#------------------------------------------------------------------------------ #$Date: 2020-01-15 02:24:57 +0200 (Wed, 15 Jan 2020) $ #$Revision: 246844 $ #$URL: file:///home/coder/svn-repositories/cod/cif/4/03/78/4037816.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_4037816 loop_ _publ_author_name 'Jiang, Wei' 'Zhuge, Juanping' 'Li, Jianxiao' 'Histand, Gary' 'Lin, Dongen' _publ_section_title ; Direct Sulfenylation of the Purines C8-H Bond with Thiophenols. ; _journal_name_full 'The Journal of organic chemistry' _journal_paper_doi 10.1021/acs.joc.9b03115 _journal_year 2020 _chemical_formula_moiety 'C14 H12 F2 N4 S2' _chemical_formula_sum 'C14 H12 F2 N4 S2' _chemical_formula_weight 338.40 _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_date 2019-07-11 _audit_creation_method ; Olex2 1.2 (compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506) ; _cell_angle_alpha 104.662(7) _cell_angle_beta 93.314(7) _cell_angle_gamma 98.017(7) _cell_formula_units_Z 2 _cell_length_a 8.0145(7) _cell_length_b 8.3149(6) _cell_length_c 11.3067(9) _cell_measurement_reflns_used 4105 _cell_measurement_temperature 100.00(10) _cell_measurement_theta_max 29.2640 _cell_measurement_theta_min 2.5410 _cell_volume 718.40(10) _computing_cell_refinement 'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)' _computing_data_collection 'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)' _computing_data_reduction 'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)' _computing_molecular_graphics 'Olex2 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 (Dolomanov et al., 2009)' _computing_structure_refinement 'ShelXL (Sheldrick, 2015)' _computing_structure_solution 'ShelXT (Sheldrick, 2015)' _diffrn_ambient_environment N~2~ _diffrn_ambient_temperature 100.00(10) _diffrn_detector 'CCD plate' _diffrn_detector_area_resol_mean 5.2684 _diffrn_detector_type AtlasS2 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 1.000 _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 -40.00 62.00 1.00 1.00 -- -11.59 57.00 60.00 102 2 \w -85.00 17.00 1.00 1.00 -- -11.59 -57.00 -90.00 102 3 \w -21.00 88.00 1.00 1.00 -- 11.74 77.00-180.00 109 4 \w -20.00 53.00 1.00 1.00 -- 11.74 -99.00-150.00 73 5 \w -16.00 23.00 1.00 1.00 -- 11.74 57.00 90.00 39 6 \w 34.00 99.00 1.00 1.00 -- 11.74-178.00 30.00 65 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'SuperNova, Dual, Cu at zero, AtlasS2' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 -0.0086623000 _diffrn_orient_matrix_UB_12 0.0088284000 _diffrn_orient_matrix_UB_13 -0.0607287000 _diffrn_orient_matrix_UB_21 -0.0106418000 _diffrn_orient_matrix_UB_22 -0.0887619000 _diffrn_orient_matrix_UB_23 -0.0234840000 _diffrn_orient_matrix_UB_31 -0.0887461000 _diffrn_orient_matrix_UB_32 -0.0046395000 _diffrn_orient_matrix_UB_33 0.0023353000 _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0344 _diffrn_reflns_av_unetI/netI 0.0401 _diffrn_reflns_Laue_measured_fraction_full 1.000 _diffrn_reflns_Laue_measured_fraction_max 1.000 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_h_min -9 _diffrn_reflns_limit_k_max 9 _diffrn_reflns_limit_k_min -9 _diffrn_reflns_limit_l_max 13 _diffrn_reflns_limit_l_min -13 _diffrn_reflns_number 8127 _diffrn_reflns_point_group_measured_fraction_full 1.000 _diffrn_reflns_point_group_measured_fraction_max 1.000 _diffrn_reflns_theta_full 25.000 _diffrn_reflns_theta_max 25.000 _diffrn_reflns_theta_min 2.565 _diffrn_source 'micro-focus sealed X-ray tube' _diffrn_source_type 'SuperNova (Mo) X-ray Source' _exptl_absorpt_coefficient_mu 0.394 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.79771 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.38.43f (Rigaku Oxford Diffraction, 2015) 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 1.564 _exptl_crystal_description block _exptl_crystal_F_000 348 _exptl_crystal_size_max 0.15 _exptl_crystal_size_mid 0.14 _exptl_crystal_size_min 0.12 _refine_diff_density_max 0.275 _refine_diff_density_min -0.341 _refine_diff_density_rms 0.067 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.089 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 201 _refine_ls_number_reflns 2534 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.089 _refine_ls_R_factor_all 0.0426 _refine_ls_R_factor_gt 0.0358 _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^)+(0.0409P)^2^+0.2566P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0857 _refine_ls_wR_factor_ref 0.0907 _reflns_Friedel_coverage 0.000 _reflns_number_gt 2207 _reflns_number_total 2534 _reflns_threshold_expression 'I > 2\s(I)' _iucr_refine_instructions_details ; TITL jw-19-3_a.res in P-1 jw-19-3.res created by SHELXL-2018/3 at 13:43:19 on 11-Jul-2019 REM Old TITL jw-19-3 in P-1 REM SHELXT solution in P-1: R1 0.091, Rweak 0.005, Alpha 0.033 REM 0.000 for 0 systematic absences, Orientation as input REM Formula found by SHELXT: C14 N4 S2 F2 CELL 0.71073 8.0145 8.3149 11.3067 104.662 93.314 98.017 ZERR 2 0.0007 0.0006 0.0009 0.007 0.007 0.007 LATT 1 SFAC C H F N S UNIT 28 24 4 8 4 L.S. 10 PLAN 20 BOND $H list 4 fmap 2 acta OMIT -3 50 REM REM REM WGHT 0.040900 0.256600 FVAR 0.70200 S2 5 0.261330 0.305588 0.101139 11.00000 0.01686 0.01944 = 0.01703 0.00005 0.00014 0.00262 S1 5 0.784468 0.757833 0.487672 11.00000 0.01408 0.02227 = 0.01693 0.00036 0.00181 0.00386 F1 3 0.814303 0.071373 0.136056 11.00000 0.02376 0.03209 = 0.02191 0.00606 -0.00084 0.01054 F2 3 0.894508 0.111506 -0.082592 11.00000 0.02081 0.02575 = 0.03011 0.00507 0.01026 0.00653 N3 4 0.199068 0.519914 0.309717 11.00000 0.01265 0.01713 = 0.01510 0.00553 0.00058 0.00135 N1 4 0.503351 0.856599 0.583650 11.00000 0.01876 0.02098 = 0.01315 0.00457 0.00183 0.00712 N4 4 0.479651 0.522934 0.291088 11.00000 0.01646 0.01493 = 0.01261 0.00280 0.00201 0.00368 N2 4 0.214625 0.741224 0.499746 11.00000 0.01817 0.02378 = 0.01332 0.00630 0.00347 0.00679 C3 1 0.454882 0.640656 0.397863 11.00000 0.01671 0.01420 = 0.01362 0.00694 0.00379 0.00342 C4 1 0.282537 0.640155 0.409421 11.00000 0.01917 0.01819 = 0.01201 0.00745 0.00344 0.00543 C5 1 0.324655 0.456593 0.241886 11.00000 0.01715 0.01606 = 0.01425 0.00671 0.00340 0.00337 C10 1 0.708990 0.141240 0.072745 11.00000 0.01826 0.01514 = 0.01739 0.00211 -0.00340 0.00120 C9 1 0.564244 0.188547 0.119772 11.00000 0.01923 0.01581 = 0.01007 -0.00078 -0.00019 -0.00018 AFIX 43 H9 2 0.537164 0.174872 0.195885 11.00000 -1.20000 AFIX 0 C8 1 0.459098 0.257288 0.051210 11.00000 0.01812 0.01131 = 0.01649 0.00063 0.00155 -0.00051 C2 1 0.566328 0.753017 0.491445 11.00000 0.01717 0.01434 = 0.01439 0.00717 0.00121 0.00412 C7 1 -0.063338 0.561782 0.199377 11.00000 0.01519 0.02341 = 0.02302 0.00451 0.00119 0.00239 AFIX 137 H7A 2 -0.018077 0.535070 0.121242 11.00000 -1.50000 H7B 2 -0.037419 0.680972 0.235972 11.00000 -1.50000 H7C 2 -0.183906 0.527580 0.188049 11.00000 -1.50000 AFIX 0 C1 1 0.334258 0.844590 0.580787 11.00000 0.01991 0.02206 = 0.01393 0.00299 0.00206 0.00872 AFIX 43 H1 2 0.295088 0.919580 0.644899 11.00000 -1.20000 AFIX 0 C6 1 0.014978 0.469368 0.283215 11.00000 0.01127 0.02087 = 0.02178 0.00460 0.00104 -0.00208 AFIX 23 H6A 2 -0.036879 0.490941 0.359925 11.00000 -1.20000 H6B 2 -0.009786 0.349220 0.244864 11.00000 -1.20000 AFIX 0 C13 1 0.497673 0.275123 -0.063385 11.00000 0.02383 0.01539 = 0.02091 0.00541 0.00031 0.00342 AFIX 43 H13 2 0.426154 0.321381 -0.108592 11.00000 -1.20000 AFIX 0 C11 1 0.749892 0.159386 -0.040580 11.00000 0.01969 0.01295 = 0.02117 -0.00020 0.00583 -0.00044 C14 1 0.865370 0.918627 0.626158 11.00000 0.01812 0.02152 = 0.02000 -0.00009 -0.00152 0.00149 AFIX 137 H14A 2 0.832210 1.023489 0.621211 11.00000 -1.50000 H14B 2 0.986660 0.930918 0.635682 11.00000 -1.50000 H14C 2 0.820382 0.887222 0.695431 11.00000 -1.50000 AFIX 0 C12 1 0.643656 0.223515 -0.110170 11.00000 0.02964 0.01920 = 0.01910 0.00743 0.00943 0.00230 AFIX 43 H12 2 0.669244 0.232247 -0.187714 11.00000 -1.20000 AFIX 0 HKLF 4 REM jw-19-3_a.res in P-1 REM wR2 = 0.0907, GooF = S = 1.089, Restrained GooF = 1.089 for all data REM R1 = 0.0358 for 2207 Fo > 4sig(Fo) and 0.0426 for all 2534 data REM 201 parameters refined using 0 restraints END WGHT 0.0403 0.2623 REM Highest difference peak 0.275, deepest hole -0.341, 1-sigma level 0.067 Q1 1 0.5195 0.6530 0.4662 11.00000 0.05 0.27 Q2 1 0.4964 0.3194 0.0232 11.00000 0.05 0.27 Q3 1 0.3815 0.2749 0.0838 11.00000 0.05 0.27 Q4 1 0.8199 0.8568 0.4423 11.00000 0.05 0.26 Q5 1 0.2889 0.3832 0.1796 11.00000 0.05 0.26 Q6 1 0.6642 0.7618 0.4890 11.00000 0.05 0.25 Q7 1 0.4821 0.5880 0.3661 11.00000 0.05 0.24 Q8 1 0.7593 0.6212 0.4804 11.00000 0.05 0.21 Q9 1 0.2380 0.1590 0.0934 11.00000 0.05 0.21 Q10 1 0.6133 0.1418 0.0757 11.00000 0.05 0.21 Q11 1 0.7709 0.6452 0.5359 11.00000 0.05 0.21 Q12 1 0.5653 -0.0214 0.0025 11.00000 0.05 0.21 Q13 1 0.1378 0.3187 0.1268 11.00000 0.05 0.21 Q14 1 0.7912 0.8872 0.8103 11.00000 0.05 0.21 Q15 1 0.8000 0.8055 0.5788 11.00000 0.05 0.20 Q16 1 0.6878 0.2243 -0.2157 11.00000 0.05 0.20 Q17 1 0.3789 0.6042 0.4177 11.00000 0.05 0.20 Q18 1 0.5224 0.5198 -0.0344 11.00000 0.05 0.20 Q19 1 0.6983 0.2401 0.2576 11.00000 0.05 0.20 Q20 1 0.6993 0.0920 -0.0052 11.00000 0.05 0.19 REM The information below was added by Olex2. REM REM R1 = 0.0358 for 2207 Fo > 4sig(Fo) and 0.0426 for all 9625 data REM n/a parameters refined using n/a restraints REM Highest difference peak 0.27, deepest hole -0.34 REM Mean Shift 0, Max Shift 0.000. REM +++ Tabular Listing of Refinement Information +++ REM R1_all = 0.0426 REM R1_gt = 0.0358 REM wR_ref = 0.0907 REM GOOF = 1.089 REM Shift_max = 0.000 REM Shift_mean = 0 REM Reflections_all = 9625 REM Reflections_gt = 2207 REM Parameters = n/a REM Hole = -0.34 REM Peak = 0.27 REM Flack = n/a ; _cod_data_source_file jo9b03115_si_001.cif _cod_data_source_block jw-19-3 _cod_database_code 4037816 _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. ; _reflns_odcompleteness_completeness 99.97 _reflns_odcompleteness_iscentric 1 _reflns_odcompleteness_theta 26.32 _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: C9(H9), C1(H1), C13(H13), C12(H12) 2.c Idealised Me refined as rotating group: C7(H7A,H7B,H7C), C14(H14A,H14B,H14C) ; _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 1.313 _oxdiff_exptl_absorpt_empirical_full_min 0.675 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn S2 S 0.26133(7) 0.30559(7) 0.10114(5) 0.01874(16) Uani 1 1 d . S1 S 0.78447(6) 0.75783(7) 0.48767(5) 0.01854(17) Uani 1 1 d . F1 F 0.81430(15) 0.07137(17) 0.13606(11) 0.0256(3) Uani 1 1 d . F2 F 0.89451(15) 0.11151(16) -0.08259(12) 0.0254(3) Uani 1 1 d . N3 N 0.1991(2) 0.5199(2) 0.30972(15) 0.0149(4) Uani 1 1 d . N1 N 0.5034(2) 0.8566(2) 0.58365(15) 0.0172(4) Uani 1 1 d . N4 N 0.4797(2) 0.5229(2) 0.29109(15) 0.0147(4) Uani 1 1 d . N2 N 0.2146(2) 0.7412(2) 0.49975(15) 0.0177(4) Uani 1 1 d . C3 C 0.4549(3) 0.6407(3) 0.39786(18) 0.0141(4) Uani 1 1 d . C4 C 0.2825(3) 0.6402(3) 0.40942(18) 0.0155(5) Uani 1 1 d . C5 C 0.3247(3) 0.4566(3) 0.24189(18) 0.0152(5) Uani 1 1 d . C10 C 0.7090(3) 0.1412(3) 0.07274(19) 0.0177(5) Uani 1 1 d . C9 C 0.5642(3) 0.1885(3) 0.11977(18) 0.0162(5) Uani 1 1 d . H9 H 0.537164 0.174872 0.195885 0.019 Uiso 1 1 calc R C8 C 0.4591(3) 0.2573(3) 0.05121(19) 0.0162(5) Uani 1 1 d . C2 C 0.5663(3) 0.7530(3) 0.49145(18) 0.0145(5) Uani 1 1 d . C7 C -0.0633(3) 0.5618(3) 0.1994(2) 0.0209(5) Uani 1 1 d . H7A H -0.018077 0.535070 0.121242 0.031 Uiso 1 1 calc GR H7B H -0.037419 0.680972 0.235972 0.031 Uiso 1 1 calc GR H7C H -0.183906 0.527580 0.188049 0.031 Uiso 1 1 calc GR C1 C 0.3343(3) 0.8446(3) 0.58079(19) 0.0184(5) Uani 1 1 d . H1 H 0.295088 0.919580 0.644899 0.022 Uiso 1 1 calc R C6 C 0.0150(2) 0.4694(3) 0.2832(2) 0.0186(5) Uani 1 1 d . H6A H -0.036879 0.490941 0.359925 0.022 Uiso 1 1 calc R H6B H -0.009786 0.349220 0.244864 0.022 Uiso 1 1 calc R C13 C 0.4977(3) 0.2751(3) -0.0634(2) 0.0200(5) Uani 1 1 d . H13 H 0.426154 0.321381 -0.108592 0.024 Uiso 1 1 calc R C11 C 0.7499(3) 0.1594(3) -0.0406(2) 0.0189(5) Uani 1 1 d . C14 C 0.8654(3) 0.9186(3) 0.62616(19) 0.0212(5) Uani 1 1 d . H14A H 0.832210 1.023489 0.621211 0.032 Uiso 1 1 calc GR H14B H 0.986660 0.930918 0.635682 0.032 Uiso 1 1 calc GR H14C H 0.820382 0.887222 0.695431 0.032 Uiso 1 1 calc GR C12 C 0.6437(3) 0.2235(3) -0.1102(2) 0.0221(5) Uani 1 1 d . H12 H 0.669244 0.232247 -0.187714 0.027 Uiso 1 1 calc R 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 0.0169(3) 0.0194(3) 0.0170(3) 0.0000(2) 0.0001(2) 0.0026(2) S1 0.0141(3) 0.0223(3) 0.0169(3) 0.0004(2) 0.0018(2) 0.0039(2) F1 0.0238(7) 0.0321(8) 0.0219(7) 0.0061(6) -0.0008(6) 0.0105(6) F2 0.0208(7) 0.0258(7) 0.0301(7) 0.0051(6) 0.0103(6) 0.0065(6) N3 0.0127(9) 0.0171(10) 0.0151(9) 0.0055(8) 0.0006(7) 0.0014(7) N1 0.0188(9) 0.0210(10) 0.0132(9) 0.0046(8) 0.0018(8) 0.0071(8) N4 0.0165(9) 0.0149(9) 0.0126(9) 0.0028(7) 0.0020(7) 0.0037(7) N2 0.0182(9) 0.0238(11) 0.0133(9) 0.0063(8) 0.0035(8) 0.0068(8) C3 0.0167(11) 0.0142(11) 0.0136(10) 0.0069(9) 0.0038(9) 0.0034(9) C4 0.0192(11) 0.0182(12) 0.0120(10) 0.0074(9) 0.0034(9) 0.0054(9) C5 0.0171(11) 0.0161(11) 0.0142(11) 0.0067(9) 0.0034(9) 0.0034(9) C10 0.0183(11) 0.0151(11) 0.0174(11) 0.0021(9) -0.0034(9) 0.0012(9) C9 0.0192(11) 0.0158(11) 0.0101(10) -0.0008(9) -0.0002(9) -0.0002(9) C8 0.0181(11) 0.0113(11) 0.0165(11) 0.0006(9) 0.0015(9) -0.0005(9) C2 0.0172(11) 0.0143(11) 0.0144(10) 0.0072(9) 0.0012(9) 0.0041(9) C7 0.0152(11) 0.0234(12) 0.0230(12) 0.0045(10) 0.0012(9) 0.0024(9) C1 0.0199(11) 0.0221(12) 0.0139(11) 0.0030(9) 0.0021(9) 0.0087(10) C6 0.0113(10) 0.0209(12) 0.0218(12) 0.0046(9) 0.0010(9) -0.0021(9) C13 0.0238(12) 0.0154(12) 0.0209(12) 0.0054(9) 0.0003(10) 0.0034(10) C11 0.0197(11) 0.0130(11) 0.0212(12) -0.0002(9) 0.0058(9) -0.0004(9) C14 0.0181(11) 0.0215(12) 0.0200(12) -0.0001(10) -0.0015(9) 0.0015(10) C12 0.0296(13) 0.0192(12) 0.0191(11) 0.0074(10) 0.0094(10) 0.0023(10) 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' 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' 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 C5 S2 C8 101.75(10) C2 S1 C14 101.61(10) C4 N3 C5 105.34(16) C4 N3 C6 126.54(16) C5 N3 C6 128.12(18) C1 N1 C2 117.49(18) C5 N4 C3 103.38(16) C1 N2 C4 111.16(17) N4 C3 C4 110.60(18) N4 C3 C2 132.82(18) C4 C3 C2 116.58(18) N3 C4 C3 106.27(17) N2 C4 N3 127.65(18) N2 C4 C3 126.1(2) N3 C5 S2 117.58(15) N4 C5 S2 128.00(15) N4 C5 N3 114.39(18) F1 C10 C9 120.34(18) F1 C10 C11 118.26(17) C9 C10 C11 121.4(2) C10 C9 H9 120.8 C10 C9 C8 118.41(18) C8 C9 H9 120.8 C9 C8 S2 120.62(15) C9 C8 C13 120.92(18) C13 C8 S2 118.17(16) N1 C2 S1 120.92(16) N1 C2 C3 119.17(18) C3 C2 S1 119.92(15) H7A C7 H7B 109.5 H7A C7 H7C 109.5 H7B C7 H7C 109.5 C6 C7 H7A 109.5 C6 C7 H7B 109.5 C6 C7 H7C 109.5 N1 C1 H1 115.3 N2 C1 N1 129.49(19) N2 C1 H1 115.3 N3 C6 C7 113.03(17) N3 C6 H6A 109.0 N3 C6 H6B 109.0 C7 C6 H6A 109.0 C7 C6 H6B 109.0 H6A C6 H6B 107.8 C8 C13 H13 120.2 C8 C13 C12 119.7(2) C12 C13 H13 120.2 F2 C11 C10 119.09(19) F2 C11 C12 120.58(18) C12 C11 C10 120.32(19) S1 C14 H14A 109.5 S1 C14 H14B 109.5 S1 C14 H14C 109.5 H14A C14 H14B 109.5 H14A C14 H14C 109.5 H14B C14 H14C 109.5 C13 C12 H12 120.4 C11 C12 C13 119.27(19) C11 C12 H12 120.4 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance S2 C5 1.756(2) S2 C8 1.777(2) S1 C2 1.746(2) S1 C14 1.800(2) F1 C10 1.356(2) F2 C11 1.351(2) N3 C4 1.369(3) N3 C5 1.382(2) N3 C6 1.468(3) N1 C2 1.346(3) N1 C1 1.343(3) N4 C3 1.392(3) N4 C5 1.315(3) N2 C4 1.343(3) N2 C1 1.329(3) C3 C4 1.394(3) C3 C2 1.396(3) C10 C9 1.370(3) C10 C11 1.380(3) C9 H9 0.9300 C9 C8 1.386(3) C8 C13 1.388(3) C7 H7A 0.9600 C7 H7B 0.9600 C7 H7C 0.9600 C7 C6 1.522(3) C1 H1 0.9300 C6 H6A 0.9700 C6 H6B 0.9700 C13 H13 0.9300 C13 C12 1.389(3) C11 C12 1.375(3) C14 H14A 0.9600 C14 H14B 0.9600 C14 H14C 0.9600 C12 H12 0.9300 loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_sigma 0 0 2 1776.33 19.07 0 0 2 1724.67 18.87 0 0 -2 1711.45 19.78 0 0 -2 1730.8 18.23 0 0 3 595.8 13.44 0 0 3 577.42 13.27 0 0 -3 601.43 13.23 0 0 -3 582.16 14.23 0 0 4 196.34 8.87 0 0 4 201.53 8.99 0 0 -4 201.99 8.9 0 0 -4 192.77 9.66 0 0 -5 1998.32 19.23 0 0 -5 2045.68 35.27 0 0 -5 1907.15 30.67 0 0 5 1928.39 31.38 0 0 5 1965.41 30.9 0 0 -6 327.28 13.95 0 0 6 342.54 14.15 0 0 6 345.43 14.32 0 0 -6 355.73 16.29 0 0 -6 329.47 8.05 0 0 7 198.78 11.63 0 0 7 188.82 12.22 0 0 -7 196.19 13.24 0 0 7 188.09 11.23 0 0 -7 178.53 5.92 0 0 -7 181.99 11.28 0 0 -8 102.53 3.77 0 0 -8 124.33 11.46 0 0 8 127.55 9.9 0 0 8 137.63 10.23 0 0 -8 129.63 10.32 0 0 -9 143.74 11.54 0 0 9 134.24 10.69 0 0 9 132.81 10.55 0 0 -9 134.25 12.8 0 0 -10 598.4 28.83 0 0 10 600.03 23.78 0 0 -10 598.16 25.08 0 0 -11 119.83 13.68 0 0 11 140.17 11.92 0 0 -11 130.62 12.5 0 0 11 122.57 12.31 0 0 12 42.59 7.68 0 0 -12 36.03 8.01 0 0 -12 39.07 7.34 0 0 12 30.42 5.8 0 0 -13 91.91 11.74 0 0 -13 119.11 15.35 0 0 13 110.31 11.24 0 0 13 86.23 11.37 0 0 14 14.34 5.21 0 0 -14 8.26 4.3 0 -1 14 118.28 14.46 0 1 -14 121.28 14 0 1 -14 117.85 15.72 0 -1 13 37.33 8.04 0 1 -13 31.2 7.8 0 1 -13 26.29 6.11 0 -1 13 36.55 6.69 0 1 -12 236.36 20.12 0 1 -12 218.88 16.87 0 -1 12 204.03 15.38 0 -1 12 186.12 16.68 0 1 -11 57.87 8.24 0 -1 11 63.12 8.32 0 1 -11 59.09 9.37 0 -1 10 4.78 2.48 0 -1 10 1.83 1.28 0 1 -10 2.8 1.85 0 1 -10 3.19 1.22 0 1 -10 2.96 1.81 0 -1 9 42.03 6.25 0 1 -9 32.3 5.96 0 1 -9 39.34 6.04 0 -1 9 36.76 5.61 0 -1 8 46.17 6.2 0 -1 8 39.52 5.85 0 1 -8 44.34 6.65 0 1 -8 53 6.44 0 -1 8 34.07 5.1 0 -1 7 482.51 18.84 0 1 -7 459.58 17.7 0 1 -7 445.3 19.27 0 -1 7 493.22 18.36 0 -1 7 506.42 19.6 0 -1 6 42.42 5.19 0 -1 6 40.39 4.95 0 1 -6 38.92 5.21 0 1 -6 50.41 5.35 0 -1 5 35.32 4.24 0 1 -5 29.96 4.09 0 -1 5 30.61 3.96 0 1 -5 31.06 3.87 0 1 -4 436.16 13.79 0 -1 4 425.7 13.24 0 -1 4 441.49 13.42 0 1 -4 443.54 13 0 -1 3 1.83 0.93 0 1 -3 3.37 1.02 0 -1 3 3.68 1.07 0 1 -3 2.17 0.79 0 1 -2 2575.67 22.63 0 -1 2 2630.99 23.09 0 1 -2 2593.55 24.37 0 -1 2 2664.31 24.8 0 -1 2 2702.76 24.71 0 -1 1 646.7 8.66 0 1 -1 653.94 8.69 0 -1 1 645.77 10.16 0 1 0 71.25 3.25 0 1 1 11.18 0.97 0 -1 -1 9.83 0.89 0 1 1 9.85 1.35 0 1 1 10.11 1.23 0 1 2 641.98 10.45 0 1 2 691.76 8.91 0 1 2 688.9 13.21 0 -1 -2 642.5 13.3 0 -1 -2 653.68 12.24 0 1 2 695.7 12.92 0 -1 -2 648.73 13.53 0 1 2 663.24 12.59 0 1 3 370.76 10.9 0 1 3 334.38 6.69 0 -1 -3 340.18 10.43 0 1 3 344.9 10.56 0 1 3 333.75 10.65 0 -1 -3 351.56 11.79 0 -1 -3 327.64 11.28 0 -1 -4 833.7 18.61 0 -1 -4 836.9 20.57 0 1 4 865.83 18.82 0 1 4 852.11 19.63 0 -1 -4 840.62 21.14 0 1 4 850.68 18.9 0 -1 -5 206.89 11.5 0 1 5 225.73 10.53 0 1 5 208.65 10.27 0 -1 -5 209.22 11.85 0 -1 -5 222.12 10.68 0 1 6 39.11 4.89 0 1 6 30.31 4.21 0 -1 -6 32.17 5.19 0 -1 -6 27.41 4.16 0 1 7 152.35 10.09 0 -1 -7 141.66 11.93 0 1 7 147.71 10.03 0 -1 -7 169.62 11.15 0 1 7 142.59 10.89 0 1 8 6.24 2.28 0 -1 -8 14.19 4.29 0 1 8 4.18 1.84 0 1 8 9.7 2.65 0 -1 -8 11.01 3.24 0 1 8 9.42 2.66 0 -1 -9 50.83 8.24 0 -1 -9 36.36 6.01 0 1 9 41.8 5.92 0 1 9 41.34 6.28 0 1 10 361.8 18.21 0 1 10 368.21 19.55 0 -1 -10 352.57 23.27 0 -1 -10 370.29 20.43 0 1 11 15.37 4.27 0 -1 -11 14.81 4.43 0 -1 -11 12.12 4.84 0 1 12 114.69 12.2 0 -1 -12 103.07 14.31 0 -1 -12 109.88 12.54 0 -1 -13 7.19 4.46 0 1 13 5.94 3.25 0 1 14 8.12 4.36 0 -1 -14 5.54 4.46 0 2 -14 48.13 10.23 0 2 -14 37.54 7.78 0 2 -13 65.02 9.79 0 2 -13 80.27 11.83 0 -2 13 87.86 10.86 0 2 -12 385.76 22.03 0 2 -12 376.14 24.17 0 -2 12 360 21.52 0 2 -11 45.55 7.41 0 2 -11 36.35 7.1 0 -2 11 41.17 7.03 0 -2 10 38.51 6.12 0 2 -10 48.53 7.56 0 2 -10 43.5 6.63 0 -2 10 48.89 7.34 0 2 -9 -0.79 1.62 0 -2 9 1.78 1.13 0 2 -9 1.81 2.08 0 2 -8 15.04 3.71 0 -2 8 10.63 3.13 0 2 -8 15.19 3.61 0 -2 8 16.71 3.75 0 2 -7 625.25 22.15 0 2 -7 564.58 19.61 0 -2 7 589.32 20.81 0 -2 7 583.31 20.97 0 -2 6 17.51 3.34 0 2 -6 13.04 2.72 0 -2 6 11.09 2.74 0 2 -6 17.25 3.37 0 2 -5 179.19 9.98 0 -2 5 191.65 9.92 0 2 -5 186.9 9.5 0 -2 5 184.96 10.19 0 -2 4 1237.48 22.66 0 -2 4 1254.55 24.29 0 -2 4 1242.15 23.88 0 2 -4 1234.82 22.1 0 -2 3 3021.67 31.25 0 -2 3 3085.59 34.67 0 2 -3 3039.51 34.24 0 2 -3 3039.6 30.52 0 -2 3 3036.51 33.67 0 2 -2 9957.36 58.67 0 -2 2 9761.29 56.34 0 2 -2 9820.49 48.12 0 -2 2 9999 48.27 0 2 -1 465.28 12.14 0 2 -1 496.91 9.89 0 -2 1 495.54 11.89 0 2 0 1222.88 19.27 0 -2 0 1257.5 18.72 0 2 1 417.34 7.24 0 -2 -1 413.91 6.37 0 2 2 1427.44 20.79 0 2 2 1454.34 15.89 0 2 2 1461.25 23.71 0 2 3 504.69 14.32 0 2 3 523.23 15.41 0 2 3 542.14 11.49 0 -2 -3 516.22 15.86 0 2 3 536.55 11.62 0 -2 -3 518.46 15.68 0 2 4 334.7 13.4 0 -2 -4 331.32 12.46 0 2 4 322.95 12.64 0 2 4 305.97 12.48 0 2 4 329.39 10.58 0 -2 -4 295.06 13.32 0 2 4 323.21 9.03 0 -2 -4 318.59 13.98 0 2 5 1052.03 24.58 0 2 5 995.95 20.76 0 -2 -5 969.64 26.74 0 -2 -5 923.5 26.65 0 2 5 954.51 15.17 0 2 5 1005.14 24.95 0 -2 -5 964.6 23.45 0 2 6 22.04 3.79 0 2 6 22.2 3.46 0 2 6 14.96 3.33 0 -2 -6 17.3 3.96 0 -2 -6 20.04 3.76 0 -2 -6 11.23 3.16 0 2 6 21.34 3.93 0 2 7 616.19 21.51 0 2 7 579.02 21.61 0 -2 -7 563.62 24.02 0 2 7 570.95 19.19 0 -2 -7 543.81 20.85 0 -2 -7 546.86 24.39 0 -2 -8 697.31 25.23 0 2 8 657.67 22.27 0 -2 -8 650.75 28.82 0 2 9 48.24 6.52 0 -2 -9 62.11 8.09 0 -2 -9 53.92 8.97 0 2 10 244.16 15.48 0 -2 -10 233.57 19.96 0 2 11 64.51 8.62 0 -2 -11 70.85 11.64 0 2 12 5.67 2.58 0 -2 -12 6.38 3.29 0 2 13 265.05 19.68 0 -2 -13 280.46 25.81 0 -2 -14 42.83 10.12 0 2 14 53.36 9.24 0 3 -14 143.5 16.16 0 3 -14 149.85 15.18 0 -3 14 142.85 16.13 0 -3 13 6.92 3.39 0 3 -13 7.27 3.67 0 3 -13 0.18 1.25 0 3 -12 45.54 8.36 0 3 -12 38.27 7.03 0 -3 12 44.1 7.98 0 3 -11 30.12 5.85 0 -3 11 35.64 6.37 0 3 -11 38.27 7.08 0 3 -10 8.85 2.89 0 -3 10 6.61 2.97 0 3 -10 9.69 3.34 0 3 -9 531.64 23.48 0 -3 9 538.64 22.83 0 -3 9 539.89 23.97 0 3 -9 491.58 20.96 0 -3 8 93.33 9.16 0 3 -8 109.15 9.94 0 -3 8 98.18 9.4 0 3 -8 100.97 8.93 0 -3 7 8.91 2.7 0 -3 7 9.99 2.93 0 -3 7 11.38 2.93 0 3 -7 13.18 3.08 0 -3 6 88.54 8.04 0 3 -6 94.7 7.61 0 -3 6 97.81 8.29 0 -3 6 120.05 8.82 0 3 -5 26.75 3.72 0 -3 5 30.48 4.13 0 -3 5 32.42 4.55 0 -3 5 20.94 3.59 0 -3 4 787.43 21.28 0 -3 4 748.91 19.8 0 3 -4 819.59 21.34 0 3 -4 804.58 18.39 0 -3 4 760.47 18.33 0 3 -3 95.07 7 0 -3 3 99.45 6.82 0 3 -3 103.55 6.03 0 -3 3 99.32 5.96 0 3 -2 -0.19 0.39 0 3 -2 0.92 0.5 0 -3 2 0.37 0.52 0 3 -1 49.87 4.9 0 -3 1 53.18 4.69 0 -3 0 773.38 18 0 3 0 751.62 19.01 0 -3 -1 0.35 0.26 0 3 1 1.01 1.12 0 3 2 348.33 8.49 0 3 2 327.23 13.39 0 3 2 349.95 11.54 0 3 3 57.37 5.17 0 3 3 48.76 3.63 0 3 3 59.45 5.97 0 3 4 5.88 1.43 0 3 4 2.78 1.24 0 -3 -4 4.57 1.85 0 3 4 2.42 1.06 0 -3 -4 4.95 1.95 0 -3 -5 24.75 4.62 0 3 5 19.31 2.74 0 3 5 18.46 3.77 0 -3 -5 22.58 4.35 0 3 5 21.71 3.91 0 3 5 23.54 3.18 0 3 6 21.83 4.25 0 3 6 18.21 2.58 0 3 6 14.82 2.84 0 -3 -6 18.88 4.34 0 -3 -6 19.66 4.66 0 3 7 86.75 7.47 0 -3 -7 86.4 10.28 0 -3 -7 78.59 9.54 0 3 8 79.54 7.8 0 -3 -8 92.26 11.45 0 -3 -9 92.61 12.24 0 3 9 102.97 9.46 0 3 10 53.62 7.35 0 -3 -10 45.59 9.36 0 -3 -11 15.73 5.47 0 3 11 14.14 3.84 0 -3 -12 94.84 15.23 0 3 12 96.73 11.09 0 -3 -13 4.65 4 0 4 -14 41.7 8.02 0 4 -13 23.71 5.71 0 -4 13 27.97 7.06 0 4 -12 15.26 4.58 0 -4 12 17.6 5.22 0 4 -11 57.44 8.08 0 -4 11 47.62 7.84 0 -4 10 44.38 7.3 0 -4 10 40.32 6.75 0 4 -10 44.34 6.7 0 4 -9 38.5 5.88 0 -4 9 25.17 5.1 0 -4 9 27.85 5.57 0 4 -8 11.08 2.98 0 -4 8 12.28 3.39 0 -4 8 7.95 2.97 0 -4 7 109.51 10.09 0 -4 7 121.67 9.8 0 4 -7 112.12 8.94 0 -4 6 364.6 17.62 0 -4 6 385.64 16 0 -4 6 379.52 16.97 0 4 -6 359.88 15.09 0 4 -5 2432.75 42.52 0 -4 5 2256.06 39.96 0 -4 5 2372.51 36.56 0 -4 5 2401.08 43.26 0 4 -5 2311.25 35.45 0 4 -4 1717.51 28.55 0 -4 4 1702.85 28.67 0 -4 4 1727.99 32.48 0 4 -4 1670.96 34.25 0 -4 3 84.43 6.95 0 4 -3 81.43 7.46 0 4 -3 81.81 5.9 0 4 -2 351.89 15.43 0 -4 2 339.42 13.66 0 4 -2 377.4 12.31 0 4 -1 2.16 1.51 0 -4 1 1.19 0.77 0 4 0 282.2 13.75 0 -4 0 260.35 7.79 0 4 1 491.14 18.42 0 -4 -1 494.42 8.7 0 4 2 152.02 10.5 0 4 2 156.59 8.46 0 4 3 402.85 17.88 0 -4 -3 431.42 17.68 0 4 3 388.21 10.47 0 4 4 363.5 11.55 0 4 4 377.59 18.01 0 -4 -4 383.37 18.06 0 4 4 370.78 13.85 0 -4 -4 363.44 17.67 0 4 4 380.3 15.93 0 -4 -5 341.52 18.48 0 4 5 312.95 12.78 0 4 5 317.38 11.97 0 4 5 346.72 16.48 0 -4 -5 353.4 18.71 0 4 6 612.1 18.44 0 4 6 654.7 18.58 0 -4 -6 643.75 27.75 0 4 7 94.92 7.92 0 -4 -7 82.99 10.71 0 4 7 94.38 6.56 0 4 8 298.86 15.07 0 -4 -8 322.79 22.72 0 -4 -9 65.32 10.94 0 4 9 63.02 7.48 0 -4 -10 51.84 10.43 0 4 10 49.59 7.12 0 -4 -11 178.57 20.45 0 -4 -12 38.88 10.17 0 5 -14 13.88 4.14 0 -5 13 118.48 13.61 0 5 -13 106.08 12.17 0 5 -12 0.92 1.25 0 -5 12 1.54 1.59 0 5 -11 158.27 13.54 0 -5 11 154.96 14.51 0 -5 10 0.58 1.52 0 5 -10 2.81 1.68 0 -5 9 43.4 6.77 0 5 -9 41.29 6.21 0 -5 9 35.86 6.4 0 -5 8 252.12 15.39 0 -5 8 236.9 15.31 0 5 -8 250 14.52 0 -5 8 251.49 16.6 0 -5 7 34.15 5.27 0 5 -7 32.48 4.9 0 -5 7 36.25 6.14 0 5 -6 476.47 17.83 0 -5 6 481.25 21.81 0 5 -6 413.39 19.75 0 -5 6 471.43 18.27 0 -5 5 224.29 11.68 0 5 -5 236.28 11.82 0 5 -5 232.48 14.46 0 5 -4 212.51 13.77 0 5 -4 190.65 10.24 0 5 -3 107.95 7.38 0 5 -3 127.75 10.59 0 5 -2 14.45 3.55 0 5 -2 9.09 2.02 0 5 -1 230.25 14.17 0 5 0 612.38 23.21 0 -5 0 597.65 20.69 0 -5 0 586.29 12.45 0 -5 -1 109.23 4.11 0 5 1 115.89 10.25 0 -5 -1 114.43 9.32 0 -5 -2 1.97 1.57 0 -5 -2 1.39 0.92 0 -5 -3 12.48 3.24 0 5 3 9.11 2.35 0 -5 -3 10.6 3.23 0 -5 -4 24.26 4.91 0 5 4 17.25 2.4 0 5 4 18.95 3.57 0 5 4 22.49 4.18 0 5 5 275.4 13.65 0 -5 -5 278.07 18.28 0 5 5 291.55 11.11 0 5 6 0.45 0.8 0 5 6 0.46 0.53 0 5 7 60.52 6.23 0 5 7 49.91 5.56 0 -5 -7 54.81 9.35 0 5 8 44.46 5.77 0 -5 -8 47.61 9.39 0 -5 -9 56.04 11.04 0 -5 -10 98.07 15.24 0 6 -14 25.83 6.17 0 6 -13 98.02 11.61 0 -6 12 17.99 4.85 0 6 -12 23.93 5.5 0 6 -11 5.47 2.69 0 -6 11 7.66 2.96 0 6 -10 -0.02 0.98 0 -6 10 1.2 1.91 0 -6 9 160.22 13.65 0 -6 9 168.43 14.86 0 6 -9 154.04 12.15 0 -6 8 128.09 11.68 0 6 -8 116.77 10.14 0 -6 8 98.43 9.74 0 -6 8 138.26 13.09 0 6 -7 1018.53 28.5 0 -6 7 1099.58 30.44 0 -6 7 1073.72 36.3 0 -6 7 1045.11 32.04 0 6 -6 266.16 13.83 0 -6 6 285.41 16.19 0 6 -6 268.21 17.25 0 6 -5 16.79 4.18 0 6 -5 14.9 3.02 0 -6 5 15.46 3.81 0 6 -4 43.86 7.11 0 -6 4 58.8 7.18 0 6 -4 56.98 5.94 0 6 -3 69.73 8.86 0 6 -3 63.09 6.22 0 -6 3 70.59 7.86 0 6 -2 87.74 7.33 0 -6 2 98.5 8.88 0 6 -2 90.66 10.15 0 -6 1 8.7 1.9 0 6 -1 11.84 3.74 0 -6 1 15.3 3.61 0 -6 0 30.53 2.82 0 -6 0 36.74 5.48 0 -6 -1 132.75 3.95 0 -6 -1 146.89 11.35 0 -6 -1 156.78 11.99 0 -6 -2 210.89 14.17 0 6 2 207.1 11.48 0 -6 -2 216.69 14.54 0 -6 -3 611.02 25.74 0 6 3 721.61 23.13 0 -6 -4 221.87 16.41 0 6 4 196.93 12.79 0 6 5 119.91 9.99 0 -6 -5 162.25 15.12 0 6 6 288.27 15.53 0 -6 -6 267.92 20.68 0 -6 -7 16.92 5.84 0 -6 -8 159.65 18.21 0 -6 -9 44.02 10.13 0 7 -14 5.1 3.18 0 7 -13 47.17 8.08 0 7 -12 43.76 7.45 0 7 -11 63.37 8.72 0 -7 11 60.44 9.06 0 7 -10 38.14 6.3 0 -7 10 37.83 6.96 0 -7 9 20.06 5.1 0 7 -9 26.5 5.21 0 -7 8 531.59 24.21 0 7 -8 495.93 21.29 0 7 -7 365.4 17.5 0 7 -7 396.58 22.98 0 -7 6 412.29 20.33 0 7 -6 407.08 17.69 0 7 -6 420.58 23.52 0 -7 5 31.25 5.45 0 7 -5 38.41 7.07 0 7 -5 35.46 5.11 0 -7 4 23.26 5.05 0 7 -4 3.55 1.69 0 -7 3 197.8 13.69 0 7 -3 149.78 10.32 0 -7 2 260.08 15.93 0 7 -2 254.62 13.6 0 -7 1 294.39 17.02 0 -7 1 302.91 11 0 -7 0 1.36 1.35 0 -7 0 1.75 0.61 0 -7 -1 21.5 4.8 0 -7 -1 26.69 5.36 0 7 1 28.19 4.23 0 -7 -2 8.49 3.13 0 7 2 10.82 2.67 0 -7 -2 11.26 3.8 0 -7 -3 89.87 10.79 0 7 4 4.59 2.31 0 -7 -4 7.1 3.59 0 -7 -5 6.89 3.63 0 7 5 6.72 2.65 0 -7 -6 2.19 2.45 0 -7 -7 7.87 4.3 0 8 -11 38.76 6.92 0 8 -10 32.27 5.95 0 -8 10 31.75 6.38 0 -8 9 723.3 29.94 0 8 -9 745.57 27.61 0 -8 8 22.21 5.09 0 8 -8 26.93 5.08 0 -8 7 99.51 10.58 0 8 -7 119.01 10.23 0 -8 6 -0.4 0.89 0 8 -6 1.68 1.34 0 8 -5 2.17 1.57 0 -8 5 12.65 4.14 0 -8 4 189.03 14.25 0 8 -4 165.64 11.45 0 8 -3 94.36 8.73 0 -8 3 89.76 10.02 0 -8 2 148.94 12.89 0 8 -2 135.98 10.71 0 -8 1 120.18 11.75 0 8 -1 133.65 10.9 0 8 0 44.83 5.5 0 -8 0 52.53 8.02 0 -8 0 43.48 7.27 0 -8 -1 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1 9.76 3.79 1 -8 2 23 5.24 -1 8 -2 14.18 2.93 1 -8 3 5.26 2.51 -1 8 -3 5.55 1.78 1 -8 4 26.16 5.5 -1 8 -4 22.57 3.58 1 -8 5 10.76 3.9 -1 8 -5 10.92 2.45 -1 8 -6 4.52 1.86 1 -8 6 5.6 2.75 1 -8 7 37.79 7.14 -1 8 -7 47.44 5.59 1 -8 8 238.42 18.23 -1 8 -8 244.71 13.45 -1 8 -9 244.31 14.16 1 -8 9 259.18 19.66 -1 8 -10 14.45 3.93 1 -8 10 3.06 2.87 1 -8 11 17.77 5.65 1 -8 12 -0.16 2.43 1 -7 -8 29.53 8.11 1 -7 -7 1.75 1.47 -1 7 6 137.13 12.57 1 -7 -6 194.08 18.07 -1 7 5 17.44 4.45 1 -7 -5 22.52 5.75 -1 7 4 124.5 11.85 1 -7 -4 118.63 12.54 1 -7 -3 5.67 2.82 -1 7 3 0.92 1.07 1 -7 -3 4.82 2.22 -1 7 3 0.76 1.05 1 -7 -2 5.28 2.41 1 -7 -2 5.86 2.42 -1 7 2 3.81 2.07 -1 7 2 4.98 1.78 1 -7 -2 3.89 1.14 1 -7 -1 155.74 7.66 1 -7 -1 152.45 12.95 1 -7 0 12.04 3.6 -1 7 0 11.3 2.23 1 -7 0 8.58 2.02 1 -7 1 172.72 13.41 1 -7 1 186 10.69 -1 7 -2 458.32 15.39 1 -7 2 482.08 22.28 1 -7 3 103.2 10.63 -1 7 -3 37.18 4.57 -1 7 -4 24.44 3.45 1 -7 4 25.67 5.28 1 -7 5 13.25 3.74 -1 7 -5 18.16 3.06 -1 7 -6 43.15 4.96 1 -7 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2.39 1 -4 -10 187.5 18.68 -1 4 10 154.31 13.27 1 -4 -9 0.98 1.18 -1 4 9 0.17 1.25 -1 4 8 1.7 1.02 -1 4 8 1.09 1 1 -4 -8 4.03 1.74 -1 4 7 5.33 1.87 -1 4 7 3.85 1.65 1 -4 -7 4.81 2.45 1 -4 -7 3.93 2.76 1 -4 -6 229.39 14.94 1 -4 -6 210.04 14.72 -1 4 6 214.72 12.21 -1 4 6 240.93 12.84 1 -4 -5 0.66 1.06 -1 4 5 -0.19 0.52 -1 4 5 0.68 0.92 -1 4 5 0.7 0.85 1 -4 -5 0.79 0.79 -1 4 4 7.3 2.02 -1 4 4 8.64 2.33 1 -4 -4 4.62 1.93 -1 4 4 7.51 2.63 1 -4 -3 55.84 4.53 1 -4 -3 49.63 5.75 -1 4 3 44.98 4.78 -1 4 3 45.27 6.09 -1 4 3 44.72 5.26 -1 4 3 36.87 4.09 1 -4 -3 49.06 5.94 1 -4 -2 83.64 5.3 -1 4 2 78 6.94 -1 4 2 80.41 7.99 -1 4 2 71.6 5.41 1 -4 -1 93.03 5.82 -1 4 1 96.77 5.51 -1 4 1 92.01 8.42 -1 4 0 17.32 1.98 1 -4 0 19.43 2.83 -1 4 0 14.48 3.21 -1 4 -1 27.92 4.78 1 -4 1 36.75 4.79 1 -4 2 0.43 0.6 -1 4 -2 0.39 0.31 -1 4 -2 0.08 0.96 1 -4 3 583.32 20.44 -1 4 -3 606.78 12.78 -1 4 -4 1306.38 33.26 1 -4 4 1294.14 31.78 1 -4 4 1284.3 21.67 -1 4 -4 1302.21 21.24 1 -4 5 42.07 4.42 -1 4 -5 39.2 4.08 1 -4 5 28.91 5.23 -1 4 -6 1.36 0.82 1 -4 6 1.03 1.11 1 -4 6 -0.79 0.8 -1 4 -7 71.6 6.64 1 -4 7 67.8 8.62 1 -4 7 81.65 9.19 1 -4 7 74.98 7.26 -1 4 -8 9.66 2.73 1 -4 8 10.92 3.45 1 -4 8 13.9 3.89 1 -4 8 14.67 3.6 -1 4 -9 273.59 14.84 1 -4 9 244.86 15.28 1 -4 9 228.83 16.79 1 -4 9 212.7 16.49 1 -4 10 81.07 10.55 -1 4 -10 87.4 8.99 -1 4 -11 82.68 9.29 1 -4 11 83.75 11.37 -1 4 -12 30.69 6.09 1 -4 12 45.8 8.62 -1 4 -13 0.38 1.15 1 -4 13 0.66 1.72 -1 4 -14 279.11 20.31 1 -4 14 279.36 23.38 1 -4 14 284.19 24.03 1 -3 -13 47.58 10.86 -1 3 13 43.88 8.17 1 -3 -12 0.1 1.81 -1 3 12 -0.26 1.81 -1 3 11 0.41 2.73 1 -3 -11 -0.14 2.26 -1 3 10 59.14 8.25 1 -3 -10 59.17 9.91 1 -3 -9 37.99 6.32 -1 3 9 45.71 6.64 1 -3 -9 39.93 7.57 -1 3 8 168.88 11.98 1 -3 -8 178.55 13.04 1 -3 -8 152.07 13.17 1 -3 -8 169.03 14.43 1 -3 -7 1.26 0.87 -1 3 7 3.69 1.85 1 -3 -7 2.72 1.61 -1 3 7 1.55 1.09 1 -3 -7 1.59 1.69 1 -3 -6 6.62 2.51 -1 3 6 9.48 2.39 -1 3 6 10.01 2.83 1 -3 -6 7.45 2.38 1 -3 -6 8.38 3.03 -1 3 6 6.18 1.96 -1 3 6 11.4 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26.52 3.91 -1 3 -6 19.26 3.14 -1 3 -7 547.5 18.29 1 -3 7 529.94 19.26 1 -3 7 551.53 23.27 -1 3 -7 564.24 23.42 -1 3 -8 210.02 12.23 -1 3 -8 180.34 14.08 1 -3 8 196.32 12.76 1 -3 8 187.68 14.5 1 -3 8 207.04 14.97 1 -3 9 546.29 25.15 -1 3 -9 533.67 21.15 -1 3 -9 538.44 25.66 -1 3 -10 37.19 7.1 -1 3 -10 48.08 6.76 -1 3 -11 12.24 4.05 -1 3 -11 19.34 5.49 1 -3 12 129.26 14.46 -1 3 -12 122.23 14.35 -1 3 -12 101.66 11.04 1 -3 13 115.36 14.08 -1 3 -13 111.93 12.28 -1 3 -13 139.19 16.17 -1 3 -14 53.57 11.03 1 -3 14 34.2 9.1 1 -3 14 39.96 8.77 1 -3 15 47.08 10.29 -1 2 14 19.76 6.08 -1 2 13 12.02 4.07 1 -2 -13 14.19 5.42 1 -2 -12 308.82 21.36 -1 2 12 246.57 18.61 1 -2 -12 262.39 22.51 1 -2 -11 19.55 4.96 -1 2 11 19.95 4.8 1 -2 -11 24.25 6.19 -1 2 10 41.56 6.7 1 -2 -10 34.76 6.45 1 -2 -10 45.83 8.42 1 -2 -9 91.83 9.75 1 -2 -9 89.43 10.9 -1 2 9 107.52 10.03 -1 2 8 7.78 2.65 1 -2 -8 8 2.59 1 -2 -8 6.21 2.69 1 -2 -7 29.38 5.04 1 -2 -7 25.92 5.05 -1 2 7 39.01 6 1 -2 -7 33.36 5.05 -1 2 7 35.95 5.14 -1 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2.83 -2 -2 -10 334.84 26.47 2 2 11 26.67 5.37 -2 -2 -11 23.23 8.1 -2 -2 -12 -5.06 3.7 2 2 12 0.24 1.64 -2 -3 14 29.4 7.41 2 3 -14 21.19 5.92 -2 -3 13 57.32 9.81 2 3 -13 59.68 9.7 -2 -3 12 137.56 11.76 -2 -3 12 127.15 14.02 -2 -3 12 144.58 11.96 2 3 -12 132.5 13.68 -2 -3 11 144.21 13.94 2 3 -11 130.9 13.06 -2 -3 10 114.8 7.55 2 3 -10 104.13 11.14 -2 -3 10 116.62 9.42 -2 -3 10 112.1 11.61 -2 -3 9 9.69 3.13 -2 -3 9 12.18 2.3 -2 -3 9 17.17 3.32 2 3 -9 14.85 4.16 2 3 -8 3.11 1.64 -2 -3 8 3.3 1.95 -2 -3 8 1.53 0.88 -2 -3 8 3.18 0.95 -2 -3 7 93.97 6 -2 -3 7 83.23 8.36 -2 -3 7 88.58 5.82 2 3 -7 99.13 9.39 -2 -3 7 79.86 8.76 -2 -3 6 77.79 7.51 2 3 -6 69.61 7.51 -2 -3 6 86.67 5.51 -2 -3 6 74.49 8.06 -2 -3 6 88.96 4.99 -2 -3 5 23.36 2.23 -2 -3 5 26.68 3.94 2 3 -5 17.19 3.58 -2 -3 5 23.86 2.82 -2 -3 5 21.77 4.09 2 3 -4 112.34 8.79 -2 -3 4 107.37 7.31 -2 -3 4 115.41 4.63 2 3 -4 112.55 5.64 -2 -3 4 115.35 8.87 -2 -3 3 182.35 8.62 -2 -3 3 202.08 6.64 2 3 -3 182.77 10.77 2 3 -3 192.8 7.79 -2 -3 2 0.11 0.36 2 3 -2 0.13 0.9 -2 -3 2 0.95 0.52 -2 -3 2 0.54 0.72 2 3 -2 0.46 0.64 -2 -3 1 0.84 0.86 2 3 -1 1.09 0.69 -2 -3 1 0.34 0.57 -2 -3 0 36.28 4.28 2 3 0 34.18 3.82 -2 -3 0 35.24 2.52 2 3 1 483.87 15.64 2 3 1 496.84 15.83 2 3 2 73.53 6.58 2 3 2 74.19 3.01 2 3 2 69.06 6.36 -2 -3 -3 89.71 9.02 2 3 3 110.56 8.6 2 3 3 116.32 8.78 -2 -3 -3 113.29 10.36 -2 -3 -4 39.18 6.57 2 3 4 39.45 5.45 2 3 4 48.01 5.95 2 3 4 38.02 5.11 -2 -3 -4 49.74 7.17 -2 -3 -5 0.58 2.29 2 3 6 8.37 1.29 -2 -3 -6 4.73 2.86 2 3 6 5.03 1.2 2 3 7 0.27 0.86 -2 -3 -7 2.37 2.65 -2 -3 -8 -0.88 1.38 2 3 8 -1.25 0.96 -2 -3 -9 3.46 2.71 2 3 9 4.49 2.54 2 3 10 149.65 11.49 -2 -3 -10 164.41 19.54 -2 -3 -11 20.15 7.5 2 4 -14 23.37 6.46 2 4 -13 46.42 8.7 -2 -4 13 28.72 7.37 2 4 -12 185.23 16.48 -2 -4 12 201.62 17.84 2 4 -11 2.67 2.46 -2 -4 11 2.04 2.11 -2 -4 10 19.25 3.71 -2 -4 10 18.32 5.05 -2 -4 10 14.1 2.94 2 4 -10 18.08 4.79 -2 -4 9 6.62 1.99 -2 -4 9 2.76 1.18 -2 -4 9 3.21 1.97 2 4 -9 6.49 2.86 -2 -4 8 1.47 0.86 2 4 -8 2 1.46 -2 -4 8 0.39 0.37 -2 -4 8 1.89 1.26 -2 -4 7 386.95 12.38 2 4 -7 402.25 19.52 -2 -4 7 436.39 20.98 -2 -4 7 367.61 17.94 -2 -4 7 394.14 14.49 -2 -4 6 1.42 0.69 -2 -4 6 -0.33 0.72 -2 -4 6 1.89 1.26 -2 -4 6 1.14 0.6 2 4 -6 0.76 0.58 -2 -4 5 52.78 5.78 -2 -4 5 46.65 3.84 2 4 -5 51.45 4.87 2 4 -5 51.91 6.53 -2 -4 5 51.14 6.4 -2 -4 4 781.5 20.16 -2 -4 4 783.27 15.89 2 4 -4 845.48 25.39 2 4 -4 787.73 19.5 2 4 -3 594 17.28 -2 -4 3 608.79 15.94 2 4 -3 586.14 20.75 -2 -4 3 600.31 14.58 -2 -4 2 807.68 18.77 -2 -4 2 786.75 15.85 2 4 -2 817.59 20.39 2 4 -2 817.73 24.67 -2 -4 2 798.05 18.09 2 4 -1 189.05 10.09 -2 -4 1 189.72 6.63 2 4 0 57.32 5.84 -2 -4 -1 1945.03 38.07 2 4 1 1968.52 35.85 -2 -4 -2 333.99 17.08 2 4 2 385.63 16.8 -2 -4 -2 364.71 18.71 -2 -4 -3 827.94 29.04 2 4 3 908.83 27.2 -2 -4 -3 819.2 29.85 2 4 4 6.7 0.97 -2 -4 -4 3.16 1.45 2 4 5 5.91 1.26 -2 -4 -5 5.55 2.78 -2 -4 -6 299.26 21.64 2 4 6 314.53 10.61 -2 -4 -7 1.37 2.58 2 4 7 0.29 0.55 2 4 8 404.92 15.24 -2 -4 -8 405.91 28.67 -2 -4 -9 10.92 5.53 -2 -4 -10 54.4 11.66 2 5 -14 55.99 10.01 2 5 -13 4.29 2.73 -2 -5 13 16.5 5.14 -2 -5 12 -0.16 1.7 2 5 -12 7.56 3.45 -2 -5 11 1.88 1.99 2 5 -11 2.56 2.3 2 5 -10 0.36 1.48 -2 -5 10 0.82 0.94 -2 -5 9 223.61 11.14 -2 -5 9 214.7 12.44 -2 -5 9 191.52 14.95 2 5 -9 192.38 15.22 2 5 -8 1.84 0.88 -2 -5 8 2.49 1.29 -2 -5 8 3.95 1.44 -2 -5 8 4.13 1.32 -2 -5 7 49.44 6.67 -2 -5 7 47.9 4.67 2 5 -7 43.98 6.6 -2 -5 7 52.49 6.06 2 5 -6 200.81 11.37 -2 -5 6 171.19 11.54 -2 -5 6 182.33 8.85 2 5 -6 185.6 13.31 2 5 -5 19.65 4.38 2 5 -5 25.36 4.15 -2 -5 5 20.76 2.99 -2 -5 5 20.52 3.63 2 5 -4 169.29 10.75 -2 -5 4 170.64 9.59 -2 -5 4 173.65 8.99 2 5 -4 182.01 12.58 -2 -5 3 51.22 4.67 2 5 -3 51.32 6.01 2 5 -3 55.42 6.88 -2 -5 3 53.37 5.14 2 5 -2 0.52 0.95 -2 -5 2 2.11 0.84 2 5 -2 1.63 1.16 -2 -5 1 1.69 1.22 2 5 -1 2.93 2.08 -2 -5 1 1.32 0.55 2 5 0 127.99 9.98 -2 -5 0 128.15 9.95 2 5 1 160.49 11.64 -2 -5 -1 161.89 12.06 -2 -5 -2 -0.43 0.88 -2 -5 -3 16.65 4.47 -2 -5 -4 183.01 15.88 -2 -5 -5 21.87 5.93 -2 -5 -6 -1.06 1.26 -2 -5 -7 6.56 5.17 -2 -5 -8 60.07 11.5 -2 -5 -9 27.94 8.66 -2 -6 13 0.69 1.8 2 6 -13 1.93 2.44 -2 -6 12 2.06 1.43 2 6 -12 -0.2 1.93 -2 -6 11 -0.15 1.39 2 6 -11 1.62 2.37 -2 -6 10 7.14 3.31 -2 -6 10 8.28 2.29 2 6 -10 12.97 4.31 -2 -6 9 83.44 10.18 -2 -6 9 89.75 7.28 2 6 -9 92.22 10.64 -2 -6 8 4.6 2.4 -2 -6 8 5.17 2.15 -2 -6 8 5.89 2.04 2 6 -8 4.51 2.42 -2 -6 7 1.95 1.73 -2 -6 7 2.76 1.3 2 6 -7 1.4 1.06 -2 -6 7 2.08 1.28 2 6 -6 47.7 6.51 -2 -6 6 59.25 6.91 2 6 -6 54.78 7.57 -2 -6 5 33.9 4.89 2 6 -5 29.28 5.54 2 6 -5 27.98 5.15 2 6 -4 167.85 12.52 -2 -6 4 185.07 10.05 2 6 -4 172.08 12.98 -2 -6 3 18.98 3.53 2 6 -3 24.5 4.9 -2 -6 3 18.66 4.72 -2 -6 3 10.44 3.93 2 6 -3 3.82 3.23 -2 -6 2 228.45 13.13 -2 -6 2 230.53 8.25 -2 -6 2 254.78 13.39 2 6 -2 227.97 15.17 2 6 -2 231.83 14.71 2 6 -1 72.58 8.4 -2 -6 1 67.71 7.53 -2 -6 0 42.3 6.4 -2 -6 -1 737.24 28.19 -2 -6 -2 335.05 20.28 -2 -6 -3 307.03 20.54 -2 -6 -4 27.81 6.61 -2 -6 -5 15.24 5.12 -2 -6 -6 389.66 27.95 -2 -6 -7 38.01 9.01 -2 -6 -8 208.24 22.92 2 7 -13 5.62 3.34 2 7 -12 1.16 1.3 -2 -7 12 -1.16 1.3 -2 -7 11 113.72 13.48 2 7 -11 99.79 12.32 -2 -7 10 0.68 1.93 2 7 -10 0.19 1.69 -2 -7 9 -0.18 0.98 2 7 -9 2.64 1.96 -2 -7 8 80.48 9.34 2 7 -8 93.5 10.84 -2 -7 7 3.79 1.54 2 7 -7 2.05 1.73 2 7 -7 3.33 1.8 -2 -7 7 4.97 1.65 2 7 -6 39.63 6.68 -2 -7 6 41.78 5.84 -2 -7 6 49.87 5.82 2 7 -6 50.35 7.55 2 7 -5 11.53 3.73 2 7 -5 13.88 4.35 -2 -7 5 22.12 3.95 -2 -7 5 9.28 2.63 -2 -7 4 11.49 2.48 2 7 -4 12.59 3.78 -2 -7 4 13.94 3.28 2 7 -4 10.65 3.4 -2 -7 4 10.06 2.87 -2 -7 3 1.93 1.77 2 7 -3 0.61 1.17 -2 -7 3 4.15 1.54 2 7 -3 1.55 0.99 -2 -7 3 1.48 1.63 -2 -7 2 25.05 5 -2 -7 2 30.41 5.6 2 7 -2 27.18 5.85 -2 -7 2 23.45 2.44 -2 -7 1 139.85 12.06 -2 -7 0 3.6 1.67 -2 -7 -1 56.29 8.59 -2 -7 -2 0.98 1.78 -2 -7 -3 0.67 1.1 -2 -7 -4 12.52 5.16 -2 -7 -5 45.06 9.69 -2 -7 -6 20.87 7.11 2 8 -13 7.91 4.35 2 8 -12 23.3 6.65 -2 -8 12 26.96 7 -2 -8 11 4.17 2.76 2 8 -11 2.06 2.14 -2 -8 10 14.2 4.1 2 8 -10 18.31 5.18 2 8 -9 13.86 4.73 -2 -8 9 10.17 3.62 -2 -8 8 28.42 5.78 -2 -8 8 20.92 4.05 2 8 -8 17.05 4.85 -2 -8 7 8.09 2.57 -2 -8 7 8.91 2.66 2 8 -7 10.12 3.76 -2 -8 6 23.46 4.41 -2 -8 6 22.77 4.36 2 8 -6 22.27 5.2 -2 -8 5 1.02 1.62 2 8 -5 -0.58 0.77 -2 -8 4 147.35 12.01 -2 -8 4 142.32 8.69 2 8 -4 126.8 12.45 -2 -8 4 140.31 11.29 -2 -8 3 2.78 1.84 2 8 -3 -0.79 1.76 -2 -8 3 1.23 0.55 2 8 -2 1.1 1.71 -2 -8 2 7.77 3.54 -2 -8 1 85.17 10.22 -2 -8 0 10.11 3.88 -2 -8 -1 58.74 9.42 -2 -8 -2 3.37 2.43 -2 -8 -3 65.03 11.12 -2 -8 -4 84.71 13.53 -2 -9 11 5.67 4.16 -2 -9 10 5.49 3.14 2 9 -10 7.22 4.54 -2 -9 9 0.47 1.37 2 9 -9 -0.23 2.02 2 9 -8 10.02 3.87 2 9 -7 0.1 1.81 -2 -9 6 1.08 1.07 -2 -9 6 0.45 0.86 2 9 -6 0.5 1.4 2 9 -5 11.28 3.79 -2 -9 5 16.33 4.3 -2 -9 5 16.24 4.12 2 9 -4 19.61 5.25 -2 -9 4 15.82 4.47 -2 -9 4 21.19 4.65 -2 -9 3 85.46 10.47 -2 -9 3 120.29 11.83 2 9 -3 111.64 12.3 -2 -9 2 2 1.69 2 9 -2 -1.82 2.52 -2 -9 1 29.39 6.84 2 9 -1 12.88 4.14 -2 -9 0 2.17 2.49 -2 -9 -1 -0.02 2.01 -2 -9 -2 45.74 9.44 -2 -10 6 21.55 5.28 -2 -10 5 7.42 3.59 -2 -10 5 6.79 3.21 -2 -10 4 3.25 2.34 -2 -10 3 1.28 0.94 -2 -10 2 0.41 0.92 -2 -10 1 18.15 5.93 -3 10 3 124.49 16.63 -3 10 2 21.14 6.52 -3 10 1 11.62 4.65 -3 10 0 8.45 4.59 3 -10 0 13.58 5.39 3 -10 1 11 4.35 -3 10 -1 9.79 4.27 3 -10 2 87.64 12.36 -3 10 -2 80.34 13.01 -3 10 -3 42.86 9.59 3 -10 3 30.18 7.3 -3 10 -4 0.17 1.05 3 -10 4 6.13 3.42 -3 10 -5 -0.62 1.27 3 -10 5 1.28 1.92 -3 10 -6 7.36 3.45 3 -10 6 0.65 1.4 3 -10 7 22.82 6.75 3 -10 8 39.22 9.13 3 -10 9 1.88 1.99 -3 9 4 21.18 6.63 3 -9 -3 51.12 9.04 -3 9 3 43.95 9.01 3 -9 -3 46.17 8.84 -3 9 2 7.08 3.26 3 -9 -2 12.06 4.16 3 -9 -1 57.35 9.51 -3 9 1 43.76 9.37 3 -9 0 131.73 14.31 -3 9 0 125.16 15.55 -3 9 -1 339.74 25.25 3 -9 1 362.56 23.72 -3 9 -2 20.57 6.37 3 -9 2 27.57 6.99 3 -9 3 30.83 7.1 -3 9 -3 26.13 7.35 -3 9 -4 51.93 9.85 3 -9 4 75.72 11.19 3 -9 5 103.13 13.18 -3 9 -5 80.64 12.33 3 -9 6 113.37 14.21 -3 9 -6 120.09 14.92 3 -9 7 3.44 2.74 -3 9 -7 1.46 2.17 -3 9 -8 -2.28 2.35 3 -9 8 -0.14 2.6 3 -9 9 38.23 8.59 -3 9 -9 30.65 7.77 3 -9 10 5.16 3.57 -3 9 -10 6.82 3.95 3 -9 11 10.42 5.2 -3 9 -11 1.82 1.89 3 -8 -6 35.46 7.71 3 -8 -5 85.93 11.39 3 -8 -5 87.61 11.71 -3 8 5 80.43 11.82 -3 8 4 5.51 2.88 3 -8 -4 5.93 3.56 3 -8 -4 2.88 2.23 -3 8 3 8.56 3.85 3 -8 -3 10.79 4.06 3 -8 -2 41.43 7.59 -3 8 2 34.6 7.58 3 -8 -1 239.37 18.28 -3 8 1 235.35 19.76 3 -8 0 32.52 5.72 3 -8 0 24.13 5.88 -3 8 0 29.3 6.95 3 -8 1 10.28 3.81 3 -8 1 16.31 4.19 -3 8 -1 16.97 5.46 3 -8 2 29.23 6.03 -3 8 -2 16.81 5.28 3 -8 2 24.32 5.85 3 -8 3 4.48 3.11 -3 8 -3 0.7 1.29 3 -8 4 104.89 12.56 -3 8 -4 86.03 11.71 3 -8 5 13.95 5.24 -3 8 -5 8.73 3.87 3 -8 6 27.44 6.84 -3 8 -6 31.86 7.34 3 -8 7 10.37 4.41 -3 8 -7 19.3 5.54 3 -8 8 37.47 8.19 -3 8 -8 26.48 6.79 3 -8 9 8.21 4.34 -3 8 -9 12.73 4.75 3 -8 10 10.69 4.59 -3 8 -10 9.03 4.09 3 -8 11 63.11 11.98 -3 8 -11 29.91 7.79 -3 8 -12 10.71 4.63 3 -8 12 17.82 6.58 3 -8 13 10.05 4.59 3 -7 -8 4.88 3.17 3 -7 -7 14.78 4.97 -3 7 6 79.9 10.99 3 -7 -6 94.84 11.74 -3 7 5 5.66 2.95 3 -7 -5 -0.38 1.34 3 -7 -5 2.81 1.84 -3 7 4 3.1 2.38 3 -7 -4 3.56 2.35 3 -7 -4 1.7 0.77 -3 7 3 3.51 2.46 3 -7 -3 3.87 2.58 3 -7 -3 1.23 0.96 3 -7 -2 3.87 1.95 3 -7 -2 10.63 3.81 -3 7 2 9.51 3.97 -3 7 2 6.38 1.77 3 -7 -1 327.13 19.96 -3 7 1 339.44 11.04 -3 7 1 334.13 21.75 3 -7 -1 328.46 17.06 3 -7 0 24.63 4.98 -3 7 0 21.24 1.95 -3 7 0 20.41 2.06 -3 7 0 12.53 4.2 3 -7 0 17.58 4.85 3 -7 1 42.45 7.22 -3 7 -1 40.11 7.49 3 -7 1 25.74 5.17 3 -7 2 3.49 3.31 3 -7 2 2.71 2.41 -3 7 -2 0.53 1.69 3 -7 3 5.08 2.92 -3 7 -3 2.61 1.14 3 -7 4 92.01 11.29 -3 7 -4 100.97 11.83 -3 7 -5 0.62 1.82 3 -7 5 -0.22 1.13 3 -7 6 27.93 6.93 -3 7 -6 24 5.89 3 -7 7 34.34 7.62 -3 7 -7 32.89 6.93 3 -7 8 1.2 1.3 -3 7 -8 2.15 1.09 -3 7 -8 2.86 2.54 -3 7 -9 39.47 4.77 3 -7 9 35.32 8.22 3 -7 10 6.68 3.16 -3 7 -10 2.21 2.65 3 -7 11 18.32 6.27 -3 7 -11 16.98 5.87 -3 7 -12 9.03 3.72 3 -7 12 13.97 5.57 3 -7 13 15.93 6.43 3 -6 -10 3.89 3.29 3 -6 -9 32.4 7.63 -3 6 8 66.37 9.16 3 -6 -8 54.14 9.26 -3 6 7 90.8 10.35 -3 6 7 109.95 12.29 3 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10 -5 1 22.23 6.69 10 -5 2 13.61 5.77 10 -5 2 26.52 7.83 10 -5 3 77.58 13.54 10 -4 -2 6.21 3.19 10 -4 -1 41.55 8.71 10 -4 0 -2.91 3.24 10 -4 1 122.78 15.13 10 -4 1 115.66 15.85 10 -4 2 0.53 2.28 10 -4 2 -0.84 2.38 10 -4 3 12.01 5.06 10 -4 3 12.27 5.58 10 -4 4 3.21 3.41 10 -3 -2 120.69 13.69 10 -3 -1 6.17 2.33 10 -3 0 25.62 6.48 10 -3 0 11.7 5.2 10 -3 1 122.34 16.49 10 -3 1 146.44 16.13 10 -3 2 3.27 2.63 10 -3 2 6.16 2.43 10 -3 3 75.28 12.45 10 -3 3 93.51 15.11 10 -3 4 2.8 3.58 10 -3 4 7.08 4.43 10 -2 -7 -0.43 1.53 10 -2 -6 3.31 2.33 10 -2 -5 50.26 9.14 10 -2 -4 127.38 14.05 10 -2 -3 15.41 5.15 10 -2 -2 5.54 2.82 10 -2 -1 293.06 22.31 10 -2 -1 261.62 19.85 10 -2 0 23.18 6 10 -2 0 31.74 8.04 10 -2 0 27.01 6.81 10 -2 1 53.63 9.73 10 -2 1 47.26 9.89 10 -2 1 31.02 6.64 10 -2 2 11.93 5.05 10 -2 2 9.55 5.89 10 -2 2 6.3 2.48 10 -2 3 -0.09 2.3 10 -2 3 2.81 3.39 10 -2 3 2.56 2.67 10 -2 4 6.13 3.12 10 -2 4 4.36 3.42 10 -2 4 1.97 2.11 10 -1 -7 48.02 9.52 10 -1 -6 -1.67 2.02 10 -1 -5 2.77 3.17 10 -1 -4 89.74 12.39 10 -1 -3 -0.06 1.82 10 -1 -2 113.93 13.97 10 -1 -1 6.98 3.29 10 -1 0 5.48 2.81 10 -1 0 8.26 3.97 10 -1 0 5.26 2.8 10 -1 1 83.22 13.02 10 -1 1 82.14 11.84 10 -1 1 93.72 12.15 10 -1 2 -2.17 2.72 10 -1 2 0.03 2.43 10 -1 3 202.26 18.45 10 -1 3 232.75 21.25 10 -1 4 7.48 3.58 10 -1 4 8.79 4.06 10 -1 4 11.56 5.34 10 0 -6 91.79 13.22 10 0 -5 41.63 8.92 10 0 -4 47.72 9.14 10 0 -3 83.41 12.54 10 0 -2 3.68 3.32 10 0 -1 63.72 10.81 10 0 0 4.35 1.37 10 0 1 41.23 7.97 10 0 1 26.07 7.12 10 0 1 31.86 7.55 -10 0 -2 3.14 3.85 10 0 2 3.15 2.82 10 0 2 0.4 2.03 10 0 3 61.57 10.49 10 0 3 49.37 9.88 -10 0 -3 49.44 10.74 10 0 3 45.51 10.03 -10 0 -4 28.51 8.84 10 0 4 36.33 9.55 10 1 -4 108.55 14.83 10 1 -3 -8.47 4.08 10 1 -2 18.25 5.98 10 1 -1 84.78 12.75 10 1 0 -11.36 4.63 10 1 1 115.3 14.72 10 1 2 15.15 6.12 -10 -1 -2 7.37 3.81 10 1 3 9.72 5.36 -10 -1 -3 2.25 2.79 11 -1 -3 -2.91 4.34 11 -1 -2 26.54 7.68 11 -1 -1 9.57 4.09 11 -1 0 8.41 4.54