0A Se04 Na0E 150.27(19) . .
Cu0A Se04 Na0E 75.55(13) . 1_545
Cu0A Se04 Na0E 75.55(13) 1_565 .
Cu0A Se04 Na0E 150.27(19) 1_565 1_545
Cu0A Se04 Na0F 74.79(10) 1_565 1_565
Cu0A Se04 Na0F 74.79(10) . 1_565
Cu0A Se04 Na0G 73.31(12) 1_565 .
Cu0A Se04 Na0G 142.35(17) . .
Cu0A Se04 Na0G 142.35(17) 1_565 1_545
Cu0A Se04 Na0G 73.31(12) . 1_545
Cu0A Se04 Na00 121.76(8) 1_565 .
Cu0A Se04 Na00 121.76(8) . .
Cu0B Se04 Na0E 129.17(15) 7_656 .
Cu0B Se04 Na0E 129.17(15) 7_656 1_545
Cu0B Se04 Na0F 66.71(9) 7_656 1_565
Cu0B Se04 Na0G 113.92(15) 7_656 1_545
Cu0B Se04 Na0G 113.92(15) 7_656 .
Cu0B Se04 Na00 166.3(4) 7_656 .
Na0E Se04 Na0E 82.5(2) 1_545 .
Na0E Se04 Na0F 82.84(17) . 1_565
Na0E Se04 Na0F 82.84(17) 1_545 1_565
Na0E Se04 Na0G 115.5(2) 1_545 .
Na0E Se04 Na0G 65.9(2) . .
Na0E Se04 Na0G 115.5(2) . 1_545
Na0E Se04 Na0G 65.88(19) 1_545 1_545
Na0E Se04 Na00 58.9(3) . .
Na0E Se04 Na00 58.9(3) 1_545 .
Na0F Se04 Na0G 139.72(11) 1_565 .
Na0F Se04 Na0G 139.72(11) 1_565 1_545
Na0F Se04 Na00 127.0(4) 1_565 .
Na0G Se04 Na0G 79.1(2) 1_545 .
Na0G Se04 Na00 56.7(3) 1_545 .
Na0G Se04 Na00 56.7(3) . .
Cu09 Se05 Cu09 109.63(14) 7_666 7_656
Cu09 Se05 Cu0B 59.69(10) 7_656 7_646
Cu09 Se05 Cu0B 59.69(10) 7_666 7_656
Cu09 Se05 Cu0B 138.34(14) 7_666 7_646
Cu09 Se05 Cu0B 138.34(14) 7_656 7_656
Cu09 Se05 Na0E 72.40(12) 7_656 5_666
Cu09 Se05 Na0E 72.40(12) 7_666 5_666
Cu09 Se05 Na0F 77.74(6) 7_666 1_565
Cu09 Se05 Na0F 150.59(13) 7_656 1_565
Cu09 Se05 Na0F 150.59(13) 7_666 .
Cu09 Se05 Na0F 77.74(6) 7_656 .
Cu0A Se05 Cu09 119.77(9) . 7_666
Cu0A Se05 Cu09 119.77(9) . 7_656
Cu0A Se05 Cu0B 60.69(9) . 7_656
Cu0A Se05 Cu0B 60.69(9) . 7_646
Cu0A Se05 Na0E 152.1(2) . 5_666
Cu0A Se05 Na0F 75.69(8) . .
Cu0A Se05 Na0F 75.69(8) . 1_565
Cu0B Se05 Cu09 69.41(10) . 7_656
Cu0B Se05 Cu09 69.41(10) . 7_666
Cu0B Se05 Cu0A 97.13(15) . .
Cu0B Se05 Cu0B 99.97(15) 7_646 7_656
Cu0B Se05 Cu0B 69.33(11) . 7_656
Cu0B Se05 Cu0B 69.33(11) . 7_646
Cu0B Se05 Na0E 128.87(8) 7_646 5_666
Cu0B Se05 Na0E 128.87(8) 7_656 5_666
Cu0B Se05 Na0E 110.7(2) . 5_666
Cu0B Se05 Na0F 132.95(11) 7_656 .
Cu0B Se05 Na0F 132.95(11) 7_646 1_565
Cu0B Se05 Na0F 137.05(5) . 1_565
Cu0B Se05 Na0F 70.49(8) 7_646 .
Cu0B Se05 Na0F 137.05(5) . .
Cu0B Se05 Na0F 70.49(8) 7_656 1_565
Na0F Se05 Na0E 83.58(13) . 5_666
Na0F Se05 Na0E 83.58(13) 1_565 5_666
Na0F Se05 Na0F 83.03(6) . 1_565
Se01 Cu06 Se01 112.12(14) . 1_545
Se01 Cu06 Cu09 126.69(13) . 1_545
Se01 Cu06 Cu09 52.85(8) . .
Se01 Cu06 Cu09 126.69(13) 1_545 .
Se01 Cu06 Cu09 52.85(8) 1_545 1_545
Se01 Cu06 Cu0A 166.25(11) . .
Se01 Cu06 Cu0A 81.16(6) 1_545 .
Se01 Cu06 Cu0A 166.25(11) 1_545 1_565
Se01 Cu06 Cu0A 81.16(6) . 1_565
Se01 Cu06 Cu0B 114.19(9) 1_545 7_656
Se01 Cu06 Cu0B 114.19(9) . 7_656
Se01 Cu06 Na0D 59.98(8) . 3_545
Se01 Cu06 Na0D 59.98(8) 1_545 3_545
Se01 Cu06 Na0E 62.75(9) 1_545 3_545
Se01 Cu06 Na0E 62.75(9) . 3_545
Se01 Cu06 Na0G 123.27(17) . 1_545
Se01 Cu06 Na0G 61.13(13) . .
Se01 Cu06 Na0G 123.27(17) 1_545 .
Se01 Cu06 Na0G 61.13(13) 1_545 1_545
Se04 Cu06 Se01 119.97(8) . 1_545
Se04 Cu06 Se01 119.97(8) . .
Se04 Cu06 Cu09 108.25(11) . 1_545
Se04 Cu06 Cu09 108.25(11) . .
Se04 Cu06 Cu0A 51.20(7) . .
Se04 Cu06 Cu0A 51.20(7) . 1_565
Se04 Cu06 Cu0B 69.30(13) . 7_656
Se04 Cu06 Na0D 127.12(17) . 3_545
Se04 Cu06 Na0E 171.6(2) . 3_545
Se04 Cu06 Na0G 66.33(15) . .
Se04 Cu06 Na0G 66.33(15) . 1_545
Cu09 Cu06 Cu09 92.79(11) . 1_545
Cu09 Cu06 Cu0A 57.94(9) . 1_565
Cu09 Cu06 Cu0A 116.81(12) . .
Cu09 Cu06 Cu0A 116.81(12) 1_545 1_565
Cu09 Cu06 Cu0A 57.94(9) 1_545 .
Cu09 Cu06 Na0D 107.52(13) 1_545 3_545
Cu09 Cu06 Na0D 107.52(13) . 3_545
Cu09 Cu06 Na0E 66.46(12) 1_545 3_545
Cu09 Cu06 Na0E 66.46(12) . 3_545
Cu09 Cu06 Na0G 171.56(12) 1_545 .
Cu09 Cu06 Na0G 171.56(12) . 1_545
Cu09 Cu06 Na0G 95.10(9) . .
Cu09 Cu06 Na0G 95.10(9) 1_545 1_545
Cu0A Cu06 Cu0A 85.38(11) . 1_565
Cu0A Cu06 Na0D 133.20(8) . 3_545
Cu0A Cu06 Na0D 133.20(8) 1_565 3_545
Cu0A Cu06 Na0E 124.32(12) 1_565 3_545
Cu0A Cu06 Na0E 124.32(12) . 3_545
Cu0A Cu06 Na0G 65.51(14) . 1_545
Cu0A Cu06 Na0G 115.36(16) 1_565 1_545
Cu0A Cu06 Na0G 115.36(16) . .
Cu0A Cu06 Na0G 65.51(14) 1_565 .
Cu0B Cu06 Cu09 62.34(9) 7_656 1_545
Cu0B Cu06 Cu09 62.34(9) 7_656 .
Cu0B Cu06 Cu0A 54.48(8) 7_656 .
Cu0B Cu06 Cu0A 54.49(8) 7_656 1_565
Cu0B Cu06 Na0D 163.58(18) 7_656 3_545
Cu0B Cu06 Na0E 102.31(19) 7_656 3_545
Cu0B Cu06 Na0G 119.16(17) 7_656 .
Cu0B Cu06 Na0G 119.16(17) 7_656 1_545
Na0E Cu06 Na0D 61.3(2) 3_545 3_545
Na0G Cu06 Na0D 72.90(18) 1_545 3_545
Na0G Cu06 Na0D 72.90(18) . 3_545
Na0G Cu06 Na0E 119.69(18) . 3_545
Na0G Cu06 Na0E 119.69(18) 1_545 3_545
Na0G Cu06 Na0G 76.87(17) 1_545 .
Se02 Cu07 Se03 116.98(11) . 5_575
Se02 Cu07 Se03 116.98(11) . 5_565
Se02 Cu07 Cu07 80.26(14) . 5_575
Se02 Cu07 Cu08 113.52(12) . 5_565
Se02 Cu07 Cu08 113.52(12) . 5_575
Se02 Cu07 Cu08 55.09(8) . .
Se02 Cu07 Cu08 55.09(8) . 1_565
Se02 Cu07 Na0C 119.4(2) . 5_575
Se02 Cu07 Na0C 62.01(17) . 3_455
Se02 Cu07 Na0C 62.01(17) . 3_445
Se02 Cu07 Na0D 179.1(2) . 5_575
Se03 Cu07 Se03 112.56(15) 5_565 5_575
Se03 Cu07 Cu07 113.08(13) 5_565 5_575
Se03 Cu07 Cu07 113.08(13) 5_575 5_575
Se03 Cu07 Cu08 53.96(10) 5_565 5_565
Se03 Cu07 Cu08 53.96(10) 5_575 5_575
Se03 Cu07 Cu08 126.58(15) 5_565 5_575
Se03 Cu07 Cu08 126.58(15) 5_575 5_565
Se03 Cu07 Cu08 169.94(11) 5_575 .
Se03 Cu07 Cu08 77.47(7) 5_575 1_565
Se03 Cu07 Cu08 169.94(11) 5_565 1_565
Se03 Cu07 Cu08 77.47(7) 5_565 .
Se03 Cu07 Na0C 60.20(15) 5_565 3_445
Se03 Cu07 Na0C 60.20(15) 5_575 3_455
Se03 Cu07 Na0C 120.82(19) 5_565 3_455
Se03 Cu07 Na0C 59.92(9) 5_575 5_575
Se03 Cu07 Na0C 120.82(19) 5_575 3_445
Se03 Cu07 Na0C 59.92(9) 5_565 5_575
Se03 Cu07 Na0D 63.35(10) 5_565 5_575
Se03 Cu07 Na0D 63.35(10) 5_575 5_575
Cu07 Cu07 Cu08 59.86(10) 5_575 5_575
Cu07 Cu07 Cu08 61.35(8) 5_575 1_565
Cu07 Cu07 Cu08 59.86(10) 5_575 5_565
Cu07 Cu07 Cu08 61.34(8) 5_575 .
Cu07 Cu07 Na0C 123.57(18) 5_575 3_455
Cu07 Cu07 Na0C 123.57(18) 5_575 3_445
Cu07 Cu07 Na0C 160.4(2) 5_575 5_575
Cu07 Cu07 Na0D 98.8(2) 5_575 5_575
Cu08 Cu07 Cu08 92.49(11) 1_565 .
Cu08 Cu07 Cu08 59.32(13) 1_565 5_575
Cu08 Cu07 Cu08 121.21(13) 1_565 5_565
Cu08 Cu07 Cu08 121.20(13) . 5_575
Cu08 Cu07 Cu08 90.77(12) 5_565 5_575
Cu08 Cu07 Cu08 59.32(13) . 5_565
Cu08 Cu07 Na0C 107.93(14) 5_575 5_575
Cu08 Cu07 Na0C 128.25(10) . 5_575
Cu08 Cu07 Na0C 128.25(10) 1_565 5_575
Cu08 Cu07 Na0C 114.76(19) 1_565 3_445
Cu08 Cu07 Na0C 62.77(15) . 3_445
Cu08 Cu07 Na0C 114.76(19) . 3_455
Cu08 Cu07 Na0C 107.93(14) 5_565 5_575
Cu08 Cu07 Na0C 171.88(14) 5_565 3_455
Cu08 Cu07 Na0C 97.25(10) 5_565 3_445
Cu08 Cu07 Na0C 97.25(10) 5_575 3_455
Cu08 Cu07 Na0C 171.88(14) 5_575 3_445
Cu08 Cu07 Na0C 62.76(15) 1_565 3_455
Cu08 Cu07 Na0D 124.46(13) 1_565 5_575
Cu08 Cu07 Na0D 65.90(13) 5_565 5_575
Cu08 Cu07 Na0D 65.90(13) 5_575 5_575
Cu08 Cu07 Na0D 124.46(13) . 5_575
Na0C Cu07 Na0C 74.7(2) 3_455 3_445
Na0C Cu07 Na0C 70.8(2) 3_445 5_575
Na0C Cu07 Na0C 70.8(2) 3_455 5_575
Na0D Cu07 Na0C 118.66(18) 5_575 3_445
Na0D Cu07 Na0C 118.66(18) 5_575 3_455
Na0D Cu07 Na0C 61.6(2) 5_575 5_575
Se02 Cu08 Se02 112.15(16) . 1_545
Se02 Cu08 Cu07 78.52(7) . 5_575
Se02 Cu08 Cu07 128.17(15) . 1_545
Se02 Cu08 Cu07 78.52(7) 1_545 5_565
Se02 Cu08 Cu07 128.17(15) 1_545 .
Se02 Cu08 Cu07 54.50(9) 1_545 1_545
Se02 Cu08 Cu07 169.21(12) 1_545 5_575
Se02 Cu08 Cu07 169.21(12) . 5_565
Se02 Cu08 Cu07 54.50(9) . .
Se02 Cu08 Cu08 114.67(11) . 5_565
Se02 Cu08 Cu08 114.67(11) 1_545 5_565
Se02 Cu08 Na0C 63.76(11) . 3_445
Se02 Cu08 Na0C 63.76(11) 1_545 3_445
Se02 Cu08 Na0D 120.35(17) . 1_545
Se02 Cu08 Na0D 120.35(17) 1_545 .
Se02 Cu08 Na0D 59.74(13) 1_545 1_545
Se02 Cu08 Na0D 59.74(13) . .
Se02 Cu08 Na0G 59.31(8) . 3_445
Se02 Cu08 Na0G 59.31(8) 1_545 3_445
Se03 Cu08 Se02 116.76(10) . .
Se03 Cu08 Se02 116.76(10) . 1_545
Se03 Cu08 Cu07 112.40(13) . .
Se03 Cu08 Cu07 54.34(8) . 5_575
Se03 Cu08 Cu07 112.40(13) . 1_545
Se03 Cu08 Cu07 54.34(8) . 5_565
Se03 Cu08 Cu08 77.82(15) . 5_565
Se03 Cu08 Na0C 178.6(2) . 3_445
Se03 Cu08 Na0D 61.97(15) . 1_545
Se03 Cu08 Na0D 61.97(15) . .
Se03 Cu08 Na0G 119.91(18) . 3_445
Cu07 Cu08 Cu07 92.49(11) . 1_545
Cu07 Cu08 Cu07 58.80(13) 1_545 5_565
Cu07 Cu08 Cu07 58.80(13) . 5_575
Cu07 Cu08 Cu07 120.68(13) 1_545 5_575
Cu07 Cu08 Cu07 90.77(12) 5_565 5_575
Cu07 Cu08 Cu07 120.68(13) . 5_565
Cu07 Cu08 Na0C 66.73(14) 1_545 3_445
Cu07 Cu08 Na0C 124.98(12) 5_575 3_445
Cu07 Cu08 Na0C 66.73(14) . 3_445
Cu07 Cu08 Na0C 124.98(12) 5_565 3_445
Cu07 Cu08 Na0D 96.26(9) . .
Cu07 Cu08 Na0D 62.86(14) 5_575 .
Cu07 Cu08 Na0D 96.26(9) 1_545 1_545
Cu07 Cu08 Na0D 170.96(12) 1_545 .
Cu07 Cu08 Na0D 114.18(17) 5_575 1_545
Cu07 Cu08 Na0D 170.96(12) . 1_545
Cu07 Cu08 Na0D 114.18(17) 5_565 .
Cu07 Cu08 Na0D 62.86(14) 5_565 1_545
Cu07 Cu08 Na0G 129.07(10) 5_575 3_445
Cu07 Cu08 Na0G 108.07(14) 1_545 3_445
Cu07 Cu08 Na0G 129.07(10) 5_565 3_445
Cu07 Cu08 Na0G 108.07(14) . 3_445
Cu08 Cu08 Cu07 61.07(10) 5_565 .
Cu08 Cu08 Cu07 59.61(9) 5_565 5_575
Cu08 Cu08 Cu07 61.08(10) 5_565 1_545
Cu08 Cu08 Cu07 59.61(9) 5_565 5_565
Cu08 Cu08 Na0C 100.8(2) 5_565 3_445
Cu08 Cu08 Na0D 121.75(18) 5_565 .
Cu08 Cu08 Na0D 121.75(18) 5_565 1_545
Cu08 Cu08 Na0G 162.3(2) 5_565 3_445
Na0C Cu08 Na0D 119.04(19) 3_445 1_545
Na0C Cu08 Na0D 119.04(19) 3_445 .
Na0C Cu08 Na0G 61.5(2) 3_445 3_445
Na0D Cu08 Na0D 74.91(18) 1_545 .
Na0D Cu08 Na0G 71.32(17) . 3_445
Na0D Cu08 Na0G 71.32(17) 1_545 3_445
Se01 Cu09 Se05 119.30(9) . 7_656
Se01 Cu09 Se05 119.30(9) . 7_666
Se01 Cu09 Cu06 55.79(8) . 1_565
Se01 Cu09 Cu06 55.79(8) . .
Se01 Cu09 Cu0A 86.66(12) . 1_565
Se01 Cu09 Cu0B 110.24(11) . 7_656
Se01 Cu09 Cu0B 172.86(17) . 1_565
Se01 Cu09 Cu0B 110.24(11) . 7_666
Se01 Cu09 Na0E 61.91(15) . 3_545
Se01 Cu09 Na0E 61.91(15) . 3
Se01 Cu09 Na0F 123.18(12) . 3_565
Se05 Cu09 Se05 109.63(14) 7_666 7_656
Se05 Cu09 Cu06 78.75(7) 7_666 1_565
Se05 Cu09 Cu06 171.29(11) 7_656 1_565
Se05 Cu09 Cu06 171.29(11) 7_666 .
Se05 Cu09 Cu06 78.75(7) 7_656 .
Se05 Cu09 Cu0A 109.40(11) 7_656 1_565
Se05 Cu09 Cu0A 109.40(11) 7_666 1_565
Se05 Cu09 Cu0B 127.14(14) 7_656 7_666
Se05 Cu09 Cu0B 63.40(9) 7_666 1_565
Se05 Cu09 Cu0B 54.61(10) 7_666 7_666
Se05 Cu09 Cu0B 127.14(14) 7_666 7_656
Se05 Cu09 Cu0B 63.40(9) 7_656 1_565
Se05 Cu09 Cu0B 54.61(10) 7_656 7_656
Se05 Cu09 Na0E 122.06(16) 7_656 3
Se05 Cu09 Na0E 62.62(14) 7_656 3_545
Se05 Cu09 Na0E 62.62(14) 7_666 3
Se05 Cu09 Na0E 122.06(16) 7_666 3_545
Se05 Cu09 Na0F 58.51(7) 7_656 3_565
Se05 Cu09 Na0F 58.51(7) 7_666 3_565
Cu06 Cu09 Cu06 92.79(11) 1_565 .
Cu06 Cu09 Cu0A 64.43(8) . 1_565
Cu06 Cu09 Cu0A 64.43(8) 1_565 1_565
Cu06 Cu09 Cu0B 55.38(11) . 7_656
Cu06 Cu09 Cu0B 118.68(13) . 7_666
Cu06 Cu09 Cu0B 55.39(11) 1_565 7_666
Cu06 Cu09 Cu0B 118.68(13) 1_565 7_656
Cu06 Cu09 Na0E 115.49(17) . 3
Cu06 Cu09 Na0E 63.42(14) . 3_545
Cu06 Cu09 Na0E 63.42(14) 1_565 3
Cu06 Cu09 Na0E 115.49(17) 1_565 3_545
Cu06 Cu09 Na0F 129.94(7) 1_565 3_565
Cu06 Cu09 Na0F 129.95(7) . 3_565
Cu0A Cu09 Na0E 127.77(14) 1_565 3
Cu0A Cu09 Na0E 127.77(14) 1_565 3_545
Cu0A Cu09 Na0F 150.17(12) 1_565 3_565
Cu0B Cu09 Cu06 120.54(11) 1_565 1_565
Cu0B Cu09 Cu06 120.54(11) 1_565 .
Cu0B Cu09 Cu0A 86.20(15) 1_565 1_565
Cu0B Cu09 Cu0A 54.83(9) 7_666 1_565
Cu0B Cu09 Cu0A 54.83(9) 7_656 1_565
Cu0B Cu09 Cu0B 92.71(13) 7_656 7_666
Cu0B Cu09 Cu0B 65.32(12) 1_565 7_656
Cu0B Cu09 Cu0B 65.32(12) 1_565 7_666
Cu0B Cu09 Na0E 169.85(15) 7_666 3_545
Cu0B Cu09 Na0E 123.15(17) 1_565 3
Cu0B Cu09 Na0E 96.15(11) 7_666 3
Cu0B Cu09 Na0E 96.15(11) 7_656 3_545
Cu0B Cu09 Na0E 123.15(16) 1_565 3_545
Cu0B Cu09 Na0E 169.85(15) 7_656 3
Cu0B Cu09 Na0F 108.09(10) 7_656 3_565
Cu0B Cu09 Na0F 108.09(10) 7_666 3_565
Cu0B Cu09 Na0F 63.96(10) 1_565 3_565
Na0E Cu09 Na0E 74.62(19) 3_545 3
Na0E Cu09 Na0F 73.80(15) 3_545 3_565
Na0E Cu09 Na0F 73.80(15) 3 3_565
Se04 Cu0A Se04 115.87(15) 1_545 .
Se04 Cu0A Se05 116.68(10) . .
Se04 Cu0A Se05 116.68(10) 1_545 .
Se04 Cu0A Cu06 51.87(9) 1_545 1_545
Se04 Cu0A Cu06 122.12(14) 1_545 .
Se04 Cu0A Cu06 122.12(14) . 1_545
Se04 Cu0A Cu06 51.87(9) . .
Se04 Cu0A Cu09 108.61(11) . 1_545
Se04 Cu0A Cu09 108.61(11) 1_545 1_545
Se04 Cu0A Cu0B 69.97(8) . 7_656
Se04 Cu0A Cu0B 170.99(16) . 7_646
Se04 Cu0A Cu0B 170.99(16) 1_545 7_656
Se04 Cu0A Cu0B 69.97(8) 1_545 7_646
Se04 Cu0A Na0E 61.37(9) . 1_545
Se04 Cu0A Na0E 61.36(9) 1_545 1_545
Se04 Cu0A Na0F 123.17(12) . .
Se04 Cu0A Na0F 123.17(12) 1_545 1_565
Se04 Cu0A Na0F 62.70(8) 1_545 .
Se04 Cu0A Na0F 62.70(8) . 1_565
Se04 Cu0A Na0G 64.16(9) 1_545 1_545
Se04 Cu0A Na0G 64.15(9) . 1_545
Se05 Cu0A Cu06 117.26(11) . 1_545
Se05 Cu0A Cu06 117.26(11) . .
Se05 Cu0A Cu09 85.28(12) . 1_545
Se05 Cu0A Cu0B 63.32(11) . 7_656
Se05 Cu0A Cu0B 63.32(11) . 7_646
Se05 Cu0A Na0E 122.29(19) . 1_545
Se05 Cu0A Na0F 60.17(7) . .
Se05 Cu0A Na0F 60.17(7) . 1_565
Se05 Cu0A Na0G 177.44(19) . 1_545
Cu06 Cu0A Cu06 85.38(11) . 1_545
Cu06 Cu0A Na0E 103.97(14) 1_545 1_545
Cu06 Cu0A Na0E 103.97(14) . 1_545
Cu06 Cu0A Na0F 100.91(4) 1_545 .
Cu06 Cu0A Na0F 173.71(8) 1_545 1_565
Cu06 Cu0A Na0F 173.70(8) . .
Cu06 Cu0A Na0F 100.91(4) . 1_565
Cu06 Cu0A Na0G 61.11(11) . 1_545
Cu06 Cu0A Na0G 61.11(11) 1_545 1_545
Cu09 Cu0A Cu06 57.64(8) 1_545 .
Cu09 Cu0A Cu06 57.64(8) 1_545 1_545
Cu09 Cu0A Na0E 152.43(19) 1_545 1_545
Cu09 Cu0A Na0F 126.13(8) 1_545 .
Cu09 Cu0A Na0F 126.13(8) 1_545 1_565
Cu09 Cu0A Na0G 92.16(17) 1_545 1_545
Cu0B Cu0A Cu06 55.11(11) 7_646 1_545
Cu0B Cu0A Cu06 55.11(11) 7_656 .
Cu0B Cu0A Cu06 119.48(15) 7_656 1_545
Cu0B Cu0A Cu06 119.48(15) 7_646 .
Cu0B Cu0A Cu09 62.44(10) 7_646 1_545
Cu0B Cu0A Cu09 62.44(10) 7_656 1_545
Cu0B Cu0A Cu0B 103.40(16) 7_656 7_646
Cu0B Cu0A Na0E 126.94(9) 7_646 1_545
Cu0B Cu0A Na0E 126.94(9) 7_656 1_545
Cu0B Cu0A Na0F 120.84(14) 7_656 .
Cu0B Cu0A Na0F 65.24(9) 7_656 1_565
Cu0B Cu0A Na0F 65.24(9) 7_646 .
Cu0B Cu0A Na0F 120.84(14) 7_646 1_565
Cu0B Cu0A Na0G 115.44(13) 7_646 1_545
Cu0B Cu0A Na0G 115.44(13) 7_656 1_545
Na0E Cu0A Na0F 74.38(13) 1_545 1_565
Na0E Cu0A Na0F 74.38(13) 1_545 .
Na0F Cu0A Na0F 72.80(7) 1_565 .
Na0G Cu0A Na0E 60.3(2) 1_545 1_545
Na0G Cu0A Na0F 121.68(11) 1_545 .
Na0G Cu0A Na0F 121.68(11) 1_545 1_565
Se04 Cu0B Cu0B 135.61(11) 7_656 7_656
Se04 Cu0B Cu0B 135.61(11) 7_656 7_646
Se05 Cu0B Se04 97.06(11) 7_656 7_656
Se05 Cu0B Se04 97.06(11) 7_646 7_656
Se05 Cu0B Se04 135.69(17) . 7_656
Se05 Cu0B Se05 110.67(11) . 7_656
Se05 Cu0B Se05 110.67(11) . 7_646
Se05 Cu0B Se05 99.97(15) 7_646 7_656
Se05 Cu0B Cu06 83.45(15) . 7_656
Se05 Cu0B Cu09 165.67(16) 7_656 7_656
Se05 Cu0B Cu09 91.39(15) . 1_545
Se05 Cu0B Cu09 165.67(16) 7_646 7_666
Se05 Cu0B Cu09 55.98(9) . 7_666
Se05 Cu0B Cu09 81.98(6) 7_646 7_656
Se05 Cu0B Cu09 81.98(6) 7_656 7_666
Se05 Cu0B Cu09 55.98(9) . 7_656
Se05 Cu0B Cu0A 118.66(12) . 7_656
Se05 Cu0B Cu0A 118.66(12) . 7_646
Se05 Cu0B Cu0B 58.70(13) . 7_656
Se05 Cu0B Cu0B 51.96(10) 7_656 7_656
Se05 Cu0B Cu0B 51.96(10) 7_646 7_646
Se05 Cu0B Cu0B 117.1(2) 7_656 7_646
Se05 Cu0B Cu0B 117.1(2) 7_646 7_656
Se05 Cu0B Cu0B 58.70(13) . 7_646
Cu06 Cu0B Se04 52.24(11) 7_656 7_656
Cu06 Cu0B Se05 125.04(10) 7_656 7_656
Cu06 Cu0B Se05 125.04(10) 7_656 7_646
Cu06 Cu0B Cu09 62.27(9) 7_656 7_656
Cu06 Cu0B Cu09 62.27(9) 7_656 7_666
Cu06 Cu0B Cu0B 115.37(17) 7_656 7_646
Cu06 Cu0B Cu0B 115.37(17) 7_656 7_656
Cu09 Cu0B Se04 132.92(17) 1_545 7_656
Cu09 Cu0B Se04 96.78(11) 7_656 7_656
Cu09 Cu0B Se04 96.78(11) 7_666 7_656
Cu09 Cu0B Se05 56.92(9) 1_545 7_646
Cu09 Cu0B Se05 56.92(9) 1_545 7_656
Cu09 Cu0B Cu06 174.84(19) 1_545 7_656
Cu09 Cu0B Cu09 114.68(12) 1_545 7_656
Cu09 Cu0B Cu09 114.68(12) 1_545 7_666
Cu09 Cu0B Cu09 92.71(13) 7_656 7_666
Cu09 Cu0B Cu0A 112.38(13) 1_545 7_656
Cu09 Cu0B Cu0A 112.38(13) 1_545 7_646
Cu09 Cu0B Cu0B 114.45(19) 7_666 7_646
Cu09 Cu0B Cu0B 61.44(14) 1_545 7_656
Cu09 Cu0B Cu0B 53.24(10) 7_666 7_656
Cu09 Cu0B Cu0B 61.44(14) 1_545 7_646
Cu09 Cu0B Cu0B 114.45(19) 7_656 7_656
Cu09 Cu0B Cu0B 53.24(11) 7_656 7_646
Cu0A Cu0B Se04 51.87(8) 7_656 7_656
Cu0A Cu0B Se04 51.87(8) 7_646 7_656
Cu0A Cu0B Se05 130.00(17) 7_656 7_646
Cu0A Cu0B Se05 55.99(9) 7_656 7_656
Cu0A Cu0B Se05 130.00(17) 7_646 7_656
Cu0A Cu0B Se05 55.99(9) 7_646 7_646
Cu0A Cu0B Cu06 70.41(12) 7_656 7_656
Cu0A Cu0B Cu06 70.41(12) 7_646 7_656
Cu0A Cu0B Cu09 62.73(9) 7_656 7_666
Cu0A Cu0B Cu09 132.66(17) 7_656 7_656
Cu0A Cu0B Cu09 62.73(9) 7_646 7_656
Cu0A Cu0B Cu09 132.66(17) 7_646 7_666
Cu0A Cu0B Cu0A 103.40(16) 7_656 7_646
Cu0A Cu0B Cu0B 83.85(7) 7_646 7_646
Cu0A Cu0B Cu0B 172.19(19) 7_656 7_646
Cu0A Cu0B Cu0B 83.85(7) 7_656 7_656
Cu0A Cu0B Cu0B 172.19(19) 7_646 7_656
Cu0B Cu0B Cu0B 88.8(2) 7_646 7_656
Se02 Na0C Se02 82.6(2) 3 3_545
Se02 Na0C Cu07 138.15(12) 3 5_575
Se02 Na0C Cu07 44.19(11) 3_545 3_545
Se02 Na0C Cu07 138.15(12) 3_545 5_575
Se02 Na0C Cu07 44.19(11) 3 3
Se02 Na0C Cu07 94.8(2) 3_545 3
Se02 Na0C Cu07 94.8(2) 3 3_545
Se02 Na0C Cu08 45.50(12) 3_545 3
Se02 Na0C Cu08 45.50(12) 3 3
Se02 Na0C Na00 61.7(4) 3 1_565
Se02 Na0C Na00 112.9(5) 3_545 1_565
Se02 Na0C Na00 112.9(5) 3 .
Se02 Na0C Na00 61.7(4) 3_545 .
Se03 Na0C Se02 174.5(3) . 3
Se03 Na0C Se02 96.51(5) 1_565 3
Se03 Na0C Se02 86.1(2) 7_565 3
Se03 Na0C Se02 96.51(5) . 3_545
Se03 Na0C Se02 174.5(3) 1_565 3_545
Se03 Na0C Se02 86.1(2) 7_565 3_545
Se03 Na0C Se03 83.9(2) . 1_565
Se03 Na0C Se03 99.3(2) 7_565 1_565
Se03 Na0C Se03 99.3(2) 7_565 .
Se03 Na0C Cu07 141.3(3) . 3
Se03 Na0C Cu07 141.3(3) 1_565 3_545
Se03 Na0C Cu07 87.7(2) 7_565 5_575
Se03 Na0C Cu07 44.05(12) . 5_575
Se03 Na0C Cu07 44.80(12) 7_565 3_545
Se03 Na0C Cu07 44.05(12) 1_565 5_575
Se03 Na0C Cu07 44.80(12) 7_565 3
Se03 Na0C Cu07 88.26(11) 1_565 3
Se03 Na0C Cu07 88.26(11) . 3_545
Se03 Na0C Cu08 136.26(14) 1_565 3
Se03 Na0C Cu08 136.26(14) . 3
Se03 Na0C Cu08 63.64(18) 7_565 3
Se03 Na0C Na00 138.3(3) 7_565 .
Se03 Na0C Na00 62.2(4) 1_565 1_565
Se03 Na0C Na00 138.3(3) 7_565 1_565
Se03 Na0C Na00 114.0(5) 1_565 .
Se03 Na0C Na00 114.0(5) . 1_565
Se03 Na0C Na00 62.2(4) . .
Cu07 Na0C Cu07 109.2(2) 3_545 5_575
Cu07 Na0C Cu07 109.2(2) 3 5_575
Cu07 Na0C Cu07 74.7(2) 3_545 3
Cu08 Na0C Cu07 151.3(3) 3 5_575
Cu08 Na0C Cu07 50.50(13) 3 3_545
Cu08 Na0C Cu07 50.50(13) 3 3
O00H Na0C Se02 86.1(3) . 3_545
O00H Na0C Se02 86.1(3) . 3
O00H Na0C Se03 169.6(5) . 7_565
O00H Na0C Se03 88.4(3) . .
O00H Na0C Se03 88.4(3) . 1_565
O00H Na0C Cu07 102.8(4) . 5_575
O00H Na0C Cu07 129.3(3) . 3
O00H Na0C Cu07 129.3(3) . 3_545
O00H Na0C Cu08 105.9(4) . 3
O00H Na0C Na00 40.8(3) . .
O00H Na0C Na00 40.8(3) . 1_565
Na00 Na0C Cu07 151.8(5) . 3
Na00 Na0C Cu07 95.1(3) 1_565 3
Na00 Na0C Cu07 98.9(5) . 5_575
Na00 Na0C Cu07 95.1(3) . 3_545
Na00 Na0C Cu07 151.8(5) 1_565 3_545
Na00 Na0C Cu07 98.9(5) 1_565 5_575
Na00 Na0C Cu08 102.7(5) . 3
Na00 Na0C Cu08 102.7(5) 1_565 3
Na00 Na0C Na00 81.6(6) 1_565 .
Se01 Na0D Se01 84.0(2) 3_455 3_445
Se01 Na0D Se03 96.42(4) 3_455 1_565
Se01 Na0D Se03 175.2(3) 3_445 1_565
Se01 Na0D Se03 175.2(3) 3_455 .
Se01 Na0D Se03 96.42(4) 3_445 .
Se01 Na0D Cu06 44.28(12) 3_455 3_455
Se01 Na0D Cu06 44.28(12) 3_445 3_455
Se01 Na0D Cu07 136.17(13) 3_455 5_575
Se01 Na0D Cu07 136.17(13) 3_445 5_575
Se01 Na0D Cu08 140.4(3) 3_455 .
Se01 Na0D Cu08 87.56(11) 3_455 1_565
Se01 Na0D Cu08 140.4(3) 3_445 1_565
Se01 Na0D Cu08 87.56(11) 3_445 .
Se01 Na0D Na00 114.9(4) 3_445 1_565
Se01 Na0D Na00 63.8(4) 3_445 .
Se01 Na0D Na00 63.8(4) 3_455 1_565
Se01 Na0D Na00 114.9(4) 3_455 .
Se02 Na0D Se01 98.1(2) . 3_455
Se02 Na0D Se01 98.1(2) . 3_445
Se02 Na0D Se03 86.61(19) . 1_565
Se02 Na0D Se03 86.61(19) . .
Se02 Na0D Cu06 85.3(2) . 3_455
Se02 Na0D Cu07 65.19(17) . 5_575
Se02 Na0D Cu08 45.11(11) . 1_565
Se02 Na0D Cu08 45.11(11) . .
Se02 Na0D Na00 138.9(3) . .
Se02 Na0D Na00 138.9(3) . 1_565
Se03 Na0D Se03 82.8(2) 1_565 .
Se03 Na0D Cu06 137.76(12) . 3_455
Se03 Na0D Cu06 137.76(12) 1_565 3_455
Se03 Na0D Cu07 45.29(12) . 5_575
Se03 Na0D Cu07 45.29(12) 1_565 5_575
Se03 Na0D Cu08 44.30(11) 1_565 1_565
Se03 Na0D Cu08 44.31(11) . .
Se03 Na0D Cu08 95.1(2) . 1_565
Se03 Na0D Cu08 95.1(2) 1_565 .
Se03 Na0D Na00 112.0(5) . 1_565
Se03 Na0D Na00 112.0(5) 1_565 .
Se03 Na0D Na00 61.4(4) 1_565 1_565
Se03 Na0D Na00 61.4(4) . .
Cu07 Na0D Cu06 150.5(3) 5_575 3_455
Cu07 Na0D Cu08 51.24(12) 5_575 .
Cu07 Na0D Cu08 51.25(12) 5_575 1_565
Cu08 Na0D Cu06 107.7(2) . 3_455
Cu08 Na0D Cu06 107.7(2) 1_565 3_455
Cu08 Na0D Cu08 74.91(18) . 1_565
O00H Na0D Se01 86.8(3) . 3_445
O00H Na0D Se01 86.8(3) . 3_455
O00H Na0D Se02 173.4(5) . .
O00H Na0D Se03 88.5(3) . .
O00H Na0D Se03 88.5(3) . 1_565
O00H Na0D Cu06 101.3(4) . 3_455
O00H Na0D Cu07 108.3(4) . 5_575
O00H Na0D Cu08 131.3(3) . 1_565
O00H Na0D Cu08 131.3(3) . .
O00H Na0D Na00 40.3(3) . 1_565
O00H Na0D Na00 40.3(3) . .
Na00 Na0D Cu06 101.1(4) . 3_455
Na00 Na0D Cu06 101.1(4) 1_565 3_455
Na00 Na0D Cu07 101.4(4) 1_565 5_575
Na00 Na0D Cu07 101.4(4) . 5_575
Na00 Na0D Cu08 151.2(5) 1_565 .
Na00 Na0D Cu08 151.2(5) . 1_565
Na00 Na0D Cu08 95.3(3) 1_565 1_565
Na00 Na0D Cu08 95.3(3) . .
Na00 Na0D Na00 80.3(5) 1_565 .
Se01 Na0E Se01 83.2(2) 3_445 3_455
Se01 Na0E Se04 177.9(3) 3_445 1_565
Se01 Na0E Se04 177.9(3) 3_455 .
Se01 Na0E Se04 97.07(4) 3_445 .
Se01 Na0E Se04 97.07(4) 3_455 1_565
Se01 Na0E Se05 85.2(2) 3_455 5_666
Se01 Na0E Se05 85.2(2) 3_445 5_666
Se01 Na0E Cu06 45.38(12) 3_455 3_455
Se01 Na0E Cu06 45.38(12) 3_445 3_455
Se01 Na0E Cu09 42.90(11) 3_455 3_455
Se01 Na0E Cu09 94.2(2) 3_455 3_445
Se01 Na0E Cu09 94.2(2) 3_445 3_455
Se01 Na0E Cu09 42.90(11) 3_445 3_445
Se01 Na0E Cu0A 137.23(12) 3_455 1_565
Se01 Na0E Cu0A 137.23(12) 3_445 1_565
Se01 Na0E Na00 112.5(5) 3_445 1_565
Se01 Na0E Na00 112.5(5) 3_455 .
Se01 Na0E Na00 62.8(4) 3_445 .
Se01 Na0E Na00 62.8(4) 3_455 1_565
Se04 Na0E Se04 82.5(2) 1_565 .
Se04 Na0E Se05 96.9(2) 1_565 5_666
Se04 Na0E Se05 96.9(2) . 5_666
Se04 Na0E Cu06 135.88(15) 1_565 3_455
Se04 Na0E Cu06 135.88(15) . 3_455
Se04 Na0E Cu09 87.45(12) 1_565 3_455
Se04 Na0E Cu09 87.46(12) . 3_445
Se04 Na0E Cu09 139.0(3) . 3_455
Se04 Na0E Cu09 139.0(3) 1_565 3_445
Se04 Na0E Cu0A 43.09(11) 1_565 1_565
Se04 Na0E Cu0A 43.09(11) . 1_565
Se04 Na0E Na00 115.3(5) . 1_565
Se04 Na0E Na00 66.0(4) 1_565 1_565
Se04 Na0E Na00 115.3(5) 1_565 .
Se04 Na0E Na00 66.0(4) . .
Se05 Na0E Cu06 63.50(18) 5_666 3_455
Se05 Na0E Cu09 44.98(12) 5_666 3_445
Se05 Na0E Cu09 44.98(12) 5_666 3_455
Se05 Na0E Cu0A 85.6(2) 5_666 1_565
Se05 Na0E Na00 139.7(3) 5_666 1_565
Se05 Na0E Na00 139.7(3) 5_666 .
Cu06 Na0E Cu09 50.12(13) 3_455 3_445
Cu06 Na0E Cu09 50.12(13) 3_455 3_455
Cu06 Na0E Cu0A 149.1(3) 3_455 1_565
Cu09 Na0E Cu09 74.62(19) 3_455 3_445
Cu09 Na0E Cu0A 107.9(2) 3_455 1_565
Cu09 Na0E Cu0A 107.9(2) 3_445 1_565
O00H Na0E Se01 88.0(3) . 3_455
O00H Na0E Se01 88.0(3) . 3_445
O00H Na0E Se04 90.0(3) . 1_565
O00H Na0E Se04 90.0(3) . .
O00H Na0E Se05 170.8(5) . 5_666
O00H Na0E Cu06 107.3(4) . 3_455
O00H Na0E Cu09 129.8(3) . 3_455
O00H Na0E Cu09 129.8(3) . 3_445
O00H Na0E Cu0A 103.7(4) . 1_565
O00H Na0E Na00 39.2(3) . 1_565
O00H Na0E Na00 39.2(3) . .
Na00 Na0E Cu06 102.5(5) . 3_455
Na00 Na0E Cu06 102.5(5) 1_565 3_455
Na00 Na0E Cu09 96.1(3) 1_565 3_455
Na00 Na0E Cu09 96.1(3) . 3_445
Na00 Na0E Cu09 150.7(5) . 3_455
Na00 Na0E Cu09 150.7(5) 1_565 3_445
Na00 Na0E Cu0A 101.3(4) . 1_565
Na00 Na0E Cu0A 101.3(4) 1_565 1_565
Na00 Na0E Na00 78.4(5) . 1_565
Se04 Na0F Se04 180.0 1_545 5_656
Se04 Na0F Cu0A 137.49(4) 1_545 5_656
Se04 Na0F Cu0A 137.49(4) 5_656 .
Se04 Na0F Cu0A 137.49(4) 5_656 1_545
Se04 Na0F Cu0A 42.51(4) 1_545 .
Se04 Na0F Cu0A 42.51(4) 5_656 5_656
Se04 Na0F Cu0A 42.51(4) 5_656 5_646
Se04 Na0F Cu0A 42.51(4) 1_545 1_545
Se04 Na0F Cu0A 137.49(4) 1_545 5_646
Se04 Na0F Cu0B 52.47(8) 1_545 7_646
Se04 Na0F Cu0B 52.47(8) 5_656 3_445
Se04 Na0F Cu0B 127.53(8) 1_545 3_445
Se04 Na0F Cu0B 127.53(8) 5_656 7_646
Se05 Na0F Se04 96.63(6) 1_545 5_656
Se05 Na0F Se04 96.63(6) 5_656 1_545
Se05 Na0F Se04 83.37(6) 1_545 1_545
Se05 Na0F Se04 83.37(6) 5_646 5_656
Se05 Na0F Se04 83.37(6) . 1_545
Se05 Na0F Se04 83.37(6) 5_656 5_656
Se05 Na0F Se04 96.63(6) 5_646 1_545
Se05 Na0F Se04 96.63(6) . 5_656
Se05 Na0F Se05 180.0 . 5_646
Se05 Na0F Se05 83.03(6) 5_646 5_656
Se05 Na0F Se05 83.03(6) . 1_545
Se05 Na0F Se05 96.97(6) . 5_656
Se05 Na0F Se05 180.0 5_656 1_545
Se05 Na0F Se05 96.97(6) 5_646 1_545
Se05 Na0F Cu0A 44.15(7) 5_656 5_656
Se05 Na0F Cu0A 135.85(7) 5_646 .
Se05 Na0F Cu0A 86.04(6) . 5_656
Se05 Na0F Cu0A 44.15(7) . .
Se05 Na0F Cu0A 93.96(6) 1_545 .
Se05 Na0F Cu0A 93.96(6) . 1_545
Se05 Na0F Cu0A 86.03(6) 5_646 1_545
Se05 Na0F Cu0A 135.85(7) 1_545 5_656
Se05 Na0F Cu0A 93.97(6) 5_656 5_646
Se05 Na0F Cu0A 86.04(6) 5_656 .
Se05 Na0F Cu0A 135.85(7) 5_656 1_545
Se05 Na0F Cu0A 135.85(7) . 5_646
Se05 Na0F Cu0A 93.97(6) 5_646 5_656
Se05 Na0F Cu0A 44.15(7) 1_545 1_545
Se05 Na0F Cu0A 44.15(7) 5_646 5_646
Se05 Na0F Cu0A 86.03(6) 1_545 5_646
Se05 Na0F Cu0B 131.07(5) . 3_445
Se05 Na0F Cu0B 48.93(5) 5_656 3_445
Se05 Na0F Cu0B 131.07(5) 5_656 7_646
Se05 Na0F Cu0B 48.93(5) 1_545 7_646
Se05 Na0F Cu0B 131.07(5) 1_545 3_445
Se05 Na0F Cu0B 48.93(5) 5_646 3_445
Se05 Na0F Cu0B 48.93(5) . 7_646
Se05 Na0F Cu0B 131.07(5) 5_646 7_646
Cu0A Na0F Cu0A 72.80(7) 5_656 5_646
Cu0A Na0F Cu0A 107.20(7) 5_656 .
Cu0A Na0F Cu0A 180.0 5_646 .
Cu0A Na0F Cu0A 180.0 5_656 1_545
Cu0A Na0F Cu0A 72.80(7) 1_545 .
Cu0A Na0F Cu0A 107.20(7) 1_545 5_646
Cu0B Na0F Cu0A 45.14(5) 7_646 .
Cu0B Na0F Cu0A 45.14(5) 7_646 1_545
Cu0B Na0F Cu0A 134.86(5) 3_445 1_545
Cu0B Na0F Cu0A 45.14(5) 3_445 5_646
Cu0B Na0F Cu0A 45.14(5) 3_445 5_656
Cu0B Na0F Cu0A 134.86(5) 3_445 .
Cu0B Na0F Cu0A 134.86(5) 7_646 5_646
Cu0B Na0F Cu0A 134.86(5) 7_646 5_656
Cu0B Na0F Cu0B 180.0 7_646 3_445
Se01 Na0G Se02 97.7(2) . 3_545
Se01 Na0G Se02 97.7(2) . 3
Se01 Na0G Se04 85.90(18) . 1_565
Se01 Na0G Se04 85.90(18) . .
Se01 Na0G Cu06 45.79(10) . .
Se01 Na0G Cu06 45.79(10) . 1_565
Se01 Na0G Cu0A 67.53(16) . 1_565
Se01 Na0G Na0E 127.4(3) . .
Se01 Na0G Na00 139.5(3) . 1_565
Se01 Na0G Na00 139.5(3) . .
Se02 Na0G Se02 83.6(2) 3_545 3
Se02 Na0G Se04 98.56(4) 3 1_565
Se02 Na0G Se04 98.56(4) 3_545 .
Se02 Na0G Se04 175.6(3) 3 .
Se02 Na0G Se04 175.6(3) 3_545 1_565
Se02 Na0G Cu06 86.60(11) 3_545 .
Se02 Na0G Cu06 86.60(11) 3 1_565
Se02 Na0G Cu06 140.3(3) 3 .
Se02 Na0G Cu06 140.3(3) 3_545 1_565
Se02 Na0G Cu0A 136.79(11) 3_545 1_565
Se02 Na0G Cu0A 136.79(11) 3 1_565
Se02 Na0G Na0E 120.12(18) 3_545 .
Se02 Na0G Na0E 120.12(18) 3 .
Se02 Na0G Na00 112.6(4) 3_545 1_565
Se02 Na0G Na00 61.6(4) 3_545 .
Se02 Na0G Na00 112.6(4) 3 .
Se02 Na0G Na00 61.6(4) 3 1_565
Se04 Na0G Se04 79.1(2) . 1_565
Se04 Na0G Cu06 43.97(10) . .
Se04 Na0G Cu06 94.1(2) . 1_565
Se04 Na0G Cu06 94.1(2) 1_565 .
Se04 Na0G Cu06 43.98(10) 1_565 1_565
Se04 Na0G Cu0A 42.53(11) . 1_565
Se04 Na0G Cu0A 42.53(11) 1_565 1_565
Se04 Na0G Na0E 55.49(16) . .
Se04 Na0G Na0E 55.49(16) 1_565 .
Cu06 Na0G Cu06 76.87(17) . 1_565
Cu06 Na0G Cu0A 53.39(12) 1_565 1_565
Cu06 Na0G Cu0A 53.39(12) . 1_565
Cu06 Na0G Na0E 98.0(2) 1_565 .
Cu06 Na0G Na0E 98.0(2) . .
Cu0A Na0G Na0E 59.9(2) 1_565 .
O00H Na0G Se01 171.0(5) . .
O00H Na0G Se02 89.1(3) . 3_545
O00H Na0G Se02 89.1(3) . 3
O00H Na0G Se04 87.1(3) . .
O00H Na0G Se04 87.1(3) . 1_565
O00H Na0G Cu06 129.2(3) . 1_565
O00H Na0G Cu06 129.2(3) . .
O00H Na0G Cu0A 103.4(4) . 1_565
O00H Na0G Na0E 43.6(4) . .
O00H Na0G Na00 40.3(3) . .
O00H Na0G Na00 40.3(3) . 1_565
Na00 Na0G Se04 114.0(5) . 1_565
Na00 Na0G Se04 65.5(4) 1_565 1_565
Na00 Na0G Se04 65.5(4) . .
Na00 Na0G Se04 114.0(5) 1_565 .
Na00 Na0G Cu06 154.7(5) 1_565 .
Na00 Na0G Cu06 95.8(3) 1_565 1_565
Na00 Na0G Cu06 95.8(3) . .
Na00 Na0G Cu06 154.7(5) . 1_565
Na00 Na0G Cu0A 102.7(4) 1_565 1_565
Na00 Na0G Cu0A 102.7(4) . 1_565
Na00 Na0G Na0E 58.5(4) . .
Na00 Na0G Na0E 58.5(4) 1_565 .
Na00 Na0G Na00 80.4(5) . 1_565
Na0D O00H Na0C 87.4(5) . .
Na0E O00H Na0C 177.6(8) . .
Na0E O00H Na0D 90.2(6) . .
Na0E O00H Na0G 92.6(6) . .
Na0G O00H Na0C 89.7(6) . .
Na0G O00H Na0D 177.2(8) . .
Na00 O00H Na0C 86.1(8) 1_565 .
Na00 O00H Na0C 86.1(8) . .
Na00 O00H Na0D 88.8(8) . .
Na00 O00H Na0D 88.8(8) 1_565 .
Na00 O00H Na0E 93.8(8) . .
Na00 O00H Na0E 93.8(8) 1_565 .
Na00 O00H Na0G 91.0(8) 1_565 .
Na00 O00H Na0G 91.0(8) . .
Na00 O00H Na00 171.9(16) . 1_565
Se02 Na00 Na0E 122.5(5) 3_545 1_545
Se02 Na00 Na0E 122.5(5) 3_545 .
Se03 Na00 Se02 91.9(6) . 3_545
Se03 Na00 Na0E 122.7(5) . 1_545
Se03 Na00 Na0E 122.7(5) . .
Na0C Na00 Se02 58.7(4) 1_545 3_545
Na0C Na00 Se02 58.7(4) . 3_545
Na0C Na00 Se03 57.8(4) . .
Na0C Na00 Se03 57.8(4) 1_545 .
Na0C Na00 Na0C 81.6(6) . 1_545
Na0C Na00 Na0D 66.1(3) . .
Na0C Na00 Na0D 66.1(3) 1_545 1_545
Na0C Na00 Na0D 115.9(7) . 1_545
Na0C Na00 Na0D 115.9(7) 1_545 .
Na0C Na00 Na0E 178.4(6) 1_545 .
Na0C Na00 Na0E 178.4(6) . 1_545
Na0C Na00 Na0E 100.00(11) 1_545 1_545
Na0C Na00 Na0E 100.00(11) . .
Na0C Na00 Na0G 116.3(7) 1_545 .
Na0C Na00 Na0G 116.3(7) . 1_545
Na0C Na00 Na0G 66.4(4) 1_545 1_545
Na0C Na00 Na0G 66.4(4) . .
Na0D Na00 Se02 124.7(5) . 3_545
Na0D Na00 Se02 124.7(5) 1_545 3_545
Na0D Na00 Se03 58.1(4) . .
Na0D Na00 Se03 58.1(4) 1_545 .
Na0D Na00 Na0D 80.3(5) 1_545 .
Na0D Na00 Na0E 112.7(7) 1_545 .
Na0D Na00 Na0E 64.6(3) 1_545 1_545
Na0D Na00 Na0E 112.7(7) . 1_545
Na0D Na00 Na0E 64.6(3) . .
Na0E Na00 Na0E 78.4(5) . 1_545
Na0G Na00 Se02 57.6(4) 1_545 3_545
Na0G Na00 Se02 57.6(4) . 3_545
Na0G Na00 Se03 124.2(5) 1_545 .
Na0G Na00 Se03 124.2(5) . .
Na0G Na00 Na0D 99.57(9) 1_545 1_545
Na0G Na00 Na0D 177.2(8) 1_545 .
Na0G Na00 Na0D 99.57(9) . .
Na0G Na00 Na0D 177.2(8) . 1_545
Na0G Na00 Na0E 64.8(3) 1_545 1_545
Na0G Na00 Na0E 64.8(3) . .
Na0G Na00 Na0E 113.0(7) . 1_545
Na0G Na00 Na0E 113.0(7) 1_545 .
Na0G Na00 Na0G 80.4(5) . 1_545
O00H Na00 Se02 91.8(8) 1_545 3_545
O00H Na00 Se02 91.8(8) . 3_545
O00H Na00 Se03 93.5(8) . .
O00H Na00 Se03 93.5(8) 1_545 .
O00H Na00 Na0C 134.7(10) . 1_545
O00H Na00 Na0C 134.6(10) 1_545 .
O00H Na00 Na0C 53.1(6) 1_545 1_545
O00H Na00 Na0C 53.1(6) . .
O00H Na00 Na0D 131.1(10) . 1_545
O00H Na00 Na0D 51.0(6) . .
O00H Na00 Na0D 131.1(10) 1_545 .
O00H Na00 Na0D 51.0(6) 1_545 1_545
O00H Na00 Na0E 125.3(10) . 1_545
O00H Na00 Na0E 125.3(10) 1_545 .
O00H Na00 Na0E 46.9(6) 1_545 1_545
O00H Na00 Na0E 46.9(6) . .
O00H Na00 Na0G 128.8(10) . 1_545
O00H Na00 Na0G 48.7(6) 1_545 1_545
O00H Na00 Na0G 128.8(10) 1_545 .
O00H Na00 Na0G 48.7(6) . .
O00H Na00 O00H 171.9(16) 1_545 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Se01 Cu06 2.450(2) .
Se01 Cu06 2.450(2) 1_565
Se01 Cu09 2.361(4) .
Se01 Na0D 3.039(6) 3_545
Se01 Na0D 3.039(6) 3
Se01 Na0E 3.060(6) 3
Se01 Na0E 3.060(6) 3_545
Se01 Na0G 2.993(7) .
Se01 Na00 3.27(2) 3
Se02 Cu07 2.432(4) .
Se02 Cu08 2.450(2) 1_565
Se02 Cu08 2.450(2) .
Se02 Na0C 3.081(7) 3_445
Se02 Na0C 3.081(7) 3_455
Se02 Na0D 2.987(8) .
Se02 Na0G 3.051(7) 3_455
Se02 Na0G 3.051(7) 3_445
Se02 Na00 3.18(2) 3_455
Se03 Cu07 2.444(2) 5_565
Se03 Cu07 2.444(2) 5_575
Se03 Cu08 2.432(4) .
Se03 Na0C 3.041(7) 1_545
Se03 Na0C 3.041(7) .
Se03 Na0C 3.010(9) 7_565
Se03 Na0D 3.074(7) .
Se03 Na0D 3.074(7) 1_545
Se03 Na00 3.18(2) .
Se04 Cu06 2.421(4) .
Se04 Cu0A 2.399(2) 1_565
Se04 Cu0A 2.399(2) .
Se04 Cu0B 2.865(4) 7_656
Se04 Na0E 3.082(7) 1_545
Se04 Na0E 3.082(7) .
Se04 Na0F 3.154(2) 1_565
Se04 Na0G 3.193(7) 1_545
Se04 Na0G 3.193(7) .
Se04 Na00 3.43(2) .
Se05 Cu09 2.487(2) 7_666
Se05 Cu09 2.487(2) 7_656
Se05 Cu0A 2.462(4) .
Se05 Cu0B 2.446(5) .
Se05 Cu0B 2.654(3) 7_646
Se05 Cu0B 2.654(3) 7_656
Se05 Na0E 3.124(9) 5_666
Se05 Na0F 3.0666(19) .
Se05 Na0F 3.0666(19) 1_565
Cu06 Cu09 2.807(3) 1_545
Cu06 Cu09 2.807(3) .
Cu06 Cu0A 2.998(3) 1_565
Cu06 Cu0A 2.998(3) .
Cu06 Cu0B 2.610(5) 7_656
Cu06 Na0D 3.401(9) 3_545
Cu06 Na0E 3.272(9) 3_545
Cu06 Na0G 3.270(6) 1_545
Cu06 Na0G 3.270(6) .
Cu07 Cu07 2.783(6) 5_575
Cu07 Cu08 2.856(3) 5_565
Cu07 Cu08 2.856(3) 5_575
Cu07 Cu08 2.814(3) .
Cu07 Cu08 2.814(3) 1_565
Cu07 Na0C 3.350(8) 3_455
Cu07 Na0C 3.411(9) 5_575
Cu07 Na0C 3.350(8) 3_445
Cu07 Na0D 3.258(9) 5_575
Cu08 Cu08 2.806(6) 5_565
Cu08 Na0C 3.243(9) 3_445
Cu08 Na0D 3.343(7) .
Cu08 Na0D 3.342(7) 1_545
Cu08 Na0G 3.457(9) 3_445
Cu09 Cu0A 2.817(4) 1_565
Cu09 Cu0B 2.809(3) 7_666
Cu09 Cu0B 2.809(3) 7_656
Cu09 Cu0B 2.562(5) 1_565
Cu09 Na0E 3.354(7) 3
Cu09 Na0E 3.354(7) 3_545
Cu09 Na0F 3.514(3) 3_565
Cu0A Cu0B 2.590(3) 7_656
Cu0A Cu0B 2.590(3) 7_646
Cu0A Na0E 3.400(9) 1_545
Cu0A Na0F 3.425(3) 1_565
Cu0A Na0F 3.425(3) .
Cu0A Na0G 3.399(8) 1_545
Cu0B Cu0B 2.906(6) 7_646
Cu0B Cu0B 2.906(6) 7_656
Na0C O00H 2.494(18) .
Na0C Na00 3.111(18) 1_565
Na0C Na00 3.111(18) .
Na0D O00H 2.448(16) .
Na0D Na00 3.151(18) .
Na0D Na00 3.151(18) 1_565
Na0E O00H 2.355(17) .
Na0E Na00 3.215(19) .
Na0E Na00 3.215(19) 1_565
Na0G O00H 2.366(16) .
Na0G Na00 3.150(17) 1_565
Na0G Na00 3.150(17) .
O00H Na00 2.038(2) .
O00H Na00 2.038(2) 1_565
