#------------------------------------------------------------------------------ #$Date: 2025-04-03 08:32:21 +0300 (Thu, 03 Apr 2025) $ #$Revision: 298703 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/71/70/7717097.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_7717097 loop_ _publ_author_name 'Mukhopadhyay, Joy' 'Sahoo, Subash C.' 'Bharatam, Prasad V.' _publ_section_title ; (Imidazol-2-ylidene) → S coordination interactions and its modulation upon S-oxidation. ; _journal_issue 41 _journal_name_full 'Dalton transactions (Cambridge, England : 2003)' _journal_page_first 17050 _journal_page_last 17058 _journal_paper_doi 10.1039/d4dt02286f _journal_volume 53 _journal_year 2024 _chemical_formula_moiety 'C F3 O3 S, C12 H13 Cl F N2 O2 S' _chemical_formula_sum 'C13 H13 Cl F4 N2 O5 S2' _chemical_formula_weight 452.82 _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2yn' _space_group_name_H-M_alt 'P 1 21/n 1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_date 2024-03-06 _audit_creation_method ; Olex2 1.5-ac5-024 (compiled 2022.04.12 svn.rca3783a0 for Rigaku Oxford Diffraction, GUI svn.r6498) ; _audit_update_record ; 2024-03-13 deposited with the CCDC. 2024-09-23 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 92.262(4) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 7.7355(4) _cell_length_b 10.8997(5) _cell_length_c 21.2900(10) _cell_measurement_reflns_used 6785 _cell_measurement_temperature 293(2) _cell_measurement_theta_max 25.8210 _cell_measurement_theta_min 3.4190 _cell_volume 1793.66(15) _computing_cell_refinement 'CrysAlisPro 1.171.42.90a (Rigaku OD, 2023)' _computing_data_collection 'CrysAlisPro 1.171.42.90a (Rigaku OD, 2023)' _computing_data_reduction 'CrysAlisPro 1.171.42.90a (Rigaku OD, 2023)' _computing_molecular_graphics 'Olex2 1.5-ac5-024 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.5-ac5-024 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2017/1 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' _diffrn_ambient_temperature 293(2) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_detector_type HyPix3000 _diffrn_measured_fraction_theta_full 0.977 _diffrn_measured_fraction_theta_max 0.922 _diffrn_measurement_details ; List of Runs (angles in degrees, time in seconds): # Type Start End Width t~exp~ \w \q \k \f Frames #-------------------------------------------------------------------------- 1 \w -53.00 -11.00 0.50 17.99 -- -9.32 -23.00 20.00 84 2 \w -4.00 22.00 0.50 17.99 -- -9.32 23.00-174.00 52 3 \w 6.00 76.00 0.50 17.99 -- 9.60 23.00-174.00 140 4 \w -44.00 -19.00 0.50 17.99 -- 9.60 -23.00 20.00 50 5 \w -55.00 -11.00 0.50 17.99 -- -9.32 125.00 120.00 88 6 \w -13.00 12.00 0.50 17.99 -- 9.60 -99.00 -90.00 50 7 \w -39.00 -9.00 0.50 17.99 -- 9.60 -77.00 -90.00 60 8 \w -9.00 39.00 0.50 17.99 -- 9.60 77.00 0.00 96 9 \w -38.00 20.00 0.50 17.99 -- 9.60 -77.00 -60.00 116 10 \w 9.00 34.00 0.50 17.99 -- 9.60-125.00 90.00 50 11 \w -6.00 39.00 0.50 17.99 -- 9.60 77.00 60.00 90 12 \w 25.00 56.00 0.50 17.99 -- 9.60-125.00-180.00 62 13 \w 18.00 56.00 0.50 17.99 -- 9.60-125.00 -30.00 76 14 \w 7.00 32.00 0.50 17.99 -- 9.60-125.00 60.00 50 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'SuperNova, Single source at offset/far, HyPix3000' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 -0.0852093000 _diffrn_orient_matrix_UB_12 -0.0236347000 _diffrn_orient_matrix_UB_13 0.0014377000 _diffrn_orient_matrix_UB_21 0.0299447000 _diffrn_orient_matrix_UB_22 -0.0584584000 _diffrn_orient_matrix_UB_23 -0.0093327000 _diffrn_orient_matrix_UB_31 0.0163495000 _diffrn_orient_matrix_UB_32 -0.0160298000 _diffrn_orient_matrix_UB_33 0.0319769000 _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0597 _diffrn_reflns_av_unetI/netI 0.0607 _diffrn_reflns_Laue_measured_fraction_full 0.977 _diffrn_reflns_Laue_measured_fraction_max 0.922 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_h_min -9 _diffrn_reflns_limit_k_max 13 _diffrn_reflns_limit_k_min -13 _diffrn_reflns_limit_l_max 26 _diffrn_reflns_limit_l_min -27 _diffrn_reflns_number 17191 _diffrn_reflns_point_group_measured_fraction_full 0.977 _diffrn_reflns_point_group_measured_fraction_max 0.922 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.124 _diffrn_reflns_theta_min 3.231 _diffrn_source 'micro-focus sealed X-ray tube' _diffrn_source_type 'SuperNova (Mo) X-ray Source' _exptl_absorpt_coefficient_mu 0.515 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.58054 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.42.90a (Rigaku Oxford Diffraction, 2023) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_crystal_colour colourless _exptl_crystal_colour_primary colourless _exptl_crystal_density_diffrn 1.677 _exptl_crystal_description block _exptl_crystal_F_000 920 _exptl_crystal_size_max 0.011 _exptl_crystal_size_mid 0.008 _exptl_crystal_size_min 0.006 _refine_diff_density_max 0.338 _refine_diff_density_min -0.354 _refine_diff_density_rms 0.060 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.057 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 246 _refine_ls_number_reflns 3648 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.057 _refine_ls_R_factor_all 0.0903 _refine_ls_R_factor_gt 0.0505 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0490P)^2^+0.4144P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1094 _refine_ls_wR_factor_ref 0.1256 _reflns_Friedel_coverage 0.000 _reflns_number_gt 2303 _reflns_number_total 3648 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d4dt02286f2.cif _cod_data_source_block ex-jmso2 _cod_depositor_comments ; Adding full bibliography for 7717095--7717097.cif. 2025-04-02 Z value and formula fixed to values more according to usual chemical conventions. miguel ; _cod_original_formula_sum 'C52 H52 Cl4 F16 N8 O20 S8' _cod_original_formula_weight 1811.29 _cod_original_formula_moiety '4(C F3 O3 S), 4(C12 H13 Cl F N2 O2 S)' _cod_original_formula_units_Z 1 _cod_database_code 7717097 _shelx_shelxl_version_number 2017/1 _chemical_oxdiff_formula 'C H N O Cl F S' _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 ; 1. Fixed Uiso At 1.2 times of: All C(H) groups, All C(H,H) groups At 1.5 times of: All C(H,H,H) groups 2.a Secondary CH2 refined with riding coordinates: C6(H6A,H6B) 2.b Aromatic/amide H refined with riding coordinates: C3(H3), C2(H2), C12(H12), C9(H9), C11(H11) 2.c Idealised Me refined as rotating group: C4(H4A,H4B,H4C), C5(H5A,H5B,H5C) ; _shelx_res_file ; TITL ex-jmso2_a.res in P2(1)/n ex-jmso2.res created by SHELXL-2017/1 at 11:29:45 on 06-Mar-2024 REM Old TITL Ex-JMSO2 in P2(1)/n REM SHELXT solution in P2(1)/n REM R1 0.201, Rweak 0.017, Alpha 0.038, Orientation as input REM Formula found by SHELXT: C14 N2 O5 F3 S Cl2 CELL 0.71073 7.7355 10.8997 21.29 90 92.262 90 ZERR 1 0.0004 0.0005 0.001 0 0.004 0 LATT 1 SYMM 0.5-X,0.5+Y,0.5-Z SFAC C H Cl F N O S UNIT 52 52 4 16 8 20 8 L.S. 15 PLAN 5 list 4 fmap 2 53 ACTA REM REM REM WGHT 0.049000 0.414400 FVAR 0.41077 S2 7 -0.475185 0.873388 0.407146 11.00000 0.04210 0.04592 = 0.04675 -0.00327 0.00027 0.00882 S1 7 0.732727 0.290860 0.377324 11.00000 0.04079 0.04203 = 0.05441 0.01273 -0.00128 0.00608 CL1 3 0.338088 0.228703 0.263012 11.00000 0.10297 0.09996 = 0.07015 -0.02599 -0.03454 0.02015 O2 6 0.772457 0.381190 0.424008 11.00000 0.04986 0.04246 = 0.08439 -0.00432 -0.01145 0.00478 O1 6 0.738875 0.322478 0.312578 11.00000 0.06796 0.07515 = 0.05588 0.03302 0.00425 0.01183 F2 4 -0.324003 0.660732 0.418072 11.00000 0.11528 0.05728 = 0.08717 0.00818 -0.01336 0.03036 F4 4 -0.510885 0.670804 0.343008 11.00000 0.09950 0.07818 = 0.09272 -0.02957 -0.01838 -0.01021 F3 4 -0.265608 0.757309 0.335907 11.00000 0.09471 0.09206 = 0.09272 -0.01170 0.04723 0.01560 N2 5 0.992294 0.158843 0.441752 11.00000 0.03342 0.04222 = 0.04908 0.00731 0.00274 0.00417 O3 6 -0.324462 0.932014 0.434034 11.00000 0.05797 0.05807 = 0.08016 -0.01943 -0.02423 0.01025 O5 6 -0.548733 0.935493 0.353176 11.00000 0.07454 0.05978 = 0.07515 0.00952 -0.02370 0.01776 N1 5 0.930283 0.085355 0.348832 11.00000 0.05288 0.05248 = 0.04345 0.00280 0.00610 0.00713 O4 6 -0.596917 0.830944 0.450564 11.00000 0.08371 0.09930 = 0.08125 -0.00170 0.04395 0.00595 F1 4 0.021909 0.580489 0.354314 11.00000 0.08140 0.08874 = 0.19869 0.05530 0.04360 0.05327 C7 1 0.391580 0.314662 0.381572 11.00000 0.03460 0.04082 = 0.04906 0.00415 0.00223 0.00331 C1 1 0.886632 0.170982 0.390367 11.00000 0.04201 0.04205 = 0.04354 0.01134 0.00290 0.00261 C6 1 0.531506 0.221571 0.392730 11.00000 0.04078 0.04018 = 0.04937 0.00608 -0.00062 0.00379 AFIX 23 H6A 2 0.511763 0.151575 0.365239 11.00000 -1.20000 H6B 2 0.531837 0.193147 0.435910 11.00000 -1.20000 AFIX 0 C13 1 -0.390760 0.733394 0.374207 11.00000 0.06031 0.05093 = 0.04841 -0.00105 0.00079 0.00233 C4 1 0.991640 0.228828 0.500777 11.00000 0.05131 0.05831 = 0.05215 0.00094 -0.01025 0.00276 AFIX 137 H4A 2 1.025162 0.312093 0.493017 11.00000 -1.50000 H4B 2 1.071792 0.192493 0.530916 11.00000 -1.50000 H4C 2 0.877538 0.227595 0.516940 11.00000 -1.50000 AFIX 0 C3 1 1.064862 0.019154 0.374761 11.00000 0.05010 0.05244 = 0.07059 0.00740 0.01266 0.01892 AFIX 43 H3 2 1.120059 -0.046264 0.355934 11.00000 -1.20000 AFIX 0 C2 1 1.103449 0.064562 0.431772 11.00000 0.03771 0.05800 = 0.06703 0.00941 0.00029 0.01338 AFIX 43 H2 2 1.190463 0.036874 0.459651 11.00000 -1.20000 AFIX 0 C8 1 0.298921 0.326019 0.324774 11.00000 0.04367 0.04781 = 0.06072 0.00544 -0.00649 0.00391 C12 1 0.354687 0.395849 0.428972 11.00000 0.05758 0.05980 = 0.05533 -0.00022 0.01441 0.00167 AFIX 43 H12 2 0.415397 0.390231 0.467447 11.00000 -1.20000 AFIX 0 C9 1 0.172380 0.415755 0.315654 11.00000 0.04263 0.07238 = 0.08845 0.02697 -0.00914 0.00384 AFIX 43 H9 2 0.109588 0.422453 0.277650 11.00000 -1.20000 AFIX 0 C10 1 0.143716 0.493125 0.364071 11.00000 0.04998 0.05677 = 0.11980 0.02982 0.03028 0.01775 C11 1 0.229521 0.485193 0.420418 11.00000 0.07507 0.06094 = 0.08713 0.00016 0.03707 0.01408 AFIX 43 H11 2 0.204756 0.538865 0.452809 11.00000 -1.20000 AFIX 0 C5 1 0.843296 0.057853 0.287384 11.00000 0.09470 0.08000 = 0.04713 -0.00436 0.00134 0.00938 AFIX 137 H5A 2 0.723026 0.041518 0.293188 11.00000 -1.50000 H5B 2 0.896123 -0.012753 0.269201 11.00000 -1.50000 H5C 2 0.854241 0.126933 0.259852 11.00000 -1.50000 AFIX 0 HKLF 4 REM ex-jmso2_a.res in P2(1)/n REM R1 = 0.0505 for 2303 Fo > 4sig(Fo) and 0.0903 for all 3648 data REM 246 parameters refined using 0 restraints END WGHT 0.0490 0.4144 REM Highest difference peak 0.338, deepest hole -0.354, 1-sigma level 0.060 Q1 1 -0.4181 0.7365 0.3172 11.00000 0.05 0.34 Q2 1 -0.3898 0.7996 0.3022 11.00000 0.05 0.31 Q3 1 -0.4720 0.7957 0.4665 11.00000 0.05 0.25 Q4 1 0.9503 0.0549 0.2524 11.00000 0.05 0.23 Q5 1 0.5548 0.2389 0.4640 11.00000 0.05 0.23 ; _shelx_res_checksum 99779 _shelx_hkl_file ; 0 0 4 9287.67 474.21 0 0 -4 9811.22 474.34 0 0 -4 9999.00 474.68 0 0 4 9888.98 474.77 0 0 -4 8498.23 472.60 0 0 5 0.43 1.54 0 0 -5 -0.84 1.26 0 0 5 -1.54 1.75 0 0 -5 0.48 1.32 0 0 -5 0.84 0.64 0 0 6 970.82 53.88 0 0 -6 949.34 53.80 0 0 6 961.60 54.56 0 0 -6 983.21 54.35 0 0 -6 1008.09 51.92 0 0 -7 -0.58 1.67 0 0 7 1.19 1.40 0 0 -7 1.32 1.55 0 0 7 1.45 1.90 0 0 -7 0.49 0.64 0 0 8 17.61 3.40 0 0 -8 16.53 3.19 0 0 -8 11.26 2.88 0 0 8 8.30 2.59 0 0 -8 17.12 2.08 0 0 9 -0.76 1.89 0 0 -9 0.74 1.94 0 0 9 0.94 2.06 0 0 -9 0.84 1.70 0 0 -9 0.32 0.65 0 0 10 168.33 13.70 0 0 -10 202.97 14.40 0 0 -10 174.08 11.42 0 0 10 183.22 15.02 0 0 -10 181.37 14.42 0 0 -11 -0.89 2.22 0 0 -11 0.40 0.82 0 0 -11 -0.66 1.55 0 0 11 1.16 2.36 0 0 -11 1.01 1.68 0 0 -12 160.76 14.01 0 0 -12 175.07 11.80 0 0 -12 189.35 13.54 0 0 -12 191.18 15.33 0 0 12 165.06 15.48 0 0 -13 -1.03 2.57 0 0 -13 -0.49 1.08 0 0 -13 -0.78 1.59 0 0 -13 1.17 2.18 0 0 13 1.38 2.56 0 0 -14 41.80 6.39 0 0 -14 32.97 4.14 0 0 -14 35.54 5.26 0 0 -14 16.27 4.68 0 0 14 34.28 6.84 0 0 15 1.60 2.97 0 0 -15 -1.33 2.21 0 0 -15 0.59 1.30 0 0 -15 -0.91 1.85 0 0 -15 -1.16 2.37 0 0 -15 2.85 2.90 0 0 16 68.32 10.34 0 0 -16 68.72 9.43 0 0 -16 81.54 8.72 0 0 -16 80.51 7.30 0 0 -16 67.58 9.12 0 0 -16 68.15 10.07 0 0 17 -1.82 3.99 0 0 -17 1.40 1.84 0 0 -17 -2.58 2.83 0 0 -17 -1.60 2.66 0 0 -17 1.03 2.58 0 0 18 7.71 4.25 0 0 -18 5.39 3.37 0 0 19 4.07 4.15 0 0 20 2.14 5.03 0 0 21 -2.25 3.73 0 0 -23 2.90 4.17 0 0 -24 6.14 6.75 0 0 -25 -3.23 5.37 0 0 -26 6.77 6.30 0 0 -27 3.54 5.09 0 1 -3 199.92 10.81 0 -1 3 205.33 10.82 0 1 3 202.24 10.80 0 -1 -3 200.24 10.79 0 -1 3 193.69 11.61 0 1 -3 196.57 11.65 0 1 3 194.28 12.13 0 1 -3 189.62 12.30 0 -1 -3 194.91 12.05 0 1 3 194.32 12.33 0 -1 -3 200.95 12.35 0 -1 -3 188.02 12.44 0 -1 3 203.50 12.06 0 1 -3 209.01 12.22 0 -1 -3 197.13 11.01 0 1 3 212.72 10.94 0 -1 -3 207.16 10.80 0 1 3 196.00 10.77 0 1 -3 206.81 10.79 0 -1 4 176.96 9.42 0 1 -4 185.34 9.42 0 -1 -4 171.84 9.38 0 1 4 181.83 9.42 0 1 4 199.76 9.44 0 1 -4 186.07 9.39 0 1 -4 197.56 10.80 0 1 -4 174.86 11.73 0 1 -4 182.10 11.46 0 1 4 159.02 11.05 0 -1 -4 183.31 11.16 0 1 -4 181.47 11.26 0 1 4 163.85 11.62 0 -1 -4 195.13 12.02 0 -1 -4 191.90 11.58 0 -1 -5 32.18 2.12 0 1 -5 35.86 2.15 0 1 5 33.33 2.18 0 1 -5 34.18 2.13 0 -1 -5 31.24 2.66 0 1 -5 27.70 3.95 0 1 -5 32.64 3.33 0 1 5 31.91 4.22 0 -1 -5 36.09 3.86 0 1 5 33.95 3.83 0 1 -5 27.79 3.63 0 -1 -5 37.96 4.51 0 1 5 32.53 4.30 0 -1 -5 29.99 3.83 0 1 6 31.10 2.12 0 1 -6 32.53 2.05 0 1 -6 29.51 2.70 0 1 -6 31.13 2.01 0 -1 -6 29.33 2.72 0 1 -6 37.34 3.61 0 1 -6 30.45 4.24 0 1 6 35.64 4.54 0 1 6 23.36 3.52 0 -1 -6 28.89 3.75 0 -1 -6 35.72 4.33 0 -1 -6 29.35 4.27 0 1 7 138.63 10.66 0 1 -7 124.61 10.36 0 1 -7 131.36 9.04 0 -1 7 117.53 10.28 0 1 -7 115.09 9.64 0 1 7 111.69 9.52 0 -1 -7 119.17 9.50 0 -1 -7 127.42 7.90 0 1 -7 142.71 8.12 0 1 -7 119.27 6.81 0 -1 -7 119.63 10.18 0 -1 -7 120.73 9.82 0 1 -8 897.90 46.47 0 -1 8 765.90 48.12 0 1 8 788.56 48.20 0 1 -8 862.72 48.42 0 -1 -8 823.30 47.06 0 1 -8 826.27 47.54 0 1 8 859.18 47.53 0 1 -8 833.37 44.86 0 -1 -8 837.71 44.80 0 1 -8 845.22 43.79 0 -1 -8 770.28 47.93 0 -1 -8 825.17 47.44 0 1 -9 56.82 4.66 0 -1 -9 56.52 4.65 0 1 -9 56.01 5.61 0 1 -9 51.42 6.59 0 1 9 50.21 6.74 0 -1 9 57.86 7.23 0 -1 -9 45.07 6.26 0 1 9 50.51 6.20 0 -1 -9 55.73 6.24 0 1 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14 281.67 23.51 0 1 -14 273.50 22.55 0 -1 -14 341.33 24.20 0 -1 -14 295.78 22.15 0 1 15 17.87 5.42 0 1 -15 1.37 2.34 0 1 -15 8.35 3.03 0 -1 -15 14.37 3.69 0 1 15 20.53 5.13 0 1 -15 14.67 4.34 0 1 -15 9.92 2.52 0 -1 -15 10.90 2.66 0 -1 -15 14.76 4.25 0 -1 -15 20.22 5.25 0 -1 -15 8.42 3.77 0 1 -16 151.92 11.35 0 -1 -16 152.25 11.48 0 1 16 144.29 14.34 0 1 -16 140.37 13.95 0 -1 -16 150.76 13.99 0 1 -16 147.08 12.95 0 -1 -16 148.52 12.90 0 1 -16 165.15 12.89 0 1 16 136.02 15.48 0 1 -16 145.07 14.73 0 -1 -16 133.05 13.63 0 -1 -16 140.26 14.91 0 1 17 35.28 7.65 0 1 -17 21.36 5.79 0 1 -17 21.56 4.43 0 -1 -17 23.46 4.94 0 1 -17 27.56 5.20 0 1 -17 31.08 6.16 0 -1 -17 22.57 4.06 0 1 -17 21.94 3.92 0 -1 -17 25.07 5.64 0 -1 -17 12.83 4.95 0 -1 -17 33.32 6.56 0 1 18 327.00 28.12 0 1 -18 365.50 29.36 0 -1 -18 371.39 26.61 0 -1 -18 346.69 23.00 0 -1 -18 371.86 26.14 0 1 -18 329.00 25.92 0 1 19 52.13 10.35 0 1 -19 89.34 12.98 0 1 -19 64.64 9.42 0 1 -20 11.71 6.16 0 1 20 6.57 4.48 0 1 -21 10.03 5.56 0 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165.90 9.97 0 3 -3 1680.50 87.62 0 -3 3 1672.47 87.42 0 -3 3 1636.99 87.12 0 3 -3 1632.64 89.07 0 -3 3 1597.36 88.89 0 3 -3 1671.20 86.27 0 3 3 1653.26 86.28 0 -3 3 1533.02 88.69 0 -3 3 1562.67 88.15 0 3 3 1708.22 86.42 0 3 -3 1751.90 86.45 0 -3 3 1612.64 86.28 0 -3 -3 1636.06 86.27 0 3 -4 85.03 5.31 0 -3 4 74.49 5.15 0 3 4 86.39 5.33 0 -3 -4 77.16 5.14 0 -3 4 88.15 6.48 0 3 -4 73.12 6.17 0 -3 4 70.69 5.83 0 -3 4 62.95 6.74 0 3 -4 93.51 7.87 0 3 -4 62.14 4.91 0 3 4 80.95 4.49 0 3 4 76.83 5.13 0 -3 4 62.64 6.70 0 3 -4 72.27 6.71 0 -3 4 76.96 6.71 0 3 4 97.76 7.96 0 3 5 15.48 1.70 0 3 -5 14.02 1.65 0 -3 -5 9.32 1.39 0 -3 5 14.30 1.66 0 3 -5 4.95 1.73 0 3 -5 10.18 2.76 0 -3 5 10.97 2.02 0 3 -5 6.83 1.90 0 -3 -5 10.38 1.60 0 3 5 14.20 1.24 0 3 5 12.77 1.55 0 3 -5 11.37 1.48 0 -3 5 8.38 2.59 0 3 -5 19.67 3.56 0 -3 5 8.79 2.45 0 -3 5 16.65 2.81 0 3 -5 7.80 2.30 0 3 5 10.03 2.66 0 3 6 629.61 32.78 0 -3 6 610.76 32.69 0 -3 -6 642.21 32.72 0 3 -6 648.70 32.78 0 3 -6 606.70 34.54 0 -3 6 627.61 34.26 0 3 -6 653.40 36.77 0 3 -6 632.13 34.57 0 3 -6 549.94 32.53 0 3 6 591.73 32.63 0 -3 6 589.08 36.17 0 3 6 648.22 35.86 0 3 -6 631.37 36.26 0 -3 6 627.40 35.17 0 3 -6 565.60 35.38 0 3 6 564.47 36.10 0 -3 -6 592.47 33.06 0 3 6 591.69 36.93 0 -3 -7 290.80 15.87 0 3 7 290.96 15.98 0 3 -7 272.87 15.84 0 3 -7 262.31 17.62 0 -3 7 297.88 17.69 0 3 -7 304.14 18.04 0 3 -7 275.91 19.49 0 3 -7 301.13 16.59 0 3 -7 280.28 15.83 0 3 7 267.16 15.78 0 3 -7 280.56 19.31 0 3 7 286.90 18.98 0 -3 7 223.68 17.65 0 3 -7 289.86 19.11 0 -3 -7 299.34 16.60 0 3 7 324.24 20.89 0 -3 -7 283.74 19.03 0 3 7 273.05 19.43 0 3 8 298.81 17.20 0 3 -8 312.18 17.19 0 3 -8 291.12 19.25 0 3 -8 309.49 21.31 0 3 -8 315.70 19.51 0 3 -8 323.65 17.99 0 3 -8 302.10 17.09 0 3 -8 309.72 20.95 0 3 8 330.76 20.98 0 3 -8 319.39 20.93 0 -3 -8 308.42 20.78 0 3 8 276.05 21.55 0 3 8 299.46 21.25 0 -3 -8 298.12 17.89 0 3 -9 17.05 2.01 0 3 9 17.71 2.09 0 3 -9 27.36 5.15 0 3 -9 19.79 3.39 0 3 -9 21.24 3.60 0 3 -9 19.06 2.09 0 -3 -9 16.58 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3.05 0 4 3 32.72 3.04 0 -4 3 39.42 4.71 0 4 -3 30.86 3.03 0 4 3 40.24 3.33 0 -4 3 29.51 2.94 0 -4 -3 34.89 3.08 0 -4 4 194.56 12.31 0 4 -4 136.10 11.74 0 -4 4 178.29 13.64 0 4 -4 181.04 13.88 0 -4 4 189.93 11.85 0 4 4 192.27 11.03 0 4 -4 194.64 10.98 0 -4 4 157.52 13.30 0 -4 4 191.70 13.18 0 4 -4 148.22 10.72 0 -4 -4 187.73 10.94 0 -4 4 178.42 10.90 0 4 4 207.13 11.26 0 4 -5 414.54 22.69 0 4 5 423.26 22.77 0 -4 5 401.51 22.55 0 -4 -5 398.00 22.49 0 4 -5 406.08 24.37 0 4 -5 463.00 26.91 0 -4 5 375.67 23.44 0 -4 5 400.24 25.86 0 4 5 400.96 22.53 0 4 -5 414.11 22.57 0 -4 5 365.84 25.62 0 -4 5 405.15 24.96 0 4 5 403.42 26.22 0 4 6 320.28 17.65 0 -4 6 292.17 17.37 0 -4 -6 312.73 17.52 0 4 -6 329.58 17.66 0 4 -6 298.01 19.29 0 -4 6 299.99 18.62 0 4 -6 354.24 21.87 0 -4 6 285.70 20.59 0 4 6 293.38 17.37 0 4 -6 298.20 17.35 0 -4 6 295.58 20.88 0 4 -6 272.29 19.91 0 -4 6 321.31 20.02 0 4 6 312.57 21.32 0 4 7 72.75 5.31 0 4 -7 71.27 5.28 0 -4 -7 66.52 5.11 0 4 -7 75.07 6.92 0 -4 7 57.78 5.94 0 4 -7 74.68 8.37 0 4 7 67.36 5.15 0 4 -7 80.05 5.64 0 4 -7 68.04 5.08 0 -4 7 78.37 8.36 0 4 7 81.40 8.14 0 -4 7 67.27 6.96 0 4 -7 54.28 6.90 0 4 7 66.06 8.44 0 4 7 67.52 8.02 0 4 8 1401.27 74.21 0 4 -8 1425.76 74.17 0 -4 -8 1386.15 73.97 0 4 -8 1282.73 76.21 0 -4 8 1474.39 76.23 0 4 -8 1458.45 76.71 0 4 -8 1525.57 79.78 0 4 8 1315.60 73.93 0 4 -8 1454.79 74.69 0 4 -8 1415.81 74.00 0 -4 8 1355.00 78.67 0 4 8 1337.34 77.91 0 4 -8 1416.86 78.68 0 4 -8 1455.08 78.42 0 -4 8 1357.34 76.97 0 4 8 1498.92 79.66 0 -4 -8 1440.54 74.72 0 4 8 1460.59 80.34 0 4 -9 57.19 4.38 0 4 9 50.03 4.30 0 4 -9 41.21 5.45 0 4 -9 30.73 5.93 0 4 -9 54.81 6.07 0 4 -9 50.67 4.16 0 4 -9 60.49 4.90 0 4 -9 36.69 6.06 0 4 9 50.93 6.74 0 4 -9 59.82 7.23 0 4 9 36.37 6.43 0 4 9 54.18 7.85 0 -4 -9 53.41 4.84 0 4 -10 45.72 4.11 0 4 10 46.46 4.25 0 4 -10 54.39 6.05 0 4 -10 54.13 6.18 0 4 -10 48.79 7.31 0 4 -10 55.83 4.87 0 4 -10 47.27 6.95 0 4 -10 43.96 6.77 0 4 10 42.35 6.61 0 4 10 56.86 7.85 0 -4 -10 47.36 6.63 0 4 10 59.20 8.38 0 -4 -10 42.89 4.76 0 4 -11 390.67 21.09 0 4 11 322.99 20.79 0 4 -11 352.89 23.44 0 4 -11 443.78 28.24 0 4 -11 421.50 27.35 0 4 -11 439.67 24.83 0 4 -11 343.94 21.62 0 4 -11 370.22 25.83 0 4 11 355.85 25.29 0 4 -11 371.57 25.97 0 -4 -11 345.21 24.94 0 4 11 363.74 27.29 0 -4 -11 370.58 22.16 0 4 -12 158.57 10.36 0 4 -12 184.96 16.56 0 4 -12 174.62 13.08 0 4 12 176.51 15.69 0 4 -12 161.05 13.23 0 4 -12 176.03 15.76 0 4 -12 158.36 11.20 0 4 -12 141.79 13.94 0 4 12 141.91 13.94 0 4 -12 164.85 15.02 0 -4 -12 164.50 11.61 0 -4 -12 155.75 14.14 0 4 12 143.50 15.30 0 4 -13 21.29 4.07 0 4 13 29.80 6.27 0 4 -13 20.24 5.58 0 4 -13 23.87 5.63 0 4 -13 25.85 4.94 0 4 -13 21.76 3.35 0 4 -13 22.93 5.17 0 4 13 16.38 4.67 0 4 -13 16.73 4.88 0 -4 -13 8.41 3.87 0 4 13 24.75 6.06 0 4 14 14.42 4.85 0 4 -14 10.76 3.24 0 4 -14 6.50 3.64 0 4 -14 20.46 4.47 0 4 -14 12.71 5.16 0 4 -14 17.06 3.05 0 4 14 13.40 4.64 0 4 -14 10.78 3.94 0 4 -14 21.28 5.55 0 -4 -14 16.43 4.38 0 4 -15 75.46 8.79 0 4 -15 95.47 12.24 0 4 15 95.91 12.20 0 4 -15 89.38 9.78 0 4 -15 90.54 7.91 0 4 -15 96.07 12.03 0 4 15 95.28 11.20 0 4 -15 76.04 10.91 0 4 -15 95.71 11.31 0 4 -15 95.91 11.92 0 -4 -15 62.23 9.40 0 4 -16 202.33 16.17 0 4 -16 158.32 17.20 0 4 -16 169.45 17.15 0 4 16 174.24 16.71 0 4 16 182.98 18.15 0 4 -16 154.10 17.10 0 4 17 7.91 4.17 0 4 -17 7.50 4.42 0 4 17 5.83 4.58 0 4 -17 5.81 4.27 0 4 18 8.30 4.16 0 4 -18 13.77 5.68 0 4 18 12.34 5.15 0 4 -18 6.27 4.62 0 4 19 3.48 4.09 0 4 -19 6.16 4.18 0 4 19 8.67 4.76 0 4 -19 -2.25 4.57 0 4 -20 27.79 7.44 0 4 20 20.54 6.70 0 4 -20 36.16 10.29 0 4 21 2.38 4.43 0 4 -21 4.44 4.12 0 4 22 7.46 5.06 0 4 -22 4.58 5.38 0 4 23 7.74 5.26 0 4 -23 9.45 5.56 0 4 24 8.02 5.90 0 4 -24 19.44 7.30 0 4 25 8.26 6.06 0 5 0 0.31 0.83 0 -5 0 0.82 1.92 0 -5 0 -0.44 1.31 0 5 0 -0.70 0.87 0 -5 0 -0.32 0.87 0 5 -1 206.02 12.18 0 5 1 188.71 12.06 0 -5 1 175.89 14.39 0 -5 -1 225.93 15.41 0 -5 1 178.40 12.65 0 -5 1 208.50 12.22 0 5 1 213.08 12.44 0 -5 -1 198.23 12.13 0 5 -1 182.81 12.15 0 5 -2 5.32 1.40 0 5 2 6.03 1.42 0 -5 2 3.39 2.24 0 -5 2 3.66 1.49 0 -5 2 7.99 1.61 0 5 2 6.66 1.45 0 -5 -2 3.48 1.23 0 5 -2 4.84 1.40 0 -5 3 574.75 33.09 0 5 -3 538.81 35.81 0 -5 3 574.67 35.51 0 -5 3 599.76 32.83 0 5 3 610.28 32.12 0 5 -3 598.78 32.01 0 -5 3 534.83 34.42 0 5 -3 597.28 32.19 0 5 3 608.79 32.30 0 -5 -3 569.67 31.92 0 -5 3 537.66 31.82 0 -5 4 150.84 10.56 0 5 -4 148.99 12.69 0 -5 4 149.10 10.10 0 -5 4 144.14 12.37 0 5 -4 135.29 9.14 0 5 4 137.96 9.21 0 -5 4 168.13 12.98 0 -5 4 126.87 11.27 0 5 4 134.92 9.34 0 -5 -4 141.23 9.20 0 -5 4 125.81 9.04 0 5 -4 156.73 9.57 0 5 -5 303.46 17.05 0 -5 5 261.98 16.65 0 -5 -5 278.96 16.72 0 5 5 284.11 17.01 0 -5 5 316.57 18.71 0 5 -5 308.98 21.08 0 -5 5 263.91 19.97 0 -5 5 288.76 17.78 0 5 5 284.44 16.80 0 5 -5 301.16 16.85 0 -5 5 286.49 20.51 0 -5 5 281.14 19.35 0 5 5 256.52 20.30 0 -5 6 0.98 0.94 0 5 6 1.83 1.01 0 -5 -6 0.97 1.00 0 5 -6 -0.35 0.93 0 5 -6 1.39 1.63 0 -5 6 1.54 1.28 0 5 -6 -1.07 1.78 0 5 6 0.99 1.06 0 5 -6 0.96 1.06 0 5 -6 0.63 0.82 0 -5 6 1.98 2.47 0 -5 6 -1.03 1.72 0 -5 6 1.57 1.84 0 5 6 1.09 2.22 0 -5 -7 145.15 9.51 0 5 7 149.07 9.84 0 5 -7 154.83 9.85 0 5 -7 162.53 11.99 0 -5 7 155.16 10.88 0 5 -7 147.98 13.29 0 -5 7 123.33 12.28 0 5 7 131.96 9.54 0 5 -7 154.59 9.64 0 5 -7 155.31 9.75 0 -5 7 121.01 12.37 0 -5 7 136.32 11.72 0 5 7 138.78 13.27 0 5 8 419.22 23.87 0 5 -8 425.70 23.81 0 -5 8 405.30 25.10 0 5 -8 402.41 25.99 0 5 -8 424.08 28.51 0 5 -8 408.14 23.54 0 5 8 388.02 23.45 0 5 -8 429.70 23.93 0 -5 8 405.94 28.15 0 5 8 424.96 27.86 0 -5 8 423.08 26.49 0 5 -8 421.57 27.43 0 5 8 419.48 28.65 0 5 8 459.24 30.00 0 5 9 1.18 1.04 0 5 -9 0.76 0.94 0 5 -9 2.35 2.15 0 5 -9 -1.25 2.32 0 -5 9 -0.65 1.33 0 5 -9 2.89 1.37 0 5 -9 0.34 0.89 0 -5 9 1.21 2.01 0 5 9 -1.08 1.80 0 5 -9 2.09 2.30 0 -5 9 -0.83 1.38 0 5 9 1.44 2.67 0 5 9 -1.28 2.61 0 5 -10 45.34 4.36 0 5 10 39.82 4.22 0 5 -10 47.26 5.92 0 5 -10 41.37 7.03 0 5 -10 51.74 4.80 0 5 10 37.45 6.32 0 5 -10 52.04 7.21 0 5 10 53.50 8.45 0 -5 10 49.48 6.29 0 5 10 35.27 6.68 0 5 11 10.20 2.15 0 5 -11 12.32 2.20 0 5 -11 13.58 3.37 0 5 -11 16.88 3.74 0 5 -11 8.55 3.61 0 5 -11 14.66 2.64 0 5 -11 13.64 4.53 0 5 -11 13.49 3.99 0 5 11 7.20 3.21 0 5 11 33.99 6.88 0 5 11 11.44 4.64 0 5 12 -0.44 1.25 0 5 -12 -0.43 1.14 0 5 -12 3.16 3.47 0 5 -12 -0.89 2.08 0 5 -12 -0.95 2.24 0 5 -12 -1.52 2.52 0 5 -12 1.06 1.32 0 5 -12 -1.30 3.05 0 5 12 2.53 2.78 0 5 -12 1.33 2.92 0 5 12 -5.11 3.46 0 5 12 1.50 3.30 0 5 -13 30.50 5.11 0 5 -13 29.93 7.09 0 5 -13 27.42 5.24 0 5 -13 22.55 6.04 0 5 -13 33.11 4.28 0 5 -13 38.14 6.79 0 5 -13 34.59 6.75 0 5 13 28.00 5.97 0 5 13 43.00 8.17 0 5 -14 113.58 13.54 0 5 14 91.02 11.59 0 5 -14 80.10 9.11 0 5 -14 101.60 10.42 0 5 -14 95.51 12.31 0 5 -14 107.22 8.61 0 5 -14 79.99 10.78 0 5 14 81.32 10.55 0 5 -14 109.12 12.47 0 5 14 88.54 12.37 0 5 -15 5.42 3.69 0 5 -15 4.59 3.32 0 5 15 14.74 4.76 0 5 -15 10.13 4.45 0 5 15 8.66 5.00 0 5 -16 1.90 3.86 0 5 -16 1.83 2.63 0 5 16 -1.84 3.74 0 5 16 -1.55 3.40 0 5 -17 4.00 3.33 0 5 -17 9.85 4.91 0 5 17 6.48 4.26 0 5 17 1.95 3.25 0 5 18 13.55 5.12 0 5 18 10.30 4.90 0 5 -18 27.20 7.41 0 5 19 2.17 4.03 0 5 -19 4.37 4.80 0 5 20 40.95 9.15 0 5 -20 49.87 10.05 0 5 21 4.76 5.23 0 5 -21 4.70 5.52 0 5 22 2.48 4.61 0 5 -22 -2.42 4.93 0 5 23 10.32 6.08 0 5 -23 9.98 6.23 0 5 24 -2.67 4.95 0 5 -24 2.56 5.21 0 6 0 11.41 2.10 0 -6 0 14.49 3.72 0 -6 0 14.38 2.53 0 6 0 13.68 2.29 0 -6 0 7.20 1.76 0 6 -1 32.31 3.39 0 6 1 37.79 3.62 0 -6 1 25.43 4.87 0 -6 -1 23.12 4.60 0 -6 1 22.13 3.29 0 -6 -1 23.86 3.01 0 6 1 29.19 3.43 0 6 -1 29.12 3.40 0 -6 1 23.52 3.02 0 6 2 158.48 8.23 0 6 2 160.64 10.20 0 6 -2 164.81 10.24 0 -6 2 135.60 12.64 0 -6 -2 155.37 13.10 0 -6 2 140.60 10.73 0 -6 -2 123.82 9.70 0 6 2 150.05 10.32 0 6 -2 146.54 10.24 0 -6 2 136.53 9.88 0 -6 3 0.57 1.15 0 -6 3 1.46 1.21 0 -6 3 1.03 1.91 0 6 -3 -0.24 0.66 0 6 -3 2.26 0.99 0 6 3 1.55 1.12 0 -6 3 0.90 1.98 0 -6 -3 0.38 0.94 0 6 3 0.44 1.15 0 6 -3 1.27 1.00 0 -6 3 0.76 1.10 0 -6 4 88.26 7.28 0 -6 4 73.34 6.45 0 -6 4 70.79 8.57 0 6 -4 73.64 8.96 0 6 -4 76.27 5.89 0 6 4 62.74 5.61 0 6 -4 70.67 5.26 0 -6 4 74.61 8.80 0 -6 4 67.83 7.79 0 6 -4 69.16 5.88 0 -6 4 64.47 5.64 0 -6 -4 64.27 5.59 0 6 4 79.01 6.25 0 -6 5 479.22 26.52 0 6 -5 418.28 29.04 0 -6 5 413.57 25.25 0 -6 5 420.65 28.59 0 6 -5 432.13 24.49 0 6 -5 437.31 24.03 0 6 5 459.82 24.73 0 -6 5 373.26 28.10 0 -6 5 447.10 27.88 0 -6 -5 427.68 24.47 0 6 -5 444.60 24.88 0 -6 5 398.12 24.28 0 6 5 390.37 24.59 0 6 6 26.31 5.47 0 6 -6 23.67 5.44 0 -6 6 21.44 4.87 0 -6 6 34.87 4.15 0 6 6 23.19 3.09 0 6 -6 27.20 3.03 0 6 -6 32.56 3.44 0 -6 6 28.60 5.58 0 -6 6 30.09 5.03 0 6 6 24.01 3.19 0 -6 -6 22.18 2.96 0 6 -6 25.77 3.30 0 6 7 60.28 5.71 0 6 -7 67.26 5.84 0 -6 7 57.90 6.15 0 6 -7 65.47 8.67 0 -6 7 79.58 9.11 0 6 -7 67.40 5.50 0 6 7 67.57 5.72 0 6 -7 69.39 5.67 0 -6 7 62.20 8.38 0 -6 7 68.23 7.78 0 6 7 75.34 9.66 0 6 -8 88.41 6.77 0 6 8 75.96 6.63 0 -6 8 70.52 7.06 0 6 -8 76.55 8.17 0 6 -8 70.47 9.45 0 -6 8 74.88 9.18 0 6 -8 71.84 6.14 0 6 -8 88.39 6.54 0 -6 8 63.32 8.91 0 -6 8 90.40 8.87 0 6 8 87.14 10.35 0 6 -9 217.85 14.00 0 6 9 194.68 13.83 0 -6 9 211.30 15.09 0 6 -9 229.53 16.55 0 6 -9 197.66 17.94 0 6 -9 234.57 14.04 0 6 -9 217.90 13.64 0 -6 9 203.93 18.04 0 6 9 213.64 17.69 0 -6 9 205.98 16.13 0 6 9 224.03 19.56 0 6 9 223.77 18.79 0 6 -10 77.67 6.81 0 6 10 79.28 6.92 0 6 -10 81.29 8.78 0 6 -10 73.71 10.16 0 6 -10 90.97 7.18 0 -6 10 82.81 10.38 0 6 10 88.01 10.17 0 -6 10 89.42 9.00 0 6 10 81.49 10.75 0 6 10 94.70 12.01 0 6 11 24.01 3.49 0 6 -11 23.60 3.44 0 6 -11 27.41 6.08 0 6 -11 20.02 4.60 0 6 -11 33.91 3.98 0 6 11 23.78 5.75 0 6 -11 30.37 6.27 0 6 11 28.42 6.89 0 6 11 25.27 6.43 0 6 12 16.78 2.96 0 6 -12 18.90 3.18 0 6 -12 32.47 5.34 0 6 -12 25.79 6.23 0 6 -12 33.85 4.10 0 6 -12 17.65 5.03 0 6 12 22.04 5.35 0 6 12 11.18 5.01 0 6 12 26.48 6.39 0 6 -13 145.33 15.54 0 6 -13 124.14 11.88 0 6 -13 144.84 15.20 0 6 -13 130.48 10.28 0 6 13 124.77 13.56 0 6 -13 139.08 14.19 0 6 13 134.60 14.81 0 6 13 109.19 14.49 0 6 14 26.87 6.25 0 6 -14 26.83 6.72 0 6 -14 36.06 7.92 0 6 14 28.46 7.88 0 6 -15 61.09 10.28 0 6 15 59.07 9.31 0 6 15 80.60 11.98 0 6 15 54.68 9.57 0 6 -16 -2.01 3.73 0 6 16 6.47 4.24 0 6 16 2.21 4.49 0 6 16 1.87 3.80 0 6 -17 46.31 9.37 0 6 17 53.25 9.82 0 6 17 38.62 7.85 0 6 18 -4.15 4.22 0 6 -18 6.63 4.49 0 6 19 26.12 8.01 0 6 -19 32.19 8.45 0 6 20 -2.28 4.63 0 6 -20 2.39 4.43 0 6 21 -2.38 4.84 0 6 -21 -2.47 5.03 0 6 22 -2.47 4.59 0 6 -22 10.19 6.35 0 6 23 15.39 7.10 0 6 -23 13.09 6.56 0 6 24 -2.66 5.84 0 6 -24 -2.67 4.96 0 7 0 0.89 1.04 0 -7 0 1.11 1.85 0 -7 0 -0.54 1.36 0 -7 0 -0.44 1.20 0 7 0 1.02 1.03 0 7 1 2.70 1.18 0 7 -1 1.76 1.27 0 -7 -1 -1.10 2.59 0 -7 1 -3.38 2.47 0 -7 -1 3.80 2.25 0 -7 1 -0.56 1.54 0 -7 1 1.75 1.21 0 7 -1 3.03 1.45 0 -7 -1 2.19 1.41 0 7 1 2.59 1.42 0 7 2 136.48 9.80 0 7 -2 123.57 9.56 0 -7 -2 130.42 12.66 0 -7 2 120.37 12.49 0 -7 2 159.45 10.94 0 7 2 167.39 10.68 0 -7 2 137.30 9.73 0 -7 -2 133.24 9.66 0 7 -2 144.76 10.16 0 -7 3 29.73 4.15 0 -7 3 15.29 4.40 0 -7 3 19.54 3.20 0 -7 -3 15.60 4.18 0 7 3 24.96 3.25 0 7 -3 18.65 2.92 0 -7 3 19.64 4.67 0 7 -3 38.29 4.06 0 7 3 16.71 2.86 0 -7 -3 18.36 2.84 0 -7 3 25.05 3.22 0 -7 4 10.73 2.76 0 -7 4 16.92 3.00 0 -7 4 14.62 4.38 0 7 4 19.83 2.97 0 7 -4 15.10 2.57 0 7 -4 19.47 2.38 0 -7 4 24.82 5.49 0 -7 4 12.57 3.79 0 7 4 22.34 3.21 0 -7 -4 20.56 2.97 0 7 -4 15.83 2.76 0 -7 5 111.55 9.28 0 -7 5 131.95 12.75 0 7 -5 128.68 13.38 0 7 -5 124.33 9.04 0 7 -5 121.50 8.35 0 7 5 124.73 9.09 0 -7 5 121.55 12.81 0 -7 5 138.62 12.19 0 7 -5 124.58 9.31 0 7 5 119.22 9.33 0 7 6 93.70 11.60 0 -7 6 103.74 11.34 0 7 -6 121.78 12.72 0 -7 6 106.47 8.77 0 7 -6 121.71 7.98 0 7 6 96.70 8.04 0 7 -6 104.52 8.11 0 -7 6 126.68 12.68 0 -7 6 87.19 9.97 0 7 6 108.19 8.60 0 7 -6 113.12 8.57 0 -7 7 54.68 5.77 0 -7 7 46.34 7.51 0 7 -7 51.14 8.31 0 7 -7 56.57 4.96 0 7 -7 55.67 5.22 0 7 7 50.58 5.07 0 -7 7 49.05 8.09 0 7 7 56.76 5.63 0 7 -7 44.73 5.10 0 7 7 57.98 9.05 0 7 -8 31.41 6.44 0 -7 8 23.19 3.83 0 7 -8 21.05 3.18 0 7 -8 22.45 3.17 0 -7 8 24.73 6.03 0 -7 8 22.32 5.24 0 7 -8 28.38 3.70 0 7 8 18.85 3.32 0 7 8 20.19 5.59 0 -7 9 75.91 7.51 0 7 -9 90.82 11.06 0 7 -9 76.37 6.55 0 -7 9 74.82 9.78 0 -7 9 63.08 9.60 0 7 9 67.77 10.12 0 7 9 67.76 10.40 0 7 9 74.74 6.84 0 7 -9 72.94 6.73 0 7 10 20.34 6.22 0 7 10 28.47 6.74 0 7 -10 11.14 4.49 0 -7 10 18.97 3.70 0 -7 10 17.08 5.25 0 7 -10 23.50 3.45 0 7 10 28.69 6.38 0 7 -10 19.93 3.51 0 7 10 16.11 3.17 0 7 11 -1.74 3.54 0 7 11 1.94 3.22 0 7 -11 0.56 1.46 0 -7 11 1.60 3.51 0 7 11 -1.47 3.00 0 7 -11 0.60 1.59 0 7 11 -0.60 1.33 0 7 -12 158.41 16.60 0 7 -12 162.49 11.61 0 7 12 146.81 15.16 0 7 -12 154.58 13.82 0 7 12 152.35 17.31 0 7 12 123.50 15.29 0 7 13 234.47 20.98 0 7 -13 280.87 23.36 0 7 13 226.24 23.14 0 7 13 267.66 23.25 0 7 14 27.46 6.65 0 7 -14 18.87 6.16 0 7 14 13.69 6.16 0 7 14 24.18 7.60 0 7 15 14.96 5.53 0 7 -15 3.96 3.70 0 7 15 9.11 5.36 0 7 -16 20.75 6.24 0 7 16 13.71 5.36 0 7 16 16.53 6.82 0 7 16 5.74 4.25 0 7 -17 2.17 3.60 0 7 17 -4.88 4.53 0 7 17 2.01 4.09 0 7 -18 2.27 3.78 0 7 18 12.63 5.25 0 7 -19 2.36 3.40 0 7 19 6.60 5.48 0 7 20 2.30 4.26 0 7 -21 2.54 5.95 0 7 21 2.39 4.86 0 7 -22 -2.61 6.13 0 7 22 -2.48 4.61 0 7 -23 37.44 9.74 0 7 23 12.82 6.82 0 8 0 14.43 2.98 0 -8 0 23.79 5.16 0 8 0 15.33 2.81 0 -8 -1 4.96 3.10 0 -8 1 6.33 2.98 0 8 -1 4.19 1.87 0 8 1 3.62 1.82 0 -8 1 3.06 1.62 0 8 1 4.67 1.79 0 8 -1 7.12 2.00 0 -8 -2 24.75 5.42 0 -8 2 11.63 3.98 0 8 -2 19.10 3.24 0 8 2 22.20 3.63 0 -8 2 16.90 3.37 0 8 2 20.85 3.23 0 8 -2 16.25 2.92 0 -8 -3 182.09 15.65 0 -8 3 158.89 15.29 0 8 3 160.84 11.76 0 8 -3 154.58 11.59 0 8 -3 171.17 12.32 0 8 3 187.23 12.69 0 -8 3 193.04 13.23 0 -8 4 14.96 4.68 0 -8 -4 2.50 2.59 0 8 4 5.31 2.17 0 8 -4 11.78 2.56 0 -8 4 4.43 3.28 0 8 -4 15.74 3.01 0 8 4 13.93 3.01 0 -8 4 19.68 3.66 0 -8 5 -1.51 2.80 0 8 5 4.26 1.82 0 8 -5 0.51 1.54 0 8 5 0.64 1.67 0 8 -5 -1.21 1.51 0 -8 5 -1.38 2.57 0 8 -6 132.15 14.99 0 -8 6 151.47 14.94 0 8 -6 139.83 10.63 0 -8 6 150.39 15.21 0 8 6 197.09 16.96 0 8 6 151.79 11.42 0 8 -6 143.70 11.13 0 8 -7 4.96 4.12 0 -8 7 -1.42 3.33 0 8 -7 1.05 1.57 0 -8 7 3.15 3.20 0 8 7 1.65 3.07 0 8 7 -0.66 1.90 0 8 -7 3.17 1.97 0 -8 8 22.69 6.20 0 8 8 15.48 5.20 0 8 -8 16.77 5.61 0 8 -8 9.76 2.63 0 8 8 15.45 3.28 0 -8 9 3.33 3.39 0 8 9 3.56 3.63 0 8 9 2.72 1.96 0 8 -9 4.68 2.29 0 8 -9 -1.71 3.48 0 8 -10 10.52 4.45 0 8 10 23.95 6.55 0 8 10 18.01 6.28 0 -8 10 15.37 5.56 0 8 10 11.22 4.69 0 8 10 18.25 3.55 0 8 -10 22.02 3.85 0 8 -11 10.80 4.76 0 8 11 12.67 5.84 0 8 11 7.62 4.51 0 -8 11 15.77 5.07 0 8 11 6.54 4.33 0 8 11 11.35 3.00 0 8 -11 14.22 3.23 0 8 12 80.37 11.23 0 8 12 112.11 14.48 0 8 12 94.72 12.84 0 8 -12 72.65 11.40 0 8 13 32.44 7.29 0 8 13 34.75 8.14 0 8 13 38.78 9.04 0 8 -13 28.97 7.37 0 8 14 1.75 2.91 0 8 14 -2.37 3.93 0 8 14 4.23 4.30 0 8 -14 -2.01 3.72 0 8 15 1.80 3.66 0 8 -15 2.09 3.88 0 8 15 9.77 6.08 0 8 15 10.92 5.44 0 8 -16 21.72 7.29 0 8 16 20.15 7.61 0 8 -17 11.28 4.98 0 8 17 7.79 6.12 0 8 17 10.35 5.18 0 8 -18 37.51 9.07 0 8 18 37.40 9.81 0 8 18 25.88 7.57 0 8 -19 12.16 5.72 0 8 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12.04 -2 2 17 64.85 10.54 2 2 -17 90.16 10.01 -2 2 17 48.54 9.79 2 2 -16 96.48 10.69 2 2 -16 78.29 10.94 -2 2 16 137.47 14.26 2 2 -16 92.20 9.96 -2 2 16 74.89 11.62 2 2 -16 81.87 10.67 -2 -2 16 74.15 11.32 2 -2 -16 87.69 11.03 2 2 -16 119.97 13.94 2 -2 -16 106.98 11.99 2 -2 -16 96.02 12.01 2 2 -15 23.50 5.92 2 2 -15 30.64 5.65 -2 2 15 8.14 4.16 -2 2 15 18.85 5.76 2 2 -15 13.17 4.33 2 2 -15 17.64 4.32 -2 -2 15 15.83 5.34 2 -2 -15 18.95 5.23 2 2 -15 19.34 5.91 2 -2 -15 19.65 5.42 2 -2 -15 22.78 5.71 2 2 -14 32.39 5.68 -2 2 14 32.23 6.75 2 2 -14 32.14 6.49 2 2 -14 32.30 6.15 2 -2 -14 24.04 3.96 2 2 -14 27.09 5.10 -2 2 14 20.81 5.63 -2 -2 14 26.61 6.15 2 2 -14 11.55 4.73 2 -2 -14 23.22 5.41 2 -2 -14 28.10 5.92 2 -2 -14 31.59 6.66 2 2 -13 112.99 11.03 -2 2 13 124.10 12.87 2 -2 -13 116.29 12.02 2 2 -13 124.92 12.67 2 2 -13 117.33 10.98 -2 -2 13 122.41 12.76 2 -2 -13 97.35 9.07 -2 2 13 123.66 13.09 2 2 -13 105.01 11.40 2 2 -13 100.67 12.48 2 -2 -13 137.06 12.89 2 -2 -13 141.80 13.40 -2 2 12 3.17 1.90 -2 -2 12 2.54 2.58 2 -2 -12 0.60 1.21 -2 2 12 4.14 3.03 2 2 -12 2.18 2.56 2 2 -12 3.77 3.13 -2 2 12 -1.35 2.51 2 2 -12 0.98 1.82 2 -2 -12 -1.15 2.14 2 2 -12 2.91 3.42 2 -2 -12 1.20 2.63 2 -2 -12 1.26 2.57 -2 2 11 149.47 11.24 2 2 -11 149.40 11.26 2 -2 -11 134.80 10.51 -2 -2 11 121.33 12.77 2 2 -11 150.51 12.98 -2 -2 11 149.49 11.89 2 -2 -11 140.00 13.08 2 2 -11 153.24 12.76 2 2 -11 142.92 13.49 -2 2 11 164.10 14.45 2 2 -11 136.61 14.07 2 -2 -11 140.45 13.14 2 -2 -11 155.66 13.89 -2 2 10 147.36 11.75 2 2 -10 157.27 11.85 -2 2 10 147.90 14.11 2 2 -10 142.40 12.74 2 -2 -10 153.68 13.58 2 2 -10 165.44 14.27 2 -2 -10 172.52 11.48 -2 -2 10 162.67 14.02 2 2 -10 161.56 13.40 -2 -2 10 170.89 12.78 2 2 -10 203.96 16.15 2 -2 -10 161.39 13.89 2 -2 -10 158.11 14.01 2 2 -9 34.91 4.51 -2 2 9 32.92 4.54 -2 -2 9 41.21 5.94 2 -2 -9 30.60 3.85 2 2 -9 33.82 5.16 -2 -2 9 43.67 5.16 -2 -2 9 39.98 5.43 2 2 -9 36.86 5.96 2 2 -9 31.36 5.75 2 -2 -9 44.68 6.15 -2 2 9 29.29 5.53 2 -2 -9 31.08 5.38 2 -2 -9 22.54 4.78 -2 -2 9 28.14 5.00 -2 2 8 250.61 17.22 -2 -2 8 279.82 18.72 2 2 -8 270.32 18.12 -2 -2 8 249.60 17.38 2 2 -8 258.54 17.12 -2 -2 8 270.94 18.35 -2 2 8 245.02 18.96 2 -2 -8 269.87 18.74 2 2 -8 246.31 18.65 2 2 -8 264.39 19.86 -2 -2 8 253.76 18.65 2 -2 -8 267.43 18.69 2 -2 -8 246.65 18.34 -2 2 7 285.47 19.39 -2 -2 7 291.35 19.90 2 2 -7 281.77 19.47 -2 -2 7 333.24 19.95 2 2 -7 291.84 19.23 2 -2 -7 332.36 18.92 -2 -2 7 311.54 20.19 -2 2 7 294.54 20.98 2 -2 -7 312.03 20.63 2 2 -7 244.05 19.81 -2 -2 7 310.09 20.97 2 2 -7 326.80 22.13 2 -2 -7 292.08 20.12 2 -2 -7 318.85 20.76 -2 2 6 46.80 5.56 -2 -2 6 51.20 5.74 -2 -2 6 55.19 5.82 2 2 -6 42.34 5.11 -2 2 6 50.81 4.03 2 2 -6 41.70 5.18 2 -2 -6 52.59 5.15 2 -2 -6 55.30 6.20 -2 -2 6 52.64 5.88 2 2 -6 55.09 6.41 -2 2 6 33.47 5.45 2 2 -6 35.92 6.08 -2 -2 6 53.51 6.52 2 -2 -6 46.26 5.59 2 -2 -6 48.02 5.78 -2 2 5 1190.91 64.55 -2 -2 5 1125.66 63.55 2 2 -5 1188.31 63.46 -2 2 5 1195.22 61.64 2 2 -5 1157.13 64.17 -2 2 5 1110.59 64.97 2 2 -5 1117.62 64.56 -2 -2 5 1175.62 64.59 2 -2 -5 1213.40 64.12 2 -2 -5 1134.93 64.25 -2 -2 5 1246.33 65.87 2 2 -5 1173.94 66.19 2 -2 -5 1142.10 63.54 -2 2 4 883.26 51.28 -2 2 4 926.74 51.70 2 -2 -4 932.47 50.96 2 2 -4 954.85 50.12 -2 2 4 951.96 51.96 2 2 -4 902.52 52.98 -2 -2 4 869.21 52.44 2 -2 -4 921.67 51.09 2 -2 -4 914.18 50.52 -2 2 3 503.35 30.75 -2 2 3 551.92 31.31 2 2 -3 523.94 28.94 2 -2 -3 504.43 30.34 -2 2 3 527.44 30.96 -2 -2 3 588.48 32.36 2 -2 -3 527.99 30.08 -2 2 3 492.10 29.46 -2 2 2 1884.11 102.67 -2 2 2 1891.86 102.92 2 2 -2 1905.20 101.86 2 2 -2 1901.36 100.04 2 -2 -2 1871.08 102.26 2 -2 -2 1961.00 101.02 -2 -2 2 1909.10 103.65 -2 2 2 1945.18 101.65 -2 2 2 1935.74 100.77 2 -2 -2 1949.08 101.44 -2 2 1 1655.47 87.64 -2 2 1 1653.26 88.46 2 -2 -1 1694.37 88.37 2 2 -1 1611.97 88.82 2 -2 -1 1707.03 90.00 2 -2 -1 1634.65 87.91 -2 2 1 1757.96 90.62 -2 2 1 1840.54 90.58 2 -2 -1 1643.73 89.65 -2 2 0 383.50 21.41 2 2 0 390.78 21.91 2 -2 0 327.68 22.73 -2 2 0 380.45 20.82 2 -2 0 374.66 20.78 2 -2 0 369.48 22.93 -2 2 0 414.59 23.81 -2 2 0 384.02 23.64 -2 -2 -1 225.33 12.58 2 2 1 218.84 12.47 -2 2 -1 194.86 11.87 -2 2 -1 215.39 12.32 -2 2 -1 213.29 14.32 2 -2 1 213.43 13.91 2 -2 1 221.51 14.06 2 -2 2 471.49 29.06 -2 -2 -2 523.07 27.55 2 2 2 490.90 26.60 -2 2 -2 523.22 29.87 -2 2 -2 490.66 29.78 2 -2 2 475.45 28.69 2 2 3 0.81 0.81 -2 -2 -3 -0.26 0.79 2 -2 3 -0.40 1.29 2 2 3 0.81 0.84 2 -2 3 0.52 1.29 2 2 3 -0.66 1.54 -2 2 -3 -0.69 1.39 -2 2 -3 0.65 1.61 2 -2 3 -0.57 1.16 2 -2 4 190.70 12.82 2 2 4 175.35 11.63 2 2 4 176.75 11.22 2 -2 4 178.07 11.91 2 2 4 181.84 13.23 -2 2 -4 184.91 13.50 2 -2 4 190.73 12.61 2 -2 5 40.11 4.68 2 2 5 32.27 4.22 2 2 5 35.49 3.72 2 -2 5 44.71 4.47 -2 2 -5 44.82 4.58 2 2 5 60.33 5.93 2 2 5 40.45 3.43 -2 2 -5 42.35 5.23 2 -2 5 49.09 4.86 2 2 5 30.75 4.14 -2 2 -5 45.02 5.26 2 -2 6 378.67 22.72 2 2 6 391.53 21.89 2 2 6 371.44 23.02 2 -2 6 381.21 22.39 -2 2 -6 391.06 22.78 2 -2 6 404.40 23.82 -2 -2 -6 302.87 21.58 2 2 6 396.07 23.65 2 2 6 381.36 21.24 -2 2 -6 363.83 23.52 2 2 6 383.70 23.59 -2 2 -6 353.75 23.26 2 2 6 374.97 23.05 2 2 6 367.77 24.27 2 -2 6 394.38 22.72 2 -2 7 421.83 26.38 2 2 7 445.33 27.53 2 -2 7 444.16 27.60 -2 2 -7 465.30 26.92 -2 -2 -7 438.54 26.20 2 -2 7 467.46 26.63 2 2 7 422.69 27.18 2 2 7 468.82 25.64 -2 2 -7 434.54 27.55 2 2 7 474.38 29.07 -2 2 -7 460.27 27.73 2 2 7 448.51 27.40 2 2 7 451.08 27.37 2 -2 8 84.50 7.04 2 2 8 83.51 8.13 2 -2 8 76.92 7.66 -2 2 -8 85.24 7.58 -2 -2 -8 71.87 6.78 2 -2 8 81.34 6.91 2 2 8 84.15 7.75 2 2 8 76.55 6.51 -2 2 -8 73.56 7.66 -2 2 -8 93.49 8.33 2 2 8 69.08 7.38 2 2 8 86.06 7.67 2 2 8 83.71 9.07 2 2 9 224.37 17.08 -2 -2 -9 235.23 15.58 2 -2 9 208.78 16.37 -2 2 -9 249.68 16.63 2 2 9 220.87 16.06 2 -2 9 256.65 15.58 2 2 9 238.63 15.43 -2 2 -9 238.92 16.67 -2 2 -9 227.20 16.66 2 2 9 250.14 16.22 2 2 9 233.10 18.32 2 2 10 38.10 6.07 -2 2 -10 46.69 7.00 2 -2 10 39.34 5.45 -2 -2 -10 42.37 4.99 -2 2 -10 44.66 5.73 2 -2 10 43.94 4.72 -2 2 -10 37.15 5.49 2 2 10 37.49 4.67 2 2 10 44.22 5.36 -2 2 -10 35.88 5.01 2 2 10 42.16 6.81 2 2 10 47.45 5.33 -2 -2 -10 32.74 4.96 -2 2 -11 56.46 8.49 2 -2 11 67.52 7.53 2 2 11 67.83 8.28 -2 2 -11 69.48 7.71 -2 -2 -11 64.02 6.63 2 2 11 81.00 7.08 2 2 11 50.43 6.23 2 -2 11 71.18 6.39 -2 -2 -11 65.32 6.26 2 2 11 70.03 6.85 -2 2 -11 64.81 7.06 -2 -2 -11 69.74 7.48 -2 2 -11 63.07 7.29 2 -2 12 138.58 12.01 -2 2 -12 114.87 13.24 2 2 12 129.52 13.06 -2 2 -12 147.16 12.55 -2 -2 -12 132.71 11.07 2 2 12 156.38 10.97 2 -2 12 157.69 10.84 2 2 12 144.46 11.45 -2 2 -12 131.79 11.28 -2 -2 -12 147.74 12.17 -2 2 -12 129.42 11.74 -2 2 -13 122.91 11.89 -2 -2 -13 120.50 10.50 2 2 13 144.71 10.21 2 -2 13 139.89 10.09 2 2 13 131.11 10.96 -2 2 -13 127.54 11.69 2 -2 13 104.12 10.75 2 2 13 121.21 12.65 -2 2 -13 144.46 14.20 -2 -2 -13 115.17 11.04 -2 2 -13 122.31 11.30 -2 -2 -13 111.16 11.04 2 -2 14 1.00 2.20 -2 -2 -14 -0.80 1.76 -2 2 -14 -0.99 1.84 -2 -2 -14 -1.01 2.78 2 2 14 3.00 1.80 2 -2 14 0.62 1.27 -2 2 -14 -1.15 2.14 2 2 14 1.44 2.93 -2 2 -14 1.55 2.88 -2 -2 -14 -1.01 2.05 -2 -2 -14 2.65 2.91 -2 -2 -15 238.07 17.80 -2 2 -15 255.28 20.04 2 2 15 289.88 17.26 2 2 15 252.07 21.29 -2 2 -15 284.44 22.60 -2 -2 -15 242.46 18.97 -2 -2 -15 230.91 18.66 -2 2 -15 267.57 19.18 -2 -2 -15 197.89 19.41 -2 -2 -16 17.10 3.95 -2 2 -16 14.79 4.66 2 2 16 14.62 3.12 -2 -2 -16 19.98 4.67 -2 -2 -16 8.87 4.65 2 2 16 14.87 5.19 -2 2 -16 11.91 4.95 -2 -2 -17 27.90 5.84 2 2 17 30.89 4.39 2 2 17 33.44 7.33 2 2 18 9.33 4.67 2 2 19 102.77 13.86 2 2 20 72.73 11.79 -2 3 25 2.77 5.15 2 3 -25 3.32 4.78 2 -3 -25 6.38 7.01 -2 3 25 4.79 4.87 -2 3 24 10.77 6.32 2 3 -24 3.15 6.40 2 -3 -24 6.02 4.99 -2 3 24 -2.35 4.36 -2 3 23 4.59 5.04 -2 3 23 2.60 4.32 2 3 -23 2.98 5.53 -2 3 22 8.94 5.56 -2 3 22 -2.50 4.64 2 3 -22 5.62 6.17 -2 3 21 -2.16 4.40 -2 3 21 2.40 4.46 2 3 -21 5.30 4.92 -2 3 20 -2.09 4.25 -2 3 20 6.87 6.59 2 3 -20 2.50 4.63 -2 3 19 2.02 4.43 -2 3 19 6.55 5.12 2 3 -19 -2.35 4.36 -2 3 18 89.01 12.93 -2 3 18 84.82 13.05 2 3 -18 108.32 14.42 -2 3 17 3.69 4.06 2 3 -17 2.08 3.86 -2 3 17 5.87 3.99 -2 3 16 23.98 6.56 2 3 -16 19.93 5.37 -2 3 16 15.79 5.71 2 3 -16 16.70 4.86 2 3 -16 17.62 4.40 2 3 -16 17.62 5.70 2 -3 -16 16.21 5.63 2 3 -15 12.16 4.21 -2 3 15 6.94 4.79 2 3 -15 4.67 3.67 -2 3 15 8.33 4.80 2 3 -15 2.47 2.91 2 3 -15 7.82 3.05 2 -3 -15 5.44 3.58 2 3 -15 11.06 4.60 2 -3 -15 1.54 2.88 2 -3 -15 12.84 4.44 2 3 -14 420.14 28.20 -2 3 14 344.75 28.51 2 3 -14 457.38 31.24 2 -3 -14 382.57 27.95 2 -3 -14 388.96 28.66 2 3 -14 377.02 27.04 -2 3 14 397.69 29.46 2 3 -14 403.72 29.06 2 -3 -14 371.37 27.58 2 3 -13 126.11 12.68 2 -3 -13 138.45 13.19 -2 3 13 116.32 13.35 2 3 -13 128.94 13.47 2 3 -13 131.07 12.50 2 3 -13 144.47 14.89 2 -3 -13 126.41 12.98 2 -3 -13 118.97 13.18 -2 3 12 14.59 3.34 2 3 -12 15.76 4.34 -2 -3 12 10.83 1.88 -2 3 12 14.01 4.56 2 3 -12 21.23 5.22 2 3 -12 12.40 4.51 2 -3 -12 16.45 4.63 2 -3 -12 19.17 4.80 2 -3 -12 23.17 5.11 -2 3 11 123.22 10.45 2 -3 -11 100.91 8.70 2 3 -11 118.27 11.53 -2 -3 11 153.22 11.79 2 3 -11 115.90 10.02 2 -3 -11 113.50 11.61 2 3 -11 129.94 12.76 -2 3 11 122.27 12.67 2 -3 -11 137.70 12.61 2 -3 -11 133.55 12.67 -2 -3 11 110.36 11.60 2 3 -11 123.05 13.27 -2 -3 11 138.89 8.40 -2 3 10 110.81 9.95 -2 3 10 128.72 10.58 -2 -3 10 137.09 8.66 2 -3 -10 119.50 8.96 2 3 -10 127.78 11.56 -2 -3 10 123.96 10.93 -2 3 10 113.32 12.21 -2 -3 10 127.65 12.04 2 3 -10 130.84 12.50 -2 -3 10 137.82 12.46 2 3 -10 120.42 12.86 2 -3 -10 134.17 12.24 2 -3 -10 145.67 12.71 -2 3 9 24.64 4.09 -2 -3 9 25.21 2.83 -2 3 9 22.38 3.80 -2 -3 9 19.27 3.82 2 -3 -9 11.86 2.30 2 3 -9 23.05 4.26 -2 -3 9 7.09 3.05 2 3 -9 27.19 5.11 2 3 -9 22.26 5.18 -2 3 9 17.25 4.47 -2 -3 9 13.69 3.82 2 -3 -9 17.76 4.20 2 -3 -9 21.93 4.62 -2 3 8 181.45 13.84 -2 3 8 167.64 13.41 -2 -3 8 194.32 14.29 2 3 -8 228.19 15.13 -2 -3 8 200.86 15.29 -2 3 8 178.62 15.32 -2 -3 8 182.14 15.29 2 3 -8 185.52 16.14 2 -3 -8 191.38 14.93 2 -3 -8 201.04 15.03 -2 3 7 459.59 27.23 2 3 -7 428.12 27.02 -2 -3 7 452.71 27.39 -2 3 7 425.60 26.65 -2 3 7 424.03 28.43 -2 -3 7 455.64 28.24 2 3 -7 475.88 30.02 -2 -3 7 404.17 28.27 2 -3 -7 418.75 27.54 -2 3 6 53.47 6.10 -2 -3 6 54.81 6.47 2 3 -6 49.18 5.79 2 3 -6 60.70 7.08 -2 -3 6 61.41 7.00 2 -3 -6 61.90 6.86 -2 3 6 56.32 6.58 2 3 -6 53.78 7.34 -2 -3 6 64.31 7.57 -2 3 6 51.51 6.70 -2 3 6 53.97 6.05 -2 3 5 0.70 1.42 2 3 -5 0.56 1.30 -2 3 5 0.65 1.72 2 3 -5 -0.83 2.30 -2 3 5 0.86 1.42 2 3 -5 2.06 2.09 -2 -3 5 -0.95 2.09 -2 3 5 1.56 1.94 -2 3 5 0.70 1.65 2 -3 -5 -0.70 1.85 -2 3 4 107.27 9.29 2 3 -4 108.07 8.25 2 3 -4 107.27 9.51 -2 3 4 101.52 8.95 -2 3 4 108.21 9.76 -2 -3 4 118.95 10.60 -2 3 4 107.08 8.92 2 -3 -4 116.30 9.25 -2 3 4 93.59 8.98 -2 3 3 41.02 5.26 2 3 -3 41.91 4.26 2 3 -3 39.52 5.15 -2 3 3 50.13 5.40 2 -3 -3 40.06 4.82 -2 3 3 49.90 5.10 -2 -3 3 49.37 6.46 -2 3 3 42.16 5.26 -2 3 2 1528.28 81.17 2 3 -2 1528.92 81.06 -2 3 2 1516.80 80.51 2 -3 -2 1465.32 78.16 -2 -3 2 1501.93 82.43 -2 3 2 1467.09 81.40 -2 3 1 1257.70 70.02 2 -3 -1 1290.56 68.41 -2 -3 1 1270.85 70.44 2 3 -1 1365.08 70.65 -2 3 1 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264.44 19.58 3 -3 4 276.80 18.08 3 -3 5 115.33 9.95 3 3 5 111.62 8.09 3 -3 5 100.63 8.75 -3 -3 -5 117.54 7.94 3 3 5 100.29 7.69 3 3 5 88.93 9.80 -3 3 -5 101.90 10.58 3 -3 5 115.48 9.59 3 -3 6 879.08 51.38 3 3 6 919.19 49.01 3 3 6 830.41 49.41 3 -3 6 882.17 50.32 -3 -3 -6 933.41 48.78 3 3 6 866.24 52.36 3 3 6 914.18 48.03 -3 3 -6 923.69 53.45 3 3 6 899.38 51.11 3 -3 6 899.43 50.95 3 -3 7 342.77 21.87 3 3 7 346.62 19.99 3 3 7 307.57 20.55 3 -3 7 352.50 21.15 3 3 7 287.01 22.15 3 3 7 326.16 18.87 -3 3 -7 354.78 23.82 3 3 7 293.39 21.25 3 3 7 344.83 23.52 3 -3 7 330.69 21.34 3 -3 8 110.13 9.15 3 3 8 92.62 8.36 3 -3 8 96.49 9.43 3 -3 8 78.96 7.70 -3 3 -8 85.16 8.06 3 3 8 93.30 9.50 3 3 8 79.99 6.31 -3 3 -8 91.30 9.88 3 3 8 77.59 8.24 3 -3 8 83.05 8.06 3 3 8 93.18 9.29 3 3 8 57.38 8.43 3 3 9 -0.83 1.69 3 3 9 2.85 2.36 3 -3 9 0.69 1.53 3 -3 9 0.98 1.63 -3 3 -9 0.77 1.69 3 3 9 1.01 2.06 -3 3 -9 -1.14 2.67 3 3 9 -1.29 2.83 3 3 9 0.90 1.82 3 3 10 401.32 27.41 3 3 10 439.25 28.42 3 -3 10 461.24 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7.50 3.11 4 4 -8 6.03 3.20 -4 4 8 11.15 3.86 4 4 -7 90.40 9.77 4 4 -7 68.85 8.75 4 4 -7 72.35 9.18 4 -4 -7 60.67 7.81 -4 -4 7 70.51 9.75 -4 4 7 66.94 9.17 4 -4 -7 74.42 8.42 -4 4 7 71.09 9.47 4 -4 -6 37.20 5.90 4 -4 -6 32.17 5.24 4 4 -6 31.64 5.75 4 4 -6 50.01 6.87 -4 4 6 24.62 5.60 4 -4 -6 32.84 5.37 -4 -4 6 24.70 5.99 4 4 -6 26.56 5.53 -4 4 6 20.91 5.53 4 -4 -5 99.96 10.01 4 -4 -5 81.30 8.72 4 4 -5 105.20 10.33 4 4 -5 94.15 10.34 -4 4 5 94.52 10.53 4 4 -5 79.37 9.17 -4 -4 5 94.66 11.42 4 -4 -5 89.60 8.89 -4 4 5 112.97 11.91 4 4 -4 24.13 5.15 -4 4 4 23.75 5.69 4 4 -4 19.03 4.09 -4 4 4 21.09 4.82 -4 -4 4 21.21 5.51 4 -4 -4 23.66 3.92 4 4 -4 24.79 4.81 4 -4 -4 31.44 5.28 4 4 -3 19.28 4.08 4 -4 -3 14.11 2.98 -4 -4 3 11.11 4.20 -4 4 3 6.70 3.14 4 -4 -3 12.70 3.57 4 4 -3 13.33 3.95 -4 4 3 12.59 4.54 4 4 -2 50.50 6.44 4 4 -2 48.67 7.53 -4 4 2 54.72 8.28 -4 -4 2 68.51 9.01 -4 4 2 60.99 7.65 4 -4 -2 64.44 6.04 4 -4 -2 58.55 7.62 4 4 -1 166.29 15.43 4 -4 -1 186.42 15.28 -4 4 1 162.06 15.82 4 4 -1 193.99 13.88 -4 4 0 34.30 4.34 4 -4 0 37.85 5.99 4 4 0 25.79 5.37 -4 4 0 28.33 6.23 4 4 0 36.00 4.80 -4 4 -1 3.04 1.60 4 4 1 5.07 2.12 4 -4 1 7.59 3.00 4 4 1 13.59 4.11 -4 4 -1 11.41 3.94 -4 4 -2 2.67 1.29 4 -4 2 1.08 1.79 -4 4 -2 1.44 2.07 4 4 2 2.48 2.92 4 -4 2 2.74 2.14 4 -4 3 1.61 1.77 4 4 3 2.27 1.34 4 -4 3 2.75 2.28 4 -4 3 1.08 2.00 4 4 3 5.02 3.12 -4 4 -3 5.80 3.41 4 -4 4 14.18 3.37 4 -4 4 8.24 2.99 -4 4 -4 14.49 3.17 4 -4 4 21.51 4.67 4 4 4 5.05 3.01 -4 4 -4 4.40 3.26 4 -4 5 84.21 8.43 4 -4 5 65.35 7.31 -4 4 -5 74.96 7.97 4 4 5 80.28 9.73 4 -4 5 72.64 8.48 -4 4 -5 47.39 8.30 4 -4 6 250.76 18.29 -4 4 -6 249.45 18.55 4 4 6 250.77 20.24 4 -4 6 274.15 19.55 -4 4 -6 250.08 21.06 4 4 7 8.69 3.04 -4 4 -7 12.67 3.75 4 -4 7 8.80 2.96 4 -4 7 9.49 3.20 4 4 7 14.29 4.34 -4 4 -7 6.06 3.80 4 -4 8 5.27 2.74 -4 4 -8 7.02 3.23 4 4 8 2.71 2.99 4 4 8 7.99 2.88 4 4 8 2.62 2.45 -4 4 -8 4.60 3.82 4 -4 9 113.71 11.70 4 4 9 107.76 11.89 -4 4 -9 140.10 13.06 4 4 9 118.81 11.16 4 4 9 118.06 12.82 4 -4 9 84.21 9.46 4 4 9 117.56 11.94 -4 4 -9 124.04 13.30 4 -4 10 59.24 8.06 4 4 10 56.95 8.12 4 -4 10 56.64 6.83 -4 4 -10 55.96 8.62 4 4 10 49.35 8.49 4 4 10 61.79 8.75 -4 4 -10 50.15 8.42 4 -4 11 -1.25 2.93 4 4 11 1.18 2.76 4 -4 11 -0.84 1.70 -4 4 -11 1.51 3.32 4 4 11 1.63 2.71 -4 4 -11 1.59 3.23 -4 4 -12 137.65 14.44 4 -4 12 105.82 11.77 4 4 12 123.84 11.98 4 4 12 118.40 13.89 4 -4 12 114.68 10.40 4 -4 13 5.10 3.35 4 4 13 1.80 3.35 4 4 13 1.09 2.73 4 -4 13 4.99 2.19 4 4 14 7.55 4.43 4 4 14 -4.21 3.27 4 -4 14 1.67 1.96 4 -4 15 63.16 9.04 4 4 15 86.79 9.33 4 4 15 74.85 11.63 4 -4 15 76.72 8.06 4 -4 16 2.70 3.17 4 4 16 0.97 2.13 4 -4 16 4.28 2.56 4 -4 17 27.71 6.15 4 -4 17 43.69 5.92 4 -4 18 35.72 7.09 4 -4 18 51.61 6.48 4 -4 19 2.95 3.67 4 -5 -23 2.59 4.30 4 -5 -22 2.46 5.00 4 5 -22 3.08 6.27 -4 5 22 2.60 4.84 4 5 -22 12.38 7.27 -4 5 22 10.33 6.07 4 5 -21 2.96 4.92 4 -5 -21 -2.33 4.74 -4 5 21 2.53 4.21 4 5 -21 -3.02 6.64 -4 5 21 -2.50 4.14 4 5 -20 5.90 5.48 -4 5 20 4.92 5.00 -4 5 20 2.41 4.00 4 -5 -20 -2.21 4.49 -4 5 19 7.16 5.24 4 5 -19 -2.86 5.81 -4 5 19 -2.32 3.34 4 5 -19 -2.74 4.55 4 -5 -19 2.09 4.25 -4 5 18 -4.62 4.70 4 5 -18 -2.75 5.59 -4 5 18 2.23 3.71 4 5 -18 2.65 4.39 4 -5 -18 -1.98 4.64 4 5 -17 17.88 7.07 -4 5 17 4.46 4.95 4 5 -17 21.07 7.60 4 -5 -17 18.70 5.85 -4 5 16 -2.15 4.73 4 5 -16 2.50 3.59 -4 -5 16 -1.46 2.43 4 5 -16 2.46 4.08 4 -5 -16 -1.77 3.88 -4 5 15 2.07 3.85 4 5 -15 -2.37 4.40 -4 -5 15 2.88 2.93 4 5 -15 11.89 5.92 4 -5 -15 1.67 3.10 -4 -5 14 -1.67 3.10 4 5 -14 2.24 3.71 -4 -5 14 1.40 2.84 4 5 -14 2.29 4.26 -4 5 14 1.99 3.31 4 -5 -14 3.15 2.92 -4 -5 13 129.38 13.50 4 5 -13 98.35 13.65 -4 -5 13 88.69 10.76 4 5 -13 97.12 13.83 -4 5 13 84.31 12.35 4 -5 -13 81.47 11.03 -4 -5 12 110.92 12.50 4 5 -12 87.72 12.64 -4 -5 12 95.61 10.88 4 5 -12 76.34 12.16 -4 5 12 90.13 12.31 4 -5 -12 77.91 10.44 -4 5 11 1.46 2.43 -4 -5 11 10.73 4.17 -4 -5 11 -1.57 3.19 4 5 -11 9.08 4.77 -4 5 11 8.82 4.63 4 -5 -11 5.26 3.27 4 -5 -11 -1.30 2.42 -4 5 10 56.93 8.82 4 5 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-1.51 3.32 -4 5 3 1.28 3.00 4 5 -3 5.11 2.81 -4 5 2 3.85 2.84 4 5 -2 9.55 2.98 -4 -5 2 8.93 4.11 -4 5 2 2.93 3.24 -4 5 2 5.90 2.44 4 5 -1 377.34 22.60 -4 5 1 281.10 20.57 -4 5 1 318.23 24.51 -4 5 1 304.22 23.39 -4 5 0 47.81 5.64 4 -5 0 53.43 6.28 4 5 0 43.72 5.78 -4 5 0 40.15 7.09 -4 5 0 31.10 6.78 4 -5 1 46.42 5.92 4 5 1 47.22 5.91 -4 5 -1 44.31 7.22 4 5 1 43.50 7.10 -4 5 -1 41.75 7.48 -4 5 -2 3.01 3.54 4 5 2 2.57 3.03 4 -5 2 6.80 2.69 4 -5 2 5.72 2.46 4 -5 3 177.82 14.79 4 -5 3 210.94 14.84 -4 5 -3 166.50 16.61 4 5 3 188.69 16.57 4 5 4 28.60 6.04 -4 5 -4 29.05 6.35 4 -5 4 22.72 4.62 4 -5 4 22.46 4.14 -4 5 -5 -1.54 3.14 4 5 5 1.31 2.87 4 -5 5 -0.79 2.29 -4 5 -6 40.61 7.43 4 5 6 35.69 6.55 4 -5 6 31.20 4.84 -4 5 -7 9.49 4.40 4 5 7 14.69 4.61 4 -5 7 11.29 2.98 4 5 8 91.95 10.56 4 5 8 81.01 10.61 -4 5 -8 125.00 13.41 4 -5 8 107.55 9.50 4 -5 9 11.82 3.99 4 5 9 9.59 4.25 4 5 9 17.23 4.84 4 5 9 19.10 5.11 -4 5 -9 11.38 4.72 4 5 9 9.81 4.00 4 -5 9 15.31 3.55 4 -5 10 35.30 6.23 4 5 10 28.83 7.06 4 5 10 28.99 5.74 -4 5 -10 23.10 6.46 4 5 10 33.49 5.99 4 -5 10 28.26 4.52 4 -5 11 32.88 6.28 4 5 11 23.13 6.79 -4 5 -11 23.42 6.41 4 5 11 40.72 6.38 4 -5 11 31.40 4.76 4 5 12 49.08 7.31 4 -5 12 57.85 6.48 4 5 12 52.10 9.35 4 -5 12 37.12 6.89 4 -5 13 5.47 2.53 4 5 13 9.70 5.10 4 -5 13 5.34 3.15 4 -5 14 -0.79 1.87 4 5 14 -2.02 4.11 4 -5 14 1.35 2.50 4 -5 15 15.61 3.59 4 5 15 4.20 4.31 4 -5 15 12.30 4.28 4 -5 16 5.93 2.72 4 5 16 2.18 4.43 4 -5 16 -1.39 2.59 4 -5 17 2.85 2.90 4 -5 18 8.80 4.24 4 -5 19 24.08 5.99 4 -5 20 9.29 4.29 4 -6 -22 2.47 5.02 4 6 -21 3.14 5.21 -4 6 21 -2.56 5.20 -4 6 21 -2.60 3.74 4 6 -21 -3.02 5.02 4 -6 -21 4.69 5.51 4 6 -20 9.14 6.69 -4 6 20 2.48 5.04 -4 6 20 -2.53 4.70 4 6 -20 -2.92 4.85 4 -6 -20 -2.23 4.53 4 6 -19 70.61 13.37 -4 6 19 43.15 9.84 -4 6 19 51.74 10.71 4 6 -19 30.88 9.35 4 -6 -19 52.83 9.75 -4 6 18 2.39 4.45 4 -6 -18 4.00 4.40 4 6 -18 5.42 5.52 4 6 -18 8.47 6.20 4 6 -17 10.45 5.80 -4 6 17 16.24 6.44 4 6 -16 2.57 4.78 -4 6 16 2.24 4.17 4 6 -16 5.03 5.12 -4 -6 16 7.71 4.06 -4 -6 15 22.66 7.11 4 6 -15 21.86 7.09 -4 6 15 17.35 6.35 -4 -6 15 33.47 6.91 -4 -6 14 3.72 3.45 4 6 -14 2.29 4.25 -4 6 14 -2.10 4.26 -4 -6 14 -1.48 2.74 -4 -6 13 106.15 13.21 4 6 -13 101.05 13.93 -4 6 13 95.17 13.22 -4 -6 13 76.47 10.47 -4 -6 12 16.24 5.63 4 6 -12 6.05 4.13 -4 6 12 9.75 4.89 -4 -6 12 12.77 4.28 -4 -6 11 2.82 3.52 -4 -6 11 1.77 3.60 4 6 -11 1.89 3.51 -4 6 11 9.39 5.17 -4 6 11 7.72 3.85 -4 -6 10 -1.41 2.34 4 6 -10 1.77 3.59 -4 -6 10 -1.75 3.56 -4 6 10 -1.81 3.98 -4 6 10 1.54 2.86 -4 -6 9 4.24 3.32 4 6 -9 1.65 3.07 -4 6 9 5.33 3.32 -4 -6 9 4.60 2.19 -4 -6 9 1.74 3.23 -4 6 9 6.97 4.34 -4 6 9 -1.54 3.62 4 6 -8 198.98 19.07 -4 -6 8 246.35 15.96 -4 6 8 220.80 20.15 -4 -6 8 197.71 18.43 -4 6 8 235.19 20.06 -4 6 8 227.02 18.95 -4 6 7 58.36 8.98 -4 6 7 50.21 8.63 -4 6 7 50.35 8.10 -4 -6 7 52.27 6.21 4 6 -7 58.31 8.57 -4 6 6 15.33 4.99 -4 6 6 21.88 5.86 -4 -6 6 13.53 4.93 -4 6 6 17.22 4.86 -4 -6 6 16.81 3.67 4 6 -6 10.85 4.14 -4 6 5 35.74 6.98 -4 -6 5 40.92 5.43 -4 6 5 46.34 7.14 -4 6 5 60.60 9.18 -4 -6 5 53.59 8.98 -4 6 5 38.34 7.44 4 6 -5 48.63 7.48 -4 -6 4 163.09 12.97 -4 6 4 172.56 15.04 -4 -6 4 186.95 17.77 -4 6 4 178.81 16.04 -4 6 4 185.53 17.20 4 6 -4 187.70 15.73 -4 6 3 -1.33 2.91 -4 6 3 3.17 2.63 -4 -6 3 -1.63 3.59 -4 6 3 -1.54 3.12 4 6 -3 3.46 2.53 -4 6 2 1.33 3.31 -4 6 2 1.98 2.46 -4 -6 2 6.45 4.01 -4 6 2 4.62 3.62 4 6 -2 -2.19 2.41 -4 6 1 106.11 10.39 4 6 -1 101.65 10.59 -4 6 1 120.01 12.46 -4 6 1 129.84 13.51 4 6 0 26.24 5.16 -4 6 0 21.72 5.58 -4 6 0 18.73 5.22 -4 6 -1 262.05 22.03 -4 6 -1 276.90 21.59 4 -6 2 7.56 2.52 -4 6 -2 10.98 5.06 -4 6 -2 8.11 3.75 4 -6 2 8.84 3.92 4 -6 3 115.38 11.68 -4 6 -3 131.22 13.93 -4 6 -3 115.78 12.87 4 -6 3 125.27 10.17 4 -6 4 7.00 2.64 -4 6 -4 12.75 4.97 -4 6 -4 15.10 5.12 -4 -6 -4 6.44 2.42 4 -6 4 17.57 4.49 4 -6 5 252.56 15.99 -4 6 -5 218.93 19.78 -4 6 -5 174.32 17.54 -4 -6 -5 218.27 15.55 -4 6 -6 29.27 6.93 -4 6 -6 30.76 6.55 -4 -6 -6 31.59 4.71 4 -6 6 30.36 4.53 -4 6 -7 27.97 6.73 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8.75 4.21 7 -4 11 8.96 4.48 7 4 12 9.84 5.17 7 -4 12 7.18 3.97 7 -4 12 1.77 4.16 7 4 13 9.50 4.76 7 -4 13 12.77 4.58 7 -4 13 5.27 4.15 7 4 14 1.82 3.70 7 -4 14 2.71 2.76 7 -4 14 1.74 3.23 7 4 15 3.45 3.79 7 -4 15 6.51 3.43 7 -4 15 1.72 2.86 7 4 16 19.76 5.89 -7 5 16 27.29 8.54 -7 -5 16 14.60 5.54 -7 5 15 -4.83 4.48 -7 -5 15 1.83 3.05 -7 5 14 18.74 6.84 -7 -5 14 27.81 7.63 -7 5 13 4.54 3.80 -7 -5 13 24.45 6.82 -7 5 12 4.40 3.67 -7 -5 12 11.49 5.04 -7 5 11 2.13 3.53 -7 -5 11 -1.95 4.29 -7 5 10 19.07 6.88 -7 5 10 8.20 5.14 7 -5 -9 -1.66 3.08 -7 5 9 1.98 3.28 -7 5 8 2.43 4.51 7 -5 -8 1.68 3.12 -7 5 8 -1.90 3.54 -7 5 7 2.45 3.52 7 -5 -7 1.70 3.47 -7 5 7 7.34 4.57 7 -5 -6 1.72 3.20 -7 5 6 -2.47 4.58 7 -5 -5 15.69 5.29 -7 5 5 17.36 6.88 7 -5 -4 1.76 3.27 -7 5 4 2.50 5.48 7 -5 -3 -1.78 2.56 -7 5 3 17.43 7.16 7 -5 -2 3.59 3.65 -7 5 2 2.50 4.16 7 -5 -1 135.00 15.35 -7 5 1 143.29 18.26 7 -5 0 21.63 6.31 -7 5 0 35.38 9.24 7 -5 1 5.40 3.96 -7 5 -1 -2.54 4.21 7 -5 2 8.99 4.75 -7 5 -2 12.84 6.05 7 -5 3 25.07 6.62 -7 5 -3 28.34 8.39 7 -5 4 61.88 9.98 -7 5 -4 59.53 12.06 7 -5 4 41.68 8.13 7 -5 5 33.38 7.51 -7 5 -5 12.98 6.56 7 -5 5 19.85 5.77 7 -5 6 29.49 6.83 -7 5 -6 15.63 6.57 7 -5 6 16.47 5.22 7 -5 7 3.44 3.77 -7 5 -7 -2.61 5.31 7 -5 7 1.47 2.73 7 -5 8 33.99 7.47 -7 5 -8 47.05 10.60 7 -5 8 39.94 7.19 7 -5 9 5.04 3.70 7 -5 9 5.58 3.67 -7 5 -9 2.62 4.35 7 5 10 8.24 5.14 7 -5 10 10.99 4.44 7 -5 10 9.59 4.52 -7 5 -10 2.62 4.87 7 -5 11 60.32 10.38 7 5 11 76.42 11.86 7 -5 11 54.32 8.26 7 -5 12 7.44 5.13 7 5 12 9.75 5.61 7 -5 12 2.64 2.46 7 -5 13 7.39 4.86 7 -5 13 6.34 3.51 7 -5 14 10.95 5.12 7 -5 14 28.21 5.66 7 -5 15 -1.19 2.62 -7 6 15 4.99 5.08 -7 -6 14 7.61 4.74 -7 6 14 -2.43 4.51 -7 -6 13 -1.92 3.57 -7 6 13 -2.36 4.38 -7 -6 12 -1.96 4.30 -7 6 12 -2.29 4.25 -7 6 11 15.54 6.41 -7 -6 11 7.96 4.71 -7 6 10 29.74 8.83 -7 6 10 23.65 7.04 -7 6 9 -4.96 5.05 -7 6 9 -4.17 3.87 -7 6 8 2.49 4.13 -7 6 8 4.03 4.43 -7 6 7 2.50 4.16 -7 6 7 1.95 3.96 -7 6 6 35.06 8.76 -7 6 5 -5.03 5.53 -7 6 4 12.60 6.31 -7 6 3 -2.53 4.21 -7 6 2 50.91 11.09 -7 6 1 2.56 4.25 -7 6 0 33.42 8.97 -7 6 -1 2.58 4.29 -7 6 -2 25.97 8.17 -7 6 -3 18.25 7.56 -7 6 -4 73.66 13.28 -7 6 -5 -2.64 4.91 -7 6 -6 -5.33 4.96 -7 6 -7 -2.69 4.47 -7 6 -8 18.88 6.79 -7 6 -9 2.72 5.54 -7 6 -10 10.90 6.00 7 -6 10 3.98 4.38 7 -6 12 1.94 3.94 7 -6 12 -1.18 2.40 7 -6 13 1.15 2.33 7 -6 14 3.37 2.47 -7 7 13 2.46 5.40 -7 7 12 2.39 3.97 -7 -7 12 1.98 4.03 -7 7 11 9.31 5.82 -7 -7 11 14.08 5.82 -7 7 10 20.36 6.95 -7 7 10 45.34 10.36 -7 -7 10 34.85 8.48 -7 7 9 -2.53 4.19 -7 7 9 2.20 3.65 -7 7 8 2.53 4.20 -7 7 8 -2.13 3.96 -7 7 7 15.20 6.40 -7 7 7 28.95 7.94 -7 7 6 15.28 6.03 -7 7 5 10.24 6.03 -7 7 4 7.69 4.77 -7 7 3 5.15 4.79 -7 7 2 15.52 6.49 -7 7 1 5.19 4.83 -7 7 0 10.44 5.76 -7 7 -1 2.62 4.35 -7 7 -2 7.89 6.19 -7 7 -3 -2.64 4.39 -7 7 -4 -2.66 3.83 -7 7 -5 -2.67 4.97 -7 7 -6 2.69 4.47 -7 7 -7 -5.43 5.53 -7 7 -8 10.89 6.42 -7 7 -9 5.49 5.10 7 -7 10 2.04 3.39 -7 7 -10 2.76 5.13 -7 8 11 -2.44 4.54 -7 8 10 -2.38 4.42 -7 8 9 -2.32 4.31 -7 8 9 10.31 5.66 -7 8 8 2.26 4.97 -7 8 8 -2.59 4.30 -7 8 7 2.21 3.66 -7 8 7 -2.60 4.31 -7 8 6 -2.15 3.57 -7 8 6 5.20 5.71 -7 8 5 5.23 4.86 -7 8 4 2.63 4.36 -7 8 3 15.82 6.61 -7 8 2 18.53 7.35 -7 8 1 2.66 4.41 -7 8 0 5.33 5.86 -7 8 -1 58.83 12.13 -7 8 -2 -2.68 4.98 -7 8 -3 2.69 4.46 -7 8 -4 21.55 7.50 -7 8 -5 24.37 8.50 -7 8 -6 10.85 6.40 -7 8 -7 5.45 5.55 -7 8 -8 13.72 6.87 -7 8 -9 -2.76 5.62 -7 9 8 36.03 9.33 -7 9 8 37.36 9.84 -7 9 7 2.35 4.78 -7 9 7 5.36 4.46 -7 9 6 18.34 6.93 -7 9 6 18.87 7.48 -7 9 5 -2.71 4.49 -7 9 4 21.73 7.56 -7 9 3 8.17 5.55 -7 9 2 21.86 7.61 -7 9 1 2.74 4.55 -7 9 0 5.49 5.10 -7 9 -1 -2.74 4.56 -7 9 -2 13.74 7.60 -7 9 -3 2.75 5.11 -8 0 10 12.91 5.40 -8 0 9 -2.18 3.61 -8 0 8 30.87 8.34 -8 0 7 -4.45 4.89 -8 0 6 11.25 5.93 -8 0 5 -4.53 4.61 -8 0 4 79.94 12.96 -8 0 3 -2.29 3.30 -8 0 2 -2.30 5.05 -8 0 1 2.30 3.82 -8 0 0 48.40 10.25 -8 0 -1 -2.30 3.83 -8 0 -2 62.18 11.75 -8 0 -3 -4.60 5.40 -8 0 -4 6.88 4.68 -8 0 -5 4.57 5.02 -8 0 -6 9.12 5.03 -8 0 -7 2.27 4.21 -8 0 -8 4.51 4.96 8 0 8 4.17 4.91 -8 0 -9 -2.25 3.74 8 0 9 4.16 4.23 -8 0 -10 -2.25 4.18 8 0 10 12.38 5.41 8 0 11 -2.03 3.38 8 0 12 3.97 4.04 8 0 13 -1.93 3.93 8 1 -16 -5.47 5.57 -8 1 10 -2.19 4.46 8 -1 -10 2.19 4.07 -8 1 9 8.91 5.24 8 -1 -9 4.46 4.91 -8 1 8 9.04 5.94 8 -1 -8 -2.26 3.76 -8 1 7 2.28 4.65 8 -1 -7 -4.58 5.03 -8 1 6 6.92 5.07 8 -1 -6 2.32 3.85 -8 1 5 -2.33 3.86 8 -1 -5 4.67 5.13 -8 1 4 7.03 5.20 8 -1 -4 30.58 8.08 -8 -1 3 2.29 3.81 -8 1 3 -2.35 3.38 8 -1 -3 -2.36 3.92 -8 -1 2 2.30 4.27 -8 1 2 2.36 3.92 -8 -1 1 2.31 4.28 -8 1 1 -2.37 4.39 -8 -1 0 27.68 8.41 -8 1 0 14.21 7.16 -8 -1 -1 4.61 3.83 -8 1 -1 2.37 4.81 8 -1 1 -2.36 3.92 -8 -1 -2 39.20 9.25 -8 1 -2 21.30 7.69 8 -1 2 14.13 6.28 -8 1 -3 33.08 8.46 8 -1 3 25.78 7.93 -8 1 -4 2.36 3.93 8 -1 4 16.28 6.41 -8 1 -5 2.35 4.36 8 -1 5 4.62 4.29 -8 1 -6 42.17 9.63 8 -1 6 52.61 10.50 8 -1 7 30.39 7.84 -8 1 -7 27.97 7.88 8 -1 7 27.16 7.88 8 1 8 4.28 4.35 8 -1 8 -2.02 3.76 8 -1 8 4.48 4.92 -8 1 -8 2.32 5.09 8 1 9 2.15 3.99 8 -1 9 2.01 4.09 8 -1 9 3.27 3.84 8 -1 9 2.21 4.49 -8 1 -9 2.31 3.83 8 1 10 10.65 5.31 8 -1 10 1.99 3.30 8 -1 10 1.61 2.67 8 -1 10 -2.17 3.61 -8 1 -10 9.17 5.38 8 -1 11 9.75 4.88 8 -1 11 6.36 3.77 8 1 12 8.26 5.14 8 -1 12 1.90 3.53 8 -1 12 1.58 2.63 8 1 13 2.00 4.07 8 -1 13 -1.84 3.74 -8 2 10 2.28 4.24 8 -2 -10 6.29 4.92 -8 2 9 -2.32 3.86 8 -2 -9 -2.13 4.34 -8 2 8 9.44 6.28 8 -2 -8 36.82 8.30 -8 2 7 69.21 12.42 8 -2 -7 92.41 13.43 -8 2 6 4.83 4.02 8 -2 -6 6.68 4.90 -8 2 5 9.72 5.36 8 -2 -5 11.25 5.63 -8 2 4 48.96 10.49 8 -2 -4 90.67 13.45 -8 2 3 2.46 4.10 8 -2 -3 20.54 6.84 -8 2 2 7.40 5.05 8 -2 -2 16.02 6.60 -8 2 1 32.15 8.66 8 -2 -1 38.94 9.30 -8 2 0 34.69 9.23 8 -2 0 52.67 10.29 -8 2 -1 17.35 6.54 8 -2 1 9.14 5.05 -8 2 -2 2.48 4.60 8 -2 2 -2.27 4.62 -8 2 -3 2.48 4.60 8 -2 3 -2.26 3.75 -8 2 -4 4.94 4.60 8 -2 4 8.96 5.27 -8 2 -5 7.40 6.48 8 -2 5 -2.22 3.69 8 -2 6 -1.97 4.33 -8 2 -6 7.37 5.77 8 -2 6 8.79 5.16 8 -2 7 3.94 4.01 -8 2 -7 4.90 4.07 8 -2 7 2.17 3.61 8 -2 8 11.73 5.39 -8 2 -8 2.44 4.53 8 -2 8 6.43 4.37 8 2 9 2.21 4.10 8 -2 9 -1.93 3.93 8 -2 9 4.22 4.30 -8 2 -9 4.84 4.92 8 2 10 2.19 3.65 8 -2 10 3.80 3.54 8 -2 10 6.97 4.35 8 -2 10 18.66 6.45 -8 2 -10 4.80 5.28 8 2 11 2.16 4.02 8 -2 11 3.72 3.78 8 -2 11 5.14 4.50 8 2 12 -2.12 3.94 8 -2 12 -1.80 3.34 8 -2 12 -1.70 4.22 8 2 13 2.06 3.83 8 -2 13 5.24 3.84 8 -2 13 6.72 3.95 8 -2 14 -1.66 3.65 -8 -3 13 1.88 3.82 -8 -3 12 28.99 7.33 -8 3 10 11.98 5.69 8 -3 -10 25.76 7.22 -8 3 9 4.86 4.04 8 -3 -9 2.03 3.76 -8 3 8 14.77 6.51 8 -3 -8 16.57 5.76 -8 3 7 2.49 4.13 8 -3 -7 6.34 4.97 -8 3 6 77.80 13.11 8 -3 -6 57.73 10.74 -8 3 5 -2.52 4.19 8 -3 -5 2.17 4.40 -8 3 4 22.88 7.67 8 -3 -4 17.46 6.36 -8 3 3 15.33 7.08 8 -3 -3 15.36 6.09 -8 3 2 12.81 6.04 8 -3 -2 8.84 4.88 -8 3 1 2.57 4.27 8 -3 -1 2.21 3.68 -8 3 0 2.57 4.28 8 -3 0 6.63 4.86 -8 3 -1 28.41 8.20 8 -3 1 39.70 8.95 -8 3 -2 2.59 4.80 8 -3 2 4.39 4.83 -8 3 -3 56.93 11.05 8 -3 3 45.77 9.92 8 -3 4 -1.91 4.20 -8 3 -4 2.59 4.80 8 -3 4 -2.16 5.08 8 -3 5 5.75 3.93 -8 3 -5 20.69 7.45 8 -3 5 8.55 5.35 8 -3 6 -1.91 3.54 -8 3 -6 -2.58 4.80 8 -3 6 4.23 4.65 8 -3 7 28.38 7.57 -8 3 -7 25.80 7.91 8 -3 8 7.48 4.67 -8 3 -8 2.57 4.79 8 -3 8 10.27 5.40 8 3 9 2.25 3.74 8 -3 9 -1.83 4.30 8 -3 9 2.01 4.09 -8 3 -9 5.13 4.76 8 3 10 2.24 3.73 8 -3 10 -1.79 4.46 8 -3 10 1.87 4.11 8 -3 10 -1.97 3.66 -8 3 -10 2.55 5.19 8 3 11 6.63 5.25 8 -3 11 22.65 6.19 8 -3 11 25.68 6.86 8 3 12 -4.33 5.08 8 -3 12 1.69 3.45 8 -3 12 1.81 3.68 8 3 13 4.19 4.92 8 -3 13 -1.80 3.94 -8 -4 14 11.57 5.34 -8 -4 13 -1.97 4.01 -8 -4 12 4.04 3.76 -8 4 10 4.98 5.07 8 -4 -10 5.62 4.67 -8 4 9 2.53 3.65 8 -4 -9 17.24 5.29 -8 4 8 -2.56 4.74 8 -4 -8 3.92 4.60 -8 4 7 2.58 3.71 8 -4 -7 4.00 3.71 -8 4 6 -2.60 4.84 8 -4 -6 8.09 4.75 -8 4 5 -2.62 4.35 8 -4 -5 -2.06 3.42 -8 4 4 2.64 3.80 8 -4 -4 8.32 4.89 -8 4 3 5.31 5.84 8 -4 -3 6.27 4.60 -8 4 2 34.64 9.30 8 -4 -2 35.70 8.55 -8 4 1 8.02 5.88 8 -4 -1 2.12 3.94 -8 4 0 2.68 4.98 8 -4 0 2.12 3.52 -8 4 -1 21.52 7.87 8 -4 1 33.60 7.73 -8 4 -2 75.59 13.48 8 -4 2 79.52 12.32 8 -4 3 5.57 4.08 -8 4 -3 -2.70 4.49 8 -4 3 -2.08 4.23 8 -4 4 3.71 4.08 -8 4 -4 2.71 4.50 8 -4 4 2.07 3.43 8 -4 5 9.20 5.09 -8 4 -5 10.84 6.76 8 -4 5 8.12 5.08 8 -4 6 49.16 9.39 -8 4 -6 46.06 10.82 8 -4 6 46.24 9.46 8 -4 7 21.55 6.72 -8 4 -7 18.96 7.16 8 -4 7 11.85 5.50 8 -4 8 54.49 9.41 -8 4 -8 46.01 10.80 8 -4 8 38.71 8.52 8 4 9 4.57 4.65 8 -4 9 8.60 4.52 -8 4 -9 -2.70 5.02 8 -4 9 5.73 4.76 -8 4 -10 2.69 3.87 8 4 10 -2.28 4.22 8 -4 10 -1.66 3.09 8 4 11 6.70 5.25 8 -4 11 6.47 4.04 8 -4 11 1.94 3.24 8 4 12 4.36 4.45 8 -4 12 6.34 4.37 -8 -5 12 10.43 5.77 -8 -5 11 -2.14 3.97 -8 5 10 2.59 5.27 8 -5 -10 5.51 4.83 -8 5 9 15.73 6.98 8 -5 -9 29.82 7.18 -8 5 8 7.95 5.85 8 -5 -8 13.22 5.23 -8 5 7 2.67 3.84 8 -5 -7 -1.91 4.20 -8 5 6 2.70 3.88 8 -5 -6 1.94 3.60 -8 5 5 29.88 8.28 8 -5 -5 31.35 7.62 -8 5 4 2.73 4.54 8 -5 -4 -3.98 4.37 -8 5 3 2.75 3.96 8 -5 -3 8.01 4.40 -8 5 2 -2.77 5.13 8 -5 -2 2.01 4.09 -8 5 1 11.11 6.15 8 -5 -1 18.14 5.85 -8 5 0 2.79 4.63 8 -5 0 -2.02 3.74 -8 5 -1 -5.60 5.70 8 -5 1 2.01 3.74 -8 5 -2 2.81 4.69 8 -5 2 20.07 6.47 -8 5 -3 22.55 8.14 8 -5 3 9.98 4.74 -8 5 -4 2.82 5.26 8 -5 4 13.89 5.48 -8 5 -5 2.83 6.64 8 -5 5 -1.96 3.63 -8 5 -6 2.83 5.76 8 -5 6 -1.94 3.94 -8 5 -7 2.83 4.70 8 -5 7 5.73 3.89 -8 5 -8 2.83 5.75 8 -5 8 -1.89 3.84 8 -5 8 6.43 4.43 -8 5 -9 5.65 6.63 8 -5 9 1.86 3.47 8 -5 9 6.27 3.91 8 5 10 13.69 6.31 8 -5 10 12.26 5.29 8 5 11 13.38 6.68 8 -5 11 3.01 3.07 8 5 12 2.17 3.60 -8 6 9 -2.71 4.50 -8 6 8 2.74 4.55 -8 6 7 2.76 5.12 -8 6 6 -2.78 4.62 -8 6 5 16.80 7.40 -8 6 4 5.64 5.74 -8 6 3 -2.84 4.08 -8 6 2 2.85 5.30 -8 6 1 11.47 6.33 -8 6 0 2.88 5.35 -8 6 -1 11.57 7.23 -8 6 -2 2.90 5.39 -8 6 -3 14.56 7.29 -8 6 -4 -2.92 4.85 -8 6 -5 58.55 12.52 -8 6 -6 8.79 6.45 -8 6 -7 8.80 5.98 -8 6 -8 2.93 5.97 -8 6 -9 35.12 10.18 -8 7 9 5.58 6.56 -8 7 8 -2.82 5.23 -8 7 7 -2.84 4.09 -8 7 6 11.46 6.75 -8 7 5 37.25 9.99 -8 7 4 2.88 5.35 -8 7 3 -5.80 6.38 -8 7 2 2.92 4.85 -8 7 1 17.58 7.35 -8 7 0 2.94 5.47 -8 7 -1 14.77 6.53 -8 7 -2 5.93 6.52 -8 7 -3 14.87 7.44 -8 7 -4 3.00 5.57 -8 7 -5 -6.01 6.12 9 0 -9 37.90 9.58 -9 0 8 2.45 4.99 -9 0 7 66.83 12.29 -9 0 6 -2.49 4.14 -9 0 5 5.02 5.52 -9 0 4 2.52 5.12 -9 0 3 159.19 19.47 -9 0 2 5.08 4.23 -9 0 1 35.64 9.39 -9 0 0 2.55 3.66 -9 0 -1 12.73 6.38 -9 0 -2 2.53 4.21 -9 0 -3 -2.53 5.15 -9 0 -4 2.53 4.20 -9 0 -5 -2.52 4.69 -9 0 -6 -2.52 5.13 -9 0 -7 2.52 4.18 9 0 7 12.89 6.77 9 0 7 2.22 3.70 9 0 8 -5.10 6.69 9 0 9 -2.52 5.12 -9 1 9 2.45 4.08 9 -1 -9 17.00 6.99 -9 1 8 14.90 6.53 9 -1 -8 2.46 4.59 -9 1 7 2.51 4.66 9 -1 -7 2.49 4.63 -9 1 6 2.54 3.65 9 -1 -6 2.52 4.19 -9 1 5 17.86 6.74 9 -1 -5 10.17 6.01 -9 1 4 12.86 6.05 9 -1 -4 5.12 5.22 -9 1 3 10.32 6.44 9 -1 -3 5.14 5.66 -9 1 2 15.52 7.14 9 -1 -2 5.15 4.80 -9 1 1 -2.59 4.30 9 -1 -1 5.16 4.79 -9 1 0 -2.59 5.28 9 -1 0 5.16 5.24 -9 1 -1 -2.60 4.82 9 -1 1 -2.57 4.27 -9 1 -2 2.59 4.30 9 -1 2 -2.56 4.75 -9 1 -3 12.95 6.45 9 -1 3 -5.10 5.19 -9 1 -4 20.64 7.44 9 -1 4 5.07 5.59 -9 1 -5 30.93 8.91 9 -1 5 20.13 7.64 -9 1 -6 5.13 4.76 9 -1 6 2.49 4.63 9 -1 6 2.17 3.60 -9 1 -7 2.56 4.26 9 -1 7 12.33 6.15 9 -1 7 8.67 5.41 -9 1 -8 7.63 5.19 9 -1 8 7.31 5.36 9 -1 8 6.46 5.38 -9 1 -9 -5.06 4.21 9 -1 9 -2.40 4.89 -9 2 9 5.03 4.67 9 -2 -9 2.33 4.33 -9 2 8 2.55 4.74 9 -2 -8 7.11 5.57 -9 2 7 2.59 4.30 9 -2 -7 2.40 4.46 -9 2 6 5.22 4.84 9 -2 -6 -2.43 4.03 -9 2 5 2.63 4.88 9 -2 -5 -2.45 4.06 -9 2 4 5.30 5.41 9 -2 -4 12.35 6.16 -9 2 3 42.60 10.37 9 -2 -3 44.64 10.12 -9 2 2 16.03 7.03 9 -2 -2 7.46 5.09 -9 2 1 -2.68 5.44 9 -2 -1 2.49 4.13 -9 2 0 32.16 9.11 9 -2 0 44.77 10.30 -9 2 -1 24.14 8.41 9 -2 1 19.85 7.51 -9 2 -2 5.37 5.00 9 -2 2 14.82 7.11 -9 2 -3 -2.68 4.45 9 -2 3 2.46 4.56 -9 2 -4 32.04 9.26 9 -2 4 26.78 8.22 -9 2 -5 18.68 7.50 9 -2 5 29.71 7.63 -9 2 -6 -2.66 4.41 9 -2 6 2.39 4.44 9 -2 6 2.12 3.94 -9 2 -7 -2.65 4.92 9 -2 7 -2.36 4.39 9 -2 7 -2.10 3.49 9 -2 8 9.33 5.81 -9 2 -8 2.64 3.80 9 -2 9 7.51 4.42 9 -2 9 4.59 4.27 -9 2 -9 2.62 5.34 9 -3 -9 -2.21 4.11 -9 3 9 7.84 5.31 9 -3 -8 -2.26 4.60 -9 3 8 2.65 4.93 9 -3 -7 9.21 5.74 -9 3 7 -2.69 3.87 9 -3 -6 -2.33 4.32 -9 3 6 2.71 4.50 9 -3 -5 9.46 5.56 -9 3 5 2.73 3.94 9 -3 -4 2.38 3.95 -9 3 4 -2.75 4.57 9 -3 -3 9.57 5.63 -9 3 3 2.77 4.60 9 -3 -2 2.40 3.46 -9 3 2 5.56 6.10 9 -3 -1 9.64 6.00 -9 3 1 -2.79 5.66 9 -3 0 28.89 8.80 -9 3 0 19.56 8.13 9 -3 1 14.37 6.66 -9 3 -1 25.17 8.43 9 -3 2 -2.38 3.96 -9 3 -2 2.80 4.65 9 -3 3 16.60 6.56 -9 3 -3 8.41 5.73 9 -3 4 24.97 7.51 9 -3 4 30.58 8.67 -9 3 -4 50.36 11.02 9 -3 5 8.30 5.18 9 -3 5 20.87 7.22 -9 3 -5 2.80 5.21 9 -3 6 -2.05 3.81 9 -3 6 -2.29 5.04 -9 3 -6 -2.79 4.63 9 -3 7 2.03 3.78 9 -3 7 2.26 4.59 -9 3 -7 8.34 5.66 9 -3 8 26.75 7.51 -9 3 -8 22.11 8.05 9 -4 -9 4.22 4.63 -9 4 9 2.71 4.51 9 -4 -8 2.14 4.70 -9 4 8 5.49 5.58 9 -4 -7 2.18 4.43 -9 4 7 -2.77 5.15 9 -4 -6 13.33 6.67 -9 4 6 8.39 5.22 9 -4 -5 -2.24 3.72 -9 4 5 11.28 7.02 9 -4 -4 4.51 5.62 -9 4 4 2.84 5.78 9 -4 -3 2.29 4.25 -9 4 3 2.85 4.10 9 -4 -2 48.23 10.43 -9 4 2 25.79 9.39 9 -4 -1 4.60 4.28 -9 4 1 11.51 7.18 9 -4 0 18.39 6.94 -9 4 0 17.33 6.84 9 -4 1 4.59 5.04 -9 4 -1 -2.90 6.36 9 -4 2 25.10 7.67 -9 4 -2 20.30 7.70 9 -4 3 13.49 6.20 -9 4 -3 2.91 4.84 9 -4 4 20.09 6.46 -9 4 -4 8.72 5.95 9 -4 5 29.88 7.73 9 -4 6 11.80 5.20 9 -4 7 7.74 4.84 0 0 0 0.00 0.00 TITL Ex-JMSO2 in P2(1)/n REM P2(1)/n (#14 in standard setting) CELL 0.71073 7.735533 10.899687 21.289965 90.0000 92.2618 90.0000 ZERR 17.00 0.000397 0.000475 0.000986 0.0000 0.0039 0.0000 LATT 1 SYMM -x+1/2, y+1/2,-z+1/2 SFAC C H N O F S Cl UNIT 17.00 17.00 17.00 17.00 17.00 17.00 17.00 TREF HKLF 4 END _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' ; _shelx_hkl_checksum 3527 _olex2_submission_special_instructions 'No special instructions were received' _oxdiff_exptl_absorpt_empirical_details ; Empirical correction (ABSPACK) includes: - Absorption correction using spherical harmonics - Frame scaling ; _oxdiff_exptl_absorpt_empirical_full_max 1.646 _oxdiff_exptl_absorpt_empirical_full_min 0.373 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -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_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 S2 S -0.47518(10) 0.87339(7) 0.40715(3) 0.0450(2) Uani 1 1 d . . . . . S1 S 0.73273(10) 0.29086(7) 0.37732(4) 0.0458(2) Uani 1 1 d . . . . . Cl1 Cl 0.33809(15) 0.22870(10) 0.26301(5) 0.0920(4) Uani 1 1 d . . . . . O2 O 0.7725(3) 0.38119(18) 0.42401(10) 0.0593(6) Uani 1 1 d . . . . . O1 O 0.7389(3) 0.3225(2) 0.31258(10) 0.0663(7) Uani 1 1 d . . . . . F2 F -0.3240(3) 0.66073(18) 0.41807(10) 0.0870(7) Uani 1 1 d . . . . . F4 F -0.5109(3) 0.6708(2) 0.34301(10) 0.0907(7) Uani 1 1 d . . . . . F3 F -0.2656(3) 0.7573(2) 0.33591(10) 0.0920(7) Uani 1 1 d . . . . . N2 N 0.9923(3) 0.1588(2) 0.44175(11) 0.0415(6) Uani 1 1 d . . . . . O3 O -0.3245(3) 0.9320(2) 0.43403(10) 0.0661(7) Uani 1 1 d . . . . . O5 O -0.5487(3) 0.9355(2) 0.35318(10) 0.0705(7) Uani 1 1 d . . . . . N1 N 0.9303(3) 0.0854(2) 0.34883(11) 0.0495(7) Uani 1 1 d . . . . . O4 O -0.5969(4) 0.8309(3) 0.45056(12) 0.0870(8) Uani 1 1 d . . . . . F1 F 0.0219(3) 0.5805(2) 0.35431(13) 0.1219(10) Uani 1 1 d . . . . . C7 C 0.3916(4) 0.3147(2) 0.38157(14) 0.0415(7) Uani 1 1 d . . . . . C1 C 0.8866(4) 0.1710(3) 0.39037(13) 0.0425(7) Uani 1 1 d . . . . . C6 C 0.5315(4) 0.2216(3) 0.39273(14) 0.0435(7) Uani 1 1 d . . . . . H6A H 0.511763 0.151575 0.365239 0.052 Uiso 1 1 calc R U . . . H6B H 0.531837 0.193147 0.435910 0.052 Uiso 1 1 calc R U . . . C13 C -0.3908(5) 0.7334(3) 0.37421(15) 0.0533(8) Uani 1 1 d . . . . . C4 C 0.9916(4) 0.2288(3) 0.50078(14) 0.0542(9) Uani 1 1 d . . . . . H4A H 1.025162 0.312093 0.493017 0.081 Uiso 1 1 calc R U . . . H4B H 1.071792 0.192493 0.530916 0.081 Uiso 1 1 calc R U . . . H4C H 0.877538 0.227595 0.516940 0.081 Uiso 1 1 calc R U . . . C3 C 1.0649(4) 0.0192(3) 0.37476(16) 0.0574(9) Uani 1 1 d . . . . . H3 H 1.120059 -0.046264 0.355934 0.069 Uiso 1 1 calc R U . . . C2 C 1.1034(4) 0.0646(3) 0.43177(16) 0.0543(9) Uani 1 1 d . . . . . H2 H 1.190463 0.036874 0.459651 0.065 Uiso 1 1 calc R U . . . C8 C 0.2989(4) 0.3260(3) 0.32477(14) 0.0510(8) Uani 1 1 d . . . . . C12 C 0.3547(4) 0.3958(3) 0.42897(15) 0.0573(9) Uani 1 1 d . . . . . H12 H 0.415397 0.390231 0.467447 0.069 Uiso 1 1 calc R U . . . C9 C 0.1724(4) 0.4158(4) 0.31565(19) 0.0681(10) Uani 1 1 d . . . . . H9 H 0.109588 0.422453 0.277650 0.082 Uiso 1 1 calc R U . . . C10 C 0.1437(5) 0.4931(3) 0.3641(2) 0.0748(12) Uani 1 1 d . . . . . C11 C 0.2295(5) 0.4852(3) 0.4204(2) 0.0735(11) Uani 1 1 d . . . . . H11 H 0.204756 0.538865 0.452809 0.088 Uiso 1 1 calc R U . . . C5 C 0.8433(5) 0.0579(3) 0.28738(14) 0.0740(11) Uani 1 1 d . . . . . H5A H 0.723026 0.041518 0.293188 0.111 Uiso 1 1 calc R U . . . H5B H 0.896123 -0.012753 0.269201 0.111 Uiso 1 1 calc R U . . . H5C H 0.854241 0.126933 0.259852 0.111 Uiso 1 1 calc R U . . . 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 S2 0.0421(5) 0.0459(4) 0.0467(5) -0.0033(3) 0.0003(4) 0.0088(4) S1 0.0408(5) 0.0420(4) 0.0544(5) 0.0127(4) -0.0013(4) 0.0061(4) Cl1 0.1030(9) 0.1000(8) 0.0701(7) -0.0260(5) -0.0345(6) 0.0201(7) O2 0.0499(15) 0.0425(12) 0.0844(16) -0.0043(11) -0.0115(11) 0.0048(11) O1 0.0680(17) 0.0751(15) 0.0559(14) 0.0330(12) 0.0042(11) 0.0118(13) F2 0.115(2) 0.0573(12) 0.0872(15) 0.0082(11) -0.0134(13) 0.0304(13) F4 0.0995(18) 0.0782(14) 0.0927(16) -0.0296(12) -0.0184(13) -0.0102(14) F3 0.0947(18) 0.0921(16) 0.0927(16) -0.0117(12) 0.0472(14) 0.0156(14) N2 0.0334(15) 0.0422(14) 0.0491(16) 0.0073(11) 0.0027(11) 0.0042(12) O3 0.0580(16) 0.0581(14) 0.0802(16) -0.0194(11) -0.0242(12) 0.0103(12) O5 0.0745(17) 0.0598(14) 0.0752(16) 0.0095(11) -0.0237(12) 0.0178(13) N1 0.0529(18) 0.0525(15) 0.0435(16) 0.0028(12) 0.0061(12) 0.0071(14) O4 0.084(2) 0.0993(19) 0.0813(17) -0.0017(15) 0.0440(15) 0.0060(16) F1 0.0814(19) 0.0887(17) 0.199(3) 0.0553(17) 0.0436(18) 0.0533(15) C7 0.0346(18) 0.0408(16) 0.0491(19) 0.0042(14) 0.0022(14) 0.0033(14) C1 0.042(2) 0.0421(16) 0.0435(18) 0.0113(14) 0.0029(14) 0.0026(14) C6 0.0408(19) 0.0402(16) 0.0494(18) 0.0061(13) -0.0006(14) 0.0038(14) C13 0.060(2) 0.0509(19) 0.048(2) -0.0011(16) 0.0008(18) 0.0023(18) C4 0.051(2) 0.058(2) 0.052(2) 0.0009(16) -0.0103(15) 0.0028(17) C3 0.050(2) 0.0524(19) 0.071(2) 0.0074(18) 0.0127(17) 0.0189(17) C2 0.038(2) 0.058(2) 0.067(2) 0.0094(17) 0.0003(16) 0.0134(16) C8 0.044(2) 0.0478(18) 0.061(2) 0.0054(15) -0.0065(15) 0.0039(16) C12 0.058(2) 0.060(2) 0.055(2) -0.0002(17) 0.0144(17) 0.0017(18) C9 0.043(2) 0.072(2) 0.088(3) 0.027(2) -0.0091(19) 0.004(2) C10 0.050(3) 0.057(2) 0.120(4) 0.030(2) 0.030(2) 0.018(2) C11 0.075(3) 0.061(2) 0.087(3) 0.000(2) 0.037(2) 0.014(2) C5 0.095(3) 0.080(3) 0.047(2) -0.0044(18) 0.001(2) 0.009(2) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 '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' 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 O3 S2 O5 113.71(15) . . ? O3 S2 C13 103.34(15) . . ? O5 S2 C13 103.03(14) . . ? O4 S2 O3 115.82(16) . . ? O4 S2 O5 115.02(17) . . ? O4 S2 C13 103.62(16) . . ? O2 S1 C1 105.89(13) . . ? O2 S1 C6 109.42(14) . . ? O1 S1 O2 119.60(14) . . ? O1 S1 C1 106.31(14) . . ? O1 S1 C6 110.21(14) . . ? C6 S1 C1 104.18(13) . . ? C1 N2 C4 128.4(2) . . ? C1 N2 C2 108.3(3) . . ? C2 N2 C4 123.3(3) . . ? C1 N1 C3 108.0(3) . . ? C1 N1 C5 127.5(3) . . ? C3 N1 C5 124.3(3) . . ? C8 C7 C6 123.0(3) . . ? C12 C7 C6 119.2(3) . . ? C12 C7 C8 117.7(3) . . ? N2 C1 S1 125.4(2) . . ? N1 C1 S1 126.4(2) . . ? N1 C1 N2 107.9(3) . . ? C7 C6 S1 108.47(19) . . ? F2 C13 S2 111.7(2) . . ? F2 C13 F3 106.4(3) . . ? F4 C13 S2 112.0(2) . . ? F4 C13 F2 107.3(3) . . ? F4 C13 F3 108.2(3) . . ? F3 C13 S2 111.0(2) . . ? C2 C3 N1 108.2(3) . . ? C3 C2 N2 107.6(3) . . ? C7 C8 Cl1 120.6(2) . . ? C7 C8 C9 121.4(3) . . ? C9 C8 Cl1 118.0(3) . . ? C11 C12 C7 121.3(3) . . ? C10 C9 C8 117.8(3) . . ? F1 C10 C9 117.1(4) . . ? F1 C10 C11 119.8(4) . . ? C11 C10 C9 123.1(4) . . ? C10 C11 C12 118.7(3) . . ? 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 S2 O3 1.429(2) . ? S2 O5 1.432(2) . ? S2 O4 1.423(2) . ? S2 C13 1.812(3) . ? S1 O2 1.424(2) . ? S1 O1 1.423(2) . ? S1 C1 1.782(3) . ? S1 C6 1.772(3) . ? Cl1 C8 1.725(3) . ? F2 C13 1.315(3) . ? F4 C13 1.312(4) . ? F3 C13 1.316(4) . ? N2 C1 1.346(4) . ? N2 C4 1.470(4) . ? N2 C2 1.362(4) . ? N1 C1 1.338(4) . ? N1 C3 1.365(4) . ? N1 C5 1.478(4) . ? F1 C10 1.350(4) . ? C7 C6 1.496(4) . ? C7 C8 1.387(4) . ? C7 C12 1.380(4) . ? C3 C2 1.334(4) . ? C8 C9 1.392(5) . ? C12 C11 1.380(5) . ? C9 C10 1.357(5) . ? C10 C11 1.351(5) . ?