#------------------------------------------------------------------------------ #$Date: 2019-11-11 20:36:41 +0200 (Mon, 11 Nov 2019) $ #$Revision: 227284 $ #$URL: file:///home/coder/svn-repositories/cod/cif/4/03/58/4035876.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_4035876 loop_ _publ_author_name 'Zhao, Meng-Yao' 'Wang, De-Xian' 'Wang, Mei-Xiang' _publ_section_title ; Synthesis, Structure, and Properties of Corona[6]arenes and Their Assembly with Anions in the Crystalline State. ; _journal_issue 3 _journal_name_full 'The Journal of organic chemistry' _journal_page_first 1502 _journal_page_last 1509 _journal_paper_doi 10.1021/acs.joc.7b03136 _journal_volume 83 _journal_year 2018 _chemical_formula_moiety 'C31 H21 N9 O3 S2' _chemical_formula_sum 'C31 H21 N9 O3 S2' _chemical_formula_weight 631.69 _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 2017-07-03 _audit_creation_method ; Olex2 1.2 (compiled 2017.03.28 svn.r3405 for OlexSys, GUI svn.r5337) ; _cell_angle_alpha 96.925(3) _cell_angle_beta 112.160(4) _cell_angle_gamma 98.871(3) _cell_formula_units_Z 2 _cell_length_a 10.4612(5) _cell_length_b 11.1373(4) _cell_length_c 13.8290(5) _cell_measurement_reflns_used 10810 _cell_measurement_temperature 173(2) _cell_measurement_theta_max 31.178 _cell_measurement_theta_min 1.861 _cell_volume 1445.95(11) _computing_cell_refinement 'CrysAlisPro 1.171.39.9d (Rigaku OD, 2015)' _computing_data_collection 'CrystalClear (Rigaku Inc., 2007)' _computing_data_reduction 'CrysAlisPro 1.171.39.9d (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_temperature 173.15 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 0.998 _diffrn_measurement_device_type 'MM007-HF CCD(Saturn 724+)' _diffrn_measurement_method '\w scans at fixed \c = 45\%' _diffrn_radiation_monochromator Confocal _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0505 _diffrn_reflns_av_unetI/netI 0.0520 _diffrn_reflns_Laue_measured_fraction_full 1.000 _diffrn_reflns_Laue_measured_fraction_max 0.998 _diffrn_reflns_limit_h_max 13 _diffrn_reflns_limit_h_min -13 _diffrn_reflns_limit_k_max 14 _diffrn_reflns_limit_k_min -14 _diffrn_reflns_limit_l_max 17 _diffrn_reflns_limit_l_min -17 _diffrn_reflns_number 20308 _diffrn_reflns_point_group_measured_fraction_full 1.000 _diffrn_reflns_point_group_measured_fraction_max 0.998 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.498 _diffrn_reflns_theta_min 1.621 _diffrn_source 'Rotating Anode' _exptl_absorpt_coefficient_mu 0.236 _exptl_absorpt_correction_T_max 1.000 _exptl_absorpt_correction_T_min 0.8887 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.39.9d (Rigaku Oxford Diffraction, 2015) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_crystal_colour red _exptl_crystal_density_diffrn 1.451 _exptl_crystal_description rod _exptl_crystal_F_000 652 _exptl_crystal_size_max 0.29 _exptl_crystal_size_mid 0.11 _exptl_crystal_size_min 0.09 _refine_diff_density_max 0.281 _refine_diff_density_min -0.260 _refine_diff_density_rms 0.050 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.026 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 407 _refine_ls_number_reflns 6636 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.026 _refine_ls_R_factor_all 0.0739 _refine_ls_R_factor_gt 0.0499 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0443P)^2^+0.4211P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1055 _refine_ls_wR_factor_ref 0.1175 _reflns_Friedel_coverage 0.000 _reflns_number_gt 4926 _reflns_number_total 6636 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file jo7b03136_si_005.cif _cod_data_source_block mx6078a _cod_database_code 4035876 _shelx_shelxl_version_number 2014/7 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_max 0.979 _shelx_estimated_absorpt_t_min 0.935 _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: C7(H7A,H7B) 2.b Aromatic/amide H refined with riding coordinates: C2(H2), C3(H3), C5(H5), C6(H6), C9(H9), C10(H10), C12(H12), C13(H13), C17(H17), C18(H18), C20(H20), C21(H21), C25(H25), C26(H26), C28(H28), C29(H29) 2.c Idealised Me refined as rotating group: C23(H23A,H23B,H23C) ; _shelx_res_file ; mx6078a.res created by SHELXL-2014/7 TITL mx6078a_a.res in P-1 CELL 0.71073 10.4612 11.1373 13.829 96.925 112.16 98.871 ZERR 2 0.0005 0.0004 0.0005 0.003 0.004 0.003 LATT 1 SFAC C H N O S UNIT 62 42 18 6 4 L.S. 4 0 63 PLAN 20 SIZE 0.29 0.11 0.09 TEMP -100 BOND $H list 4 fmap 2 acta omit-2 55 REM REM REM WGHT 0.044300 0.421100 FVAR 0.50135 S1 5 -0.168708 0.343569 0.151475 11.00000 0.03378 0.04978 = 0.03255 -0.00077 0.00480 0.01034 S2 5 0.444483 1.044641 0.805996 11.00000 0.04297 0.03050 = 0.04840 0.00840 0.01155 0.00609 O1 4 0.688767 0.668514 0.991336 11.00000 0.06671 0.04499 = 0.02682 0.00145 0.00472 0.02861 O2 4 0.805189 0.101145 0.684650 11.00000 0.04112 0.04161 = 0.04119 -0.00121 0.01130 0.01422 O3 4 0.361774 0.217532 0.294042 11.00000 0.04400 0.07160 = 0.02916 0.00410 0.01211 0.02806 N1 3 0.626209 0.958750 0.954628 11.00000 0.04363 0.03895 = 0.04105 -0.00004 0.00692 0.00996 N2 3 0.686025 0.870643 0.997173 11.00000 0.04625 0.04253 = 0.03506 -0.00099 0.00653 0.01487 N3 3 0.500972 0.717983 0.861674 11.00000 0.04575 0.03655 = 0.04201 0.00842 0.00589 0.01084 N4 3 0.441850 0.806150 0.816888 11.00000 0.04227 0.03340 = 0.04168 0.00865 0.00831 0.00808 N5 3 0.714732 0.262965 0.723132 11.00000 0.03256 0.03204 = 0.02862 0.00215 0.00584 0.00912 N6 3 0.140792 0.189083 0.171004 11.00000 0.04274 0.04332 = 0.02613 0.00241 0.01073 0.01168 N7 3 0.016516 0.219355 0.139170 11.00000 0.04117 0.04197 = 0.02755 0.00260 0.00948 0.01013 N8 3 0.093404 0.366046 0.301721 11.00000 0.03475 0.03699 = 0.02662 0.00272 0.00785 0.00863 N9 3 0.218767 0.333987 0.334668 11.00000 0.03626 0.03887 = 0.02806 0.00289 0.00951 0.01082 C1 1 -0.154618 0.473375 0.246869 11.00000 0.02817 0.04281 = 0.02934 0.00660 0.00696 0.01050 C2 1 -0.146800 0.588948 0.219880 11.00000 0.04741 0.05176 = 0.03071 0.01535 0.01638 0.01807 AFIX 43 H2 2 -0.144385 0.598182 0.153149 11.00000 -1.20000 AFIX 0 C3 1 -0.142475 0.691169 0.289372 11.00000 0.05070 0.03957 = 0.03814 0.01835 0.02001 0.01858 AFIX 43 H3 2 -0.137563 0.769982 0.269594 11.00000 -1.20000 AFIX 0 C4 1 -0.145190 0.680592 0.387663 11.00000 0.02882 0.04064 = 0.03106 0.00893 0.01086 0.01111 C5 1 -0.152772 0.563767 0.414019 11.00000 0.04474 0.04393 = 0.02994 0.01152 0.01757 0.01018 AFIX 43 H5 2 -0.153839 0.554657 0.481152 11.00000 -1.20000 AFIX 0 C6 1 -0.158811 0.460236 0.344241 11.00000 0.04394 0.03932 = 0.03842 0.01228 0.01756 0.00883 AFIX 43 H6 2 -0.165765 0.380935 0.363018 11.00000 -1.20000 AFIX 0 C7 1 -0.138314 0.792952 0.464425 11.00000 0.03499 0.04377 = 0.03648 0.01183 0.01413 0.01575 AFIX 23 H7A 2 -0.201926 0.768416 0.499872 11.00000 -1.20000 H7B 2 -0.174766 0.856044 0.423153 11.00000 -1.20000 AFIX 0 C8 1 0.008128 0.851893 0.549551 11.00000 0.03726 0.03207 = 0.03288 0.01352 0.01621 0.01504 C9 1 0.023631 0.916114 0.647739 11.00000 0.04005 0.03605 = 0.03869 0.01256 0.02118 0.01436 AFIX 43 H9 2 -0.058268 0.921870 0.660861 11.00000 -1.20000 AFIX 0 C10 1 0.155816 0.971702 0.726564 11.00000 0.04531 0.03296 = 0.03229 0.00845 0.01800 0.01144 AFIX 43 H10 2 0.164453 1.013413 0.793562 11.00000 -1.20000 AFIX 0 C11 1 0.275456 0.965886 0.706748 11.00000 0.03748 0.02882 = 0.03906 0.01137 0.01501 0.01026 C12 1 0.261831 0.905274 0.608807 11.00000 0.03759 0.03480 = 0.04345 0.01024 0.02013 0.01147 AFIX 43 H12 2 0.343642 0.902865 0.594737 11.00000 -1.20000 AFIX 0 C13 1 0.129108 0.847988 0.531050 11.00000 0.04274 0.03793 = 0.03446 0.00734 0.01952 0.01396 AFIX 43 H13 2 0.120945 0.805625 0.464411 11.00000 -1.20000 AFIX 0 C14 1 0.509439 0.922461 0.863319 11.00000 0.03482 0.03248 = 0.03552 0.00487 0.01695 0.00759 C15 1 0.621119 0.754401 0.945705 11.00000 0.04328 0.04086 = 0.02581 0.00356 0.01115 0.01592 C16 1 0.688828 0.562933 0.923334 11.00000 0.04613 0.03401 = 0.02557 0.00674 0.00807 0.01736 C17 1 0.567704 0.473937 0.862169 11.00000 0.04068 0.04231 = 0.04762 0.00393 0.01750 0.01365 AFIX 43 H17 2 0.479380 0.480969 0.864248 11.00000 -1.20000 AFIX 0 C18 1 0.578402 0.374052 0.797644 11.00000 0.03368 0.03331 = 0.05059 0.00132 0.01183 0.00296 AFIX 43 H18 2 0.496019 0.312412 0.754191 11.00000 -1.20000 AFIX 0 C19 1 0.707187 0.362747 0.795551 11.00000 0.03434 0.02893 = 0.02939 0.00478 0.00960 0.00717 C20 1 0.827576 0.452149 0.859803 11.00000 0.03182 0.03661 = 0.02924 0.00655 0.00904 0.00558 AFIX 43 H20 2 0.916620 0.444924 0.859258 11.00000 -1.20000 AFIX 0 C21 1 0.817814 0.551546 0.924481 11.00000 0.03920 0.03272 = 0.02684 0.00509 0.00286 0.00498 AFIX 43 H21 2 0.900406 0.611994 0.969738 11.00000 -1.20000 AFIX 0 C22 1 0.795228 0.175721 0.752400 11.00000 0.02943 0.03220 = 0.03777 0.00360 0.00880 0.00314 C23 1 0.865602 0.171934 0.868580 11.00000 0.05152 0.03724 = 0.03916 0.00666 0.00601 0.01232 AFIX 137 H23A 2 0.853825 0.085660 0.877905 11.00000 -1.50000 H23B 2 0.822287 0.217951 0.908255 11.00000 -1.50000 H23C 2 0.966581 0.209720 0.895336 11.00000 -1.50000 AFIX 0 C24 1 0.625772 0.253016 0.611965 11.00000 0.03107 0.03133 = 0.02975 0.00077 0.00899 0.00931 C25 1 0.511238 0.153962 0.562834 11.00000 0.03126 0.03414 = 0.03628 0.00579 0.01262 0.00714 AFIX 43 H25 2 0.493986 0.092903 0.601443 11.00000 -1.20000 AFIX 0 C26 1 0.421767 0.143892 0.457331 11.00000 0.02754 0.03954 = 0.03922 -0.00043 0.00851 0.00680 AFIX 43 H26 2 0.343112 0.075965 0.422513 11.00000 -1.20000 AFIX 0 C27 1 0.449210 0.234400 0.403967 11.00000 0.03235 0.04940 = 0.02910 0.00346 0.00917 0.01852 C28 1 0.561327 0.333764 0.451271 11.00000 0.05156 0.04036 = 0.04079 0.01246 0.01821 0.01260 AFIX 43 H28 2 0.577251 0.395286 0.412659 11.00000 -1.20000 AFIX 0 C29 1 0.651281 0.342684 0.556924 11.00000 0.03951 0.03388 = 0.03910 0.00400 0.01181 0.00195 AFIX 43 H29 2 0.730243 0.410431 0.591217 11.00000 -1.20000 AFIX 0 C30 1 0.236027 0.249322 0.267979 11.00000 0.03631 0.04020 = 0.02723 0.00918 0.01280 0.01251 C31 1 -0.002227 0.308498 0.205323 11.00000 0.03413 0.03393 = 0.02717 0.00670 0.01047 0.00567 HKLF 4 REM mx6078a_a.res in P-1 REM R1 = 0.0499 for 4926 Fo > 4sig(Fo) and 0.0739 for all 6636 data REM 407 parameters refined using 0 restraints END WGHT 0.0443 0.4206 REM Highest difference peak 0.281, deepest hole -0.260, 1-sigma level 0.050 Q1 1 -0.0736 0.3305 0.1773 11.00000 0.05 0.28 Q2 1 -0.1758 0.3739 0.2181 11.00000 0.05 0.27 Q3 1 0.3471 1.0203 0.7532 11.00000 0.05 0.27 Q4 1 -0.0598 0.8186 0.5100 11.00000 0.05 0.24 Q5 1 0.0608 0.8450 0.5433 11.00000 0.05 0.23 Q6 1 0.4611 0.9636 0.8164 11.00000 0.05 0.22 Q7 1 -0.1811 0.6271 0.3956 11.00000 0.05 0.21 Q8 1 0.5938 0.1801 0.5637 11.00000 0.05 0.20 Q9 1 0.1987 0.9285 0.7094 11.00000 0.05 0.20 Q10 1 0.0134 0.8957 0.5924 11.00000 0.05 0.20 Q11 1 0.4466 1.0761 0.8854 11.00000 0.05 0.20 Q12 1 0.7649 0.3886 0.8377 11.00000 0.05 0.20 Q13 1 0.4035 0.2163 0.4530 11.00000 0.05 0.20 Q14 1 0.2750 0.1565 0.2268 11.00000 0.05 0.20 Q15 1 0.0661 0.4271 0.3360 11.00000 0.05 0.19 Q16 1 0.6366 0.5097 0.9012 11.00000 0.05 0.19 Q17 1 0.4637 0.1783 0.4254 11.00000 0.05 0.19 Q18 1 0.0960 0.9614 0.6713 11.00000 0.05 0.19 Q19 1 0.1769 0.1429 0.1277 11.00000 0.05 0.19 Q20 1 0.9823 0.1530 0.8768 11.00000 0.05 0.19 ; _shelx_res_checksum 15410 _shelx_hkl_file ; 0 0 -1 1.26 0.21 0 0 1 0.86 0.20 0 0 1 1.49 0.36 0 0 -1 1.16 0.32 0 0 2 1548.73 16.98 0 0 2 1401.51 10.26 0 0 -2 1573.68 10.25 0 0 -2 1460.63 16.74 0 0 3 648.91 8.68 0 0 -3 613.72 7.92 0 0 3 651.19 13.52 0 0 -3 671.03 14.02 0 0 -4 53.69 4.68 0 0 4 52.01 4.47 0 0 4 47.21 2.74 0 0 -4 49.89 2.63 0 0 -4 45.50 2.78 0 0 5 99.69 7.04 0 0 -5 102.69 4.22 0 0 -5 104.87 7.00 0 0 -5 106.04 4.51 0 0 5 98.52 4.46 0 0 -6 222.43 7.02 0 0 6 185.33 6.81 0 0 -6 204.20 10.84 0 0 -7 750.15 13.94 0 0 7 786.82 15.28 0 0 7 778.91 18.86 0 0 8 87.77 5.55 0 0 -8 92.83 8.45 0 0 -8 96.51 5.35 0 0 8 76.16 6.41 0 0 -9 17.35 2.39 0 0 9 16.30 3.35 0 0 9 16.84 2.68 0 0 -9 23.60 4.41 0 0 10 5.78 2.22 0 0 -10 6.04 1.55 0 0 10 5.03 1.52 0 0 11 5.51 1.83 0 0 -11 1.73 0.86 0 0 11 1.43 1.36 0 0 -11 2.46 2.49 0 0 12 43.55 6.79 0 0 -12 47.15 7.59 0 0 12 45.10 5.30 0 0 -12 37.26 4.21 0 0 13 33.02 6.42 0 0 -13 35.57 7.01 0 0 -13 27.38 3.76 0 0 13 43.21 5.61 0 0 14 37.32 6.78 0 0 14 54.25 6.48 0 0 -14 46.03 5.16 0 0 -14 52.23 8.81 0 0 -15 122.90 14.57 0 0 15 99.31 9.37 0 0 15 99.85 12.14 0 0 16 3.45 2.31 0 0 -16 2.88 3.31 0 0 17 6.87 3.39 0 0 -17 14.12 6.20 0 1 17 4.43 2.74 0 -1 -17 11.11 5.20 0 -1 -16 5.49 3.87 0 1 16 4.19 2.32 0 1 15 7.43 3.84 0 1 15 9.47 2.95 0 -1 -15 12.35 5.54 0 -1 -14 61.87 10.45 0 -1 -14 52.68 5.43 0 1 14 48.25 7.77 0 1 14 54.24 6.81 0 1 13 31.13 5.97 0 1 13 38.58 5.32 0 -1 -13 37.63 7.21 0 -1 -13 36.72 4.23 0 1 12 2.28 1.86 0 -1 -12 0.77 1.39 0 -1 -12 1.52 1.04 0 1 12 5.02 1.90 0 -1 -11 163.88 8.43 0 1 11 170.69 11.40 0 -1 -11 178.48 14.68 0 1 11 166.46 9.70 0 1 10 43.90 4.70 0 -1 -10 43.64 6.94 0 -1 -10 37.34 3.82 0 1 10 32.67 4.70 0 -1 -9 79.77 8.49 0 1 9 89.65 6.10 0 -1 -9 93.49 5.70 0 -1 -8 286.90 15.62 0 1 8 248.72 9.44 0 -1 -7 254.70 13.79 0 1 7 242.49 8.54 0 1 6 198.30 7.05 0 -1 -6 193.63 11.20 0 -1 -5 273.14 12.13 0 1 5 271.91 7.49 0 1 4 65.39 5.56 0 1 4 69.39 3.36 0 -1 -4 74.47 5.48 0 -1 -4 65.16 3.02 0 1 3 119.27 3.86 0 -1 -3 127.21 3.72 0 -1 -3 130.11 6.71 0 1 3 124.02 6.92 0 1 3 125.54 4.43 0 -1 -2 357.60 5.64 0 -1 -2 324.64 5.02 0 -1 -2 332.49 6.20 0 1 2 338.63 6.41 0 1 2 339.43 10.02 0 1 2 340.50 5.44 0 1 1 1578.50 8.71 0 1 1 1481.51 9.63 0 -1 -1 1507.25 8.36 0 -1 -1 1529.71 17.87 0 1 1 1616.42 13.05 0 1 1 1616.17 19.03 0 -1 -1 1571.16 12.51 0 1 0 1.98 0.32 0 -1 0 1.66 0.57 0 1 0 2.38 0.63 0 -1 0 3.55 0.76 0 -1 0 1.68 0.32 0 1 0 2.37 0.77 0 1 -1 99.79 2.49 0 1 -1 98.03 4.18 0 -1 1 102.96 2.30 0 -1 1 95.99 2.44 0 1 -1 105.05 3.34 0 -1 1 103.68 4.35 0 -1 1 91.22 3.12 0 1 -1 109.45 2.36 0 1 -2 675.16 7.62 0 1 -2 644.77 7.19 0 -1 2 689.92 12.55 0 -1 2 617.07 7.31 0 -1 2 599.29 10.30 0 1 -2 631.57 10.57 0 -1 2 670.33 7.76 0 1 -2 644.03 11.29 0 1 -3 592.59 8.00 0 -1 3 601.34 12.44 0 1 -3 582.39 12.40 0 -1 3 549.76 12.12 0 1 -3 595.86 11.54 0 -1 3 563.85 8.45 0 1 -4 325.55 6.76 0 -1 4 325.45 7.32 0 -1 4 340.70 7.48 0 -1 4 348.85 11.12 0 -1 4 298.51 10.02 0 1 -4 321.89 10.68 0 1 -4 314.38 6.88 0 -1 5 166.57 8.14 0 -1 5 168.93 8.78 0 1 -5 156.59 5.32 0 1 -5 164.85 5.33 0 -1 5 165.44 5.88 0 1 -5 167.41 8.61 0 1 -6 3.08 0.88 0 1 -6 4.15 1.62 0 -1 6 4.90 1.17 0 -1 6 5.65 1.72 0 1 -7 439.92 16.70 0 -1 7 449.14 15.61 0 1 -7 414.37 10.25 0 -1 7 437.56 11.70 0 1 -8 12.36 3.18 0 -1 8 11.24 2.12 0 1 -8 11.13 1.82 0 -1 8 9.05 2.56 0 1 -9 25.72 4.92 0 -1 9 22.67 3.12 0 1 -9 20.02 2.61 0 -1 9 26.49 4.55 0 1 -10 5.68 1.50 0 -1 10 11.24 3.33 0 1 -10 10.92 3.40 0 -1 10 7.81 2.05 0 1 -11 4.14 2.44 0 1 -11 0.29 0.80 0 -1 11 0.68 1.55 0 -1 11 1.73 2.41 0 -1 12 90.97 9.85 0 1 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15 12.48 3.65 0 -7 15 -1.14 2.51 0 7 -15 7.74 2.44 0 7 -16 -0.78 2.18 0 -7 16 2.93 3.86 0 -7 16 3.76 2.55 0 7 -16 2.51 2.11 0 -7 17 2.92 2.46 0 7 -17 4.40 4.24 0 -7 17 8.01 6.27 0 -7 18 8.36 6.75 0 -8 -13 5.23 5.06 0 8 13 0.75 1.41 0 -8 -12 3.08 3.05 0 8 12 6.12 2.84 0 8 11 12.28 3.22 0 -8 -11 14.40 6.09 0 8 10 4.73 1.98 0 -8 -10 0.92 2.08 0 -8 -9 -2.96 3.11 0 8 9 -0.48 1.21 0 -8 -8 28.63 6.43 0 8 8 27.56 3.76 0 -8 -7 6.14 2.39 0 8 7 2.10 1.29 0 -8 -7 2.35 1.59 0 8 6 3.71 1.33 0 8 6 5.20 1.57 0 -8 -6 4.70 2.08 0 -8 -6 6.15 4.08 0 8 5 100.22 5.97 0 8 5 103.36 7.45 0 -8 -5 121.15 9.43 0 -8 -5 133.31 13.67 0 -8 -4 3.85 2.51 0 -8 -4 1.01 1.42 0 8 4 0.08 0.73 0 8 4 2.34 0.98 0 8 3 28.05 3.62 0 -8 -3 18.98 4.97 0 -8 -3 27.98 4.81 0 8 3 24.61 2.65 0 -8 -2 32.77 5.40 0 -8 -2 35.00 7.21 0 8 2 32.23 2.84 0 8 2 35.53 4.15 0 8 1 47.38 4.68 0 8 1 56.85 3.55 0 -8 -1 48.18 6.48 0 -8 0 105.18 9.95 0 8 0 87.48 6.21 0 8 0 90.71 4.31 0 8 -1 370.81 8.46 0 -8 1 382.39 19.73 0 8 -1 371.09 12.64 0 -8 2 0.65 2.18 0 -8 2 1.26 1.14 0 8 -2 2.70 1.13 0 8 -2 1.90 0.67 0 8 -3 131.50 4.98 0 -8 3 118.45 14.10 0 8 -3 113.91 6.99 0 -8 3 143.98 12.75 0 -8 4 102.55 15.06 0 -8 4 108.35 11.32 0 8 -4 111.27 7.09 0 8 -5 32.42 4.63 0 -8 5 41.16 7.19 0 -8 5 33.11 3.45 0 8 -5 29.04 3.64 0 8 -6 144.74 10.26 0 -8 6 139.41 7.18 0 8 -6 139.16 8.25 0 -8 7 20.78 5.73 0 8 -7 25.99 4.76 0 -8 7 26.98 3.37 0 8 -7 23.66 3.43 0 8 -8 0.76 1.66 0 -8 8 0.43 0.77 0 -8 8 3.42 3.19 0 8 -8 1.75 1.07 0 8 -9 -0.08 0.95 0 -8 9 -0.03 0.60 0 -8 10 1.32 1.17 0 8 -10 0.71 1.13 0 8 -10 -0.06 0.74 0 -8 11 3.82 3.40 0 8 -11 7.38 2.08 0 8 -11 6.58 3.14 0 -8 11 8.48 2.26 0 8 -12 9.35 3.62 0 -8 12 5.97 2.27 0 -8 12 -1.31 2.12 0 8 -12 6.54 2.07 0 -8 13 0.46 1.47 0 8 -13 4.24 2.59 0 8 -13 0.16 1.02 0 -8 13 -0.98 3.31 0 8 -14 -0.98 1.96 0 -8 14 2.88 2.65 0 8 -14 -0.18 1.39 0 -8 14 1.64 1.69 0 8 -15 19.15 5.78 0 -8 15 6.38 2.70 0 -8 15 9.77 6.47 0 8 -15 9.83 3.19 0 8 -16 1.22 1.39 0 -8 16 0.29 4.04 0 8 -16 -2.71 3.44 0 -8 16 0.34 1.15 0 8 -17 10.75 5.31 0 -8 17 14.21 7.45 0 9 12 39.48 6.06 0 -9 -12 44.64 10.89 0 -9 -11 -1.11 3.23 0 9 11 -0.06 1.09 0 9 10 2.39 1.79 0 -9 -10 9.77 5.49 0 -9 -9 10.53 5.18 0 9 9 16.46 3.30 0 9 8 0.37 0.57 0 -9 -8 -1.01 2.34 0 9 7 14.82 2.80 0 -9 -7 12.42 4.71 0 -9 -7 18.62 3.82 0 -9 -6 83.98 11.67 0 -9 -6 108.59 9.44 0 9 6 89.66 6.42 0 9 6 85.22 7.39 0 9 5 103.62 6.44 0 -9 -5 97.35 12.58 0 -9 -5 96.60 9.02 0 9 5 90.79 7.39 0 -9 -4 254.07 14.90 0 9 4 202.77 10.78 0 -9 -4 231.78 19.12 0 9 4 226.58 8.92 0 -9 -3 35.49 5.69 0 9 3 35.27 3.36 0 9 3 35.34 4.47 0 9 2 183.32 7.17 0 -9 -2 189.50 13.43 0 9 2 173.33 9.79 0 -9 -2 186.71 16.87 0 9 1 0.02 0.99 0 -9 -1 -0.42 2.04 0 9 1 0.89 0.66 0 9 0 36.66 3.00 0 9 0 35.43 4.31 0 -9 0 41.90 6.78 0 -9 0 43.54 8.96 0 9 -1 5.39 1.61 0 -9 1 6.46 2.89 0 -9 1 3.59 2.97 0 9 -1 2.67 0.87 0 -9 2 4.56 2.16 0 9 -2 1.34 1.12 0 -9 2 4.25 3.08 0 9 -2 0.85 0.27 0 9 -3 52.79 5.20 0 9 -3 52.28 3.36 0 -9 3 57.70 8.65 0 -9 3 46.44 9.15 0 9 -4 21.76 3.39 0 9 -4 19.51 2.07 0 -9 4 28.90 5.89 0 -9 5 39.57 7.89 0 -9 5 55.22 11.66 0 9 -5 53.17 5.21 0 -9 6 71.96 10.14 0 9 -6 77.91 6.41 0 9 -6 65.10 7.10 0 -9 7 16.96 5.74 0 9 -7 17.29 3.24 0 9 -7 12.59 3.17 0 -9 7 10.68 2.20 0 9 -8 19.06 3.35 0 -9 8 25.15 3.54 0 -9 8 27.07 7.35 0 9 -8 15.54 3.82 0 -9 9 25.69 3.66 0 -9 9 26.89 7.00 0 9 -9 30.53 5.68 0 9 -9 25.15 3.85 0 -9 10 4.22 3.66 0 9 -10 4.85 1.76 0 9 -10 8.80 2.55 0 -9 10 4.08 1.47 0 9 -11 10.90 3.58 0 -9 11 19.08 7.02 0 9 -11 17.88 3.58 0 -9 11 19.39 3.59 0 9 -12 -0.73 1.95 0 -9 12 -0.43 0.73 0 9 -12 0.66 1.18 0 -9 12 1.76 3.33 0 9 -13 37.73 7.27 0 -9 13 54.29 11.60 0 -9 13 40.50 5.74 0 9 -13 35.57 5.22 0 -9 14 18.77 6.86 0 9 -14 21.54 5.79 0 9 -14 20.77 4.12 0 -9 14 21.16 4.43 0 -9 15 4.10 4.15 0 9 -15 3.77 3.44 0 9 -15 4.18 1.86 0 9 -16 15.53 5.98 0 -9 16 10.18 6.44 0 9 -16 6.66 2.40 0 -9 17 4.42 5.11 0 9 -17 10.99 4.92 0 10 11 0.50 1.29 0 -10 -11 -0.51 3.02 0 -10 -10 4.73 3.67 0 10 10 4.30 1.95 0 -10 -9 6.29 4.36 0 10 9 -0.23 1.06 0 10 8 2.42 1.20 0 -10 -8 2.52 2.84 0 -10 -7 7.66 3.00 0 10 7 4.13 1.44 0 -10 -7 10.17 4.94 0 10 6 6.58 2.57 0 -10 -6 16.91 6.64 0 10 6 5.99 1.76 0 -10 -6 13.46 3.82 0 10 5 15.94 2.71 0 10 5 13.33 2.97 0 -10 -5 11.59 3.70 0 -10 -5 17.44 5.95 0 -10 -4 2.30 2.54 0 -10 -4 6.26 2.92 0 10 4 4.69 1.36 0 10 4 5.90 1.94 0 10 3 21.11 2.75 0 -10 -3 25.04 5.34 0 10 3 14.38 2.99 0 10 2 33.91 3.27 0 10 2 35.15 4.83 0 -10 -2 26.96 6.72 0 -10 -2 30.27 5.65 0 10 1 21.49 3.70 0 -10 -1 18.37 5.99 0 10 1 19.20 2.35 0 -10 -1 17.08 4.28 0 -10 0 250.20 17.30 0 10 0 244.87 11.98 0 -10 0 263.62 23.16 0 10 0 237.16 7.86 0 10 -1 1.44 0.99 0 -10 1 0.95 2.39 0 10 -1 2.60 0.75 0 10 -2 1.84 1.39 0 -10 2 0.72 1.19 0 -10 2 -0.87 3.88 0 10 -2 -0.41 0.56 0 10 -3 14.44 2.86 0 10 -3 13.53 1.86 0 -10 3 5.87 4.10 0 10 -4 1.66 1.14 0 10 -4 1.44 0.68 0 -10 4 2.41 3.86 0 -10 5 7.10 3.52 0 10 -5 5.55 1.14 0 10 -5 2.15 0.87 0 -10 6 8.96 6.18 0 -10 6 6.78 2.97 0 10 -6 6.59 2.12 0 10 -7 4.86 2.14 0 10 -7 2.07 1.34 0 10 -8 42.95 6.37 0 10 -8 56.68 6.04 0 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2.48 1 -2 -5 5.62 1.22 -1 2 5 4.80 1.12 -1 2 5 5.58 1.20 1 -2 -5 5.74 2.15 -1 2 4 40.83 2.71 -1 2 4 40.73 2.83 1 -2 -4 43.34 3.00 1 -2 -4 40.89 2.49 -1 2 4 42.95 5.59 1 -2 -4 43.46 5.18 1 -2 -3 65.65 5.87 1 -2 -3 56.25 3.08 -1 2 3 56.64 3.08 -1 2 3 50.87 6.15 -1 2 3 51.99 2.62 1 -2 -3 57.23 2.52 1 -2 -3 61.23 2.83 1 -2 -2 1854.25 32.95 -1 2 2 2017.85 17.40 1 -2 -2 2018.97 12.52 -1 2 2 1847.34 33.26 -1 2 2 1957.38 12.91 -1 2 2 2097.76 19.32 1 -2 -2 2165.08 17.17 1 -2 -2 2056.62 17.47 -1 2 1 921.88 14.09 -1 2 1 896.52 23.44 1 -2 -1 850.93 6.17 1 -2 -1 857.80 13.03 1 -2 -1 670.00 17.30 -1 2 1 690.58 9.12 -1 2 1 854.59 6.61 -1 2 0 72.08 4.26 1 -2 0 74.53 4.07 1 -2 0 70.85 2.72 1 -2 0 68.72 4.28 -1 2 0 64.60 2.59 -1 2 0 68.08 3.87 1 -2 1 287.92 5.51 -1 2 -1 321.85 9.54 1 -2 1 298.36 8.68 -1 2 -1 291.93 8.35 1 -2 1 303.44 9.85 -1 2 -1 285.05 5.32 1 -2 2 776.84 7.64 -1 2 -2 841.34 15.68 -1 2 -2 789.17 9.16 -1 2 -2 582.91 13.41 1 -2 2 704.82 9.08 1 -2 2 517.29 13.79 1 -2 2 741.91 14.87 -1 2 -2 777.14 6.98 1 -2 3 502.00 7.72 -1 2 -3 539.81 13.97 -1 2 -3 523.17 8.14 1 -2 3 505.90 14.23 1 -2 3 553.58 8.98 -1 2 -3 503.99 6.87 1 -2 3 560.29 14.22 -1 2 -3 521.69 13.12 1 -2 4 23.95 1.94 -1 2 -4 23.54 1.69 -1 2 -4 25.44 3.46 1 -2 4 28.77 2.24 -1 2 -4 20.47 1.75 1 -2 4 17.02 2.97 1 -2 4 25.81 3.66 -1 2 -5 610.09 10.41 1 -2 5 588.31 17.74 -1 2 -5 585.80 17.73 1 -2 5 644.32 11.11 1 -2 5 586.18 10.95 -1 2 -5 602.13 9.92 1 -2 6 9.25 1.60 1 -2 6 5.88 2.11 -1 2 -6 9.05 1.52 1 -2 6 10.13 1.53 -1 2 -6 8.98 2.45 1 -2 7 1.14 0.68 -1 2 -7 0.45 0.49 1 -2 7 3.85 1.99 -1 2 -7 1.05 1.50 -1 2 -8 8.63 1.54 1 -2 8 8.50 2.66 1 -2 8 7.59 1.66 -1 2 -8 9.62 2.96 1 -2 9 12.61 2.34 -1 2 -9 14.85 2.18 1 -2 9 7.54 2.71 -1 2 -9 13.98 3.68 -1 2 -10 130.56 11.70 1 -2 10 144.45 11.75 1 -2 10 133.24 8.13 -1 2 -10 158.88 7.60 -1 2 -11 12.87 3.92 -1 2 -11 12.59 2.34 1 -2 11 13.90 2.79 1 -2 11 11.97 4.20 -1 2 -12 148.79 13.85 1 -2 12 143.63 9.51 1 -2 12 143.49 13.50 -1 2 -12 174.32 9.13 -1 2 -13 2.29 1.47 1 -2 13 0.71 1.11 -1 2 -13 -0.88 2.06 1 -2 13 2.60 2.67 -1 2 -14 1.98 1.38 1 -2 14 2.00 1.65 -1 2 -14 -3.27 2.52 1 -2 14 0.70 2.06 -1 2 -15 7.26 4.23 1 -2 15 8.96 4.51 1 -2 15 14.06 3.87 -1 2 -16 4.15 2.32 1 -2 16 11.38 3.52 1 -2 16 4.60 3.00 -1 2 -17 1.24 3.54 1 -2 17 2.62 2.61 1 -3 -16 2.94 4.35 -1 3 16 2.22 1.81 -1 3 15 19.21 4.39 1 -3 -15 15.81 5.88 1 -3 -15 8.37 2.53 -1 3 14 5.84 2.21 1 -3 -14 3.39 1.86 1 -3 -14 9.74 5.41 -1 3 13 33.43 5.25 1 -3 -13 43.07 8.04 1 -3 -13 29.44 4.47 -1 3 13 30.84 5.24 -1 3 12 17.50 3.67 1 -3 -12 17.93 5.64 -1 3 12 21.66 4.07 1 -3 -11 2.44 2.03 -1 3 11 5.60 2.04 -1 3 10 222.22 10.54 1 -3 -10 256.57 17.26 1 -3 -9 1.72 1.83 -1 3 9 -0.16 0.45 1 -3 -8 102.24 9.92 -1 3 8 102.89 6.31 -1 3 7 15.44 2.42 -1 3 7 21.67 2.61 1 -3 -7 25.06 4.47 -1 3 6 0.62 0.62 1 -3 -6 1.38 1.63 -1 3 6 0.87 0.54 -1 3 5 221.19 7.12 -1 3 5 235.48 8.47 1 -3 -5 227.06 12.97 -1 3 4 6.06 1.52 1 -3 -4 6.35 0.93 1 -3 -4 12.58 3.69 -1 3 4 4.72 0.98 1 -3 -4 6.16 1.16 1 -3 -4 5.87 1.17 1 -3 -3 317.16 6.22 1 -3 -3 349.90 8.78 -1 3 3 312.29 8.25 1 -3 -3 341.66 15.13 -1 3 3 303.12 6.51 1 -3 -3 318.27 8.58 -1 3 3 303.12 9.44 -1 3 2 112.21 6.00 -1 3 2 81.80 7.09 1 -3 -2 95.94 8.95 1 -3 -2 113.26 3.20 1 -3 -2 117.10 5.66 1 -3 -2 135.22 5.07 -1 3 2 117.88 3.41 -1 3 2 115.09 4.70 1 -3 -1 425.54 11.80 1 -3 -1 569.20 9.67 -1 3 1 558.48 6.08 1 -3 -1 543.43 5.87 -1 3 1 530.95 21.17 -1 3 1 601.83 15.03 1 -3 -1 455.77 15.46 -1 3 1 558.65 9.86 1 -3 0 631.90 5.44 1 -3 0 640.49 13.94 -1 3 0 684.59 10.50 -1 3 0 718.74 5.29 1 -3 0 720.92 25.34 1 -3 0 776.34 17.89 -1 3 0 779.49 17.64 1 -3 0 718.99 10.58 -1 3 -1 2636.62 33.56 -1 3 -1 2483.92 12.50 -1 3 -1 2451.09 27.31 1 -3 1 2534.90 19.96 1 -3 1 2519.59 33.49 -1 3 -1 2333.44 18.72 1 -3 1 2563.31 28.59 -1 3 -2 512.80 15.38 1 -3 2 493.49 6.52 1 -3 2 497.73 15.84 1 -3 2 476.45 8.89 -1 3 -2 477.05 12.84 -1 3 -2 482.71 6.10 1 -3 2 502.33 13.56 1 -3 3 32.83 4.41 1 -3 3 28.81 1.94 -1 3 -3 28.34 2.18 1 -3 3 34.86 3.84 1 -3 3 35.40 2.54 -1 3 -3 27.16 3.53 -1 3 -3 28.95 1.78 -1 3 -3 27.94 3.40 -1 3 -4 9.40 2.31 1 -3 4 12.50 2.87 -1 3 -4 17.56 3.08 -1 3 -4 13.08 1.57 1 -3 4 15.45 2.78 1 -3 4 14.57 1.55 -1 3 -4 13.93 1.35 1 -3 4 11.26 1.58 1 -3 5 35.50 2.88 -1 3 -5 29.95 2.22 -1 3 -5 29.83 3.97 -1 3 -5 30.12 2.49 1 -3 5 30.64 2.55 1 -3 5 34.33 4.93 1 -3 6 240.84 13.64 -1 3 -6 255.03 12.87 1 -3 6 274.37 8.41 1 -3 6 282.70 8.58 -1 3 -6 253.48 7.73 -1 3 -6 261.37 7.07 -1 3 -7 -0.55 0.33 -1 3 -7 0.41 1.23 1 -3 7 1.19 1.13 1 -3 7 1.42 0.91 -1 3 -8 65.54 4.40 1 -3 8 62.44 7.62 1 -3 8 76.95 5.30 -1 3 -8 73.65 7.87 1 -3 9 47.76 4.52 1 -3 9 38.80 6.51 -1 3 -9 47.87 3.93 -1 3 -10 10.31 3.87 -1 3 -10 4.80 1.29 1 -3 10 8.33 2.02 1 -3 10 5.77 2.76 -1 3 -11 3.73 2.31 -1 3 -11 2.10 1.13 1 -3 11 1.47 1.26 -1 3 -12 6.53 3.40 -1 3 -12 10.22 2.17 1 -3 12 7.62 2.35 -1 3 -13 3.87 1.67 1 -3 13 6.95 4.19 1 -3 13 3.18 1.76 -1 3 -13 4.46 2.91 -1 3 -14 25.32 6.63 -1 3 -14 25.90 3.74 1 -3 14 36.03 8.50 1 -3 14 28.80 4.76 1 -3 15 1.82 1.71 1 -3 15 4.78 4.08 -1 3 -15 5.09 3.43 -1 3 -16 6.83 6.01 1 -3 16 9.82 5.06 1 -3 16 0.40 1.03 1 -3 17 5.46 4.85 -1 3 -17 4.75 3.82 1 -3 17 0.87 2.20 -1 4 16 11.64 3.85 1 -4 -16 7.05 4.16 -1 4 15 7.62 2.80 1 -4 -15 8.14 4.72 1 -4 -14 0.81 1.42 -1 4 14 0.80 0.94 1 -4 -14 -0.64 1.93 -1 4 13 59.81 6.58 1 -4 -13 48.64 8.65 -1 4 12 26.33 4.30 1 -4 -12 36.87 7.77 1 -4 -11 4.35 2.80 -1 4 11 2.79 1.49 -1 4 10 26.17 3.68 1 -4 -10 18.85 5.11 1 -4 -9 651.23 27.18 -1 4 9 656.96 17.11 -1 4 8 610.33 15.33 1 -4 -8 666.15 26.22 -1 4 7 222.07 8.55 1 -4 -7 241.12 15.66 -1 4 7 205.52 10.01 -1 4 6 69.06 4.45 -1 4 6 64.96 5.44 -1 4 5 75.81 5.81 -1 4 5 70.91 4.01 1 -4 -5 83.93 5.10 1 -4 -5 94.11 8.99 -1 4 4 420.01 13.59 -1 4 4 434.91 11.29 -1 4 4 413.47 9.01 1 -4 -4 421.46 19.19 1 -4 -4 452.93 11.82 -1 4 3 849.62 14.93 1 -4 -3 895.20 14.98 -1 4 3 870.24 19.55 -1 4 3 898.17 11.74 1 -4 -3 881.01 16.89 1 -4 -3 894.63 11.40 -1 4 2 107.96 10.51 -1 4 2 151.87 8.33 1 -4 -2 137.14 11.45 -1 4 2 127.12 3.88 1 -4 -2 129.68 3.80 -1 4 2 129.67 5.55 1 -4 -2 127.56 5.42 1 -4 -2 129.11 7.07 1 -4 -1 114.88 4.93 -1 4 1 135.11 12.48 1 -4 -1 134.57 3.55 -1 4 1 125.98 3.33 -1 4 1 149.96 8.96 1 -4 -1 100.47 8.64 1 -4 -1 136.04 7.88 -1 4 1 131.49 5.41 1 -4 0 460.47 21.45 1 -4 0 514.15 10.44 -1 4 0 558.93 17.37 -1 4 0 506.20 5.65 1 -4 0 507.27 15.92 -1 4 0 513.63 10.33 1 -4 0 575.30 15.04 -1 4 -1 385.64 6.42 -1 4 -1 388.10 12.04 -1 4 -1 348.79 4.55 1 -4 1 402.36 16.07 1 -4 1 392.96 12.62 -1 4 -1 351.71 8.43 1 -4 1 387.29 9.00 -1 4 -1 420.16 15.49 1 -4 2 8.46 0.96 1 -4 2 11.92 2.44 -1 4 -2 7.14 1.27 1 -4 2 8.27 1.39 -1 4 -2 9.78 1.04 1 -4 2 12.88 3.11 -1 4 -2 6.24 1.73 -1 4 -2 6.92 2.48 1 -4 3 528.04 11.23 1 -4 3 535.77 16.07 1 -4 3 551.59 19.71 1 -4 3 564.90 9.07 -1 4 -3 572.91 19.14 -1 4 -3 536.54 15.49 -1 4 -3 530.82 10.61 -1 4 -3 544.24 8.34 -1 4 -4 15.49 2.76 -1 4 -4 12.81 1.38 1 -4 4 14.62 1.92 1 -4 4 14.69 1.68 -1 4 -4 13.18 1.75 1 -4 4 14.28 3.45 -1 4 -5 83.95 3.89 -1 4 -5 78.90 4.47 -1 4 -5 79.83 6.83 1 -4 5 68.16 7.52 1 -4 5 80.98 4.26 -1 4 -6 212.41 6.57 1 -4 6 194.30 7.20 1 -4 6 209.21 13.73 -1 4 -6 223.65 12.06 -1 4 -6 204.28 7.45 1 -4 7 53.89 4.09 -1 4 -7 54.55 3.96 -1 4 -7 59.63 6.61 1 -4 7 54.02 7.12 1 -4 8 15.56 2.36 1 -4 8 12.48 3.88 -1 4 -8 12.85 3.42 -1 4 -8 12.93 2.05 -1 4 -9 0.66 0.92 -1 4 -9 2.33 2.18 1 -4 9 -0.18 2.17 1 -4 9 0.95 1.04 1 -4 10 1.05 0.95 -1 4 -10 1.59 1.89 -1 4 -10 0.99 0.73 1 -4 11 77.64 10.32 -1 4 -11 78.06 5.82 -1 4 -11 90.43 10.30 1 -4 11 78.85 6.44 -1 4 -12 82.04 10.29 -1 4 -12 85.35 6.37 1 -4 12 90.40 7.46 1 -4 12 91.25 12.06 -1 4 -13 18.03 3.15 -1 4 -13 17.89 5.25 1 -4 13 16.73 5.33 1 -4 13 18.48 3.53 -1 4 -14 33.10 7.40 1 -4 14 29.15 7.63 1 -4 14 32.80 5.03 -1 4 -14 25.15 3.87 -1 4 -15 3.09 3.14 1 -4 15 1.32 1.75 1 -4 15 -0.16 2.54 -1 4 -16 7.87 4.22 1 -4 16 10.97 3.56 1 -4 16 9.54 5.17 -1 4 -17 9.55 5.40 1 -4 17 5.60 3.06 1 -4 17 15.47 7.31 1 -4 18 31.44 5.87 1 -5 -15 1.49 3.53 -1 5 15 5.13 3.09 1 -5 -14 29.10 8.14 -1 5 14 29.24 5.36 -1 5 13 1.17 1.36 1 -5 -13 7.17 4.31 -1 5 12 54.63 6.16 1 -5 -12 62.62 10.13 1 -5 -11 97.08 11.95 -1 5 11 74.16 6.72 1 -5 -10 94.63 11.20 -1 5 10 80.24 6.63 -1 5 9 2.17 1.46 1 -5 -9 -0.83 1.63 1 -5 -8 55.14 8.36 -1 5 8 57.62 4.97 -1 5 7 5.79 1.56 1 -5 -7 3.76 1.57 1 -5 -6 86.89 5.78 -1 5 6 86.08 5.12 1 -5 -6 87.15 10.02 1 -5 -5 1.00 0.89 -1 5 5 0.05 0.39 -1 5 5 -0.27 0.98 -1 5 5 -0.28 0.43 1 -5 -5 -0.40 1.37 -1 5 4 60.88 4.54 -1 5 4 62.76 3.74 1 -5 -4 58.60 7.89 1 -5 -4 62.28 5.16 -1 5 4 59.49 6.09 -1 5 3 400.52 8.36 1 -5 -3 462.98 22.44 1 -5 -3 405.46 8.16 1 -5 -3 434.02 13.86 -1 5 3 413.38 11.38 -1 5 3 412.06 15.74 1 -5 -2 310.61 6.69 -1 5 2 290.42 6.38 -1 5 2 301.76 13.78 -1 5 2 301.12 9.54 1 -5 -2 311.78 12.48 -1 5 1 330.90 9.66 -1 5 1 326.10 6.00 1 -5 -1 344.75 6.55 1 -5 -1 357.06 14.19 -1 5 1 325.03 15.03 1 -5 0 126.18 8.75 -1 5 0 129.29 9.52 -1 5 0 119.39 3.24 1 -5 0 154.39 13.31 -1 5 0 129.37 5.82 1 -5 0 141.13 8.31 1 -5 1 65.84 5.91 1 -5 1 85.02 7.86 -1 5 -1 67.90 2.34 -1 5 -1 79.13 3.52 1 -5 1 75.11 10.32 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333.23 7.14 -1 6 1 336.13 10.63 1 -6 -1 350.22 15.36 -1 6 1 319.63 6.52 1 -6 -1 324.04 20.36 1 -6 0 90.17 8.23 -1 6 0 96.90 3.31 1 -6 0 88.07 10.28 -1 6 0 91.73 5.40 -1 6 -1 237.08 5.02 1 -6 1 227.81 17.87 -1 6 -1 237.21 8.59 -1 6 -1 242.49 7.06 -1 6 -2 -0.03 0.48 -1 6 -2 0.55 0.31 -1 6 -2 0.39 0.51 1 -6 2 0.46 1.07 1 -6 3 77.30 3.90 -1 6 -3 67.26 6.15 -1 6 -3 65.10 4.59 -1 6 -3 61.81 3.43 1 -6 3 70.15 8.47 -1 6 -4 24.68 3.93 -1 6 -4 27.04 2.34 1 -6 4 32.62 5.87 1 -6 4 31.55 2.64 -1 6 -4 26.79 2.98 -1 6 -5 160.53 10.44 1 -6 5 175.14 6.62 -1 6 -5 173.88 6.22 1 -6 5 176.79 13.96 -1 6 -5 170.19 7.58 -1 6 -6 12.63 1.76 -1 6 -6 9.25 2.71 1 -6 6 14.70 2.11 -1 6 -6 13.48 2.24 1 -6 6 6.95 2.14 -1 6 -7 6.86 1.70 -1 6 -7 5.80 2.25 1 -6 7 9.25 1.89 1 -6 7 9.24 3.47 1 -6 8 177.08 8.27 1 -6 8 183.37 15.99 -1 6 -8 159.68 7.95 -1 6 -8 165.60 12.22 1 -6 9 132.36 13.88 -1 6 -9 120.10 10.87 1 -6 9 119.67 7.36 -1 6 -9 117.19 6.97 1 -6 10 116.71 7.59 1 -6 10 121.52 13.55 -1 6 -10 110.72 11.07 -1 6 -10 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5.43 2 3 -11 54.70 6.87 -2 -3 10 40.56 4.62 2 3 -10 31.97 4.85 2 3 -10 32.09 3.97 -2 -3 10 40.02 6.37 2 3 -9 0.37 0.45 -2 -3 9 2.20 1.30 2 3 -9 -1.12 1.43 -2 -3 9 -0.95 1.37 2 3 -8 271.44 12.20 -2 -3 8 264.36 14.46 2 3 -8 299.09 10.79 -2 -3 8 268.84 10.58 2 3 -7 20.73 2.74 2 3 -7 20.24 3.27 -2 -3 7 20.07 2.81 -2 -3 7 21.48 3.32 -2 -3 7 17.71 3.60 2 3 -6 28.78 4.66 -2 -3 6 34.06 4.94 2 3 -6 35.80 3.77 -2 -3 6 33.32 3.36 2 3 -6 35.53 3.48 -2 -3 6 36.33 3.73 2 3 -5 250.49 8.50 2 3 -5 241.20 8.23 2 3 -5 278.64 13.71 -2 -3 5 249.09 12.10 2 3 -5 285.11 9.31 -2 -3 5 268.97 9.36 -2 -3 5 250.47 8.47 2 3 -4 329.73 8.28 -2 -3 4 344.11 8.48 -2 -3 4 339.88 13.58 2 3 -4 381.81 16.31 2 3 -4 341.92 9.24 2 3 -4 329.10 9.49 -2 -3 4 347.61 9.67 -2 -3 4 334.47 9.71 -2 -3 3 112.28 5.35 2 3 -3 111.26 5.60 2 3 -3 99.77 4.73 2 3 -3 115.89 8.00 -2 -3 3 109.61 7.34 -2 -3 3 103.80 4.03 -2 -3 3 115.69 5.29 2 3 -3 96.86 3.66 2 3 -2 2282.53 24.61 -2 -3 2 2335.56 32.86 2 3 -2 2337.62 21.33 2 3 -2 2274.26 34.83 -2 -3 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233.46 16.01 -2 -3 -9 -2.67 3.16 2 3 9 1.73 1.26 -2 -3 -10 4.74 3.06 2 3 10 4.75 1.84 -2 -3 -10 5.55 1.73 2 3 11 5.10 2.03 -2 -3 -11 5.56 4.07 -2 -3 -12 5.28 5.04 2 3 12 1.03 1.34 2 3 13 2.48 1.61 -2 -3 -13 7.45 4.88 2 3 14 10.84 4.31 2 3 14 7.13 2.71 -2 -3 -14 10.73 4.70 -2 -3 -15 30.17 8.42 2 3 15 19.42 4.43 2 2 -19 4.03 4.39 -2 -2 18 2.13 1.97 2 2 -18 3.16 2.20 2 2 -17 3.44 3.84 -2 -2 17 1.59 1.80 2 2 -17 -0.24 1.13 -2 -2 16 22.83 6.31 -2 -2 16 26.28 4.96 2 2 -16 35.43 7.22 2 2 -16 22.75 4.31 -2 -2 15 15.34 5.51 2 2 -15 17.48 3.57 -2 -2 15 19.13 3.82 2 2 -15 12.68 4.77 -2 -2 14 -2.45 2.77 -2 -2 14 2.47 1.31 2 2 -14 1.51 1.60 2 2 -14 -1.90 2.05 2 2 -13 35.55 4.65 2 2 -13 40.65 6.90 -2 -2 13 46.52 7.50 -2 -2 13 37.61 5.10 2 2 -12 249.72 15.81 -2 -2 12 243.19 15.80 2 2 -12 246.56 11.75 -2 -2 12 223.14 11.81 -2 -2 11 23.02 4.87 -2 -2 11 23.82 3.53 2 2 -11 34.82 5.56 2 2 -11 25.66 3.64 2 2 -10 20.96 4.05 -2 -2 10 24.28 4.37 -2 -2 10 20.27 3.30 2 2 -10 23.01 3.15 -2 -2 9 121.42 7.40 2 2 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51.91 5.14 -4 -5 6 48.14 4.63 -4 -5 6 42.44 2.90 -4 -5 6 42.24 6.13 4 5 -6 45.60 4.43 -4 -5 6 53.36 5.21 -4 -5 5 7.07 1.05 -4 -5 5 8.82 2.02 -4 -5 5 9.22 1.66 -4 -5 5 7.90 2.41 4 5 -5 12.94 2.25 -4 -5 4 5.53 2.27 -4 -5 4 2.10 0.65 -4 -5 4 3.59 0.96 4 5 -4 2.78 1.16 -4 -5 3 0.33 0.57 -4 -5 3 1.31 0.65 4 5 -3 1.55 0.83 -4 -5 3 -1.19 1.20 4 5 -2 -0.34 0.61 -4 -5 2 -0.29 0.45 4 5 -2 -0.32 0.58 4 5 -2 -1.84 1.34 4 5 -1 209.59 7.77 -4 -5 1 214.85 12.31 -4 -5 1 198.86 8.78 4 5 -1 198.70 7.63 4 5 0 13.35 2.10 4 5 0 15.77 4.59 -4 -5 0 20.35 3.18 -4 -5 0 14.91 3.25 4 5 0 16.53 2.16 4 5 1 1.79 0.81 -4 -5 -1 0.88 1.15 4 5 1 0.59 0.41 -4 -5 -1 2.76 1.21 4 5 2 12.01 1.85 4 5 2 9.16 1.65 -4 -5 -2 10.54 2.84 -4 -5 -2 14.61 3.26 4 5 3 18.81 2.19 -4 -5 -3 19.29 3.67 4 5 3 19.63 2.64 -4 -5 -3 26.98 4.56 4 5 4 51.63 3.87 4 5 4 57.63 4.61 -4 -5 -4 57.56 7.20 4 5 5 202.89 9.17 -4 -5 -5 195.31 14.09 4 5 6 33.40 3.90 -4 -5 -6 38.47 6.95 4 5 7 4.06 1.46 -4 -5 -7 7.06 3.28 4 5 8 -0.09 0.58 -4 -5 -8 4.39 2.98 4 5 9 7.62 2.33 -4 -5 -9 5.77 2.60 4 5 10 6.04 2.17 -4 -5 -10 3.40 3.13 -4 -5 -11 -0.76 2.17 4 5 11 0.31 1.16 -4 -5 -12 27.65 8.27 4 5 12 29.47 5.33 4 4 -19 8.80 4.88 4 4 -19 0.35 1.76 -4 -4 19 4.70 3.09 4 4 -18 3.55 2.92 4 4 -18 0.59 1.92 -4 -4 18 3.00 2.46 4 4 -17 -0.71 1.24 -4 -4 17 2.49 1.93 4 4 -16 -2.02 1.91 -4 -4 16 0.18 1.96 4 4 -16 1.19 1.65 -4 -4 16 -0.89 1.62 4 4 -15 3.77 2.76 -4 -4 15 2.09 2.38 4 4 -15 1.43 1.28 -4 -4 15 0.32 1.09 4 4 -14 3.44 2.74 -4 -4 14 3.79 2.85 4 4 -14 -0.13 1.11 -4 -4 14 3.03 2.18 4 4 -13 15.12 3.59 -4 -4 13 10.86 3.89 -4 -4 13 19.51 4.04 4 4 -13 19.78 3.77 4 4 -12 12.47 3.17 -4 -4 12 16.15 4.51 4 4 -12 15.88 3.43 -4 -4 12 12.84 3.27 4 4 -11 14.46 3.09 -4 -4 11 14.93 4.11 -4 -4 11 14.11 3.34 4 4 -11 8.93 2.29 -4 -4 10 2.35 1.97 -4 -4 10 4.29 2.82 4 4 -10 3.31 1.53 4 4 -10 1.59 1.33 -4 -4 9 17.49 3.88 4 4 -9 16.48 2.83 -4 -4 9 15.89 2.99 4 4 -9 22.19 3.39 -4 -4 9 22.35 3.79 -4 -4 8 64.49 7.18 -4 -4 8 60.39 4.90 4 4 -8 66.35 4.87 4 4 -8 75.23 6.20 -4 -4 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0.78 -4 -4 -6 3.38 2.38 4 4 6 4.36 1.47 4 4 7 2.15 1.39 -4 -4 -7 4.25 2.28 4 4 8 39.85 4.54 -4 -4 -8 43.52 8.04 4 4 9 8.03 2.25 -4 -4 -9 7.94 3.49 -4 -4 -10 10.58 5.01 4 4 10 17.36 3.32 -4 -4 -11 2.70 3.15 4 4 11 0.54 0.75 4 4 12 37.64 5.89 -4 -4 -12 25.93 8.16 -4 -4 -13 34.42 9.73 4 3 -20 4.42 3.42 4 3 -20 4.94 3.04 4 3 -19 -0.52 2.59 4 3 -19 0.60 2.01 -4 -3 19 1.82 2.32 4 3 -18 4.60 2.53 -4 -3 18 9.40 3.50 4 3 -17 14.20 4.14 -4 -3 17 9.26 3.46 4 3 -17 10.13 4.36 4 3 -16 2.02 1.98 -4 -3 16 0.81 1.57 4 3 -16 -0.24 2.01 -4 -3 15 22.43 4.75 -4 -3 15 24.05 5.64 4 3 -15 17.40 3.80 4 3 -15 24.47 5.56 -4 -3 14 7.22 3.05 4 3 -14 6.86 2.59 4 3 -14 6.94 2.48 -4 -3 14 4.93 2.24 4 3 -13 139.08 11.18 -4 -3 13 118.58 9.54 -4 -3 13 120.65 11.29 4 3 -13 126.38 9.08 -4 -3 12 17.02 3.51 -4 -3 12 12.54 3.63 4 3 -12 16.32 3.25 4 3 -12 16.25 3.74 -4 -3 11 5.59 2.67 4 3 -11 1.58 0.86 -4 -3 11 6.35 1.95 4 3 -10 33.22 4.42 -4 -3 10 25.57 4.49 4 3 -10 27.13 3.78 -4 -3 10 28.31 4.12 4 3 -9 28.04 3.64 -4 -3 9 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0.68 0.82 4 -10 -1 2.94 3.91 -4 10 0 0.58 1.26 4 -10 0 0.83 1.54 -4 10 -1 238.00 11.99 4 -10 1 254.34 27.46 4 -10 1 239.89 18.49 -4 10 -2 43.59 5.13 4 -10 2 55.86 9.42 4 -10 2 47.00 12.20 -4 10 -3 7.04 2.15 4 -10 3 7.03 3.48 -4 10 -4 68.69 6.33 4 -10 4 87.83 12.65 -4 10 -4 63.57 8.56 -4 10 -5 -0.06 0.71 -4 10 -5 3.28 2.57 4 -10 5 5.49 3.98 -4 10 -6 45.01 5.09 4 -10 6 46.27 9.59 -4 10 -6 41.99 7.28 -4 10 -7 26.35 4.16 -4 10 -7 18.71 4.73 4 -10 7 25.97 7.53 -4 10 -8 9.78 2.65 -4 10 -8 7.61 3.68 4 -10 9 15.93 6.32 -4 10 -9 36.71 7.42 -4 10 -9 27.42 4.29 -4 10 -10 5.90 2.33 -4 10 -10 1.45 1.91 4 -10 11 0.65 3.39 -4 10 -11 0.36 0.90 -4 10 -11 -0.61 2.36 4 -10 12 9.41 5.84 -4 10 -12 5.95 3.32 4 -10 13 6.81 4.92 -4 10 -13 11.60 4.83 -4 11 12 3.88 2.64 -4 11 11 4.19 2.32 4 -11 -11 1.53 4.11 -4 11 10 1.96 1.58 4 -11 -10 4.62 6.92 -4 11 9 0.46 0.84 4 -11 -9 -0.28 4.09 -4 11 8 2.03 1.23 4 -11 -8 10.03 5.39 -4 11 7 26.04 3.68 4 -11 -7 40.59 10.88 -4 11 6 28.05 4.99 -4 11 6 20.37 2.98 4 -11 -6 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8.49 5.49 -5 -9 16 1.84 2.83 -5 -9 16 7.98 5.10 5 9 -16 8.77 3.15 -5 -9 15 5.89 2.74 -5 -9 15 9.43 4.97 5 9 -15 1.69 1.82 -5 -9 14 -0.81 1.31 5 9 -14 1.01 1.13 -5 -9 13 4.87 2.76 -5 -9 13 3.98 3.98 5 9 -13 2.32 1.97 -5 -9 12 1.03 1.45 -5 -9 12 1.84 3.00 5 9 -12 0.50 0.74 -5 -9 11 97.61 12.69 5 9 -11 110.66 9.24 -5 -9 11 86.71 8.63 -5 -9 10 5.87 2.28 -5 -9 10 11.33 4.33 5 9 -10 7.27 2.69 5 9 -9 8.48 2.48 -5 -9 9 18.18 3.88 -5 -9 9 8.85 3.80 5 9 -8 9.51 2.77 -5 -9 8 5.23 3.33 -5 -9 7 23.89 6.02 5 9 -7 25.47 3.96 5 9 -6 10.76 2.58 5 9 -6 12.92 2.56 -5 -9 6 17.24 4.60 5 9 -5 132.17 7.62 -5 -9 5 116.70 12.31 5 9 -5 116.08 8.32 5 9 -4 49.09 4.62 -5 -9 4 53.91 8.17 5 9 -4 56.09 5.75 5 9 -3 7.94 2.16 5 9 -3 9.03 2.03 -5 -9 3 5.84 2.58 5 9 -2 41.81 4.40 -5 -9 2 29.29 5.95 5 9 -2 36.57 4.44 5 9 -1 52.99 5.37 5 9 -1 54.53 5.09 -5 -9 1 57.11 8.38 -5 -9 1 52.91 6.37 5 9 0 20.91 3.33 5 9 0 22.71 3.27 -5 -9 0 27.28 5.04 -5 -9 0 21.20 5.16 5 9 1 3.14 1.54 -5 -9 -1 1.34 1.61 5 9 1 4.41 1.42 -5 -9 -1 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11.43 2.40 -5 -6 -5 13.84 4.54 5 6 6 0.52 0.99 -5 -6 -6 1.97 2.16 5 6 7 -0.09 0.72 -5 -6 -7 0.88 2.49 5 6 8 3.73 1.94 -5 -6 -8 6.41 3.66 5 6 9 15.43 3.45 -5 -6 -9 21.69 6.59 5 6 10 16.19 3.66 -5 -6 -10 14.92 5.86 -5 -6 -11 7.31 5.81 5 5 -19 1.16 2.46 -5 -5 19 3.56 3.14 5 5 -18 6.74 3.30 -5 -5 18 3.06 2.71 5 5 -17 0.65 1.10 -5 -5 17 4.52 2.38 -5 -5 16 15.04 4.84 5 5 -16 15.91 4.24 -5 -5 16 21.33 5.08 -5 -5 15 -0.62 1.50 5 5 -15 -1.00 1.71 -5 -5 15 2.51 2.53 5 5 -15 2.30 1.63 -5 -5 14 0.70 1.66 5 5 -14 1.83 2.13 -5 -5 14 2.88 1.87 5 5 -14 -0.16 1.18 5 5 -13 71.18 7.36 -5 -5 13 70.78 9.23 5 5 -13 73.26 7.52 -5 -5 13 95.80 9.46 -5 -5 12 2.77 1.55 5 5 -12 0.19 0.97 -5 -5 12 4.00 2.61 5 5 -12 1.44 1.40 -5 -5 11 25.23 5.30 5 5 -11 18.85 3.10 5 5 -11 22.95 3.81 -5 -5 11 20.06 3.88 -5 -5 10 45.09 6.51 5 5 -10 47.69 4.52 5 5 -10 53.90 5.80 -5 -5 10 51.22 6.02 -5 -5 9 8.53 2.21 5 5 -9 2.74 0.85 -5 -5 9 9.77 3.16 -5 -5 9 2.59 1.07 5 5 -9 8.69 2.27 -5 -5 8 3.48 1.60 5 5 -8 3.25 0.82 -5 -5 8 1.43 1.53 -5 -5 8 3.55 1.05 5 5 -8 5.87 1.71 -5 -5 7 18.35 3.92 5 5 -7 18.78 3.06 -5 -5 7 23.91 3.79 -5 -5 6 12.26 3.42 5 5 -6 13.70 2.47 -5 -5 6 14.75 2.93 -5 -5 5 14.80 2.86 -5 -5 5 20.05 3.97 5 5 -5 17.69 2.72 -5 -5 4 56.15 6.73 5 5 -4 48.74 4.25 5 5 -3 7.89 1.72 -5 -5 3 15.84 1.63 -5 -5 3 14.30 3.93 5 5 -3 17.34 2.50 -5 -5 3 13.22 1.58 5 5 -2 7.22 1.51 5 5 -2 7.80 1.71 -5 -5 2 2.57 1.62 5 5 -2 6.73 2.53 -5 -5 2 3.07 1.12 5 5 -1 3.57 1.03 5 5 -1 3.75 1.20 -5 -5 1 3.50 1.21 5 5 -1 0.70 1.21 -5 -5 1 2.35 1.12 5 5 0 0.33 0.34 5 5 0 1.40 0.98 -5 -5 0 2.30 1.28 -5 -5 0 2.75 1.56 5 5 1 128.81 5.90 5 5 1 136.83 6.92 -5 -5 -1 147.27 10.52 -5 -5 -1 136.09 9.09 5 5 2 199.91 7.42 5 5 2 195.92 8.44 -5 -5 -2 210.28 12.92 -5 -5 -2 218.60 12.45 5 5 3 3.43 1.15 5 5 3 1.49 0.95 5 5 4 67.45 4.24 5 5 4 84.83 5.92 -5 -5 -4 74.29 8.50 5 5 5 189.50 9.36 -5 -5 -5 193.90 14.58 -5 -5 -6 18.55 4.83 5 5 6 16.35 2.89 -5 -5 -7 74.73 10.02 5 5 7 73.44 6.32 5 5 8 24.37 4.06 -5 -5 -8 13.42 4.34 5 5 9 5.31 2.11 -5 -5 -9 -3.09 2.68 5 5 10 23.53 4.35 -5 -5 -10 13.48 5.29 5 5 11 18.23 3.90 -5 -5 -11 23.79 7.41 5 4 -19 4.24 3.03 -5 -4 19 4.09 2.90 5 4 -18 0.71 1.51 -5 -4 18 2.23 2.33 5 4 -17 2.49 2.65 5 4 -17 0.50 1.34 -5 -4 17 1.43 2.31 5 4 -16 9.36 3.82 5 4 -16 11.24 3.38 -5 -4 16 8.81 2.96 5 4 -15 4.79 2.46 -5 -4 15 4.44 2.91 5 4 -15 5.25 2.60 -5 -4 15 5.95 2.68 5 4 -14 5.16 2.50 -5 -4 14 8.96 3.63 5 4 -14 8.61 2.69 -5 -4 14 6.33 2.69 5 4 -13 28.14 4.69 -5 -4 13 29.13 5.29 5 4 -13 34.74 5.17 -5 -4 13 31.84 5.23 -5 -4 12 -0.15 1.53 5 4 -12 0.27 1.22 -5 -4 12 1.14 1.47 5 4 -12 1.44 1.19 5 4 -11 115.09 8.20 -5 -4 11 96.16 9.47 5 4 -11 110.37 8.31 -5 -4 11 121.90 9.62 -5 -4 10 1.19 1.48 5 4 -10 0.83 0.56 -5 -4 10 2.35 1.91 -5 -4 10 2.60 1.89 5 4 -10 -0.77 1.00 -5 -4 9 28.38 3.71 -5 -4 9 40.44 5.68 5 4 -9 37.01 3.61 5 4 -9 39.21 4.58 -5 -4 9 32.19 4.50 -5 -4 8 141.00 6.77 -5 -4 8 158.64 11.13 5 4 -8 179.00 9.46 5 4 -8 165.08 6.12 -5 -4 8 167.50 9.84 -5 -4 7 110.51 8.98 5 4 -7 137.02 8.27 -5 -4 7 128.38 8.43 -5 -4 6 18.57 3.63 5 4 -6 23.42 3.15 -5 -4 6 25.93 3.86 -5 -4 5 9.97 2.74 5 4 -5 9.15 1.87 -5 -4 5 10.57 2.54 -5 -4 4 31.07 4.47 5 4 -4 30.49 3.24 -5 -4 3 188.39 11.03 5 4 -3 156.92 6.84 -5 -4 2 30.38 2.68 5 4 -2 28.70 3.66 5 4 -2 32.55 3.10 -5 -4 2 33.08 4.72 5 4 -2 36.05 3.16 5 4 -1 4.35 1.10 5 4 -1 3.59 1.14 -5 -4 1 4.11 1.36 5 4 -1 5.55 1.98 -5 -4 1 3.86 1.53 5 4 0 35.10 3.33 5 4 0 33.24 4.93 -5 -4 0 33.08 4.85 -5 -4 0 22.19 2.48 5 4 0 30.24 2.70 -5 -4 0 31.73 3.81 5 4 1 2.76 0.85 5 4 1 0.88 0.65 -5 -4 -1 2.62 1.03 -5 -4 -1 4.49 1.88 -5 -4 -1 1.03 0.50 5 4 2 222.65 6.85 5 4 2 263.71 9.25 -5 -4 -2 250.00 13.22 -5 -4 -2 250.20 12.87 5 4 3 276.84 10.05 -5 -4 -3 269.41 14.57 5 4 4 1.04 0.78 -5 -4 -4 0.49 1.35 5 4 5 15.51 2.53 -5 -4 -5 16.41 3.79 -5 -4 -6 28.35 5.66 5 4 6 29.17 3.75 5 4 7 19.72 3.21 -5 -4 -7 23.89 5.87 -5 -4 -8 62.50 9.47 5 4 8 56.38 5.70 5 4 9 3.11 2.05 -5 -4 -9 5.88 3.31 5 4 10 6.53 2.19 -5 -4 -10 8.61 4.97 5 4 11 1.52 1.32 -5 -4 -11 5.13 4.47 -5 -4 -12 27.03 8.22 5 3 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116.27 5.25 6 -6 -3 49.29 9.78 6 -6 -3 44.09 6.01 6 -6 -3 33.08 1.87 -6 6 3 38.94 2.59 -6 6 2 42.82 4.27 6 -6 -2 45.44 11.31 6 -6 -2 42.18 6.03 6 -6 -2 42.39 1.57 -6 6 1 0.98 1.12 -6 6 1 2.13 1.95 6 -6 -1 0.21 1.71 -6 6 0 75.55 5.35 6 -6 0 73.61 8.56 -6 6 0 78.16 8.18 -6 6 -1 33.35 3.40 6 -6 1 35.34 6.01 -6 6 -1 38.30 5.90 -6 6 -2 52.88 4.21 6 -6 2 59.27 8.28 -6 6 -2 53.73 7.17 -6 6 -3 37.80 3.47 -6 6 -3 35.08 5.85 6 -6 3 29.23 6.11 6 -6 3 26.51 1.68 -6 6 -4 16.55 2.38 6 -6 4 21.37 5.19 6 -6 4 19.74 1.82 -6 6 -5 15.72 2.39 6 -6 5 14.39 4.82 -6 6 -5 15.81 4.37 6 -6 5 17.19 1.93 -6 6 -6 2.58 1.05 -6 6 -6 4.71 3.28 6 -6 6 8.54 4.08 6 -6 6 4.75 1.20 -6 6 -7 83.55 5.13 6 -6 7 90.07 12.01 6 -6 7 98.00 5.79 -6 6 -7 106.02 11.84 6 -6 8 96.11 13.21 6 -6 8 69.95 5.26 -6 6 -8 81.78 11.01 -6 6 -9 22.88 6.22 6 -6 9 18.16 6.56 -6 6 -10 6.47 4.62 6 -6 10 5.37 4.28 -6 6 -11 14.97 5.71 6 -6 11 17.41 7.15 -6 6 -12 12.91 5.70 6 -6 12 3.62 3.96 6 -6 13 4.40 5.94 6 -7 -16 3.28 4.25 -6 7 16 3.97 2.81 6 -7 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10.32 -6 9 6 39.48 3.78 6 -9 -5 30.07 4.93 6 -9 -5 19.64 8.59 -6 9 5 32.52 3.08 -6 9 4 79.18 7.28 6 -9 -4 71.62 14.01 6 -9 -4 70.81 8.03 6 -9 -3 8.62 5.47 -6 9 3 14.43 2.93 6 -9 -3 17.05 4.18 -6 9 2 116.74 8.37 6 -9 -2 95.27 16.01 6 -9 -2 130.77 12.39 -6 9 1 12.47 2.78 6 -9 -1 21.50 9.51 6 -9 -1 15.37 4.97 -6 9 0 274.09 12.45 6 -9 0 258.27 28.03 6 -9 0 266.78 19.03 -6 9 -1 40.83 4.62 6 -9 1 39.61 13.47 6 -9 1 36.39 7.22 -6 9 -2 2.36 1.36 -6 9 -2 1.35 2.10 6 -9 2 2.21 3.26 -6 9 -3 3.88 1.44 6 -9 3 1.55 2.43 -6 9 -4 8.05 1.98 6 -9 4 8.16 4.97 -6 9 -4 7.49 2.90 -6 9 -5 8.26 2.20 -6 9 -5 8.96 3.83 6 -9 5 4.41 2.44 -6 9 -6 89.54 6.92 6 -9 6 97.07 13.69 -6 9 -6 97.57 11.82 -6 9 -7 1.17 1.03 6 -9 7 1.60 3.44 -6 9 -7 0.99 1.48 6 -9 8 4.31 4.79 -6 9 -8 2.63 3.24 6 -9 9 10.85 6.28 -6 9 -9 8.50 4.30 6 -9 10 14.14 7.02 -6 9 -10 7.39 4.78 6 -9 11 8.72 6.96 -6 9 -11 -2.45 3.12 6 -10 -13 12.74 7.18 6 -10 -12 10.87 6.90 6 -10 -11 6.85 4.98 6 -10 -10 11.15 6.00 6 -10 -9 -0.91 3.11 6 -10 -8 22.19 8.25 6 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2.59 1.26 7 7 -2 52.49 5.01 -7 -7 2 62.03 8.27 7 7 -2 45.77 4.56 7 7 -1 2.30 1.02 7 7 -1 1.60 1.12 -7 -7 1 2.89 2.22 7 7 0 0.42 0.86 7 7 0 -0.89 0.94 -7 -7 0 1.22 1.72 7 7 1 68.58 5.95 -7 -7 -1 88.41 10.11 7 7 2 8.32 2.34 7 7 3 34.27 4.53 7 7 4 1.29 1.39 7 7 5 16.98 3.38 7 7 6 0.48 1.33 -7 -6 18 2.69 2.85 7 6 -18 4.05 2.76 -7 -6 17 0.19 1.33 7 6 -17 0.05 1.41 -7 -6 16 10.67 4.19 7 6 -16 10.86 3.49 -7 -6 15 5.48 2.89 -7 -6 15 6.33 3.27 7 6 -15 6.23 2.48 -7 -6 14 3.78 2.35 -7 -6 14 4.16 2.78 7 6 -14 3.68 2.19 -7 -6 13 31.74 6.41 7 6 -13 53.64 6.68 -7 -6 13 43.08 6.59 -7 -6 12 0.97 1.06 -7 -6 12 0.49 1.33 7 6 -12 0.27 0.91 -7 -6 11 2.38 2.29 -7 -6 11 -0.35 1.74 7 6 -11 0.05 1.10 -7 -6 10 7.08 2.31 -7 -6 10 0.98 1.80 7 6 -10 3.76 1.68 -7 -6 9 9.09 2.83 -7 -6 9 7.57 2.96 7 6 -9 9.89 2.66 -7 -6 8 68.29 7.38 -7 -6 8 80.11 8.99 7 6 -8 73.41 6.63 -7 -6 7 8.76 3.32 7 6 -7 10.35 2.48 -7 -6 6 2.31 2.15 7 6 -6 1.85 1.36 7 6 -5 5.26 1.72 -7 -6 5 8.00 2.87 7 6 -5 6.81 1.92 7 6 -4 20.55 3.20 -7 -6 4 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3.91 10 4 3 11.70 2.82 10 4 4 -0.18 1.01 10 4 5 1.98 1.68 -10 -3 17 5.81 3.36 10 3 -17 8.05 3.58 -10 -3 16 2.42 2.38 10 3 -16 -0.28 1.22 -10 -3 15 18.07 4.83 10 3 -15 26.57 5.57 -10 -3 14 0.26 1.79 10 3 -14 0.01 1.26 -10 -3 13 5.97 3.10 10 3 -13 5.02 2.38 -10 -3 12 -0.62 1.09 10 3 -12 0.85 1.29 -10 -3 11 9.31 3.27 -10 -3 11 6.25 2.09 10 3 -11 13.51 3.47 -10 -3 10 -0.72 1.37 -10 -3 10 2.05 1.91 10 3 -10 0.94 1.16 -10 -3 9 6.36 2.33 -10 -3 9 8.99 2.48 10 3 -9 5.75 2.13 -10 -3 8 30.74 4.80 10 3 -8 33.39 4.66 -10 -3 7 2.17 1.57 10 3 -7 1.82 1.35 10 3 -6 -0.04 0.71 10 3 -5 4.27 1.45 10 3 -5 1.45 1.01 10 3 -4 14.73 2.92 10 3 -4 13.05 2.38 10 3 -3 3.19 1.37 10 3 -2 0.89 1.04 10 3 -1 16.71 2.99 10 3 0 0.38 1.19 10 3 1 6.77 1.94 10 3 2 8.90 2.23 10 3 3 5.27 2.06 10 3 4 1.38 1.16 10 3 5 2.63 1.74 10 3 6 1.47 1.64 -10 -2 17 -2.26 2.15 10 2 -17 0.09 1.69 -10 -2 16 6.80 3.48 10 2 -16 4.29 2.50 -10 -2 15 2.88 2.33 10 2 -15 2.67 2.00 -10 -2 14 0.16 1.63 10 2 -14 1.82 1.38 -10 -2 13 3.66 2.71 10 2 -13 5.70 2.53 -10 -2 12 15.03 4.24 10 2 -12 7.76 2.54 -10 -2 11 3.69 2.09 -10 -2 11 1.23 1.47 10 2 -11 1.51 1.82 -10 -2 10 57.38 5.87 10 2 -10 51.94 6.04 -10 -2 10 46.70 6.43 -10 -2 9 7.52 2.43 -10 -2 9 10.20 2.62 10 2 -9 7.42 2.38 -10 -2 8 2.10 1.82 10 2 -8 0.50 1.10 10 2 -7 12.80 2.79 10 2 -6 4.46 1.75 10 2 -5 11.48 2.36 10 2 -5 8.65 2.10 10 2 -4 58.84 5.20 10 2 -4 45.52 4.29 10 2 -3 0.75 0.93 10 2 -3 0.28 0.96 10 2 -2 3.67 1.44 10 2 -1 1.73 1.13 10 2 0 -0.30 0.50 10 2 1 7.30 1.87 10 2 2 3.33 1.48 10 2 3 1.13 1.21 10 2 4 13.28 2.92 10 2 5 14.99 3.24 10 2 6 3.00 1.49 10 2 7 2.28 1.61 -10 -1 17 10.29 4.39 10 1 -17 6.97 3.05 -10 -1 16 10.49 4.47 10 1 -16 4.84 2.49 -10 -1 15 11.35 3.75 10 1 -15 11.08 3.66 -10 -1 14 4.85 2.80 10 1 -14 6.34 2.52 -10 -1 13 14.83 4.08 10 1 -13 15.26 3.87 -10 -1 12 2.21 1.68 10 1 -12 2.44 1.50 -10 -1 11 -2.25 2.10 10 1 -11 0.85 1.31 -10 -1 10 16.22 3.86 10 1 -10 22.89 4.11 -10 -1 9 13.54 3.52 10 1 -9 19.23 3.64 -10 -1 8 -0.36 0.86 10 1 -8 1.93 1.05 10 1 -7 3.38 1.26 10 1 -6 33.63 4.14 10 1 -5 1.21 0.82 10 1 -5 2.44 1.14 10 1 -4 3.13 1.31 10 1 -4 6.46 1.68 10 1 -3 22.57 3.26 -10 -1 3 17.29 3.05 10 1 -3 21.52 2.71 -10 -1 2 10.72 2.77 10 1 -2 6.92 1.84 -10 -1 1 35.22 5.06 10 1 -1 26.57 3.48 10 1 0 26.42 3.46 -10 -1 0 21.04 4.24 -10 -1 -1 -1.96 2.08 10 1 1 2.36 1.21 -10 -1 -2 17.95 4.74 10 1 2 16.13 2.87 10 1 3 -0.28 0.67 -10 -1 -3 -0.86 2.61 10 1 4 1.31 1.05 -10 -1 -4 0.48 2.09 10 1 5 11.19 2.65 -10 -1 -5 11.04 4.81 10 1 6 2.89 1.73 -10 -1 -6 3.25 3.05 10 1 7 1.96 1.82 -10 -1 -7 2.69 4.02 -10 0 18 7.09 4.33 -10 0 17 3.59 2.87 10 0 -17 1.64 2.26 -10 0 16 19.54 4.85 10 0 -16 13.49 4.00 -10 0 15 5.92 3.09 10 0 -15 2.54 2.16 -10 0 14 12.09 4.00 10 0 -14 8.39 3.18 -10 0 13 20.17 4.54 10 0 -13 21.22 4.34 -10 0 12 3.04 2.50 10 0 -12 2.02 1.43 10 0 -11 43.61 5.61 -10 0 11 37.23 5.65 -10 0 10 3.98 2.14 10 0 -10 0.87 1.12 10 0 -9 76.98 7.14 -10 0 9 91.31 8.38 -10 0 8 11.95 3.19 10 0 -8 13.41 2.93 -10 0 7 10.36 2.80 10 0 -7 4.32 2.21 10 0 -7 6.88 2.19 10 0 -6 2.85 2.82 10 0 -6 2.75 1.41 10 0 -5 91.75 9.63 10 0 -5 129.59 7.62 10 0 -4 1.02 1.01 10 0 -4 3.90 3.71 10 0 -4 0.83 0.76 10 0 -3 7.06 1.80 -10 0 3 4.32 1.93 10 0 -3 5.80 1.60 10 0 -2 43.54 4.28 -10 0 2 48.02 5.77 10 0 -1 15.31 2.44 -10 0 1 21.26 4.03 10 0 0 21.13 2.88 -10 0 0 23.03 4.42 -10 0 -1 -1.46 2.36 10 0 1 1.25 1.14 -10 0 -2 3.04 1.68 10 0 2 3.45 1.50 -10 0 -3 22.67 5.36 10 0 3 26.50 3.56 10 0 4 8.79 2.30 -10 0 -4 22.21 5.84 10 0 5 0.45 0.62 -10 0 -5 3.45 2.52 10 0 6 5.94 2.07 -10 0 -6 7.24 4.25 10 0 7 0.25 0.93 -10 0 -7 2.52 2.68 10 0 8 2.34 1.68 -10 0 -8 1.33 2.54 -10 1 18 3.78 3.13 -10 1 17 14.01 5.00 10 -1 -17 9.38 3.63 -10 1 16 12.15 4.13 10 -1 -16 13.50 4.10 -10 1 15 5.84 2.81 10 -1 -15 2.87 2.06 -10 1 14 5.07 2.46 10 -1 -14 7.71 2.59 10 -1 -13 59.85 7.27 -10 1 13 67.93 8.28 -10 1 12 21.18 4.41 10 -1 -12 14.97 3.86 -10 1 11 16.49 3.78 10 -1 -11 11.77 3.17 10 -1 -10 115.94 9.93 10 -1 -10 113.99 9.08 -10 1 10 111.29 9.34 -10 1 9 2.64 1.39 10 -1 -9 3.38 2.46 10 -1 -9 2.91 1.48 10 -1 -8 128.12 11.06 10 -1 -8 137.28 9.10 -10 1 8 140.86 9.90 -10 1 7 23.66 4.04 10 -1 -7 17.05 5.26 10 -1 -7 17.98 3.35 10 -1 -6 1.09 1.56 10 -1 -6 1.23 1.31 10 -1 -5 5.25 2.72 10 -1 -5 7.07 1.99 10 -1 -4 2.70 1.11 10 -1 -4 5.13 1.46 -10 1 3 15.05 3.45 10 -1 -3 17.00 2.58 10 -1 -3 15.47 2.39 10 -1 -2 5.36 1.43 -10 1 2 5.90 2.13 10 -1 -2 4.58 1.34 -10 1 1 18.59 3.96 10 -1 -1 17.94 2.62 -10 1 0 45.98 6.35 10 -1 0 36.65 3.72 10 -1 1 1.30 0.93 -10 1 -1 1.05 1.81 -10 1 -2 9.51 3.34 10 -1 2 8.34 1.91 -10 1 -3 15.87 4.62 10 -1 3 10.08 2.28 -10 1 -4 17.85 5.02 10 -1 4 25.89 3.57 -10 1 -5 11.18 4.53 10 -1 5 7.24 2.15 10 -1 6 7.94 2.30 -10 1 -6 5.22 3.48 10 -1 7 80.41 7.35 -10 1 -7 61.69 10.80 10 -1 8 3.40 1.72 -10 1 -8 7.11 4.69 -10 2 17 -1.58 2.40 10 -2 -17 3.45 2.77 -10 2 16 0.09 1.70 10 -2 -16 3.76 2.33 -10 2 15 7.69 3.55 10 -2 -15 9.04 3.14 -10 2 14 4.44 2.17 10 -2 -14 4.42 2.31 -10 2 13 18.33 4.31 10 -2 -13 20.09 5.24 10 -2 -13 13.92 3.65 -10 2 12 14.53 3.53 10 -2 -12 11.83 3.09 10 -2 -12 11.38 3.90 10 -2 -11 47.91 7.54 10 -2 -11 54.46 6.59 -10 2 11 58.98 6.98 -10 2 10 12.97 3.25 10 -2 -10 11.76 3.12 10 -2 -10 13.66 4.48 10 -2 -9 65.95 8.95 10 -2 -9 75.71 7.13 -10 2 9 84.16 7.76 -10 2 8 3.60 1.90 10 -2 -8 5.09 3.90 10 -2 -8 4.76 2.22 -10 2 7 0.27 1.04 10 -2 -7 0.78 1.10 -10 2 6 24.89 4.01 10 -2 -6 20.75 5.49 10 -2 -6 18.42 3.26 10 -2 -5 22.11 6.58 10 -2 -5 21.82 3.27 10 -2 -4 56.60 4.42 10 -2 -4 45.98 4.47 -10 2 3 10.35 2.76 10 -2 -3 7.57 1.62 10 -2 -3 8.09 1.89 -10 2 2 23.25 4.24 10 -2 -2 23.07 2.88 10 -2 -2 19.74 2.60 -10 2 1 7.69 3.36 10 -2 -1 5.78 1.38 10 -2 0 34.67 3.31 -10 2 0 34.68 5.78 -10 2 -1 41.15 6.75 10 -2 1 45.07 4.02 -10 2 -2 203.68 15.34 10 -2 2 197.21 8.55 -10 2 -3 6.57 3.32 10 -2 3 13.77 2.40 -10 2 -4 3.04 2.98 10 -2 4 9.14 2.06 -10 2 -5 24.26 5.97 10 -2 5 23.66 3.41 -10 2 -6 8.87 4.37 10 -2 6 7.26 2.16 -10 2 -7 2.12 2.48 10 -2 7 6.65 3.85 -10 2 -8 10.11 5.44 10 -3 -17 3.49 2.18 -10 3 17 1.05 1.71 10 -3 -16 1.88 1.94 -10 3 16 0.62 2.01 -10 3 15 3.26 2.42 10 -3 -15 1.74 1.70 10 -3 -15 2.47 2.39 -10 3 14 2.27 1.76 10 -3 -14 4.88 3.51 10 -3 -14 5.89 2.59 -10 3 13 -0.30 1.12 10 -3 -13 0.13 1.77 10 -3 -13 3.38 2.99 -10 3 12 1.50 1.49 10 -3 -12 2.14 1.66 10 -3 -12 0.32 2.08 10 -3 -11 48.09 6.51 -10 3 11 35.31 5.46 10 -3 -10 21.92 5.99 -10 3 10 23.62 4.27 10 -3 -9 30.79 6.58 -10 3 9 26.11 4.44 -10 3 8 4.38 1.76 10 -3 -8 5.67 4.30 -10 3 7 1.43 1.47 10 -3 -7 1.57 1.35 10 -3 -7 2.07 3.20 -10 3 6 2.74 1.80 10 -3 -6 -0.38 1.51 10 -3 -5 18.39 5.53 10 -3 -4 4.24 1.24 10 -3 -4 4.16 4.40 10 -3 -3 6.35 1.43 10 -3 -2 9.23 1.76 -10 3 2 12.42 3.41 10 -3 -2 7.63 2.02 10 -3 -1 4.13 1.20 -10 3 1 7.44 3.04 10 -3 -1 4.26 1.27 -10 3 0 -0.62 1.24 10 -3 0 1.64 0.92 10 -3 1 12.26 1.93 -10 3 -1 10.26 3.60 10 -3 2 1.21 0.76 -10 3 -2 1.27 1.80 -10 3 -3 -2.34 2.53 10 -3 3 1.47 0.76 -10 3 -4 1.37 2.21 10 -3 4 0.23 0.56 -10 3 -5 11.81 4.88 10 -3 5 7.00 4.84 -10 3 -6 23.57 6.59 10 -3 6 30.48 8.10 -10 3 -7 0.82 2.35 10 -3 7 6.03 3.98 -10 3 -8 0.09 2.44 -10 4 17 2.24 2.67 10 -4 -16 1.91 3.04 10 -4 -16 5.59 3.32 -10 4 16 3.92 2.66 10 -4 -15 3.02 3.52 10 -4 -15 3.37 3.06 -10 4 15 6.62 2.92 -10 4 14 4.01 2.59 10 -4 -14 -1.70 2.19 10 -4 -14 4.75 2.94 -10 4 13 -0.11 2.45 10 -4 -13 -0.01 1.70 -10 4 12 1.11 1.53 10 -4 -12 4.41 3.18 10 -4 -11 11.41 4.43 -10 4 11 22.67 4.34 -10 4 10 5.91 2.21 10 -4 -10 2.04 2.95 -10 4 9 7.42 2.42 10 -4 -9 5.84 3.83 -10 4 8 0.65 1.08 10 -4 -8 6.17 4.68 -10 4 7 3.11 1.41 10 -4 -7 1.76 1.62 -10 4 6 24.02 3.59 10 -4 -6 23.73 4.02 10 -4 -6 20.58 5.57 10 -4 -5 4.53 4.97 10 -4 -5 3.45 1.77 10 -4 -4 0.16 0.55 10 -4 -4 -0.02 2.36 10 -4 -3 2.21 3.11 10 -4 -3 0.91 0.54 10 -4 -3 -0.52 1.19 10 -4 -2 21.21 2.34 -10 4 2 14.60 3.48 10 -4 -2 20.28 4.40 -10 4 1 17.01 4.23 10 -4 -1 22.70 2.46 10 -4 -1 18.92 4.27 10 -4 0 8.74 3.99 -10 4 0 4.73 2.95 10 -4 0 3.99 1.20 10 -4 1 93.60 5.04 10 -4 1 93.87 10.70 -10 4 -1 88.18 10.24 10 -4 2 6.41 3.24 10 -4 2 4.09 1.16 -10 4 -2 3.72 2.33 10 -4 3 9.81 4.10 -10 4 -3 13.83 4.23 -10 4 -4 49.21 8.44 10 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7.39 6.48 11 -11 -5 8.43 9.37 11 -11 -4 2.72 4.72 11 -11 -3 20.75 11.16 11 -11 -2 2.77 7.64 11 -11 -1 9.07 9.66 11 -11 0 9.87 10.07 11 -11 1 4.97 7.55 11 -11 1 3.48 4.48 11 -11 2 2.11 3.86 11 -11 3 8.75 5.88 11 -12 -4 12.50 8.01 11 -12 -3 10.06 8.07 11 -12 2 15.70 7.38 12 7 -12 -0.37 1.19 -12 -7 11 1.69 2.02 12 7 -11 1.64 2.06 -12 -7 10 -0.45 1.56 -12 -7 9 0.91 2.47 -12 -7 8 1.17 2.25 -12 -7 7 2.22 2.30 12 6 -13 0.43 1.51 12 6 -12 3.48 2.15 12 6 -11 -0.31 1.23 12 6 -10 15.98 3.53 -12 -6 10 9.95 3.70 12 6 -10 11.57 3.53 12 6 -9 2.73 1.63 -12 -6 9 5.60 3.38 12 6 -8 1.03 1.31 -12 -6 8 -0.73 1.39 12 6 -7 2.82 1.57 12 6 -6 0.15 0.80 12 6 -5 1.99 1.70 12 6 -4 0.20 1.23 12 5 -14 0.05 1.48 -12 -5 13 0.97 2.69 12 5 -13 0.07 1.50 12 5 -12 3.90 2.24 12 5 -11 -0.37 1.10 -12 -5 10 0.99 1.58 12 5 -10 1.97 1.84 12 5 -9 0.52 1.14 -12 -5 9 1.64 1.56 12 5 -9 1.14 1.70 12 5 -8 3.45 1.77 12 5 -7 0.39 1.14 12 5 -6 0.75 1.30 12 5 -5 6.11 2.29 12 5 -4 0.49 0.73 12 5 -3 6.63 2.36 12 5 -2 3.42 1.98 12 4 -15 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-3 16.61 5.51 12 -4 4 2.70 3.51 -12 4 -4 11.03 5.47 -12 4 -5 -3.43 3.32 -12 5 15 2.41 2.12 -12 5 14 3.28 2.31 12 -5 -14 0.05 1.76 -12 5 13 8.17 2.93 12 -5 -13 11.52 4.12 -12 5 12 5.35 2.38 12 -5 -11 -0.47 2.28 12 -5 -10 18.75 7.40 12 -5 -9 12.75 6.89 12 -5 -8 2.78 5.80 12 -5 -7 3.90 5.36 12 -5 -6 1.42 2.53 12 -5 -5 0.50 2.63 12 -5 -4 -4.11 5.42 12 -5 -4 6.69 3.50 12 -5 -3 9.84 5.61 12 -5 -3 21.43 5.42 12 -5 -2 3.92 7.39 12 -5 -2 5.07 3.08 -12 5 1 3.84 2.97 12 -5 -1 1.68 2.97 -12 5 0 3.29 2.66 12 -5 0 0.64 2.67 12 -5 1 5.64 2.98 -12 5 -1 1.81 1.77 -12 5 -2 0.66 2.39 12 -5 2 1.35 3.13 -12 5 -3 8.75 5.53 12 -5 3 3.40 3.57 -12 5 -4 2.66 2.65 12 -5 4 5.57 4.21 -12 5 -5 1.40 2.57 12 -6 -12 2.86 2.78 12 -6 -11 0.33 3.36 12 -6 -10 9.26 6.35 12 -6 -9 6.32 4.99 12 -6 -8 1.26 3.41 12 -6 -7 5.65 7.21 12 -6 -6 0.82 3.31 12 -6 -5 13.08 7.03 12 -6 -4 6.01 6.98 12 -6 -3 9.59 7.01 12 -6 -3 0.36 2.31 12 -6 -2 1.37 7.03 12 -6 -2 13.17 4.55 -12 6 1 -0.97 2.66 12 -6 -1 0.27 2.27 12 -6 0 35.06 7.60 -12 6 0 28.36 6.60 -12 6 -1 -0.49 2.52 12 -6 1 0.70 2.31 12 -6 2 7.35 5.33 -12 6 -2 1.48 1.96 12 -6 3 0.33 2.82 -12 6 -3 -3.24 4.27 -12 6 -4 10.41 4.91 12 -6 4 11.61 6.42 12 -7 -14 2.69 4.08 12 -7 -13 5.16 5.24 12 -7 -12 2.82 4.17 12 -7 -11 8.59 5.04 12 -7 -10 0.50 4.37 12 -7 -9 7.84 7.47 12 -7 -8 3.86 5.26 12 -7 -7 20.97 9.53 12 -7 -6 3.75 4.54 12 -7 -5 5.83 6.34 12 -7 -4 17.85 7.92 12 -7 -3 17.18 10.17 12 -7 -2 10.73 9.34 12 -7 -2 10.20 4.30 12 -7 -1 12.23 9.28 12 -7 -1 7.78 4.32 -12 7 0 1.79 3.87 12 -7 0 -1.90 3.31 12 -7 1 1.73 2.81 -12 7 -1 -3.25 2.82 -12 7 -2 3.71 4.01 12 -7 2 1.73 3.79 12 -7 3 4.38 4.33 -12 7 -3 -2.03 2.99 12 -7 4 8.52 5.50 -12 7 -4 -1.12 4.16 12 -8 -13 5.79 5.39 12 -8 -12 11.88 6.96 12 -8 -11 -2.37 3.58 12 -8 -10 2.85 5.03 12 -8 -9 10.40 8.28 12 -8 -8 4.35 7.57 12 -8 -7 12.62 9.70 12 -8 -6 12.22 7.75 12 -8 -5 3.66 3.59 12 -8 -4 -5.42 6.49 12 -8 -3 -3.21 4.35 12 -8 -2 12.51 8.43 12 -8 -1 14.84 10.11 12 -8 -1 5.99 4.35 12 -8 0 7.20 4.82 12 -8 1 9.60 5.98 -12 8 -1 16.39 5.35 12 -8 2 6.96 5.14 -12 8 -2 9.55 5.16 -12 8 -3 -0.73 2.60 12 -8 3 7.31 5.43 12 -9 -12 5.97 4.64 12 -9 -11 4.04 6.57 12 -9 -10 2.08 5.34 12 -9 -9 5.65 8.46 12 -9 -8 -1.71 4.46 12 -9 -7 1.77 4.71 12 -9 -6 1.44 4.47 12 -9 -5 2.99 5.94 12 -9 -4 -0.62 3.59 12 -9 -3 1.36 7.20 12 -9 -2 9.47 9.75 12 -9 -1 9.53 10.67 12 -9 0 38.17 18.98 12 -9 0 23.34 7.76 12 -9 1 3.04 4.36 12 -9 2 7.87 5.33 -12 9 -2 7.32 4.49 12 -9 3 21.60 8.22 12 -10 -10 11.61 9.58 12 -10 -9 23.11 10.97 12 -10 -8 7.65 8.52 12 -10 -7 5.45 7.02 12 -10 -6 0.09 4.20 12 -10 -5 8.86 8.12 12 -10 -4 1.86 5.09 12 -10 -3 2.98 4.82 12 -10 -2 16.74 12.66 12 -10 -1 20.09 10.84 12 -10 0 3.16 7.49 12 -10 1 6.32 4.72 12 -10 2 3.61 4.38 12 -11 -6 8.22 9.39 12 -11 -5 8.89 10.39 12 -11 -4 -3.50 6.31 12 -11 -3 12.97 8.14 13 5 -13 2.74 2.51 13 5 -12 4.49 2.57 13 4 -14 4.92 3.14 13 4 -13 2.74 2.64 13 4 -12 2.66 2.17 13 4 -11 2.58 2.07 13 4 -9 5.20 1.96 13 4 -8 1.57 1.42 13 4 -7 -0.09 1.06 13 4 -6 2.01 1.69 13 4 -5 0.17 1.17 13 4 -4 3.46 1.77 13 3 -14 1.78 2.16 -13 -3 13 1.57 2.82 13 3 -13 1.42 2.10 13 3 -12 -0.75 1.22 13 3 -11 2.50 1.91 13 3 -10 2.21 2.30 13 3 -9 4.79 2.09 13 3 -8 0.08 0.86 13 3 -7 3.76 1.64 13 3 -6 2.02 1.79 13 3 -5 2.32 1.74 13 3 -4 0.61 1.17 13 3 -3 4.88 2.26 13 3 -2 13.42 3.25 13 3 -1 1.91 1.60 -13 -2 14 -0.47 1.59 13 2 -14 0.74 1.34 -13 -2 13 4.70 2.26 13 2 -13 0.92 1.69 -13 -2 12 1.12 2.46 13 2 -12 0.79 1.76 13 2 -11 3.15 1.88 13 2 -10 2.74 1.94 13 2 -8 1.28 1.43 13 2 -7 17.52 3.33 13 2 -6 2.59 1.51 13 2 -5 -0.17 0.95 13 2 -4 10.92 2.91 13 2 -3 0.32 0.88 13 2 -2 1.99 1.61 13 2 -1 0.89 1.23 13 2 0 2.99 1.95 13 1 -15 -0.81 1.55 -13 -1 14 2.35 2.07 13 1 -14 3.76 2.74 -13 -1 13 3.59 2.87 13 1 -13 3.98 2.72 -13 -1 12 4.07 3.12 13 1 -12 4.74 2.88 13 1 -11 -0.37 1.21 13 1 -10 0.48 1.32 13 1 -9 3.15 2.06 13 1 -8 2.56 1.78 13 1 -7 17.00 3.27 13 1 -6 3.86 1.83 13 1 -5 1.07 1.31 13 1 -4 15.77 3.20 13 1 -3 11.56 2.61 13 1 -2 15.32 3.03 13 1 -1 11.57 2.67 13 1 0 -0.14 0.87 13 1 1 3.32 1.75 -13 0 15 0.60 1.96 13 0 -15 4.54 2.77 -13 0 14 1.16 2.01 13 0 -14 -1.15 1.94 -13 0 13 -0.62 1.78 13 0 -13 3.23 2.16 -13 0 12 8.17 2.92 13 0 -12 8.20 3.26 -13 0 11 9.29 3.41 13 0 -11 5.88 2.60 13 0 -10 3.68 2.37 13 0 -9 15.14 3.74 13 0 -7 1.37 1.42 13 0 -6 0.82 1.21 13 0 -5 19.98 3.62 13 0 -4 0.25 0.78 13 0 -3 0.96 1.31 13 0 -2 -0.21 0.67 13 0 -1 -0.71 0.80 13 0 0 2.78 1.48 13 0 1 3.74 1.70 -13 1 15 2.27 2.09 13 -1 -15 3.58 2.61 -13 1 14 3.18 2.35 13 -1 -14 3.80 2.37 -13 1 13 1.94 1.98 13 -1 -13 3.14 2.40 -13 1 12 10.45 3.63 13 -1 -12 7.74 3.19 -13 1 11 32.15 5.86 13 -1 -11 30.52 5.37 13 -1 -10 1.17 1.65 13 -1 -9 2.44 1.85 13 -1 -8 2.65 1.92 13 -1 -7 0.16 0.62 13 -1 -6 3.86 1.55 13 -1 -5 9.19 2.26 13 -1 -4 0.18 0.88 13 -1 -3 0.93 1.11 13 -1 -2 0.69 0.75 13 -1 -1 3.16 1.52 -13 2 15 1.96 2.38 -13 2 14 -0.36 1.46 13 -2 -14 2.26 2.18 -13 2 13 0.01 1.60 13 -2 -13 0.98 1.67 -13 2 12 1.67 2.30 13 -2 -12 5.85 2.84 -13 2 11 -1.41 1.69 13 -2 -11 6.30 2.97 -13 2 10 20.50 4.50 13 -2 -10 24.48 4.61 13 -2 -9 2.78 2.02 13 -2 -8 17.01 3.53 13 -2 -7 5.71 1.78 13 -2 -6 4.32 1.55 13 -2 -5 8.26 2.22 13 -2 -4 2.75 1.47 13 -2 -3 9.38 2.15 -13 3 16 7.53 3.58 -13 3 15 0.86 2.09 -13 3 14 1.57 2.42 13 -3 -14 0.52 1.52 -13 3 13 5.77 2.92 13 -3 -13 5.85 2.68 -13 3 12 1.64 1.90 13 -3 -12 2.68 2.25 -13 3 11 0.47 1.61 13 -3 -11 0.85 1.55 -13 3 10 6.02 2.78 13 -3 -10 3.57 2.51 13 -3 -9 16.89 3.98 13 -3 -8 2.03 1.69 13 -3 -7 3.00 1.84 13 -3 -7 1.71 1.63 13 -3 1 4.43 4.15 13 -3 2 8.56 5.09 13 -4 -14 1.00 2.13 13 -4 -13 1.75 2.18 13 -4 -12 5.41 2.76 13 -4 -11 5.27 2.99 13 -4 -10 3.36 2.12 13 -4 -9 2.33 1.59 13 -4 -8 1.68 1.72 13 -4 -7 0.71 1.37 13 -4 -4 2.40 2.50 13 -4 -3 3.25 2.52 13 -4 -2 8.54 3.84 13 -4 -1 5.81 4.03 13 -4 0 5.72 4.14 13 -4 1 35.92 7.99 13 -4 2 3.70 4.20 13 -5 -13 3.65 2.42 13 -5 -12 0.71 1.72 13 -5 -11 4.85 2.64 13 -5 -10 6.18 2.55 13 -5 -9 6.60 2.94 13 -5 -8 2.59 2.54 13 -5 -7 41.93 5.91 13 -5 -5 19.88 8.22 13 -5 -4 53.59 13.85 13 -5 -3 -2.27 4.33 13 -5 -3 -0.42 2.22 13 -5 -2 1.77 5.62 13 -5 -2 3.21 3.40 -13 5 1 9.67 4.32 13 -5 -1 4.54 4.00 13 -5 0 0.46 2.28 -13 5 0 -0.88 2.83 -13 5 -1 -0.27 2.50 13 -5 1 6.12 4.72 13 -5 2 7.07 5.63 -13 5 -2 -1.25 3.03 -13 5 -3 -3.30 3.91 13 -6 -8 6.75 5.56 13 -6 -7 7.40 7.01 13 -6 -6 8.22 4.82 13 -6 -5 -5.42 5.25 13 -6 -4 6.01 5.10 13 -6 -3 9.80 8.79 13 -6 -2 32.84 13.58 13 -6 -2 59.75 10.31 13 -6 -1 2.22 3.23 13 -6 0 3.91 3.90 -13 6 0 2.72 4.04 13 -6 1 -0.78 2.88 -13 6 -1 4.68 3.41 -13 6 -2 0.60 2.77 13 -6 2 11.73 5.84 -13 6 -3 6.20 5.35 13 -7 -10 8.11 6.89 13 -7 -9 5.09 6.20 13 -7 -8 19.40 9.82 13 -7 -7 11.04 6.80 13 -7 -6 5.55 6.51 13 -7 -5 10.06 7.01 13 -7 -4 1.62 6.16 13 -7 -3 16.93 9.50 13 -7 -2 2.45 6.70 13 -7 -1 1.13 7.33 13 -7 -1 2.97 4.20 -13 7 0 1.47 3.25 13 -7 0 9.69 5.29 -13 7 -1 0.93 3.02 13 -7 1 3.93 4.56 13 -7 2 1.11 3.38 -13 7 -2 1.67 4.04 13 -8 -11 0.55 3.35 13 -8 -10 20.92 10.65 13 -8 -9 12.99 8.47 13 -8 -8 2.70 5.45 13 -8 -7 12.43 7.85 13 -8 -6 17.09 8.57 13 -8 -5 35.31 11.50 13 -8 -4 2.76 6.18 13 -8 -3 10.55 8.26 13 -8 -2 3.00 7.01 13 -8 -1 2.13 5.95 13 -8 0 19.05 12.57 13 -8 0 2.35 3.99 -13 8 -1 6.61 4.40 13 -8 1 3.67 4.39 13 -9 -11 4.25 5.28 13 -9 -10 7.99 6.73 13 -9 -9 3.93 7.19 13 -9 -8 -1.13 7.67 13 -9 -7 11.27 10.06 13 -9 -6 8.47 7.86 13 -9 -5 7.22 6.03 13 -9 -4 6.57 6.45 13 -9 -3 7.69 8.16 13 -9 -2 12.70 8.63 13 -9 -1 19.82 13.71 13 -10 -7 -3.83 5.79 13 -10 -6 6.91 8.69 13 -10 -5 4.70 6.90 13 -10 -4 17.18 8.64 13 -10 -3 4.61 7.20 14 2 -13 3.17 2.57 14 2 -12 -0.31 1.35 14 2 -10 1.06 1.14 14 2 -9 1.49 1.41 14 2 -8 1.27 0.85 14 2 -7 3.01 1.84 14 2 -6 6.71 2.42 14 2 -5 0.05 1.05 14 2 -4 -0.28 0.87 14 2 -3 1.62 1.14 14 1 -13 7.23 3.29 14 1 -12 2.74 2.16 14 1 -9 1.39 1.36 14 1 -8 1.38 1.51 14 1 -7 3.62 2.15 14 1 -6 2.14 1.58 14 1 -5 1.29 1.26 14 1 -4 0.52 0.99 14 1 -3 2.86 1.42 14 1 -2 0.75 0.93 14 0 -14 1.32 1.72 -14 0 13 1.51 2.24 14 0 -13 0.53 1.67 14 0 -12 25.11 5.28 14 0 -11 10.81 3.57 14 0 -9 0.71 0.98 14 0 -8 0.52 1.19 14 0 -7 1.98 1.42 14 0 -6 0.67 1.15 14 0 -5 4.04 2.17 14 0 -4 27.58 4.27 14 0 -3 1.45 1.21 14 0 -2 7.82 2.39 -14 1 14 5.99 3.48 -14 1 13 0.21 1.75 14 -1 -13 2.70 2.29 -14 1 12 3.54 2.07 14 -1 -12 4.53 2.54 14 -1 -11 2.93 2.11 14 -1 -8 0.77 1.13 14 -1 -7 -0.50 0.74 14 -1 -6 1.62 1.24 14 -1 -5 0.97 1.15 -14 2 14 1.71 2.04 -14 2 13 5.90 3.17 14 -2 -13 1.67 2.03 -14 2 12 6.84 3.23 14 -2 -12 4.55 2.74 14 -2 -11 13.63 3.49 14 -2 -10 2.66 1.74 14 -2 -8 0.45 1.05 14 -3 -13 1.95 2.30 14 -3 -12 1.30 2.25 14 -3 -11 0.72 1.69 14 -3 -10 75.42 7.95 14 -3 -2 3.43 3.28 14 -3 -1 5.12 3.40 14 -3 0 2.77 3.75 14 -4 -13 1.36 1.69 14 -4 -12 0.56 2.05 14 -4 -11 1.12 2.06 14 -4 -10 1.71 1.72 14 -4 -9 0.92 1.92 14 -4 -2 2.10 2.76 14 -4 -1 1.35 3.34 14 -4 0 2.66 3.36 14 -5 -12 0.91 1.69 14 -5 -11 3.14 2.34 14 -5 -10 3.57 2.55 14 -5 -9 3.44 2.23 14 -5 -1 4.69 4.36 14 -5 0 10.34 5.38 14 -6 -11 2.46 2.28 14 -6 -10 6.16 3.06 14 -6 -9 1.78 2.55 14 -6 0 6.70 5.18 14 -8 -6 4.71 6.36 14 -8 -5 11.97 7.47 14 -8 -4 17.35 9.32 14 -8 -3 18.36 10.83 14 -8 -2 4.36 8.52 14 -9 -6 13.00 10.48 14 -9 -5 4.78 6.30 14 -9 -4 2.27 5.66 15 0 -10 6.16 2.72 15 0 -9 1.71 1.83 15 0 -8 0.60 1.35 15 0 -7 1.46 1.54 TITL mx6078a in P-1 REM P-1 (#2 in standard setting) CELL 0.71073 10.461239 11.137307 13.828996 96.9247 112.1605 98.8706 ZERR 6.00 0.000501 0.000364 0.000492 0.0028 0.0039 0.0033 LATT 1 SFAC C H N O UNIT 66.00 60.00 6.00 6.00 TREF HKLF 4 END _computing_structure_solution 'SHELXT 2014/4 (Sheldrick, 2014)' ; _shelx_hkl_checksum 67945 _olex2_submission_special_instructions 'No special instructions were received' 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 S1 S -0.16871(6) 0.34357(5) 0.15147(4) 0.04199(15) Uani 1 1 d . S2 S 0.44448(6) 1.04464(5) 0.80600(5) 0.04289(16) Uani 1 1 d . O1 O 0.68877(18) 0.66851(14) 0.99134(11) 0.0491(4) Uani 1 1 d . O2 O 0.80519(15) 0.10115(13) 0.68465(12) 0.0432(4) Uani 1 1 d . O3 O 0.36177(16) 0.21753(16) 0.29404(11) 0.0478(4) Uani 1 1 d . N1 N 0.6262(2) 0.95875(17) 0.95463(15) 0.0449(5) Uani 1 1 d . N2 N 0.6860(2) 0.87064(17) 0.99717(14) 0.0445(5) Uani 1 1 d . N3 N 0.5010(2) 0.71798(16) 0.86167(15) 0.0448(5) Uani 1 1 d . N4 N 0.44185(19) 0.80615(16) 0.81689(15) 0.0417(4) Uani 1 1 d . N5 N 0.71473(17) 0.26297(15) 0.72313(13) 0.0332(4) Uani 1 1 d . N6 N 0.14079(19) 0.18908(16) 0.17100(13) 0.0385(4) Uani 1 1 d . N7 N 0.01652(19) 0.21935(16) 0.13917(13) 0.0385(4) Uani 1 1 d . N8 N 0.09340(17) 0.36605(15) 0.30172(13) 0.0344(4) Uani 1 1 d . N9 N 0.21877(18) 0.33399(15) 0.33467(13) 0.0355(4) Uani 1 1 d . C1 C -0.1546(2) 0.47337(19) 0.24687(16) 0.0346(5) Uani 1 1 d . C2 C -0.1468(2) 0.5889(2) 0.21988(17) 0.0416(5) Uani 1 1 d . H2 H -0.1444 0.5982 0.1531 0.050 Uiso 1 1 calc R C3 C -0.1425(2) 0.6912(2) 0.28937(17) 0.0402(5) Uani 1 1 d . H3 H -0.1376 0.7700 0.2696 0.048 Uiso 1 1 calc R C4 C -0.1452(2) 0.68059(19) 0.38766(16) 0.0333(4) Uani 1 1 d . C5 C -0.1528(2) 0.56377(19) 0.41402(16) 0.0383(5) Uani 1 1 d . H5 H -0.1538 0.5547 0.4812 0.046 Uiso 1 1 calc R C6 C -0.1588(2) 0.4602(2) 0.34424(17) 0.0399(5) Uani 1 1 d . H6 H -0.1658 0.3809 0.3630 0.048 Uiso 1 1 calc R C7 C -0.1383(2) 0.7930(2) 0.46443(17) 0.0373(5) Uani 1 1 d . H7A H -0.2019 0.7684 0.4999 0.045 Uiso 1 1 calc R H7B H -0.1748 0.8560 0.4232 0.045 Uiso 1 1 calc R C8 C 0.0081(2) 0.85189(18) 0.54955(15) 0.0319(4) Uani 1 1 d . C9 C 0.0236(2) 0.91611(18) 0.64774(16) 0.0354(5) Uani 1 1 d . H9 H -0.0583 0.9219 0.6609 0.043 Uiso 1 1 calc R C10 C 0.1558(2) 0.97170(18) 0.72656(16) 0.0356(5) Uani 1 1 d . H10 H 0.1645 1.0134 0.7936 0.043 Uiso 1 1 calc R C11 C 0.2755(2) 0.96589(18) 0.70675(17) 0.0345(5) Uani 1 1 d . C12 C 0.2618(2) 0.90527(18) 0.60881(17) 0.0368(5) Uani 1 1 d . H12 H 0.3436 0.9029 0.5947 0.044 Uiso 1 1 calc R C13 C 0.1291(2) 0.84799(19) 0.53105(17) 0.0365(5) Uani 1 1 d . H13 H 0.1209 0.8056 0.4644 0.044 Uiso 1 1 calc R C14 C 0.5094(2) 0.92246(18) 0.86332(16) 0.0336(4) Uani 1 1 d . C15 C 0.6211(2) 0.75440(19) 0.94570(16) 0.0370(5) Uani 1 1 d . C16 C 0.6888(2) 0.56293(18) 0.92333(15) 0.0361(5) Uani 1 1 d . C17 C 0.5677(2) 0.4739(2) 0.86217(18) 0.0435(5) Uani 1 1 d . H17 H 0.4794 0.4810 0.8642 0.052 Uiso 1 1 calc R C18 C 0.5784(2) 0.37405(19) 0.79764(19) 0.0419(5) Uani 1 1 d . H18 H 0.4960 0.3124 0.7542 0.050 Uiso 1 1 calc R C19 C 0.7072(2) 0.36275(17) 0.79555(15) 0.0319(4) Uani 1 1 d . C20 C 0.8276(2) 0.45215(18) 0.85980(15) 0.0338(5) Uani 1 1 d . H20 H 0.9166 0.4449 0.8593 0.041 Uiso 1 1 calc R C21 C 0.8178(2) 0.55155(18) 0.92448(16) 0.0365(5) Uani 1 1 d . H21 H 0.9004 0.6120 0.9697 0.044 Uiso 1 1 calc R C22 C 0.7952(2) 0.17572(18) 0.75240(17) 0.0353(5) Uani 1 1 d . C23 C 0.8656(2) 0.1719(2) 0.86858(17) 0.0462(6) Uani 1 1 d . H23A H 0.8538 0.0857 0.8779 0.069 Uiso 1 1 calc GR H23B H 0.8223 0.2180 0.9083 0.069 Uiso 1 1 calc GR H23C H 0.9666 0.2097 0.8953 0.069 Uiso 1 1 calc GR C24 C 0.6258(2) 0.25302(18) 0.61196(15) 0.0319(4) Uani 1 1 d . C25 C 0.5112(2) 0.15396(18) 0.56283(16) 0.0343(5) Uani 1 1 d . H25 H 0.4940 0.0929 0.6014 0.041 Uiso 1 1 calc R C26 C 0.4218(2) 0.14389(19) 0.45733(17) 0.0377(5) Uani 1 1 d . H26 H 0.3431 0.0760 0.4225 0.045 Uiso 1 1 calc R C27 C 0.4492(2) 0.2344(2) 0.40397(16) 0.0372(5) Uani 1 1 d . C28 C 0.5613(2) 0.3338(2) 0.45127(18) 0.0436(5) Uani 1 1 d . H28 H 0.5773 0.3953 0.4127 0.052 Uiso 1 1 calc R C29 C 0.6513(2) 0.34268(19) 0.55692(17) 0.0397(5) Uani 1 1 d . H29 H 0.7302 0.4104 0.5912 0.048 Uiso 1 1 calc R C30 C 0.2360(2) 0.24932(19) 0.26798(15) 0.0339(5) Uani 1 1 d . C31 C -0.0022(2) 0.30850(18) 0.20532(15) 0.0325(4) Uani 1 1 d . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 S1 0.0338(3) 0.0498(3) 0.0325(3) -0.0008(2) 0.0048(2) 0.0103(2) S2 0.0430(3) 0.0305(3) 0.0484(3) 0.0084(2) 0.0115(3) 0.0061(2) O1 0.0667(11) 0.0450(9) 0.0268(8) 0.0014(7) 0.0047(7) 0.0286(8) O2 0.0411(9) 0.0416(8) 0.0412(9) -0.0012(7) 0.0113(7) 0.0142(7) O3 0.0440(9) 0.0716(11) 0.0292(8) 0.0041(8) 0.0121(7) 0.0281(8) N1 0.0436(11) 0.0389(10) 0.0410(11) 0.0000(8) 0.0069(9) 0.0100(8) N2 0.0463(11) 0.0425(10) 0.0351(10) -0.0010(8) 0.0065(9) 0.0149(9) N3 0.0457(11) 0.0366(10) 0.0420(11) 0.0084(8) 0.0059(9) 0.0108(8) N4 0.0423(10) 0.0334(9) 0.0417(10) 0.0087(8) 0.0083(9) 0.0081(8) N5 0.0326(9) 0.0320(8) 0.0286(9) 0.0021(7) 0.0058(7) 0.0091(7) N6 0.0427(10) 0.0433(10) 0.0261(9) 0.0024(8) 0.0107(8) 0.0117(8) N7 0.0412(10) 0.0420(10) 0.0276(9) 0.0026(8) 0.0095(8) 0.0101(8) N8 0.0347(9) 0.0370(9) 0.0266(8) 0.0027(7) 0.0078(7) 0.0086(8) N9 0.0363(10) 0.0389(9) 0.0281(9) 0.0029(7) 0.0095(8) 0.0108(8) C1 0.0282(10) 0.0428(11) 0.0293(10) 0.0066(9) 0.0070(9) 0.0105(9) C2 0.0474(13) 0.0518(13) 0.0307(11) 0.0154(10) 0.0164(10) 0.0181(11) C3 0.0507(13) 0.0396(11) 0.0381(12) 0.0183(10) 0.0200(10) 0.0186(10) C4 0.0288(10) 0.0406(11) 0.0311(10) 0.0089(9) 0.0109(9) 0.0111(9) C5 0.0447(12) 0.0439(12) 0.0299(11) 0.0115(9) 0.0176(10) 0.0102(10) C6 0.0439(12) 0.0393(11) 0.0384(12) 0.0123(10) 0.0176(10) 0.0088(10) C7 0.0350(11) 0.0438(12) 0.0365(11) 0.0118(10) 0.0141(9) 0.0158(9) C8 0.0373(11) 0.0321(10) 0.0329(11) 0.0135(9) 0.0162(9) 0.0150(9) C9 0.0400(12) 0.0361(11) 0.0387(11) 0.0126(9) 0.0212(10) 0.0144(9) C10 0.0453(12) 0.0330(10) 0.0323(11) 0.0084(9) 0.0180(10) 0.0114(9) C11 0.0375(11) 0.0288(10) 0.0391(11) 0.0114(9) 0.0150(9) 0.0103(9) C12 0.0376(12) 0.0348(11) 0.0435(12) 0.0102(9) 0.0201(10) 0.0115(9) C13 0.0427(12) 0.0379(11) 0.0345(11) 0.0073(9) 0.0195(10) 0.0140(9) C14 0.0348(11) 0.0325(10) 0.0355(11) 0.0049(9) 0.0170(9) 0.0076(9) C15 0.0433(12) 0.0409(11) 0.0258(10) 0.0036(9) 0.0111(9) 0.0159(10) C16 0.0461(13) 0.0340(10) 0.0256(10) 0.0067(8) 0.0081(9) 0.0174(9) C17 0.0407(12) 0.0423(12) 0.0476(13) 0.0039(10) 0.0175(11) 0.0137(10) C18 0.0337(11) 0.0333(11) 0.0506(14) 0.0013(10) 0.0118(10) 0.0030(9) C19 0.0343(11) 0.0289(9) 0.0294(10) 0.0048(8) 0.0096(9) 0.0072(8) C20 0.0318(11) 0.0366(10) 0.0292(10) 0.0065(9) 0.0090(9) 0.0056(9) C21 0.0392(12) 0.0327(10) 0.0268(10) 0.0051(8) 0.0029(9) 0.0050(9) C22 0.0294(10) 0.0322(10) 0.0378(12) 0.0036(9) 0.0088(9) 0.0031(9) C23 0.0515(14) 0.0372(11) 0.0392(12) 0.0067(10) 0.0060(11) 0.0123(10) C24 0.0311(10) 0.0313(10) 0.0297(10) 0.0008(8) 0.0090(9) 0.0093(8) C25 0.0313(11) 0.0341(10) 0.0363(11) 0.0058(9) 0.0126(9) 0.0071(9) C26 0.0275(10) 0.0395(11) 0.0392(12) -0.0004(9) 0.0085(9) 0.0068(9) C27 0.0324(11) 0.0494(12) 0.0291(10) 0.0035(9) 0.0092(9) 0.0185(10) C28 0.0516(14) 0.0404(12) 0.0408(12) 0.0125(10) 0.0182(11) 0.0126(10) C29 0.0395(12) 0.0339(10) 0.0391(12) 0.0040(9) 0.0118(10) 0.0019(9) C30 0.0363(11) 0.0402(11) 0.0272(10) 0.0092(9) 0.0128(9) 0.0125(9) C31 0.0341(11) 0.0339(10) 0.0272(10) 0.0067(8) 0.0105(9) 0.0057(8) 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' 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 C31 S1 C1 102.64(9) C14 S2 C11 101.72(9) C15 O1 C16 117.78(15) C30 O3 C27 117.34(16) N2 N1 C14 116.98(18) N1 N2 C15 116.00(18) C15 N3 N4 116.97(18) C14 N4 N3 116.48(18) C19 N5 C24 115.88(15) C22 N5 C19 125.09(16) C22 N5 C24 118.99(17) N7 N6 C30 115.83(17) N6 N7 C31 117.60(16) C31 N8 N9 116.90(17) C30 N9 N8 116.65(16) C2 C1 S1 118.44(16) C2 C1 C6 119.6(2) C6 C1 S1 121.87(16) C1 C2 H2 119.8 C3 C2 C1 120.39(19) C3 C2 H2 119.8 C2 C3 H3 119.5 C2 C3 C4 121.09(19) C4 C3 H3 119.5 C3 C4 C5 117.98(19) C3 C4 C7 121.05(18) C5 C4 C7 120.96(18) C4 C5 H5 119.3 C6 C5 C4 121.37(19) C6 C5 H5 119.3 C1 C6 C5 119.56(19) C1 C6 H6 120.2 C5 C6 H6 120.2 C4 C7 H7A 108.5 C4 C7 H7B 108.5 C4 C7 C8 114.99(17) H7A C7 H7B 107.5 C8 C7 H7A 108.5 C8 C7 H7B 108.5 C9 C8 C7 120.19(19) C13 C8 C7 121.56(18) C13 C8 C9 118.20(19) C8 C9 H9 119.3 C10 C9 C8 121.5(2) C10 C9 H9 119.3 C9 C10 H10 120.3 C9 C10 C11 119.4(2) C11 C10 H10 120.3 C10 C11 S2 119.09(16) C12 C11 S2 120.91(17) C12 C11 C10 119.9(2) C11 C12 H12 119.9 C11 C12 C13 120.3(2) C13 C12 H12 119.9 C8 C13 H13 119.6 C12 C13 C8 120.7(2) C12 C13 H13 119.6 N1 C14 S2 114.37(15) N4 C14 S2 119.70(16) N4 C14 N1 125.92(19) N2 C15 O1 113.39(18) N3 C15 O1 119.32(19) N3 C15 N2 127.2(2) C17 C16 O1 122.5(2) C21 C16 O1 115.91(18) C21 C16 C17 121.6(2) C16 C17 H17 120.9 C16 C17 C18 118.2(2) C18 C17 H17 120.9 C17 C18 H18 119.5 C19 C18 C17 121.00(19) C19 C18 H18 119.5 C18 C19 N5 120.18(17) C18 C19 C20 119.44(19) C20 C19 N5 120.30(18) C19 C20 H20 120.1 C21 C20 C19 119.88(19) C21 C20 H20 120.1 C16 C21 C20 119.85(19) C16 C21 H21 120.1 C20 C21 H21 120.1 O2 C22 N5 120.33(19) O2 C22 C23 121.01(19) N5 C22 C23 118.63(19) C22 C23 H23A 109.5 C22 C23 H23B 109.5 C22 C23 H23C 109.5 H23A C23 H23B 109.5 H23A C23 H23C 109.5 H23B C23 H23C 109.5 C25 C24 N5 118.58(17) C29 C24 N5 120.82(17) C29 C24 C25 120.55(18) C24 C25 H25 120.0 C24 C25 C26 119.91(19) C26 C25 H25 120.0 C25 C26 H26 120.7 C27 C26 C25 118.56(18) C27 C26 H26 120.7 C26 C27 O3 117.41(18) C28 C27 O3 119.9(2) C28 C27 C26 122.52(19) C27 C28 H28 120.7 C27 C28 C29 118.6(2) C29 C28 H28 120.7 C24 C29 C28 119.89(19) C24 C29 H29 120.1 C28 C29 H29 120.1 O3 C30 N6 112.87(18) N9 C30 O3 119.59(18) N9 C30 N6 127.52(19) N7 C31 S1 112.86(14) N8 C31 S1 121.67(16) N8 C31 N7 125.47(18) loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance S1 C1 1.783(2) S1 C31 1.744(2) S2 C11 1.783(2) S2 C14 1.755(2) O1 C15 1.353(2) O1 C16 1.415(2) O2 C22 1.221(2) O3 C27 1.418(2) O3 C30 1.343(2) N1 N2 1.323(2) N1 C14 1.346(3) N2 C15 1.336(3) N3 N4 1.332(2) N3 C15 1.312(3) N4 C14 1.328(2) N5 C19 1.436(3) N5 C22 1.381(3) N5 C24 1.446(2) N6 N7 1.318(2) N6 C30 1.345(3) N7 C31 1.356(3) N8 N9 1.337(2) N8 C31 1.334(2) N9 C30 1.319(3) C1 C2 1.382(3) C1 C6 1.388(3) C2 H2 0.9500 C2 C3 1.382(3) C3 H3 0.9500 C3 C4 1.389(3) C4 C5 1.392(3) C4 C7 1.514(3) C5 H5 0.9500 C5 C6 1.388(3) C6 H6 0.9500 C7 H7A 0.9900 C7 H7B 0.9900 C7 C8 1.519(3) C8 C9 1.395(3) C8 C13 1.388(3) C9 H9 0.9500 C9 C10 1.386(3) C10 H10 0.9500 C10 C11 1.388(3) C11 C12 1.384(3) C12 H12 0.9500 C12 C13 1.388(3) C13 H13 0.9500 C16 C17 1.380(3) C16 C21 1.369(3) C17 H17 0.9500 C17 C18 1.386(3) C18 H18 0.9500 C18 C19 1.383(3) C19 C20 1.387(3) C20 H20 0.9500 C20 C21 1.379(3) C21 H21 0.9500 C22 C23 1.503(3) C23 H23A 0.9800 C23 H23B 0.9800 C23 H23C 0.9800 C24 C25 1.383(3) C24 C29 1.379(3) C25 H25 0.9500 C25 C26 1.384(3) C26 H26 0.9500 C26 C27 1.376(3) C27 C28 1.369(3) C28 H28 0.9500 C28 C29 1.389(3) C29 H29 0.9500