#------------------------------------------------------------------------------ #$Date: 2026-05-26 01:35:08 +0100 (Tue, 26 May 2026) $ #$Revision: 306089 $ #$URL: svn://www.crystallography.net/cod/cif/7/06/44/7064417.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_7064417 loop_ _publ_author_name 'Wang, Jia' 'Zhang, Wenbin' 'Yang, Zhihua' 'Han, Shujuan' 'Pan, Shilie' _publ_section_title ; A2Sb2SO4F6 (A = NH4+, Na+): Two Sulfate Fluoride Crystals Exhibiting Enhanced Birefringence Driven by Stereochemically Active Antimony (III) ; _journal_name_full 'New Journal of Chemistry' _journal_paper_doi 10.1039/D6NJ01379A _journal_year 2026 _chemical_formula_moiety 'F6 Na2 O4 S Sb2' _chemical_formula_sum 'F6 Na2 O4 S Sb2' _chemical_formula_weight 499.54 _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2ybc' _space_group_name_H-M_alt 'P 1 21/c 1' _atom_sites_solution_primary dual _audit_block_doi 10.25505/fiz.icsd.cc2r40lj _audit_creation_date 2025-12-17 _audit_creation_method ; Olex2 1.5 (compiled 2023.03.06 svn.rbb2c1857 for OlexSys, GUI svn.r6748) ; _audit_update_record ; 2026-03-09 deposited with the CCDC. 2026-05-25 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 112.392(2) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 6.9733(4) _cell_length_b 14.0305(10) _cell_length_c 9.5562(7) _cell_measurement_reflns_used 5778 _cell_measurement_temperature 296.15 _cell_measurement_theta_max 27.492 _cell_measurement_theta_min 2.724 _cell_volume 864.47(10) _computing_cell_refinement 'SAINT V8.41 (?, 2016)' _computing_data_reduction 'SAINT V8.41 (?, 2016)' _computing_molecular_graphics 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2018/3 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' _diffrn_ambient_temperature 296.15 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.999 _diffrn_measurement_device_type 'Bruker APEX-II CCD' _diffrn_measurement_method '\w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0793 _diffrn_reflns_av_unetI/netI 0.0267 _diffrn_reflns_Laue_measured_fraction_full 0.999 _diffrn_reflns_Laue_measured_fraction_max 0.999 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_h_min -9 _diffrn_reflns_limit_k_max 18 _diffrn_reflns_limit_k_min -18 _diffrn_reflns_limit_l_max 12 _diffrn_reflns_limit_l_min -12 _diffrn_reflns_number 30072 _diffrn_reflns_point_group_measured_fraction_full 0.999 _diffrn_reflns_point_group_measured_fraction_max 0.999 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.501 _diffrn_reflns_theta_min 2.724 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 6.683 _exptl_absorpt_correction_T_max 0.7456 _exptl_absorpt_correction_T_min 0.6383 _exptl_absorpt_correction_type none _exptl_absorpt_process_details ; SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1040 before and 0.0734 after correction. The Ratio of minimum to maximum transmission is 0.8561. The \l/2 correction factor is Not present. ; _exptl_crystal_colour 'clear light colourless' _exptl_crystal_colour_lustre clear _exptl_crystal_colour_modifier light _exptl_crystal_colour_primary colourless _exptl_crystal_density_diffrn 3.838 _exptl_crystal_description block _exptl_crystal_F_000 904 _exptl_crystal_size_max 0.1 _exptl_crystal_size_mid 0.1 _exptl_crystal_size_min 0.1 _refine_diff_density_max 0.632 _refine_diff_density_min -0.785 _refine_diff_density_rms 0.153 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.076 _refine_ls_hydrogen_treatment undef _refine_ls_matrix_type full _refine_ls_number_parameters 136 _refine_ls_number_reflns 1984 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.076 _refine_ls_R_factor_all 0.0254 _refine_ls_R_factor_gt 0.0188 _refine_ls_shift/su_max 0.002 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0168P)^2^+0.1550P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0411 _refine_ls_wR_factor_ref 0.0434 _reflns_Friedel_coverage 0.000 _reflns_number_gt 1678 _reflns_number_total 1984 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d6nj01379a2.cif _cod_data_source_block 1222 _cod_database_code 7064417 _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. ; _shelx_estimated_absorpt_t_max 0.555 _shelx_estimated_absorpt_t_min 0.555 _olex2_refinement_description ; ; _shelx_res_file ; TITL 1222_a.res in P2(1)/c 1222.res created by SHELXL-2018/3 at 18:49:58 on 17-Dec-2025 REM Old TITL 1222 in P2(1)/c REM SHELXT solution in P2(1)/c: R1 0.041, Rweak 0.002, Alpha 0.021 REM 0.231 for 83 systematic absences, Orientation as input REM Formula found by SHELXT: F6 F7 Sb2 S Na1 CELL 0.71073 6.9733 14.0305 9.5562 90 112.392 90 ZERR 4 0.0004 0.001 0.0007 0 0.002 0 LATT 1 SYMM -X,0.5+Y,0.5-Z SFAC F Na O S Sb UNIT 24 8 16 4 8 L.S. 4 0 0 PLAN 5 SIZE 0.1 0.1 0.1 TEMP 23 CONF list 4 fmap 2 53 MORE -1 ACTA OMIT 0 0 2 REM REM REM WGHT 0.016800 0.155000 FVAR 0.26536 NA1 2 0.327848 0.653151 0.345133 11.00000 0.02659 0.02665 = 0.02856 -0.00344 0.01512 -0.00381 NA2 2 1.110787 0.650567 0.614708 11.00000 0.02330 0.02937 = 0.02358 0.00096 0.00928 0.00275 SB1 5 0.692984 0.614253 0.768374 11.00000 0.01840 0.01729 = 0.01732 0.00104 0.00757 0.00036 SB2 5 0.740454 0.604827 0.189480 11.00000 0.01770 0.01782 = 0.01719 0.00034 0.00680 -0.00025 S1 4 0.210248 0.876793 0.476744 11.00000 0.01608 0.01665 = 0.01693 0.00086 0.00493 0.00067 O1 3 0.374410 0.939629 0.583374 11.00000 0.01844 0.02671 = 0.03262 -0.00823 0.00160 -0.00049 O2 3 0.049784 0.941794 0.371041 11.00000 0.01886 0.02270 = 0.02658 0.00547 0.00337 0.00372 O3 3 0.116289 0.820084 0.562662 11.00000 0.03247 0.02550 = 0.03108 0.00704 0.01866 0.00110 O4 3 0.299825 0.818826 0.389884 11.00000 0.03196 0.02242 = 0.02667 0.00068 0.01455 0.00555 F1 1 0.437598 0.655740 0.602800 11.00000 0.01752 0.02806 = 0.02565 0.00449 0.00451 0.00230 F2 1 0.693370 0.511564 0.638054 11.00000 0.03102 0.02605 = 0.02967 -0.00749 0.00816 0.00105 F3 1 0.824952 0.695821 0.665498 11.00000 0.02419 0.02818 = 0.03198 0.00837 0.01533 0.00080 F4 1 0.717348 0.499046 0.308777 11.00000 0.03734 0.02535 = 0.03288 0.00976 0.01760 0.00551 F5 1 1.006211 0.628806 0.357552 11.00000 0.01951 0.04145 = 0.01965 -0.00358 0.00348 0.00048 F6 1 0.627803 0.685674 0.305674 11.00000 0.02740 0.02278 = 0.03473 -0.00404 0.01784 0.00014 HKLF 4 REM 1222_a.res in P2(1)/c REM wR2 = 0.0434, GooF = S = 1.076, Restrained GooF = 1.076 for all data REM R1 = 0.0188 for 1678 Fo > 4sig(Fo) and 0.0254 for all 1984 data REM 136 parameters refined using 0 restraints END WGHT 0.0168 0.1550 REM Highest difference peak 0.632, deepest hole -0.785, 1-sigma level 0.153 Q1 1 0.5396 0.5807 0.7680 11.00000 0.05 0.63 Q2 1 1.0160 0.6431 0.6397 11.00000 0.05 0.46 Q3 1 0.5473 0.5018 0.6978 11.00000 0.05 0.44 Q4 1 0.7987 0.5370 0.3492 11.00000 0.05 0.43 Q5 1 1.0424 0.6407 0.3165 11.00000 0.05 0.42 ; _shelx_res_checksum 94027 _shelx_hkl_file ; 1 0 -1 0.60 0.50 1 0 -1 0.20 0.50 -1 0 1 0.50 0.60 -1 0 1 0.60 0.50 -1 0 1 0.30 0.60 -1 0 1 1.30 1.30 1 0 -1 -0.10 1.50 1 0 -1 0.00 0.40 1 0 -1 0.40 0.80 -1 0 1 -0.10 0.50 -1 0 1 -0.90 1.50 -2 0 2 3486.25 143.49 2 0 -2 3417.56 142.89 3 0 -3 5.90 5.80 3 0 -3 -0.30 0.80 -3 0 3 0.30 1.40 3 0 -3 1.10 1.40 3 0 -3 -0.70 0.60 -3 0 3 2.00 5.80 -3 0 3 -0.40 0.60 3 0 -3 -0.60 0.50 -3 0 3 2.00 2.60 4 0 -4 26.90 5.40 -4 0 4 48.40 9.80 -4 0 4 30.10 12.80 4 0 -4 31.80 7.50 4 0 -4 37.00 13.00 4 0 -4 30.40 5.60 -4 0 4 23.20 8.50 -4 0 4 28.20 6.00 4 0 -4 40.00 9.20 -4 0 4 29.30 7.60 -5 0 5 1.10 1.90 5 0 -5 4.10 13.60 -5 0 5 -0.20 3.30 -5 0 5 -0.80 13.80 5 0 -5 -0.40 1.00 5 0 -5 2.90 3.50 5 0 -5 0.50 1.30 -5 0 5 -0.60 0.90 5 0 -5 0.50 1.70 -5 0 5 0.10 1.70 -6 0 6 516.05 37.80 -6 0 6 542.25 53.89 6 0 -6 534.45 28.50 6 0 -6 508.35 37.10 6 0 -6 546.55 53.79 6 0 -6 560.44 41.20 -6 0 6 558.94 37.20 -6 0 6 544.25 32.90 -6 0 6 582.34 47.50 7 0 -7 -6.60 22.80 -7 0 7 -1.50 0.90 7 0 -7 0.00 2.90 7 0 -7 0.50 2.90 -7 0 7 -1.10 1.10 -7 0 7 -0.30 1.40 -7 0 7 2.50 5.00 -7 0 7 7.10 22.00 7 0 -7 0.40 1.50 7 0 -7 1.20 1.60 7 0 -7 -1.80 2.10 -8 0 8 516.05 36.50 -8 0 8 548.75 43.90 -8 0 8 511.95 41.10 8 0 -8 506.55 69.49 -1 1 1 4.10 2.70 1 1 -1 2.00 2.30 -1 1 1 2.20 1.10 -1 1 1 4.70 2.20 1 1 -1 2.80 1.00 1 1 -1 3.50 1.50 -1 1 1 4.40 1.20 -1 1 1 1.00 0.80 1 1 -1 1.60 1.00 1 1 -1 3.80 1.90 1 1 -1 0.80 0.80 1 -1 -1 5.90 3.30 -1 -1 1 2.10 1.10 -1 -1 1 1.70 1.60 1 -1 -1 1.30 0.80 1 -1 -1 5.30 1.60 -1 -1 1 5.50 2.00 -1 -1 1 2.60 1.00 -1 -1 1 0.60 1.60 -1 -1 1 3.00 1.40 -2 1 2 61.19 7.80 -2 1 2 73.99 11.80 2 1 -2 74.99 13.40 2 1 -2 52.19 5.90 2 1 -2 67.19 6.20 2 1 -2 39.20 6.10 2 1 -2 37.00 8.00 -2 1 2 57.59 7.40 -2 1 2 58.39 6.20 -2 1 2 63.99 10.00 2 1 -2 51.79 7.70 -2 -1 2 49.60 5.70 -2 -1 2 76.19 9.90 2 -1 -2 43.40 5.00 -2 -1 2 68.29 10.60 2 -1 -2 84.09 9.20 -2 -1 2 72.69 12.30 2 -1 -2 53.09 10.50 -2 -1 2 53.89 7.30 -2 -1 2 54.29 6.60 2 -1 -2 56.99 3.50 2 -1 -2 39.00 5.70 3 1 -3 140.79 19.10 -3 1 3 103.89 8.80 3 1 -3 153.18 17.10 -3 1 3 126.49 11.10 -3 1 3 140.39 18.40 3 1 -3 108.59 18.70 3 1 -3 121.09 8.90 -3 1 3 114.09 17.70 3 1 -3 102.89 9.30 3 1 -3 110.89 11.00 -3 1 3 104.39 12.60 3 -1 -3 109.69 17.50 3 -1 -3 123.09 8.80 3 -1 -3 106.79 12.90 -3 -1 3 101.09 13.20 -3 -1 3 116.09 17.10 -3 -1 3 104.69 17.30 -3 -1 3 113.09 9.20 3 -1 -3 116.99 10.60 -3 -1 3 113.39 9.00 3 -1 -3 122.19 7.40 4 1 -4 3.40 2.10 4 1 -4 6.50 3.90 4 1 -4 9.00 4.20 4 1 -4 21.80 10.90 4 1 -4 1.40 2.30 -4 1 4 6.50 4.80 -4 1 4 10.30 3.60 -4 1 4 6.90 3.50 -4 1 4 11.50 4.40 4 1 -4 6.60 3.20 -4 1 4 18.60 9.90 4 -1 -4 35.30 13.10 -4 -1 4 8.00 3.10 4 -1 -4 10.30 3.30 -4 -1 4 11.90 6.40 4 -1 -4 5.50 3.40 4 -1 -4 12.60 2.90 -4 -1 4 9.60 4.60 -4 -1 4 7.80 4.20 4 -1 -4 3.80 2.80 -4 -1 4 6.70 9.50 5 1 -5 56.29 11.50 -5 1 5 63.59 12.10 5 1 -5 51.39 12.40 5 1 -5 84.19 12.10 -5 1 5 51.89 14.40 -5 1 5 59.29 9.60 5 1 -5 83.39 22.70 -5 1 5 61.79 11.90 5 1 -5 69.79 14.10 5 1 -5 26.90 10.90 -5 1 5 71.59 19.50 5 -1 -5 78.39 9.60 5 -1 -5 78.49 14.20 -5 -1 5 73.29 17.00 5 -1 -5 49.99 17.10 -5 -1 5 92.79 15.90 5 -1 -5 71.19 6.10 -5 -1 5 81.89 14.30 5 -1 -5 78.09 14.40 -5 -1 5 56.89 20.30 -5 -1 5 71.69 11.20 -6 1 6 56.39 11.00 6 1 -6 79.39 12.50 -6 1 6 15.30 17.90 -6 1 6 41.20 10.60 6 1 -6 83.99 10.90 -6 1 6 45.70 12.00 -6 1 6 91.89 21.60 6 1 -6 68.99 16.00 6 1 -6 58.19 23.70 6 1 -6 48.90 11.80 -6 -1 6 7.40 19.60 6 -1 -6 69.29 14.50 -6 -1 6 68.99 19.90 -6 -1 6 87.59 16.50 6 -1 -6 74.09 19.00 6 -1 -6 71.19 27.00 -6 -1 6 50.09 10.00 -6 -1 6 64.99 14.60 6 -1 -6 71.79 9.20 6 -1 -6 52.49 13.20 7 1 -7 41.20 8.60 -7 1 7 57.09 11.80 7 1 -7 42.70 7.60 -7 1 7 36.20 14.10 7 1 -7 23.10 10.10 7 1 -7 69.99 30.80 -7 1 7 84.89 31.20 -7 1 7 40.80 12.00 -7 1 7 40.20 11.80 7 -1 -7 52.49 30.90 -7 -1 7 44.90 12.90 7 -1 -7 39.80 16.00 -7 -1 7 35.40 14.70 7 -1 -7 43.70 12.10 -7 -1 7 66.99 15.10 -7 -1 7 53.89 26.90 7 -1 -7 37.20 5.80 -7 -1 7 49.00 10.80 7 -1 -7 47.70 22.40 -8 1 8 81.59 17.50 -8 1 8 87.19 20.30 8 1 -8 85.79 7.30 8 1 -8 105.99 8.60 8 1 -8 84.89 7.00 -8 1 8 112.09 18.20 8 1 -8 161.28 45.10 8 -1 -8 99.49 40.30 -8 -1 8 66.99 17.90 -8 -1 8 114.29 22.80 -8 -1 8 89.29 16.00 0 2 0 226.58 11.80 0 2 0 201.98 14.80 0 2 0 209.58 10.40 0 -2 0 223.58 11.80 0 -2 0 244.08 14.30 1 2 -1 138.99 11.90 -1 2 1 96.39 13.00 1 2 -1 129.99 9.10 -1 2 1 134.99 9.00 1 2 -1 122.09 7.60 -1 2 1 124.19 6.70 1 2 -1 125.69 9.30 1 2 -1 123.39 9.50 1 2 -1 149.79 13.50 -1 2 1 125.39 7.30 -1 2 1 130.59 11.30 -1 -2 1 131.19 9.30 -1 -2 1 158.68 13.80 -1 -2 1 118.99 7.50 -1 -2 1 132.69 9.70 1 -2 -1 122.79 7.30 1 -2 -1 136.99 7.50 1 -2 -1 148.39 6.80 -1 -2 1 134.59 11.70 1 -2 -1 121.09 8.60 1 -2 -1 126.49 12.60 -1 -2 1 114.79 8.60 2 2 -2 90.99 7.00 2 2 -2 107.49 14.80 -2 2 2 92.19 7.80 -2 2 2 102.19 15.80 2 2 -2 91.79 15.10 2 2 -2 113.69 13.10 2 2 -2 83.99 8.70 -2 2 2 109.69 14.20 -2 2 2 95.49 7.40 -2 2 2 94.29 8.20 2 2 -2 91.89 10.60 -2 -2 2 100.09 7.40 -2 -2 2 106.99 9.70 2 -2 -2 88.79 8.00 2 -2 -2 82.89 7.60 -2 -2 2 78.59 13.30 -2 -2 2 83.49 8.00 -2 -2 2 87.19 13.20 2 -2 -2 92.49 6.80 2 -2 -2 98.09 17.10 -2 -2 2 88.49 8.90 3 2 -3 5053.29 221.08 -3 2 3 5514.35 219.78 3 -2 -3 5390.76 220.38 -3 -2 3 5151.78 221.58 4 2 -4 0.80 1.70 4 2 -4 10.30 9.80 -4 2 4 0.20 2.40 -4 2 4 9.30 3.50 4 2 -4 0.20 1.20 4 2 -4 7.70 4.50 4 2 -4 3.70 3.90 -4 2 4 9.50 8.80 -4 2 4 4.80 3.00 4 2 -4 3.30 2.70 -4 -2 4 3.00 2.90 -4 -2 4 0.90 2.10 4 -2 -4 2.90 2.40 -4 -2 4 4.00 2.70 -4 -2 4 -0.70 8.90 4 -2 -4 -11.20 7.30 -4 -2 4 8.50 5.90 -4 -2 4 2.40 2.30 4 -2 -4 -0.40 0.80 -5 2 5 1310.27 74.39 5 2 -5 1278.57 65.69 5 2 -5 1083.79 77.29 -5 2 5 1322.37 63.99 5 2 -5 1257.27 55.99 5 2 -5 1294.07 68.29 -5 2 5 1245.18 58.49 5 2 -5 1238.08 60.89 -5 2 5 1253.87 62.49 5 2 -5 1258.47 74.89 -5 2 5 1099.29 84.79 5 -2 -5 1297.67 73.79 5 -2 -5 1182.78 64.09 -5 -2 5 1235.48 63.89 -5 -2 5 1284.37 66.39 5 -2 -5 1256.67 62.89 -5 -2 5 1297.47 63.39 5 -2 -5 1230.58 78.49 -5 -2 5 1248.08 74.69 5 -2 -5 1296.07 54.59 -5 -2 5 1184.98 79.69 -6 2 6 98.29 26.80 6 2 -6 135.89 26.60 -6 2 6 114.29 15.40 6 2 -6 116.19 18.90 6 2 -6 109.39 17.00 6 2 -6 197.98 28.40 -6 2 6 155.68 22.00 -6 2 6 116.99 18.50 6 2 -6 153.28 34.10 6 2 -6 108.89 13.40 -6 2 6 94.89 21.60 -6 -2 6 154.98 22.90 -6 -2 6 96.59 28.50 -6 -2 6 158.28 23.20 6 -2 -6 130.39 21.10 6 -2 -6 171.18 34.80 -6 -2 6 123.99 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43.50 13.10 -5 10 6 52.29 13.00 5 10 -6 22.60 7.40 -5 -10 6 17.90 30.50 -5 -10 6 26.00 11.70 5 -10 -6 62.19 16.20 -5 -10 6 41.10 12.90 -5 -10 6 53.19 12.00 5 -10 -6 46.80 12.10 5 -10 -6 27.30 15.60 -5 -10 6 15.20 13.10 5 -10 -6 67.79 34.90 -6 10 7 39.00 11.80 -6 10 7 92.09 44.30 6 10 -7 68.19 14.10 6 10 -7 52.59 16.90 -6 10 7 75.29 18.60 6 10 -7 56.49 23.20 6 10 -7 88.49 41.10 -6 -10 7 49.20 51.09 -6 -10 7 55.69 16.10 6 -10 -7 94.49 45.70 -6 -10 7 67.79 17.50 6 -10 -7 51.99 12.80 -6 -10 7 63.79 25.40 6 11 -5 -44.10 36.80 6 11 -5 72.99 20.90 6 11 -5 58.19 13.40 -6 11 5 58.09 13.50 -6 11 5 35.80 11.20 6 11 -5 25.30 21.10 -6 11 5 49.20 37.90 6 11 -5 78.49 14.00 6 -11 -5 -24.00 32.20 -6 -11 5 71.39 27.10 6 -11 -5 59.49 10.80 -6 -11 5 61.39 16.80 -6 -11 5 28.10 38.40 -6 -11 5 48.60 15.00 -6 -11 5 25.20 12.60 6 -11 -5 72.09 15.50 6 -11 -5 82.19 20.30 5 11 -4 64.59 13.20 5 11 -4 45.90 37.10 5 11 -4 38.30 13.60 -5 11 4 52.19 17.00 -5 11 4 59.19 13.20 -5 11 4 49.50 13.20 -5 11 4 70.29 33.80 5 11 -4 81.69 21.90 -5 11 4 65.89 8.50 5 11 -4 69.79 13.00 -5 -11 4 33.70 12.00 5 -11 -4 32.30 29.20 -5 -11 4 39.40 13.70 -5 -11 4 79.69 25.70 5 -11 -4 62.19 9.00 -5 -11 4 42.50 11.10 5 -11 -4 34.20 14.50 5 -11 -4 67.29 17.50 -5 -11 4 84.09 19.80 5 -11 -4 65.49 14.10 4 11 -3 158.98 41.40 4 11 -3 141.19 19.60 4 11 -3 105.79 22.40 4 11 -3 170.98 20.20 -4 11 3 150.08 28.80 -4 11 3 137.69 19.10 4 11 -3 162.28 27.90 -4 11 3 155.98 14.90 4 11 -3 79.89 32.70 -4 11 3 112.39 36.20 4 -11 -3 119.49 20.00 -4 -11 3 143.99 25.90 4 -11 -3 132.29 33.80 -4 -11 3 123.89 17.80 -4 -11 3 145.19 22.30 -4 -11 3 134.09 26.30 4 -11 -3 101.39 20.00 -4 -11 3 172.68 36.10 -4 -11 3 133.89 30.60 -3 11 2 993.60 79.99 -3 11 2 933.61 52.39 -3 11 2 917.21 74.29 3 11 -2 991.70 52.39 3 11 -2 1004.80 66.39 -3 11 2 1002.70 53.09 3 11 -2 1168.48 89.19 3 11 -2 971.10 53.79 3 11 -2 984.20 83.29 3 11 -2 888.51 61.99 3 -11 -2 875.11 67.39 -3 -11 2 930.01 72.29 -3 -11 2 1067.99 63.49 -3 -11 2 1068.49 53.19 -3 -11 2 1003.50 64.79 3 -11 -2 1071.49 58.59 -3 -11 2 967.80 56.59 -3 -11 2 1006.30 75.19 3 -11 -2 916.11 67.29 3 -11 -2 1153.58 65.29 -2 11 1 113.09 15.90 -2 11 1 107.89 15.00 -2 11 1 145.59 32.20 -2 11 1 199.98 39.60 2 11 -1 95.09 14.50 -2 11 1 118.19 18.70 2 11 -1 111.39 16.30 2 11 -1 124.79 33.70 2 11 -1 179.88 27.40 2 11 -1 125.19 31.20 2 -11 -1 105.59 16.70 2 -11 -1 112.49 24.80 -2 -11 1 116.29 26.20 -2 -11 1 121.69 20.20 -2 -11 1 78.29 14.40 2 -11 -1 142.09 24.20 -2 -11 1 97.79 20.70 -2 -11 1 142.39 19.60 1 11 0 2802.32 122.79 -1 11 0 3025.80 130.79 1 11 0 2833.12 124.59 1 11 0 2890.61 159.68 1 11 0 2832.52 134.19 -1 11 0 2835.62 153.38 1 11 0 3001.80 160.68 -1 11 0 2865.51 122.29 -1 11 0 2922.81 124.09 -1 11 0 2857.21 155.18 -1 -11 0 2913.01 138.79 -1 -11 0 3030.80 152.18 -1 -11 0 2995.40 151.88 1 -11 0 2765.62 145.39 1 -11 0 2809.42 128.99 -1 -11 0 2849.81 132.69 1 -11 0 2974.70 147.19 1 -11 0 2902.11 134.69 0 11 -1 10.30 4.50 0 11 -1 11.40 4.70 0 11 1 10.00 4.90 0 11 1 32.80 11.40 0 11 -1 25.80 18.90 0 11 1 -17.20 16.40 0 11 -1 4.30 4.30 0 11 -1 26.20 19.50 0 11 1 31.60 19.90 0 11 1 11.00 4.70 0 -11 -1 19.30 7.30 0 -11 1 18.40 4.80 0 -11 -1 7.90 7.90 0 -11 1 7.50 7.40 0 -11 -1 6.90 8.10 0 -11 -1 21.00 6.30 0 -11 1 7.00 4.30 0 -11 -1 19.50 7.50 0 -11 -1 2.60 2.90 0 -11 1 10.00 7.20 0 -11 1 12.90 8.80 -1 11 2 1960.30 91.49 1 11 -2 2004.70 99.69 -1 11 2 1914.71 122.79 -1 11 2 1966.30 89.89 1 11 -2 2157.38 123.29 1 11 -2 2168.98 124.59 1 11 -2 1938.01 90.39 1 11 -2 1989.10 89.39 -1 11 2 2367.86 124.59 1 11 -2 1969.80 103.59 -1 -11 2 1904.01 112.99 -1 -11 2 1869.01 100.49 1 -11 -2 2014.50 94.29 1 -11 -2 2017.40 98.09 -1 -11 2 1965.20 88.09 -1 -11 2 1986.30 112.99 1 -11 -2 1917.91 104.29 1 -11 -2 1961.40 114.69 -1 -11 2 1905.51 86.99 -2 11 3 267.77 22.30 -2 11 3 191.18 25.40 2 11 -3 218.18 19.30 -2 11 3 203.68 35.60 2 11 -3 176.28 38.10 2 11 -3 235.68 30.70 -2 11 3 210.08 25.50 2 11 -3 243.18 38.80 2 11 -3 270.57 37.00 -2 -11 3 228.88 19.90 -2 -11 3 177.18 19.90 -2 -11 3 104.19 32.00 2 -11 -3 316.17 51.29 2 -11 -3 227.18 30.40 2 -11 -3 212.48 19.50 2 -11 -3 208.58 32.00 -2 -11 3 139.59 30.50 2 -11 -3 219.08 37.60 -2 -11 3 162.08 23.70 2 -11 -3 220.98 15.70 -3 11 4 30.40 8.70 -3 11 4 35.10 24.60 -3 11 4 27.30 13.80 3 11 -4 25.70 11.10 3 11 -4 39.40 22.80 3 11 -4 11.90 5.30 3 11 -4 8.00 7.90 -3 11 4 33.80 9.60 3 11 -4 18.20 7.60 3 11 -4 29.90 11.70 -3 -11 4 19.10 7.30 3 -11 -4 17.40 12.90 -3 -11 4 18.50 11.10 -3 -11 4 13.00 18.90 -3 -11 4 31.70 8.60 3 -11 -4 10.90 6.40 3 -11 -4 24.40 6.30 3 -11 -4 17.20 18.70 -3 -11 4 8.10 5.80 4 11 -5 85.49 14.80 -4 11 5 82.89 24.70 -4 11 5 108.39 21.90 -4 11 5 101.09 40.10 -4 11 5 78.09 11.80 4 11 -5 112.19 23.30 4 11 -5 75.59 16.50 4 11 -5 84.79 24.90 4 11 -5 116.79 37.50 -4 11 5 99.79 17.40 -4 -11 5 56.59 21.00 4 -11 -5 120.59 24.40 4 -11 -5 86.29 25.10 -4 -11 5 67.29 13.30 -4 -11 5 82.89 19.90 4 -11 -5 98.89 14.00 4 -11 -5 81.19 38.70 -4 -11 5 121.99 40.90 5 11 -6 164.68 28.30 -5 11 6 151.08 23.80 -5 11 6 155.18 34.70 -5 11 6 270.97 56.99 5 11 -6 224.48 25.60 5 11 -6 156.48 55.89 5 11 -6 184.28 28.30 5 11 -6 175.58 40.30 -5 11 6 183.68 24.90 5 -11 -6 139.69 23.00 -5 -11 6 139.09 41.20 5 -11 -6 181.58 47.40 5 -11 -6 151.88 34.70 -5 -11 6 153.48 24.60 -5 -11 6 211.28 44.70 -5 -11 6 129.79 23.70 6 11 -7 76.99 15.80 -6 11 7 67.09 17.10 6 11 -7 120.09 58.59 6 -11 -7 76.69 14.90 6 -11 -7 136.79 55.89 -6 -11 7 81.19 19.40 6 12 -5 135.19 19.40 -6 12 5 192.08 25.60 6 12 -5 197.58 25.30 -6 -12 5 189.28 30.70 -6 -12 5 115.99 24.60 6 -12 -5 155.38 13.60 6 -12 -5 188.28 32.20 6 -12 -5 88.49 49.80 5 12 -4 86.59 43.00 -5 12 4 62.09 19.90 -5 12 4 74.89 15.30 5 12 -4 83.99 41.20 -5 12 4 69.39 10.30 5 12 -4 32.60 13.50 5 12 -4 62.39 12.60 5 -12 -4 55.79 19.80 -5 -12 4 41.30 15.20 -5 -12 4 53.89 15.50 5 -12 -4 68.49 15.30 -5 -12 4 87.59 18.20 5 -12 -4 76.59 20.60 -5 -12 4 51.49 22.50 4 12 -3 144.59 48.50 -4 12 3 171.78 20.80 -4 12 3 204.68 44.40 4 12 -3 123.69 24.30 4 12 -3 146.39 20.90 4 12 -3 170.48 29.10 4 12 -3 189.58 48.30 -4 12 3 147.49 20.80 4 12 -3 159.88 20.80 -4 -12 3 157.08 27.80 -4 -12 3 254.27 36.10 4 -12 -3 221.28 29.10 4 -12 -3 223.08 34.40 -4 -12 3 145.39 19.90 -4 -12 3 115.29 21.50 -4 -12 3 169.88 34.60 -4 -12 3 155.18 34.50 3 12 -2 288.67 53.89 -3 12 2 234.38 44.40 3 12 -2 290.17 29.90 3 12 -2 267.47 36.60 -3 12 2 240.38 47.10 3 12 -2 255.67 53.39 -3 12 2 219.28 25.50 -3 12 2 279.37 24.10 3 12 -2 305.27 38.50 3 -12 -2 244.78 39.70 -3 -12 2 290.77 23.30 -3 -12 2 300.87 39.80 -3 -12 2 274.37 30.80 3 -12 -2 249.08 25.00 -3 -12 2 270.57 45.90 -3 -12 2 252.27 42.60 -3 -12 2 268.57 34.70 3 -12 -2 231.28 32.10 -3 -12 2 267.67 33.60 3 -12 -2 269.17 40.60 2 12 -1 12.20 23.40 2 12 -1 32.50 8.50 -2 12 1 32.40 9.90 2 12 -1 23.10 20.00 -2 12 1 9.60 20.80 -2 12 1 30.60 21.30 2 12 -1 24.00 9.90 2 12 -1 25.70 8.20 -2 12 1 27.10 7.90 -2 12 1 36.40 9.10 -2 -12 1 38.50 16.00 2 -12 -1 35.10 14.90 2 -12 -1 24.30 7.80 -2 -12 1 20.50 7.60 2 -12 -1 31.90 14.70 -2 -12 1 42.30 12.10 -2 -12 1 33.50 15.10 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39.80 23.00 -1 12 2 29.70 10.70 1 12 -2 16.60 8.50 -1 -12 2 29.80 10.50 1 -12 -2 32.00 7.80 1 -12 -2 39.50 14.90 -1 -12 2 22.70 9.80 -1 -12 2 28.80 7.20 -1 -12 2 20.60 11.80 1 -12 -2 11.40 5.60 1 -12 -2 15.10 10.80 1 -12 -2 13.10 10.50 1 -12 -2 32.00 10.20 2 12 -3 22.30 7.60 2 12 -3 9.50 6.90 2 12 -3 26.30 11.30 -2 12 3 7.20 4.80 -2 12 3 16.90 12.00 -2 12 3 -16.30 24.60 2 12 -3 37.50 23.50 2 -12 -3 11.20 9.10 2 -12 -3 15.30 7.90 2 -12 -3 8.50 8.70 -2 -12 3 6.20 4.10 2 -12 -3 25.90 8.60 2 -12 -3 10.10 3.90 2 -12 -3 49.80 25.40 -2 -12 3 16.80 5.90 -2 -12 3 12.80 8.00 -2 -12 3 20.60 13.50 -3 12 4 103.69 16.70 -3 12 4 94.19 25.00 -3 12 4 105.99 17.60 3 12 -4 112.39 22.90 3 12 -4 86.39 15.00 3 12 -4 111.79 29.40 3 12 -4 94.09 21.00 3 12 -4 92.79 15.20 3 12 -4 83.69 37.30 -3 12 4 73.09 15.80 -3 12 4 88.69 35.90 -3 -12 4 77.49 14.70 -3 -12 4 134.39 40.40 -3 -12 4 100.29 28.00 3 -12 -4 114.09 13.10 3 -12 -4 99.49 23.80 3 -12 -4 117.79 29.50 3 -12 -4 74.89 15.70 -3 -12 4 64.49 15.70 3 -12 -4 102.99 37.20 -3 -12 4 89.99 14.80 4 12 -5 23.70 10.80 -4 12 5 19.30 13.80 4 12 -5 32.40 9.70 4 12 -5 21.80 9.70 4 12 -5 27.50 8.60 -4 12 5 29.80 7.80 4 12 -5 50.09 21.10 4 12 -5 -13.10 23.10 -4 12 5 13.90 32.80 4 12 -5 29.70 12.90 -4 12 5 22.50 9.90 -4 -12 5 27.60 15.20 4 -12 -5 21.90 6.40 4 -12 -5 29.90 30.20 -4 -12 5 -19.70 31.70 4 -12 -5 21.90 9.30 4 -12 -5 19.40 14.60 -4 -12 5 30.10 9.10 -4 -12 5 21.90 9.80 -4 -12 5 20.90 8.70 5 12 -6 95.09 17.20 -5 12 6 115.79 23.60 -5 12 6 83.29 16.70 5 12 -6 83.79 19.40 5 12 -6 126.19 51.39 5 12 -6 107.59 30.60 5 12 -6 84.09 16.70 -5 12 6 84.39 43.90 5 -12 -6 120.99 16.90 -5 -12 6 100.99 47.80 5 -12 -6 72.79 43.10 -5 -12 6 85.79 20.50 -5 -12 6 95.99 32.30 -5 -12 6 105.69 20.10 6 12 -7 34.90 58.79 -6 12 7 -0.20 2.70 6 12 -7 2.50 4.00 -6 -12 7 8.70 7.90 6 -12 -7 2.40 4.20 -6 -12 7 76.99 56.79 6 13 -5 199.48 72.49 6 13 -5 230.68 27.10 6 13 -5 186.98 70.29 -6 -13 5 183.58 31.00 6 -13 -5 277.67 38.20 -6 -13 5 337.47 48.00 -5 13 4 -40.50 34.50 5 13 -4 6.50 5.30 5 13 -4 6.50 4.70 -5 13 4 16.80 5.60 5 13 -4 -0.70 32.40 -5 13 4 19.70 8.80 5 13 -4 30.30 32.80 -5 -13 4 17.40 8.10 5 -13 -4 26.10 12.00 -5 -13 4 4.80 8.00 -5 -13 4 16.80 9.10 5 -13 -4 23.90 9.70 -5 -13 4 14.30 9.00 4 13 -3 654.73 86.09 -4 13 3 692.63 44.30 4 13 -3 568.64 83.69 -4 13 3 677.33 83.39 4 13 -3 673.43 42.20 4 13 -3 623.04 53.49 4 13 -3 704.13 44.80 -4 13 3 707.13 42.70 -4 -13 3 621.94 52.79 4 -13 -3 659.23 46.80 -4 -13 3 484.25 68.59 4 -13 -3 725.73 63.19 4 -13 -3 724.13 53.39 -4 -13 3 625.74 49.60 -4 -13 3 681.03 52.99 -4 -13 3 721.13 49.40 3 13 -2 71.39 14.10 -3 13 2 115.39 39.20 -3 13 2 108.89 17.60 -3 13 2 104.29 18.20 3 13 -2 126.89 18.30 3 13 -2 105.09 23.70 3 13 -2 152.98 45.50 -3 13 2 73.09 34.60 3 13 -2 74.69 36.80 -3 -13 2 125.89 20.60 -3 -13 2 142.29 33.00 -3 -13 2 121.99 18.80 -3 -13 2 130.99 32.70 3 -13 -2 62.99 16.00 3 -13 -2 90.09 19.30 -3 -13 2 132.29 27.60 3 -13 -2 65.79 22.10 -3 -13 2 170.38 28.20 -3 -13 2 110.59 23.30 -2 13 1 343.07 25.30 2 13 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953.60 59.29 -2 -2 -9 897.41 55.39 -2 -2 -9 786.52 66.09 -2 -2 -9 1022.00 98.09 1 2 10 0.60 2.80 -1 2 -10 33.40 42.90 1 2 10 -1.20 1.10 1 2 10 -17.90 41.00 -1 2 -10 -2.10 1.90 -1 2 -10 -1.20 2.50 -1 2 -10 -1.40 2.00 -1 -2 -10 60.19 46.50 1 -2 10 38.10 38.50 1 -2 10 -0.80 1.10 -1 -2 -10 -0.40 3.20 -1 -2 -10 4.10 6.00 -1 -2 -10 0.30 2.80 1 -2 10 -0.30 1.60 0 2 -11 28.60 56.89 0 2 11 2.40 5.70 0 2 11 31.20 54.69 0 2 -11 15.00 10.30 0 2 -11 0.90 3.30 0 2 11 9.40 6.00 0 -2 11 3.70 4.60 0 -2 -11 0.40 3.40 0 -2 -11 3.50 4.60 0 -2 11 -47.60 48.10 0 -2 -11 83.09 56.59 0 -2 -11 13.40 9.40 -6 3 -5 28.00 7.20 -6 3 -5 38.20 15.10 6 3 5 -14.70 26.90 -6 -3 -5 26.70 8.90 -6 -3 -5 52.39 29.20 -6 -3 -5 21.30 11.70 -6 -3 -5 21.60 7.40 -5 3 -6 27.90 7.90 -5 3 -6 47.00 9.60 5 3 6 33.20 33.90 -5 3 -6 14.70 10.20 -5 3 -6 50.19 22.00 -5 -3 -6 12.00 35.20 -5 -3 -6 41.30 11.40 -5 -3 -6 32.70 10.10 -5 -3 -6 29.10 13.70 5 -3 6 27.50 17.90 -4 3 -7 -27.80 32.00 4 3 7 -0.80 1.60 4 3 7 -5.90 33.10 -4 3 -7 6.80 7.20 -4 3 -7 -0.20 1.90 -4 3 -7 1.30 4.20 -4 -3 -7 -0.30 2.40 -4 -3 -7 21.70 37.80 -4 -3 -7 3.10 3.80 -4 -3 -7 6.30 5.10 4 -3 7 -15.10 25.10 3 3 8 5.80 5.40 -3 3 -8 -1.00 1.00 -3 3 -8 2.50 4.70 -3 3 -8 -34.80 32.70 3 3 8 -34.20 30.50 -3 3 -8 -0.50 2.70 3 3 8 0.30 1.40 -3 3 -8 0.20 2.70 3 3 8 0.70 1.30 -3 -3 -8 -0.90 1.20 3 -3 8 -3.50 29.10 3 -3 8 2.30 3.70 -3 -3 -8 -0.30 2.20 -3 -3 -8 -1.40 1.60 -3 -3 -8 -21.70 39.90 2 3 9 -0.20 1.60 -2 3 -9 13.70 8.20 -2 3 -9 3.80 7.10 -2 3 -9 0.60 2.60 2 3 9 27.80 45.30 -2 3 -9 0.60 3.10 -2 3 -9 10.00 42.00 2 3 9 0.10 3.00 2 -3 9 1.80 1.70 -2 -3 -9 0.10 2.90 -2 -3 -9 -0.50 2.00 -2 -3 -9 -16.10 39.40 2 -3 9 34.80 42.40 2 -3 9 3.50 3.90 -2 -3 -9 7.70 7.80 1 3 10 1.30 3.20 -1 3 -10 44.00 47.20 1 3 10 1.10 2.50 1 3 10 -22.30 51.69 -1 3 -10 3.90 4.50 -1 3 -10 -0.50 2.60 -1 3 -10 5.90 6.10 -1 -3 -10 9.50 6.70 -1 -3 -10 60.99 51.79 -1 -3 -10 6.60 6.90 -1 -3 -10 4.20 7.40 1 -3 10 3.90 3.30 1 -3 10 3.60 4.00 1 -3 10 8.10 38.30 0 3 11 17.10 7.80 0 3 -11 23.30 13.20 0 3 -11 2.50 9.70 0 3 -11 7.30 5.90 0 3 -11 17.60 48.00 0 3 11 -91.09 57.99 0 3 11 10.70 7.30 0 -3 -11 37.70 61.19 0 -3 -11 11.00 9.70 0 -3 11 13.60 7.20 0 -3 -11 10.70 8.60 0 -3 11 25.20 51.09 0 -3 11 6.50 6.70 -6 4 -5 4.60 3.40 6 4 5 45.10 34.30 -6 4 -5 7.90 8.80 -6 -4 -5 2.90 6.30 -6 -4 -5 11.10 6.00 -6 -4 -5 5.40 5.50 -6 -4 -5 11.00 6.10 -6 -4 -5 8.90 9.50 -5 4 -6 594.94 32.20 -5 4 -6 557.84 42.60 -5 4 -6 601.74 54.99 -5 4 -6 542.95 33.40 5 4 6 504.95 65.39 -5 -4 -6 414.16 66.09 -5 -4 -6 427.56 62.49 -5 -4 -6 570.84 40.80 5 -4 6 533.65 36.20 -5 -4 -6 570.44 39.60 -4 4 -7 243.88 41.60 -4 4 -7 241.38 20.80 4 4 7 248.28 51.79 -4 4 -7 197.08 20.60 -4 -4 -7 264.67 30.80 -4 -4 -7 197.48 37.50 -4 -4 -7 221.38 31.30 -4 -4 -7 240.38 58.09 4 -4 7 219.08 40.80 3 4 8 0.30 1.30 -3 4 -8 0.10 2.20 -3 4 -8 -0.10 2.30 3 4 8 0.20 1.40 -3 4 -8 -1.80 1.70 3 4 8 -41.80 32.70 3 4 8 -1.40 1.00 -3 4 -8 -0.40 3.70 -3 4 -8 -6.20 32.20 3 -4 8 6.30 5.50 3 -4 8 -20.80 30.80 -3 -4 -8 1.60 3.50 -3 -4 -8 -0.80 3.00 -2 4 -9 213.98 32.50 2 4 9 237.98 61.69 -2 4 -9 146.99 30.30 -2 4 -9 177.38 26.80 2 4 9 156.48 27.30 -2 4 -9 177.28 23.20 -2 4 -9 143.89 47.40 2 4 9 170.78 19.40 -2 -4 -9 190.68 59.09 2 -4 9 160.58 24.30 -2 -4 -9 151.98 23.80 2 -4 9 120.39 53.99 2 -4 9 164.58 10.40 -2 -4 -9 155.28 31.00 -2 -4 -9 166.88 28.70 -1 4 -10 249.68 61.89 1 4 10 186.58 30.20 -1 4 -10 333.17 42.00 1 4 10 245.68 27.00 1 4 10 331.77 72.89 -1 4 -10 284.87 31.80 1 -4 10 283.87 20.10 1 -4 10 310.67 39.70 1 -4 10 212.68 62.89 -1 -4 -10 197.48 35.10 -1 -4 -10 179.58 65.39 -1 -4 -10 242.98 37.90 0 4 -11 27.70 13.50 0 4 11 52.49 18.40 0 4 -11 47.90 57.99 0 4 11 56.59 64.09 0 -4 11 55.59 53.69 0 -4 11 39.10 10.20 0 -4 -11 31.10 11.70 0 -4 -11 18.30 9.40 0 -4 -11 30.30 14.10 0 -4 -11 -2.30 63.09 5 5 6 37.30 42.40 -5 5 -6 -1.10 3.00 -5 5 -6 5.00 5.20 -5 5 -6 1.90 2.90 -5 5 -6 -1.10 17.20 -5 5 -6 4.40 3.10 -5 -5 -6 6.20 5.70 -5 -5 -6 4.20 3.70 -5 -5 -6 -1.40 3.70 -5 -5 -6 -1.10 37.00 -5 -5 -6 1.50 3.70 4 5 7 10.80 42.10 -4 5 -7 2.70 5.30 -4 5 -7 -9.90 30.90 -4 5 -7 0.20 1.70 -4 5 -7 3.90 3.80 -4 5 -7 1.10 4.20 4 5 7 -1.40 1.10 -4 -5 -7 35.60 45.30 4 -5 7 -0.30 0.90 -4 -5 -7 -0.20 3.90 -4 -5 -7 9.70 7.40 -4 -5 -7 -0.20 2.30 3 5 8 1.40 41.10 -3 5 -8 19.50 11.50 3 5 8 29.20 6.40 -3 5 -8 33.20 9.60 3 5 8 25.00 11.10 3 5 8 33.50 6.90 -3 5 -8 32.60 11.30 -3 5 -8 47.30 37.10 -3 -5 -8 27.60 10.30 -3 -5 -8 31.80 12.40 -3 -5 -8 26.20 12.70 3 -5 8 -14.40 32.00 -3 -5 -8 60.29 42.70 3 -5 8 27.50 9.60 -2 5 -9 4.30 5.00 2 5 9 2.40 3.20 -2 5 -9 1.20 3.80 -2 5 -9 51.49 45.30 -2 5 -9 10.30 5.40 2 5 9 4.20 4.10 2 5 9 0.80 4.50 -2 -5 -9 7.70 7.10 -2 -5 -9 7.90 8.70 2 -5 9 26.30 38.60 2 -5 9 7.80 6.40 -2 -5 -9 1.80 4.00 -2 -5 -9 56.49 45.60 -1 5 -10 12.90 41.70 1 5 10 4.20 4.50 -1 5 -10 2.50 4.50 1 5 10 44.70 52.29 -1 5 -10 3.70 4.60 1 5 10 9.70 8.40 1 -5 10 12.70 8.10 -1 -5 -10 -2.50 1.40 1 -5 10 2.60 2.70 1 -5 10 -35.30 43.40 -1 -5 -10 -0.70 2.80 -1 -5 -10 36.50 55.99 -1 -5 -10 1.00 3.10 0 5 11 0.10 2.60 0 5 -11 -23.10 50.39 0 5 11 39.70 68.69 0 5 -11 4.10 6.00 0 5 -11 3.00 4.70 0 -5 -11 -1.50 2.90 0 -5 -11 -1.50 2.20 0 -5 11 35.40 56.39 0 -5 11 0.70 2.60 0 -5 -11 33.90 64.49 0 -5 -11 -1.50 1.50 0 -5 11 2.90 4.90 -5 6 -6 41.80 12.70 -5 6 -6 43.30 8.80 5 6 6 72.89 49.00 -5 6 -6 52.69 18.30 -5 6 -6 49.80 9.80 -5 6 -6 53.79 15.30 -5 -6 -6 51.89 20.80 -5 -6 -6 54.39 15.80 -5 -6 -6 37.50 11.20 -5 -6 -6 47.80 16.60 -4 6 -7 165.68 24.50 -4 6 -7 153.48 43.00 -4 6 -7 180.28 24.50 -4 6 -7 180.38 35.50 4 6 7 163.18 60.59 4 6 7 185.68 29.40 4 -6 7 204.58 18.70 4 -6 7 209.58 40.30 -4 -6 -7 190.18 30.40 -4 -6 -7 101.99 31.10 -4 -6 -7 165.68 25.50 -4 -6 -7 216.38 57.49 -3 6 -8 -0.10 2.60 -3 6 -8 36.10 39.70 3 6 8 14.30 51.49 3 6 8 -0.80 1.00 -3 6 -8 2.30 3.40 3 6 8 -0.80 1.20 -3 6 -8 -0.10 2.20 3 6 8 0.20 1.50 -3 -6 -8 1.20 3.20 3 -6 8 -9.20 33.80 3 -6 8 1.90 2.90 -3 -6 -8 -37.60 42.90 -3 -6 -8 -0.20 2.20 -3 -6 -8 -0.50 2.60 -2 6 -9 730.73 45.40 -2 6 -9 763.72 53.59 2 6 9 465.55 86.29 -2 6 -9 728.83 89.99 -2 6 -9 610.24 46.70 2 6 9 702.83 54.59 2 6 9 658.13 40.50 -2 -6 -9 657.53 59.59 -2 -6 -9 682.73 49.40 2 -6 9 711.53 88.99 -2 -6 -9 755.82 105.19 2 -6 9 710.13 49.80 -2 -6 -9 663.13 54.29 -1 6 -10 112.29 25.00 1 6 10 67.59 18.80 1 6 10 82.19 16.30 -1 6 -10 54.19 48.00 -1 6 -10 71.09 15.70 1 -6 10 67.99 10.60 -1 -6 -10 109.49 27.70 -1 -6 -10 24.90 59.79 -1 -6 -10 88.39 23.80 1 -6 10 198.78 60.89 1 -6 10 85.09 20.00 -4 7 -7 1.30 2.50 4 7 7 4.80 2.40 -4 7 -7 87.09 36.40 -4 -7 -7 14.10 12.30 -4 -7 -7 88.39 56.49 4 -7 7 -0.10 30.20 -4 -7 -7 1.90 3.80 -3 7 -8 3.80 4.20 3 7 8 96.69 59.59 -3 7 -8 1.60 3.70 -3 7 -8 -22.90 37.60 -3 7 -8 -1.00 1.60 3 7 8 1.80 3.50 3 7 8 1.70 2.70 3 7 8 1.10 2.40 -3 -7 -8 22.10 52.49 3 -7 8 1.00 2.80 3 -7 8 10.10 36.50 -3 -7 -8 7.90 6.00 -3 -7 -8 1.90 5.00 -3 -7 -8 0.00 3.40 2 7 9 -76.19 49.70 2 7 9 -0.20 2.00 -2 7 -9 3.20 4.20 2 7 9 -1.60 1.60 -2 7 -9 -0.90 1.90 -2 7 -9 26.40 42.60 -2 7 -9 -2.50 1.30 -2 -7 -9 2.20 4.80 -2 -7 -9 28.90 54.69 2 -7 9 0.00 2.20 2 -7 9 -94.09 42.00 -2 -7 -9 -1.90 4.20 -2 -7 -9 -1.10 1.80 1 7 10 11.40 64.39 1 7 10 8.20 6.60 -1 7 -10 40.50 55.69 -1 7 -10 1.80 3.40 1 -7 10 4.50 47.30 -3 8 -8 20.90 9.90 3 8 8 -76.19 52.79 -3 8 -8 9.60 5.80 -3 8 -8 -20.80 40.70 3 8 8 5.90 4.30 3 8 8 16.30 10.30 3 8 8 11.80 6.00 -3 8 -8 12.90 6.80 -3 -8 -8 16.90 9.70 -3 -8 -8 -35.80 50.09 -3 -8 -8 8.70 7.90 3 -8 8 9.80 6.20 -3 -8 -8 8.60 9.10 3 -8 8 76.99 40.40 -4 0 -8 4.20 3.90 4 0 8 2.10 3.80 -4 0 -8 6.00 5.70 4 0 8 11.20 37.40 -4 0 -8 2.90 7.20 -4 0 -8 12.00 40.90 -3 0 -9 5.20 5.80 -3 0 -9 82.89 51.39 3 0 9 18.70 46.90 2 0 10 1.60 3.50 -2 0 -10 1.60 3.50 2 0 10 49.00 50.89 2 0 10 5.30 3.00 -2 0 -10 -17.10 47.10 -2 0 -10 -0.40 2.40 -2 0 -10 1.30 6.60 -4 1 -8 55.49 46.90 4 1 8 -38.50 38.50 -4 1 -8 18.50 8.10 4 1 8 37.10 12.30 -4 1 -8 24.00 9.50 -4 1 -8 31.40 13.80 -4 -1 -8 -82.79 42.00 -4 -1 -8 1.50 4.90 -4 -1 -8 14.70 7.80 4 -1 8 59.89 38.50 4 -1 8 29.40 10.00 -4 -1 -8 13.10 6.60 3 1 9 403.86 36.40 -3 1 -9 435.66 33.70 -3 1 -9 365.96 35.10 3 1 9 423.86 75.29 -3 1 -9 331.57 47.80 -3 1 -9 421.86 73.19 -3 -1 -9 438.56 38.50 -3 -1 -9 435.86 34.60 3 -1 9 413.56 36.00 3 -1 9 405.36 72.59 -3 -1 -9 433.16 56.29 -3 -1 -9 358.76 78.09 -2 1 -10 147.69 27.90 -2 1 -10 160.18 23.90 2 1 10 165.98 20.80 -2 1 -10 232.88 40.80 2 1 10 199.38 34.10 2 1 10 153.88 66.89 2 -1 10 205.58 62.49 -2 -1 -10 174.78 37.50 -2 -1 -10 12.50 56.79 -2 -1 -10 193.98 33.00 2 -1 10 154.48 12.30 2 -1 10 135.39 25.60 -2 -1 -10 160.28 24.90 -4 2 -8 -1.40 3.40 4 2 8 -24.60 44.60 -4 2 -8 3.20 3.40 -4 2 -8 -0.50 1.60 4 2 8 0.10 1.80 -4 -2 -8 2.80 3.90 4 -2 8 1.80 3.10 -4 -2 -8 -68.99 43.90 4 -2 8 -31.80 35.20 -4 -2 -8 -1.60 1.90 -4 -2 -8 1.40 3.20 -3 2 -9 45.90 18.00 3 2 9 39.10 13.00 3 2 9 30.00 45.20 -3 2 -9 43.70 49.50 -3 2 -9 41.10 14.20 -3 2 -9 48.60 12.50 -3 -2 -9 102.49 50.59 3 -2 9 26.10 37.40 -3 -2 -9 51.89 13.50 -3 -2 -9 22.90 12.30 2 2 10 -1.00 1.40 2 2 10 67.89 59.59 -2 2 -10 -2.50 52.29 2 2 10 -0.70 1.30 -2 2 -10 -2.10 2.20 -2 2 -10 3.80 4.90 -2 2 -10 1.50 3.60 -2 -2 -10 -0.70 2.40 -2 -2 -10 -0.60 3.30 -2 -2 -10 13.00 7.60 -2 -2 -10 49.60 56.39 2 -2 10 4.10 5.80 2 -2 10 -0.80 0.80 -4 3 -8 18.50 8.90 4 3 8 49.20 44.50 -4 3 -8 9.90 40.90 -4 3 -8 20.50 7.80 -4 3 -8 28.30 14.90 4 -3 8 25.80 9.30 -4 -3 -8 106.39 50.39 -4 -3 -8 10.50 7.00 -4 -3 -8 20.30 9.80 -4 -3 -8 27.50 14.60 3 3 9 98.49 20.40 -3 3 -9 115.89 27.40 3 3 9 91.49 48.60 3 3 9 92.49 7.40 3 3 9 100.39 7.70 -3 3 -9 104.49 50.49 -3 3 -9 113.79 18.70 -3 3 -9 107.99 22.30 3 -3 9 159.38 50.39 -3 -3 -9 19.60 48.10 -3 -3 -9 103.59 20.20 -3 -3 -9 77.99 24.90 -3 -3 -9 148.39 28.50 3 -3 9 126.59 23.30 0 0 0 0.00 0.00 _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' ; _shelx_hkl_checksum 1497 _olex2_submission_special_instructions 'No special instructions were received' loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -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_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 Na1 Na 0.32785(19) 0.65315(10) 0.34513(16) 0.0259(3) Uani 1 1 d . . . . . Na2 Na 1.11079(19) 0.65057(10) 0.61471(15) 0.0253(3) Uani 1 1 d . . . . . Sb1 Sb 0.69298(3) 0.61425(2) 0.76837(2) 0.01744(7) Uani 1 1 d . . . . . Sb2 Sb 0.74045(3) 0.60483(2) 0.18948(2) 0.01752(7) Uani 1 1 d . . . . . S1 S 0.21025(11) 0.87679(6) 0.47674(9) 0.01696(16) Uani 1 1 d . . . . . O1 O 0.3744(3) 0.93963(17) 0.5834(3) 0.0283(6) Uani 1 1 d . . . . . O2 O 0.0498(3) 0.94179(16) 0.3710(3) 0.0243(5) Uani 1 1 d . . . . . O3 O 0.1163(4) 0.82008(17) 0.5627(3) 0.0277(5) Uani 1 1 d . . . . . O4 O 0.2998(3) 0.81883(16) 0.3899(3) 0.0260(5) Uani 1 1 d . . . . . F1 F 0.4376(3) 0.65574(13) 0.6028(2) 0.0248(4) Uani 1 1 d . . . . . F2 F 0.6934(3) 0.51156(14) 0.6381(2) 0.0299(5) Uani 1 1 d . . . . . F3 F 0.8250(3) 0.69582(14) 0.6655(2) 0.0267(4) Uani 1 1 d . . . . . F4 F 0.7173(3) 0.49905(14) 0.3088(2) 0.0306(5) Uani 1 1 d . . . . . F5 F 1.0062(3) 0.62881(14) 0.3576(2) 0.0281(4) Uani 1 1 d . . . . . F6 F 0.6278(3) 0.68567(13) 0.3057(2) 0.0265(4) Uani 1 1 d . . . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Na1 0.0266(7) 0.0267(7) 0.0286(8) -0.0034(6) 0.0151(6) -0.0038(6) Na2 0.0233(7) 0.0294(7) 0.0236(7) 0.0010(6) 0.0093(6) 0.0028(5) Sb1 0.01840(12) 0.01729(12) 0.01732(13) 0.00104(8) 0.00757(9) 0.00036(8) Sb2 0.01770(12) 0.01782(12) 0.01719(13) 0.00034(8) 0.00680(9) -0.00025(8) S1 0.0161(4) 0.0167(4) 0.0169(4) 0.0009(3) 0.0049(3) 0.0007(3) O1 0.0184(12) 0.0267(13) 0.0326(15) -0.0082(11) 0.0016(11) -0.0005(9) O2 0.0189(11) 0.0227(12) 0.0266(13) 0.0055(10) 0.0034(10) 0.0037(9) O3 0.0325(13) 0.0255(13) 0.0311(14) 0.0070(11) 0.0187(11) 0.0011(10) O4 0.0320(13) 0.0224(12) 0.0267(13) 0.0007(10) 0.0146(11) 0.0055(10) F1 0.0175(9) 0.0281(11) 0.0257(11) 0.0045(9) 0.0045(8) 0.0023(8) F2 0.0310(11) 0.0261(11) 0.0297(12) -0.0075(9) 0.0082(9) 0.0011(8) F3 0.0242(10) 0.0282(11) 0.0320(11) 0.0084(9) 0.0153(9) 0.0008(8) F4 0.0373(11) 0.0253(11) 0.0329(12) 0.0098(9) 0.0176(10) 0.0055(8) F5 0.0195(9) 0.0414(12) 0.0197(11) -0.0036(9) 0.0035(8) 0.0005(8) F6 0.0274(10) 0.0228(10) 0.0347(12) -0.0040(9) 0.0178(9) 0.0001(8) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source F F 0.0171 0.0103 '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' S S 0.1246 0.1234 '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' 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 Na2 Na1 Na2 105.74(4) 1_455 4_475 ? Na2 Na1 Sb2 155.61(5) 1_455 . ? Na2 Na1 Sb2 96.07(4) 4_475 . ? S1 Na1 Na2 142.04(5) 4_575 1_455 ? S1 Na1 Na2 63.82(4) 4_575 4_475 ? S1 Na1 Sb2 58.45(2) 4_575 . ? O1 Na1 Na2 148.35(7) 4_575 1_455 ? O1 Na1 Na2 88.54(6) 4_575 4_475 ? O1 Na1 Sb2 40.34(4) 4_575 . ? O1 Na1 S1 26.75(5) 4_575 4_575 ? O3 Na1 Na2 123.21(7) 4_575 1_455 ? O3 Na1 Na2 44.17(6) 4_575 4_475 ? O3 Na1 Sb2 80.24(6) 4_575 . ? O3 Na1 S1 24.78(5) 4_575 4_575 ? O3 Na1 O1 51.38(7) 4_575 4_575 ? O4 Na1 Na2 45.47(7) . 4_475 ? O4 Na1 Na2 77.71(7) . 1_455 ? O4 Na1 Sb2 111.90(7) . . ? O4 Na1 S1 108.01(7) . 4_575 ? O4 Na1 O1 128.76(9) . 4_575 ? O4 Na1 O3 89.57(9) . 4_575 ? F1 Na1 Na2 123.67(7) . 4_475 ? F1 Na1 Na2 42.02(5) . 1_455 ? F1 Na1 Sb2 115.83(6) . . ? F1 Na1 S1 172.07(7) . 4_575 ? F1 Na1 O1 145.35(9) . 4_575 ? F1 Na1 O3 162.80(9) . 4_575 ? F1 Na1 O4 78.92(8) . . ? F1 Na1 F2 86.86(8) . 3_666 ? F1 Na1 F5 83.13(8) . 1_455 ? F1 Na1 F6 102.75(8) . . ? F2 Na1 Na2 83.13(6) 3_666 1_455 ? F2 Na1 Na2 143.51(8) 3_666 4_475 ? F2 Na1 Sb2 85.80(6) 3_666 . ? F2 Na1 S1 87.19(6) 3_666 4_575 ? F2 Na1 O1 69.51(8) 3_666 4_575 ? F2 Na1 O3 101.08(9) 3_666 4_575 ? F2 Na1 O4 160.84(9) 3_666 . ? F5 Na1 Na2 41.51(6) 1_455 1_455 ? F5 Na1 Na2 87.31(7) 1_455 4_475 ? F5 Na1 Sb2 153.29(7) 1_455 . ? F5 Na1 S1 100.52(7) 1_455 4_575 ? F5 Na1 O1 113.61(8) 1_455 4_575 ? F5 Na1 O3 84.00(8) 1_455 4_575 ? F5 Na1 O4 89.28(9) 1_455 . ? F5 Na1 F2 76.20(8) 1_455 3_666 ? F6 Na1 Na2 86.74(7) . 4_475 ? F6 Na1 Na2 143.79(8) . 1_455 ? F6 Na1 Sb2 25.26(5) . . ? F6 Na1 S1 74.05(6) . 4_575 ? F6 Na1 O1 63.17(7) . 4_575 ? F6 Na1 O3 89.59(8) . 4_575 ? F6 Na1 O4 88.73(8) . . ? F6 Na1 F2 107.06(8) . 3_666 ? F6 Na1 F5 173.30(10) . 1_455 ? Na1 Na2 Na1 104.75(4) 1_655 4_676 ? Na1 Na2 Sb1 156.63(5) 1_655 . ? Na1 Na2 Sb1 94.29(4) 4_676 . ? S1 Na2 Na1 63.93(4) 4_676 4_676 ? S1 Na2 Na1 144.28(5) 4_676 1_655 ? S1 Na2 Sb1 57.11(2) 4_676 . ? O2 Na2 Na1 150.48(6) 4_676 1_655 ? O2 Na2 Na1 89.30(6) 4_676 4_676 ? O2 Na2 Sb1 40.22(4) 4_676 . ? O2 Na2 S1 27.15(5) 4_676 4_676 ? O3 Na2 Na1 77.97(7) 1_655 1_655 ? O3 Na2 Na1 47.23(7) 1_655 4_676 ? O3 Na2 Sb1 106.67(7) 1_655 . ? O3 Na2 S1 108.44(7) 1_655 4_676 ? O3 Na2 O2 128.27(9) 1_655 4_676 ? O3 Na2 O4 90.23(9) 1_655 4_676 ? O4 Na2 Na1 125.50(7) 4_676 1_655 ? O4 Na2 Na1 43.08(6) 4_676 4_676 ? O4 Na2 Sb1 77.78(6) 4_676 . ? O4 Na2 S1 24.81(5) 4_676 4_676 ? O4 Na2 O2 51.88(7) 4_676 4_676 ? F1 Na2 Na1 78.97(6) 1_655 4_676 ? F1 Na2 Na1 41.08(5) 1_655 1_655 ? F1 Na2 Sb1 160.38(7) 1_655 . ? F1 Na2 S1 103.75(6) 1_655 4_676 ? F1 Na2 O2 120.64(8) 1_655 4_676 ? F1 Na2 O3 82.38(8) 1_655 1_655 ? F1 Na2 O4 84.94(8) 1_655 4_676 ? F1 Na2 F4 69.87(7) 1_655 3_766 ? F3 Na2 Na1 81.51(7) . 4_676 ? F3 Na2 Na1 144.32(7) . 1_655 ? F3 Na2 Sb1 25.59(5) . . ? F3 Na2 S1 70.35(6) . 4_676 ? F3 Na2 O2 62.40(7) . 4_676 ? F3 Na2 O3 81.75(8) . 1_655 ? F3 Na2 O4 83.27(8) . 4_676 ? F3 Na2 F1 160.15(9) . 1_655 ? F3 Na2 F4 123.29(9) . 3_766 ? F4 Na2 Na1 116.98(7) 3_766 4_676 ? F4 Na2 Na1 85.77(6) 3_766 1_655 ? F4 Na2 Sb1 97.72(6) 3_766 . ? F4 Na2 S1 72.22(6) 3_766 4_676 ? F4 Na2 O2 64.72(7) 3_766 4_676 ? F4 Na2 O3 151.18(9) 3_766 1_655 ? F4 Na2 O4 79.99(8) 3_766 4_676 ? F5 Na2 Na1 131.53(8) . 4_676 ? F5 Na2 Na1 41.83(6) . 1_655 ? F5 Na2 Sb1 114.90(6) . . ? F5 Na2 S1 164.52(8) . 4_676 ? F5 Na2 O2 137.99(9) . 4_676 ? F5 Na2 O3 86.26(9) . 1_655 ? F5 Na2 O4 167.32(9) . 4_676 ? F5 Na2 F1 82.52(8) . 1_655 ? F5 Na2 F3 108.22(8) . . ? F5 Na2 F4 97.36(9) . 3_766 ? O2 Sb1 Na2 51.39(6) 4_676 . ? F1 Sb1 Na2 104.14(6) . . ? F1 Sb1 O2 153.42(8) . 4_676 ? F2 Sb1 Na2 69.71(6) . . ? F2 Sb1 O2 76.30(8) . 4_676 ? F2 Sb1 F1 85.66(8) . . ? F2 Sb1 F3 89.76(9) . . ? F3 Sb1 Na2 30.77(6) . . ? F3 Sb1 O2 77.68(8) . 4_676 ? F3 Sb1 F1 82.96(8) . . ? O1 Sb2 Na1 51.35(6) 4_575 . ? F4 Sb2 Na1 69.79(6) . . ? F4 Sb2 O1 74.78(8) . 4_575 ? F4 Sb2 F5 85.02(9) . . ? F4 Sb2 F6 88.19(8) . . ? F5 Sb2 Na1 105.70(6) . . ? F5 Sb2 O1 153.47(8) . 4_575 ? F6 Sb2 Na1 30.34(6) . . ? F6 Sb2 O1 78.51(8) . 4_575 ? F6 Sb2 F5 83.92(8) . . ? Na2 S1 Na1 165.88(4) 4_475 4_576 ? O1 S1 Na1 62.41(11) . 4_576 ? O1 S1 Na2 125.92(11) . 4_475 ? O1 S1 O2 106.37(14) . . ? O2 S1 Na1 127.66(10) . 4_576 ? O2 S1 Na2 63.68(10) . 4_475 ? O3 S1 Na1 47.17(10) . 4_576 ? O3 S1 Na2 124.56(11) . 4_475 ? O3 S1 O1 109.14(15) . . ? O3 S1 O2 109.27(13) . . ? O4 S1 Na1 123.02(10) . 4_576 ? O4 S1 Na2 45.61(10) . 4_475 ? O4 S1 O1 109.46(14) . . ? O4 S1 O2 109.09(14) . . ? O4 S1 O3 113.28(15) . . ? Sb2 O1 Na1 88.30(8) 4_576 4_576 ? S1 O1 Na1 90.84(12) . 4_576 ? S1 O1 Sb2 122.69(13) . 4_576 ? Sb1 O2 Na2 88.39(7) 4_475 4_475 ? S1 O2 Na2 89.17(11) . 4_475 ? S1 O2 Sb1 117.52(12) . 4_475 ? Na2 O3 Na1 88.60(9) 1_455 4_576 ? S1 O3 Na1 108.05(13) . 4_576 ? S1 O3 Na2 133.68(14) . 1_455 ? Na1 O4 Na2 91.45(9) . 4_475 ? S1 O4 Na1 136.57(14) . . ? S1 O4 Na2 109.58(12) . 4_475 ? Na1 F1 Na2 96.90(8) . 1_455 ? Sb1 F1 Na1 133.77(10) . . ? Sb1 F1 Na2 123.73(10) . 1_455 ? Sb1 F2 Na1 133.67(11) . 3_666 ? Sb1 F3 Na2 123.64(10) . . ? Sb2 F4 Na2 135.79(10) . 3_766 ? Na2 F5 Na1 96.66(8) . 1_655 ? Sb2 F5 Na1 127.86(10) . 1_655 ? Sb2 F5 Na2 135.40(10) . . ? Sb2 F6 Na1 124.39(10) . . ? 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 Na1 Na2 3.491(2) 4_475 ? Na1 Na2 3.4495(19) 1_455 ? Na1 Sb2 3.7698(13) . ? Na1 S1 3.3231(16) 4_575 ? Na1 O1 2.945(3) 4_575 ? Na1 O3 2.563(3) 4_575 ? Na1 O4 2.385(3) . ? Na1 F1 2.283(2) . ? Na1 F2 2.325(2) 3_666 ? Na1 F5 2.316(2) 1_455 ? Na1 F6 2.308(2) . ? Na2 Sb1 3.7635(13) . ? Na2 S1 3.2817(15) 4_676 ? Na2 O2 2.942(3) 4_676 ? Na2 O3 2.433(3) 1_655 ? Na2 O4 2.489(3) 4_676 ? Na2 F1 2.326(2) 1_655 ? Na2 F3 2.313(2) . ? Na2 F4 2.390(2) 3_766 ? Na2 F5 2.302(2) . ? Sb1 O2 2.431(2) 4_676 ? Sb1 F1 1.9665(18) . ? Sb1 F2 1.9051(19) . ? Sb1 F3 1.9525(18) . ? Sb2 O1 2.441(2) 4_575 ? Sb2 F4 1.9153(19) . ? Sb2 F5 1.9646(19) . ? Sb2 F6 1.9497(18) . ? S1 O1 1.496(2) . ? S1 O2 1.498(2) . ? S1 O3 1.465(2) . ? S1 O4 1.461(2) . ? 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_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion_publ_flag Na1 S1 O1 Sb2 88.53(15) 4_576 . . 4_576 ? Na1 S1 O2 Na2 -170.05(6) 4_576 . . 4_475 ? Na1 S1 O2 Sb1 -82.30(15) 4_576 . . 4_475 ? Na1 S1 O3 Na2 -106.0(2) 4_576 . . 1_455 ? Na1 S1 O4 Na1 54.7(2) 4_576 . . . ? Na1 S1 O4 Na2 169.21(6) 4_576 . . 4_475 ? Na2 S1 O1 Na1 -166.56(6) 4_475 . . 4_576 ? Na2 S1 O1 Sb2 -78.04(17) 4_475 . . 4_576 ? Na2 S1 O2 Sb1 87.75(12) 4_475 . . 4_475 ? Na2 S1 O3 Na1 165.29(6) 4_475 . . 4_576 ? Na2 S1 O3 Na2 59.3(2) 4_475 . . 1_455 ? Na2 S1 O4 Na1 -114.5(2) 4_475 . . . ? O1 S1 O2 Na2 122.47(12) . . . 4_475 ? O1 S1 O2 Sb1 -149.78(14) . . . 4_475 ? O1 S1 O3 Na1 -8.02(16) . . . 4_576 ? O1 S1 O3 Na2 -114.01(19) . . . 1_455 ? O1 S1 O4 Na1 123.8(2) . . . . ? O1 S1 O4 Na2 -121.66(14) . . . 4_475 ? O2 S1 O1 Na1 124.40(11) . . . 4_576 ? O2 S1 O1 Sb2 -147.07(15) . . . 4_576 ? O2 S1 O3 Na1 -123.95(13) . . . 4_576 ? O2 S1 O3 Na2 130.05(18) . . . 1_455 ? O2 S1 O4 Na1 -120.1(2) . . . . ? O2 S1 O4 Na2 -5.64(16) . . . 4_475 ? O3 S1 O1 Na1 6.63(13) . . . 4_576 ? O3 S1 O1 Sb2 95.15(17) . . . 4_576 ? O3 S1 O2 Na2 -119.84(12) . . . 4_475 ? O3 S1 O2 Sb1 -32.09(18) . . . 4_475 ? O3 S1 O4 Na1 1.8(3) . . . . ? O3 S1 O4 Na2 116.29(14) . . . 4_475 ? O4 S1 O1 Na1 -117.87(12) . . . 4_576 ? O4 S1 O1 Sb2 -29.3(2) . . . 4_576 ? O4 S1 O2 Na2 4.50(13) . . . 4_475 ? O4 S1 O2 Sb1 92.25(15) . . . 4_475 ? O4 S1 O3 Na1 114.21(14) . . . 4_576 ? O4 S1 O3 Na2 8.2(2) . . . 1_455 ?