#------------------------------------------------------------------------------ #$Date: 2023-09-13 04:44:53 +0300 (Wed, 13 Sep 2023) $ #$Revision: 286318 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/02/28/2022859.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2022859 loop_ _publ_author_name 'Guseinov, Firudin I.' 'Ovsyannikov, Viacheslav O.' 'Sokolovskiy, Pavel V.' 'Sebyakin, Yurii L.' 'Samigullina, Aida I.' 'Akkurt, Mehmet' '\,Celikesir, Sevim T\"urktekin' 'Bhattarai, Ajaya' _publ_section_title ; Synthesis, crystal structure and Hirshfeld surface analysis of 3-(4-fluorophenyl)-2-formyl-7-methylimidazo[1,2-a]pyridin-1-ium chloride monohydrate ; _journal_coeditor_code JY2034 _journal_issue 10 _journal_name_full 'Acta Crystallographica Section E Crystallographic Communications' _journal_paper_doi 10.1107/S2056989023007272 _journal_volume 79 _journal_year 2023 _chemical_formula_iupac 'C15 H12 F N2 O +, Cl -, H2 O' _chemical_formula_moiety 'C15 H12 F N2 O +, Cl -, H2 O' _chemical_formula_sum 'C15 H14 Cl F N2 O2' _chemical_formula_weight 308.73 _chemical_name_systematic ; 3-(4-Fluorophenyl)-2-formyl-7-methylimidazo[1,2-a]pyridin-1-ium chloride monohydrate ; _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 mixed _atom_sites_solution_primary dual _atom_sites_solution_secondary difmap _audit_creation_method ; Olex2 1.3 (compiled 2019.09.11 svn.r3662 for OlexSys, GUI svn.r5938) ; _cell_angle_alpha 74.0382(12) _cell_angle_beta 73.7634(14) _cell_angle_gamma 72.7034(13) _cell_formula_units_Z 2 _cell_length_a 7.45681(13) _cell_length_b 8.41737(10) _cell_length_c 12.8928(2) _cell_measurement_reflns_used 11896 _cell_measurement_temperature 100.0(3) _cell_measurement_theta_max 77.3040 _cell_measurement_theta_min 3.6430 _cell_volume 725.40(2) _computing_cell_refinement ; CrysAlis PRO (Rigaku OD, 2023) ; _computing_data_collection ; CrysAlis PRO (Rigaku OD, 2023) ; _computing_data_reduction ; CrysAlis PRO (Rigaku OD, 2023) ; _computing_molecular_graphics ; ORTEP-3 for Windows (Farrugia, 2012) ; _computing_publication_material ; PLATON (Spek, 2020) ; _computing_structure_refinement ; SHELXL2019 (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXT2019 (Sheldrick, 2015a) ; _diffrn_ambient_temperature 100.0(3) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 0.991 _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'Rigaku XtaLAB Synergy Dualflex diffractometer with a HyPix detector' _diffrn_measurement_method '\w scans' _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Cu K\a' _diffrn_radiation_wavelength 1.54184 _diffrn_reflns_av_R_equivalents 0.0272 _diffrn_reflns_av_unetI/netI 0.0193 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_h_min -9 _diffrn_reflns_limit_k_max 9 _diffrn_reflns_limit_k_min -10 _diffrn_reflns_limit_l_max 16 _diffrn_reflns_limit_l_min -16 _diffrn_reflns_number 15845 _diffrn_reflns_theta_full 67.684 _diffrn_reflns_theta_max 77.870 _diffrn_reflns_theta_min 3.652 _diffrn_source 'micro-focus sealed X-ray tube' _exptl_absorpt_coefficient_mu 2.495 _exptl_absorpt_correction_T_max 1.000 _exptl_absorpt_correction_T_min 0.404 _exptl_absorpt_correction_type gaussian _exptl_absorpt_process_details ; (CrysAlis PRO; Rigaku OD, 2023) ; _exptl_crystal_colour colorless _exptl_crystal_density_diffrn 1.413 _exptl_crystal_density_method 'not measured' _exptl_crystal_description prism _exptl_crystal_F_000 320 _exptl_crystal_size_max 0.33 _exptl_crystal_size_mid 0.19 _exptl_crystal_size_min 0.15 _refine_diff_density_max 0.336 _refine_diff_density_min -0.239 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.028 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 203 _refine_ls_number_reflns 3082 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.028 _refine_ls_R_factor_all 0.0338 _refine_ls_R_factor_gt 0.0334 _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^)+(0.0415P)^2^+0.4038P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0855 _refine_ls_wR_factor_ref 0.0858 _reflns_number_gt 3033 _reflns_number_total 3082 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file jy2034sup1.cif _cod_data_source_block I _cod_database_code 2022859 _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_min 0.493 _shelx_estimated_absorpt_t_max 0.706 _shelx_hkl_file ; 0 0 1 335.54 7.36 0 0 1 330.48 7.48 0 0 2 95.62 3.02 0 0 3 399.10 10.11 0 0 4 1833.07 40.66 0 0 5 543.71 14.68 0 0 6 37.86 2.98 0 0 6 36.16 2.81 0 0 6 38.96 1.95 0 0 7 1.71 0.78 0 0 7 1.27 0.68 0 0 8 299.65 11.61 0 0 8 298.95 8.35 0 0 8 298.79 11.28 0 0 8 287.76 8.41 0 0 9 11.49 2.20 0 0 9 14.55 1.40 0 0 9 10.37 1.95 0 0 9 12.17 1.34 0 0 9 10.81 1.15 0 0 10 435.82 16.43 0 0 10 406.01 11.30 0 0 10 434.85 16.07 0 0 10 440.31 11.91 0 0 11 45.54 4.75 0 0 11 44.68 2.52 0 0 11 47.70 2.88 0 0 11 37.39 4.16 0 0 11 42.07 2.89 0 0 12 112.66 4.91 0 0 -12 116.16 4.78 0 0 12 116.02 4.74 0 0 13 266.67 8.11 0 0 -13 266.05 7.90 0 0 -14 20.25 1.35 0 0 14 23.87 1.51 0 0 14 21.31 1.60 0 0 14 23.49 1.70 0 0 14 22.75 1.45 0 0 15 4.16 0.53 0 0 15 5.18 0.59 0 -1 14 1.48 0.36 0 -1 14 1.15 0.34 0 -1 14 0.75 0.35 0 -1 14 1.07 0.38 0 1 -13 36.28 1.93 0 -1 13 40.31 2.36 0 -1 13 41.00 2.38 0 -1 13 44.46 2.62 0 -1 13 39.60 2.51 0 1 -12 153.15 5.42 0 -1 12 158.20 5.25 0 -1 12 158.51 6.05 0 -1 12 173.07 6.41 0 -1 12 155.36 6.14 0 -1 12 168.58 6.02 0 -1 11 299.92 8.94 0 -1 11 294.10 12.71 0 -1 11 321.55 9.66 0 -1 11 312.27 9.91 0 -1 10 10.37 1.26 0 -1 10 12.73 1.45 0 -1 10 13.12 1.51 0 -1 10 12.74 2.31 0 -1 10 11.20 1.50 0 -1 9 120.69 5.23 0 -1 9 118.58 4.96 0 -1 9 117.98 4.72 0 -1 9 128.41 7.84 0 -1 9 126.17 7.30 0 -1 8 1.45 0.55 0 -1 8 1.94 0.85 0 -1 8 1.45 0.51 0 -1 8 0.73 0.41 0 -1 8 1.51 0.90 0 -1 7 661.16 19.10 0 -1 7 681.86 20.17 0 -1 6 8.56 1.39 0 -1 6 6.45 1.32 0 -1 6 6.14 0.78 0 -1 5 200.22 7.18 0 -1 5 211.15 7.75 0 -1 5 205.53 5.70 0 -1 4 401.18 11.03 0 -1 4 389.50 10.81 0 -1 4 415.34 11.54 0 -1 3 351.78 9.39 0 -1 3 339.52 8.96 0 -1 3 352.43 9.54 0 -1 3 353.15 8.00 0 -1 3 328.32 7.84 0 -1 2 162.79 5.04 0 -1 2 156.62 4.51 0 -1 2 162.18 4.29 0 -1 2 168.45 5.01 0 -1 2 160.88 4.20 0 -1 1 53.40 1.73 0 -1 1 55.48 1.96 0 -1 1 56.29 1.71 0 -1 1 53.75 1.89 0 -1 0 54.96 1.57 0 -1 -1 885.72 19.51 0 -1 -1 905.40 19.49 0 -1 -2 453.82 10.25 0 -1 -2 439.90 10.17 0 -1 -3 646.98 14.51 0 -1 -3 663.62 14.49 0 1 4 493.27 12.44 0 -1 -4 462.10 10.65 0 -1 -4 488.94 10.68 0 1 5 3.65 0.77 0 1 6 527.43 15.21 0 1 6 548.86 15.21 0 1 6 538.49 12.89 0 1 7 199.62 8.10 0 1 7 188.49 7.93 0 1 8 230.82 7.12 0 1 8 250.31 10.01 0 1 8 256.56 10.06 0 1 9 95.21 6.12 0 1 9 86.12 3.68 0 1 9 83.29 3.65 0 1 10 3.23 0.70 0 1 10 4.56 0.81 0 1 11 6.51 1.80 0 1 11 8.00 1.09 0 1 11 8.72 1.13 0 -1 -11 7.26 1.12 0 1 12 103.51 7.03 0 -1 -12 101.07 4.34 0 1 12 101.96 4.26 0 1 12 104.66 4.64 0 -1 -12 103.01 4.61 0 1 12 97.34 4.12 0 1 12 98.09 7.00 0 1 13 47.98 2.74 0 -1 -13 48.03 2.80 0 -1 -13 43.84 2.45 0 1 14 8.80 0.94 0 1 14 7.00 0.94 0 -1 -14 7.36 0.94 0 1 15 0.41 0.24 0 -1 -15 0.34 0.21 0 -2 14 58.35 2.24 0 -2 14 56.78 2.16 0 -2 13 2.01 0.54 0 -2 13 1.97 0.51 0 -2 13 3.18 0.60 0 -2 13 1.62 0.35 0 -2 12 37.79 2.60 0 -2 12 39.06 2.50 0 -2 12 37.44 2.49 0 -2 12 36.94 2.17 0 -2 11 67.34 3.54 0 -2 11 62.42 3.63 0 -2 11 60.48 3.66 0 -2 11 66.61 3.57 0 -2 11 61.04 3.60 0 -2 11 59.36 3.18 0 -2 10 113.60 4.73 0 -2 10 110.15 4.95 0 -2 10 101.44 5.00 0 -2 10 101.75 5.06 0 -2 10 104.31 4.37 0 -2 10 99.14 6.50 0 -2 10 104.85 5.00 0 -2 9 140.70 5.38 0 -2 9 143.90 6.00 0 -2 9 141.07 5.53 0 -2 9 139.43 5.31 0 -2 9 132.06 7.46 0 -2 8 269.86 8.37 0 -2 8 277.72 11.00 0 -2 8 279.40 8.46 0 -2 8 276.96 8.34 0 -2 8 273.42 9.00 0 -2 7 0.33 0.36 0 -2 7 1.56 0.48 0 -2 7 1.27 0.44 0 -2 7 0.32 0.35 0 -2 7 1.15 0.47 0 -2 7 1.11 0.58 0 -2 6 369.98 11.89 0 -2 5 211.26 8.02 0 -2 5 212.88 7.45 0 -2 5 203.76 5.86 0 -2 4 47.99 2.24 0 -2 4 48.05 3.21 0 -2 4 48.81 2.77 0 -2 3 70.43 2.97 0 -2 3 71.07 2.89 0 -2 3 76.88 3.14 0 -2 3 76.96 3.89 0 -2 2 9.24 0.98 0 -2 2 10.27 0.98 0 -2 2 8.85 1.16 0 -2 2 10.03 0.84 0 -2 1 54.48 2.51 0 -2 1 47.38 1.78 0 -2 1 52.07 2.39 0 -2 0 192.43 4.90 0 -2 0 190.85 5.94 0 -2 -1 702.28 16.31 0 -2 -1 680.41 16.14 0 -2 -2 2918.02 63.23 0 -2 -2 2892.81 63.21 0 -2 -2 3042.47 62.74 0 -2 -3 2574.64 56.24 0 -2 -3 2685.77 56.30 0 -2 -3 2614.16 55.45 0 -2 -4 980.30 21.94 0 -2 -4 944.42 21.87 0 -2 -5 2585.32 56.05 0 -2 -5 2633.40 56.09 0 2 5 2677.28 57.85 0 2 6 253.34 8.85 0 2 7 59.56 4.01 0 2 8 290.96 11.07 0 2 8 294.74 10.92 0 2 8 283.70 8.05 0 2 8 278.45 8.17 0 2 9 279.43 11.38 0 2 9 275.87 11.24 0 2 9 263.56 7.98 0 -2 -10 183.17 6.50 0 2 10 170.19 5.68 0 2 10 169.74 9.03 0 2 10 171.75 9.10 0 2 10 169.26 6.04 0 -2 -11 51.20 3.10 0 2 11 44.74 2.53 0 2 11 48.36 4.75 0 2 11 50.06 4.77 0 2 11 51.96 2.93 0 -2 -11 53.90 3.28 0 -2 -12 234.55 7.74 0 2 12 215.41 10.79 0 2 12 231.67 11.16 0 2 12 225.93 7.41 0 -2 -12 238.13 7.98 0 2 13 162.52 5.56 0 -2 -13 165.05 6.04 0 -2 -13 164.40 5.77 0 2 13 160.98 5.71 0 -2 -14 2.79 0.55 0 2 14 2.04 0.47 0 -2 -14 3.53 0.69 0 2 15 119.52 3.71 0 -2 -15 122.03 3.90 0 -3 13 26.07 1.53 0 -3 13 29.63 1.61 0 -3 13 28.15 1.48 0 -3 12 10.22 1.04 0 -3 12 13.30 1.32 0 -3 12 12.15 1.25 0 -3 12 13.38 1.33 0 -3 12 12.72 1.33 0 -3 11 29.90 2.29 0 -3 11 28.29 2.25 0 -3 11 25.48 1.96 0 -3 11 28.01 2.23 0 -3 11 30.05 2.32 0 -3 10 45.38 2.95 0 -3 10 48.25 2.80 0 -3 10 43.24 3.02 0 -3 10 43.76 2.75 0 -3 10 43.62 3.08 0 -3 10 42.49 2.77 0 -3 10 46.48 3.14 0 -3 10 44.59 2.86 0 -3 10 46.80 3.11 0 -3 9 70.84 3.75 0 -3 9 69.42 3.96 0 -3 9 65.69 3.39 0 -3 9 72.89 3.74 0 -3 9 74.08 3.67 0 -3 9 70.05 3.83 0 -3 9 72.51 4.14 0 -3 9 72.57 3.84 0 -3 9 64.92 3.20 0 -3 9 68.36 3.97 0 -3 8 112.66 4.99 0 -3 8 123.30 5.40 0 -3 8 120.61 4.95 0 -3 8 127.63 5.10 0 -3 8 125.08 4.95 0 -3 8 124.24 5.20 0 -3 8 121.28 5.35 0 -3 8 116.47 5.44 0 -3 8 121.31 5.22 0 -3 8 119.76 4.76 0 -3 8 119.06 5.41 0 -3 7 98.73 4.63 0 -3 7 96.40 4.34 0 -3 7 106.41 4.45 0 -3 7 98.99 4.32 0 -3 7 100.54 4.54 0 -3 7 100.01 4.23 0 -3 7 103.16 4.21 0 -3 7 115.36 4.87 0 -3 7 98.46 4.74 0 -3 7 98.71 4.48 0 -3 7 102.70 4.28 0 -3 7 95.65 5.44 0 -3 7 98.39 4.68 0 -3 6 315.86 9.03 0 -3 6 305.49 9.30 0 -3 6 310.93 9.44 0 -3 6 306.03 8.96 0 -3 6 305.09 10.39 0 -3 6 310.74 8.72 0 -3 6 305.81 9.03 0 -3 6 305.57 9.57 0 -3 6 317.95 9.40 0 -3 6 308.22 8.66 0 -3 6 313.28 9.07 0 -3 6 307.97 9.21 0 -3 6 308.62 8.77 0 -3 6 318.61 9.35 0 -3 5 132.11 6.78 0 -3 5 128.04 5.46 0 -3 4 479.55 14.73 0 -3 4 458.51 12.44 0 -3 4 469.95 12.59 0 -3 4 470.87 12.40 0 -3 3 233.61 6.88 0 -3 3 238.93 7.62 0 -3 3 243.01 7.85 0 -3 2 2.22 0.61 0 -3 2 1.94 0.59 0 -3 1 263.45 8.21 0 -3 1 250.69 6.53 0 -3 1 269.69 8.17 0 -3 0 908.94 19.13 0 -3 0 914.65 16.58 0 -3 -1 1735.02 39.18 0 -3 -1 1681.78 39.17 0 -3 -1 1765.91 39.28 0 -3 -1 1755.18 37.69 0 -3 -2 689.05 16.68 0 -3 -2 643.40 17.07 0 -3 -2 674.61 17.01 0 -3 -3 1.09 0.44 0 -3 -3 0.94 0.34 0 -3 -3 1.66 0.52 0 -3 -4 7.71 0.83 0 -3 -4 7.51 1.08 0 -3 -4 8.83 1.15 0 3 5 13.19 1.52 0 -3 -5 13.43 1.41 0 -3 -5 12.13 1.35 0 3 6 473.83 13.47 0 -3 -6 444.19 11.98 0 -3 -6 431.17 11.87 0 3 7 975.27 25.46 0 -3 -8 3.45 0.69 0 -3 -8 3.30 0.76 0 3 8 4.13 1.15 0 3 8 2.45 0.61 0 -3 -9 52.50 3.10 0 -3 -9 56.58 3.24 0 -3 -9 56.77 3.02 0 3 9 61.23 4.80 0 3 9 62.58 4.78 0 3 10 399.83 14.72 0 3 10 380.54 10.80 0 -3 -10 406.17 11.46 0 -3 -10 363.44 10.53 0 3 10 392.58 14.74 0 -3 -10 362.38 10.58 0 -3 -11 270.27 8.50 0 3 11 279.22 12.43 0 3 11 305.30 9.03 0 -3 -11 307.87 9.51 0 3 11 290.77 12.60 0 3 12 126.95 5.04 0 -3 -12 121.20 5.27 0 -3 -12 125.03 5.25 0 3 13 1.80 0.56 0 -3 -13 1.14 0.54 0 -3 -13 1.84 0.58 0 3 14 13.40 1.18 0 -3 -14 14.66 1.39 0 3 14 12.50 1.06 0 -3 -14 13.05 1.21 0 3 15 8.96 0.70 0 -3 -15 12.71 1.03 0 -4 12 28.68 1.66 0 -4 12 26.90 1.45 0 -4 12 25.05 1.51 0 -4 11 28.92 2.00 0 -4 11 27.85 1.95 0 -4 11 30.77 1.97 0 -4 11 32.72 2.17 0 -4 11 31.27 2.09 0 -4 10 102.42 4.63 0 -4 10 98.84 4.52 0 -4 10 99.60 4.46 0 -4 10 98.84 4.36 0 -4 10 99.55 4.12 0 -4 10 97.15 4.51 0 -4 9 67.02 3.38 0 -4 9 65.31 3.77 0 -4 9 70.45 3.94 0 -4 9 63.94 3.69 0 -4 9 65.44 3.61 0 -4 9 67.99 3.70 0 -4 8 79.13 3.82 0 -4 8 78.63 4.08 0 -4 8 72.03 3.59 0 -4 8 71.90 4.10 0 -4 8 74.82 4.25 0 -4 8 73.51 4.04 0 -4 8 71.94 3.78 0 -4 8 77.40 3.79 0 -4 8 80.66 4.15 0 -4 8 74.06 4.03 0 -4 7 11.32 1.39 0 -4 7 10.87 1.50 0 -4 7 8.61 1.33 0 -4 7 11.65 1.32 0 -4 7 11.54 1.34 0 -4 7 9.99 1.46 0 -4 7 11.38 1.62 0 -4 7 8.28 1.28 0 -4 7 12.39 1.44 0 -4 7 8.76 1.36 0 -4 7 11.07 1.38 0 -4 7 10.40 1.25 0 -4 7 10.42 1.48 0 -4 6 333.76 9.84 0 -4 6 296.35 10.08 0 -4 6 328.37 10.17 0 -4 6 320.80 9.33 0 -4 6 316.00 8.86 0 -4 6 313.81 9.99 0 -4 6 329.68 10.38 0 -4 6 319.23 9.48 0 -4 6 320.89 9.89 0 -4 6 325.51 9.14 0 -4 6 314.83 9.56 0 -4 6 320.32 10.02 0 -4 6 316.43 9.65 0 -4 6 327.73 9.43 0 -4 6 322.53 9.20 0 -4 6 312.50 9.05 0 -4 5 20.28 1.81 0 -4 5 21.20 1.83 0 -4 5 22.31 1.77 0 -4 5 20.59 1.88 0 -4 5 18.89 1.52 0 -4 5 21.59 1.71 0 -4 5 19.21 1.84 0 -4 5 23.17 2.05 0 -4 5 22.07 1.80 0 -4 5 21.89 2.02 0 -4 5 22.59 1.71 0 -4 5 21.47 1.82 0 -4 5 22.10 1.72 0 -4 5 22.53 1.99 0 -4 5 23.13 1.96 0 -4 5 20.61 1.81 0 -4 5 25.10 1.90 0 -4 5 21.72 1.83 0 -4 5 19.33 1.63 0 -4 4 16.92 1.54 0 -4 4 14.37 1.48 0 -4 4 15.82 1.17 0 -4 4 16.15 1.59 0 -4 4 15.86 1.46 0 -4 4 15.15 1.81 0 -4 4 16.69 1.56 0 -4 4 17.78 1.63 0 -4 4 14.14 1.46 0 -4 4 15.97 1.49 0 -4 4 16.40 1.52 0 -4 4 14.61 1.42 0 -4 4 16.40 1.65 0 -4 4 15.89 1.57 0 -4 4 17.89 2.63 0 -4 4 15.72 1.54 0 -4 3 622.29 19.02 0 -4 3 620.74 17.32 0 -4 3 603.22 16.90 0 -4 3 628.93 14.69 0 -4 2 2.81 0.80 0 -4 2 1.46 0.67 0 -4 2 2.29 0.49 0 -4 1 863.19 23.04 0 -4 1 854.24 22.04 0 -4 1 858.89 22.11 0 -4 1 836.64 19.44 0 -4 0 297.35 10.20 0 -4 0 286.79 9.75 0 -4 0 271.07 7.24 0 -4 0 277.77 9.56 0 -4 0 279.17 7.54 0 -4 -1 227.28 6.34 0 -4 -1 221.07 8.08 0 -4 -2 5.86 1.08 0 -4 -2 6.07 1.17 0 -4 -2 5.84 0.87 0 -4 -2 6.12 0.76 0 -4 -2 4.61 1.01 0 -4 -3 3.32 0.78 0 4 3 3.47 0.59 0 -4 -3 2.89 0.82 0 -4 -3 3.75 0.90 0 -4 -3 2.94 0.53 0 -4 -4 167.73 6.94 0 -4 -4 165.68 5.16 0 -4 -4 176.91 6.92 0 4 4 167.56 5.79 0 -4 -4 163.65 5.80 0 -4 -5 126.10 5.71 0 -4 -5 121.46 4.12 0 -4 -5 123.68 5.63 0 4 5 127.62 5.29 0 -4 -6 437.55 12.58 0 4 6 414.85 12.65 0 -4 -6 398.71 10.26 0 -4 -6 416.50 12.38 0 -4 -7 240.54 7.54 0 4 7 228.87 9.04 0 -4 -7 225.21 7.40 0 -4 -7 242.85 7.42 0 4 7 231.44 7.00 0 4 7 231.25 6.92 0 -4 -8 0.71 0.43 0 -4 -8 0.30 0.34 0 -4 -8 0.45 0.40 0 4 8 0.93 0.45 0 4 8 0.21 0.35 0 -4 -9 23.97 2.02 0 -4 -9 25.91 2.23 0 -4 -9 22.00 1.94 0 4 9 24.75 1.94 0 -4 -9 25.36 2.13 0 4 9 23.23 2.90 0 4 10 47.36 4.42 0 -4 -10 40.69 2.74 0 -4 -10 41.54 2.95 0 -4 -10 40.96 2.66 0 -4 -10 43.76 2.92 0 4 10 43.17 2.70 0 4 10 41.97 4.14 0 4 11 88.35 6.16 0 4 11 79.53 5.85 0 -4 -11 86.80 4.27 0 -4 -11 80.85 3.91 0 -4 -11 84.79 4.33 0 -4 -11 75.30 3.67 0 4 12 0.87 0.46 0 -4 -12 1.74 0.66 0 -4 -12 1.94 0.69 0 -4 -12 0.95 0.44 0 4 13 41.93 2.41 0 -4 -13 39.11 2.51 0 4 14 61.81 2.61 0 -4 -14 56.86 2.69 0 -4 -15 0.72 0.22 0 -5 11 134.68 4.20 0 -5 11 140.79 4.31 0 -5 10 81.18 3.48 0 -5 10 80.93 3.42 0 -5 10 82.93 3.62 0 -5 9 0.40 0.43 0 -5 9 1.00 0.47 0 -5 9 0.65 0.48 0 -5 9 0.68 0.62 0 -5 9 0.74 0.44 0 -5 9 0.66 0.43 0 -5 8 33.29 2.52 0 -5 8 37.03 2.75 0 -5 8 35.34 2.29 0 -5 8 32.61 2.43 0 -5 8 34.85 2.47 0 -5 8 36.23 2.76 0 -5 7 677.76 17.93 0 -5 7 636.94 17.31 0 -5 7 652.27 16.93 0 -5 7 656.05 17.68 0 -5 7 650.10 16.51 0 -5 7 651.97 17.49 0 -5 7 676.87 17.21 0 -5 7 637.28 17.07 0 -5 6 462.94 12.94 0 -5 6 451.60 13.16 0 -5 6 452.76 12.28 0 -5 6 429.83 12.07 0 -5 6 472.37 13.32 0 -5 6 449.27 11.99 0 -5 6 465.25 12.44 0 -5 6 450.77 13.36 0 -5 6 459.93 12.70 0 -5 6 469.99 13.27 0 -5 6 468.51 12.88 0 -5 6 457.96 12.33 0 -5 6 460.72 13.63 0 -5 6 478.87 13.23 0 -5 5 75.02 3.77 0 -5 5 72.61 3.95 0 -5 5 68.10 3.42 0 -5 5 75.34 3.60 0 -5 5 73.70 3.93 0 -5 5 72.40 3.40 0 -5 5 75.74 3.60 0 -5 5 72.22 4.00 0 -5 5 69.28 3.88 0 -5 5 69.41 3.71 0 -5 5 72.89 3.61 0 -5 5 75.65 3.79 0 -5 5 74.50 3.77 0 -5 5 73.29 4.15 0 -5 5 73.57 3.94 0 -5 4 201.09 6.76 0 -5 4 210.78 7.13 0 -5 4 211.14 7.33 0 -5 4 211.46 6.97 0 -5 4 212.00 7.41 0 -5 4 213.07 10.44 0 -5 4 204.70 6.88 0 -5 4 201.30 6.58 0 -5 4 210.86 7.27 0 -5 4 207.86 6.77 0 -5 4 208.92 6.86 0 -5 4 205.73 7.27 0 -5 4 201.12 6.14 0 -5 4 208.50 7.19 0 -5 4 203.44 7.01 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140.20 5.23 0 -6 5 138.32 5.75 0 -6 5 132.03 5.16 0 -6 5 138.59 5.68 0 -6 5 136.88 5.10 0 -6 5 142.55 6.11 0 -6 5 137.52 5.83 0 -6 5 137.43 5.61 0 -6 5 140.54 5.45 0 -6 5 145.21 5.74 0 -6 5 139.59 5.72 0 -6 5 137.97 5.48 0 -6 5 134.64 5.21 0 -6 5 146.05 5.91 0 -6 5 152.07 6.02 0 -6 4 45.20 2.77 0 -6 4 51.59 3.15 0 -6 4 47.58 2.89 0 -6 4 46.41 3.05 0 -6 4 43.18 2.66 0 -6 4 45.52 2.57 0 -6 4 43.91 2.44 0 -6 4 49.97 3.11 0 -6 4 48.69 2.84 0 -6 4 46.01 3.01 0 -6 4 47.01 3.12 0 -6 4 47.29 2.45 0 -6 4 48.65 3.10 0 -6 4 47.67 2.98 0 -6 4 51.25 3.20 0 -6 4 45.24 2.92 0 -6 4 46.85 2.80 0 -6 4 55.54 3.27 0 -6 3 196.14 6.87 0 -6 3 190.67 6.74 0 -6 3 204.27 7.37 0 -6 3 199.14 7.27 0 -6 3 195.59 6.45 0 -6 3 197.51 6.42 0 -6 3 183.46 6.35 0 -6 3 199.85 7.01 0 -6 3 197.75 6.82 0 -6 3 187.49 6.39 0 -6 3 203.23 7.28 0 -6 3 200.39 6.44 0 -6 3 187.62 7.03 0 -6 3 184.48 6.74 0 -6 3 201.93 7.09 0 -6 3 195.26 6.88 0 -6 3 196.78 6.71 0 -6 3 196.72 6.94 0 -6 2 49.39 2.92 0 -6 2 53.93 2.99 0 -6 2 53.23 3.03 0 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4.36 1 -6 0 104.71 7.14 1 -6 0 104.73 4.69 1 -6 1 0.48 0.45 1 -6 1 0.61 0.45 1 -6 1 1.02 0.41 1 -6 1 0.55 0.57 1 -6 1 1.07 0.52 1 -6 1 0.41 0.37 1 -6 1 0.82 0.50 1 -6 1 1.59 0.58 1 -6 1 0.75 0.49 1 -6 1 0.70 0.43 1 -6 1 0.72 0.38 1 -6 1 1.50 0.61 1 -6 1 0.77 0.52 1 -6 1 1.41 0.57 1 -6 1 1.21 0.57 1 -6 1 0.48 0.43 1 -6 1 0.95 0.48 1 -6 1 0.25 0.39 1 -6 1 0.81 0.53 1 -6 1 0.32 0.54 1 -6 1 1.02 0.52 1 -6 1 1.32 0.55 1 -6 2 55.42 2.87 1 -6 2 57.81 3.39 1 -6 2 61.87 3.56 1 -6 2 57.30 2.93 1 -6 2 58.59 3.17 1 -6 2 54.54 2.94 1 -6 2 57.04 4.87 1 -6 2 60.27 3.41 1 -6 2 58.27 3.50 1 -6 2 54.58 3.16 1 -6 2 58.83 3.26 1 -6 2 60.00 3.34 1 -6 2 58.20 3.42 1 -6 2 58.30 3.43 1 -6 2 59.87 3.36 1 -6 2 54.66 2.76 1 -6 2 57.08 3.27 1 -6 2 59.34 3.35 1 -6 2 58.20 3.20 1 -6 2 52.71 5.27 1 -6 2 55.06 3.54 1 -6 2 61.06 3.56 1 -6 2 59.29 3.27 1 -6 3 58.34 3.05 1 -6 3 57.38 3.37 1 -6 3 54.14 3.00 1 -6 3 58.61 3.41 1 -6 3 56.55 3.05 1 -6 3 54.75 4.62 1 -6 3 56.13 3.33 1 -6 3 56.84 3.10 1 -6 3 58.18 3.17 1 -6 3 59.68 3.48 1 -6 3 61.51 3.57 1 -6 3 57.90 3.25 1 -6 3 57.30 3.29 1 -6 3 60.48 3.24 1 -6 3 60.39 3.33 1 -6 3 61.17 3.52 1 -6 3 56.85 3.44 1 -6 3 58.48 3.09 1 -6 3 65.50 3.75 1 -6 3 51.38 5.30 1 -6 3 59.90 3.60 1 -6 4 414.79 11.53 1 -6 4 431.04 11.99 1 -6 4 405.01 11.39 1 -6 4 410.15 11.07 1 -6 4 429.28 11.95 1 -6 4 404.14 11.00 1 -6 4 404.90 12.02 1 -6 4 443.83 12.38 1 -6 4 416.69 11.70 1 -6 4 427.53 11.82 1 -6 4 425.00 12.20 1 -6 4 412.50 12.26 1 -6 4 415.11 11.78 1 -6 4 406.75 11.84 1 -6 4 416.39 12.03 1 -6 4 400.37 11.65 1 -6 4 401.07 11.31 1 -6 4 407.98 12.37 1 -6 4 420.36 12.30 1 -6 5 100.34 4.59 1 -6 5 92.44 4.19 1 -6 5 99.93 4.26 1 -6 5 98.83 4.64 1 -6 5 99.57 4.77 1 -6 5 94.44 4.32 1 -6 5 106.70 4.71 1 -6 5 96.28 4.38 1 -6 5 95.71 4.27 1 -6 5 91.95 4.37 1 -6 5 95.79 4.36 1 -6 5 102.65 4.61 1 -6 5 88.88 3.81 1 -6 5 92.75 4.11 1 -6 5 100.96 4.38 1 -6 6 5.65 1.07 1 -6 6 3.57 0.78 1 -6 6 6.36 1.08 1 -6 6 3.47 0.75 1 -6 6 4.87 1.04 1 -6 6 4.78 0.98 1 -6 6 4.83 0.83 1 -6 6 4.34 0.79 1 -6 6 4.86 0.96 1 -6 6 4.13 0.80 1 -6 6 4.84 0.90 1 -6 6 5.64 0.93 1 -6 7 15.30 1.63 1 -6 7 13.68 1.36 1 -6 7 15.42 1.39 1 -6 7 13.99 1.43 1 -6 7 14.40 1.53 1 -6 7 14.42 1.48 1 -6 7 16.49 1.59 1 -6 8 25.64 1.85 1 -6 8 23.45 1.60 1 -6 9 3.11 0.58 1 -6 10 60.23 2.21 -1 5 14 3.02 0.42 1 -5 -14 2.92 0.43 1 -5 -13 30.76 1.86 -1 5 13 32.32 1.79 1 -5 -13 29.77 1.84 1 -5 -12 10.59 1.27 -1 5 12 9.63 1.01 -1 5 12 10.54 1.14 1 -5 -12 11.14 1.28 1 -5 -11 38.52 2.69 -1 5 11 39.95 2.44 1 -5 -11 40.56 2.68 1 -5 -10 72.96 3.28 1 -5 -10 80.80 4.25 -1 5 10 76.72 3.67 1 -5 -10 79.00 4.08 1 -5 -9 69.82 3.44 1 -5 -9 75.61 4.17 -1 5 9 75.93 3.62 1 -5 -9 72.11 3.98 1 -5 -8 127.10 5.12 1 -5 -8 133.16 5.62 1 -5 -8 133.05 5.87 -1 5 8 130.59 5.03 1 -5 -8 133.40 5.67 1 -5 -7 455.03 12.26 1 -5 -7 454.80 11.77 1 -5 -7 450.85 13.07 -1 5 7 459.82 12.16 1 -5 -7 478.46 13.12 1 -5 -6 23.36 2.16 1 -5 -6 24.41 1.81 1 -5 -6 22.57 1.87 1 -5 -6 22.36 1.66 1 -5 -6 21.58 2.60 -1 5 6 22.27 1.67 1 -5 -6 30.13 2.29 1 -5 -6 24.80 2.16 1 -5 -5 3.71 1.16 1 -5 -5 4.18 0.74 1 -5 -5 4.36 0.87 1 -5 -5 3.62 0.90 1 -5 -5 6.01 0.94 1 -5 -5 6.42 0.94 -1 5 5 4.45 0.68 1 -5 -5 6.23 1.03 1 -5 -4 5.06 1.18 1 -5 -4 6.29 1.08 1 -5 -4 6.53 0.96 1 -5 -4 6.31 1.49 1 -5 -4 7.97 1.14 1 -5 -4 5.80 0.93 1 -5 -4 5.57 1.02 1 -5 -4 7.53 1.07 1 -5 -4 6.57 0.92 1 -5 -3 305.99 11.91 1 -5 -3 298.50 8.55 1 -5 -3 295.09 8.44 1 -5 -3 276.77 9.01 1 -5 -3 286.75 8.25 1 -5 -3 297.61 8.71 1 -5 -3 291.06 8.39 1 -5 -3 298.04 8.86 1 -5 -3 291.62 8.95 1 -5 -3 283.16 10.92 1 -5 -2 156.37 7.94 1 -5 -2 147.18 5.32 1 -5 -2 144.81 5.58 1 -5 -2 152.35 5.23 1 -5 -2 155.80 5.18 1 -5 -2 141.69 5.42 1 -5 -2 149.03 5.39 1 -5 -2 159.51 5.37 1 -5 -2 157.14 7.85 1 -5 -2 160.91 5.69 1 -5 -2 148.84 5.68 1 -5 -2 153.14 7.52 1 -5 -1 2.89 1.11 1 -5 -1 2.73 0.64 1 -5 -1 2.61 0.61 1 -5 -1 1.90 0.61 1 -5 -1 1.91 0.58 1 -5 -1 2.04 0.59 1 -5 -1 3.02 0.66 1 -5 -1 2.01 0.50 1 -5 -1 1.62 0.60 1 -5 -1 1.72 0.57 1 -5 0 31.91 2.31 1 -5 0 29.60 2.14 1 -5 0 26.44 1.93 1 -5 0 26.74 2.12 1 -5 0 28.31 2.17 1 -5 0 30.53 3.47 1 -5 0 32.23 2.14 1 -5 0 32.17 2.12 1 -5 0 30.36 2.12 1 -5 0 33.38 2.16 1 -5 0 32.00 2.12 1 -5 0 28.23 2.01 1 -5 0 32.61 2.12 1 -5 0 27.74 3.15 1 -5 0 32.88 2.19 1 -5 0 29.31 1.87 1 -5 0 34.17 2.36 1 -5 0 32.46 2.10 1 -5 0 32.06 3.22 1 -5 1 127.81 5.05 1 -5 1 110.04 4.47 1 -5 1 116.12 4.90 1 -5 1 117.62 4.82 1 -5 1 121.21 5.07 1 -5 1 119.73 7.41 1 -5 1 112.74 4.56 1 -5 1 118.89 4.80 1 -5 1 117.76 4.57 1 -5 1 109.51 4.13 1 -5 1 118.30 4.45 1 -5 1 115.05 4.67 1 -5 1 114.33 4.75 1 -5 1 119.71 4.69 1 -5 1 109.70 4.76 1 -5 1 121.03 4.71 1 -5 1 120.45 4.65 1 -5 1 118.63 6.73 1 -5 1 119.04 4.37 1 -5 1 110.71 4.46 1 -5 2 60.19 4.64 1 -5 2 64.74 3.43 1 -5 2 61.21 3.20 1 -5 2 62.88 3.31 1 -5 2 60.44 3.15 1 -5 2 63.99 3.44 1 -5 2 62.33 3.31 1 -5 2 58.05 2.92 1 -5 2 61.41 3.11 1 -5 2 62.22 3.45 1 -5 2 59.57 3.45 1 -5 2 68.44 5.56 1 -5 2 58.48 3.36 1 -5 2 60.46 2.98 1 -5 2 57.11 2.72 1 -5 2 63.08 3.26 1 -5 2 62.97 3.19 1 -5 2 59.96 2.92 1 -5 2 64.32 3.40 1 -5 2 64.91 3.15 1 -5 2 56.58 2.92 1 -5 2 59.00 3.16 1 -5 2 55.81 3.19 1 -5 2 60.97 3.17 1 -5 3 237.38 8.10 1 -5 3 241.46 7.71 1 -5 3 253.25 7.95 1 -5 3 254.24 8.41 1 -5 3 252.70 8.53 1 -5 3 256.01 8.31 1 -5 3 251.20 7.98 1 -5 3 250.06 7.96 1 -5 3 254.99 7.84 1 -5 3 256.63 7.74 1 -5 3 257.85 8.23 1 -5 3 268.84 8.62 1 -5 3 244.24 7.74 1 -5 3 255.61 8.16 1 -5 3 262.21 8.36 1 -5 3 258.28 8.10 1 -5 3 261.82 8.36 1 -5 3 249.44 10.28 1 -5 3 253.95 7.82 1 -5 3 259.46 7.72 1 -5 4 2.56 0.64 1 -5 4 2.88 0.77 1 -5 4 1.29 0.57 1 -5 4 0.64 0.76 1 -5 4 2.13 0.65 1 -5 4 2.04 0.67 1 -5 4 1.68 0.59 1 -5 4 1.73 0.64 1 -5 4 2.22 0.65 1 -5 4 1.95 0.55 1 -5 4 2.01 0.63 1 -5 4 2.76 0.79 1 -5 4 3.14 0.99 1 -5 4 2.27 0.57 1 -5 4 2.04 0.64 1 -5 4 1.92 0.59 1 -5 4 1.14 0.52 1 -5 4 2.86 0.87 1 -5 4 1.64 0.55 1 -5 4 1.71 0.50 1 -5 5 16.07 1.73 1 -5 5 14.99 2.77 1 -5 5 18.19 1.90 1 -5 5 15.08 1.67 1 -5 5 13.57 1.67 1 -5 5 16.34 1.68 1 -5 5 14.34 1.56 1 -5 5 14.78 1.53 1 -5 5 16.51 1.69 1 -5 5 17.06 1.73 1 -5 5 14.95 1.43 1 -5 5 12.57 1.56 1 -5 5 14.56 1.58 1 -5 5 14.17 1.63 1 -5 5 14.55 1.64 1 -5 5 13.22 1.46 1 -5 5 13.13 1.48 1 -5 6 217.62 7.50 1 -5 6 226.06 7.35 1 -5 6 226.79 7.80 1 -5 6 237.39 8.17 1 -5 6 213.13 7.55 1 -5 6 226.63 8.22 1 -5 6 214.19 7.06 1 -5 6 238.63 8.40 1 -5 6 223.53 7.82 1 -5 6 222.81 7.53 1 -5 6 228.58 7.54 1 -5 6 222.83 7.78 1 -5 6 220.08 7.86 1 -5 6 222.87 7.73 1 -5 6 235.17 7.81 1 -5 6 219.66 7.34 1 -5 6 220.97 7.12 1 -5 7 1.13 0.45 1 -5 7 1.04 0.49 1 -5 7 2.85 0.72 1 -5 7 1.23 0.58 1 -5 7 3.37 0.78 1 -5 7 1.45 0.61 1 -5 7 1.77 0.76 1 -5 7 3.08 0.76 1 -5 7 2.44 0.76 1 -5 8 11.50 1.41 1 -5 8 12.77 1.54 1 -5 8 12.85 1.51 1 -5 8 12.24 1.35 1 -5 9 32.07 2.07 1 -5 9 29.83 2.22 1 -5 9 31.56 2.11 1 -5 10 76.76 3.52 1 -5 10 75.93 3.08 1 -5 10 81.29 3.43 1 -5 11 32.23 1.74 1 -5 11 27.86 1.57 1 -5 11 29.53 1.62 1 -4 -14 11.50 1.03 -1 4 14 10.57 0.89 1 -4 -14 9.66 0.80 1 -4 -13 0.45 0.34 1 -4 -12 26.04 1.89 1 -4 -12 26.50 2.09 -1 4 11 97.95 4.30 1 -4 -11 95.00 4.54 1 -4 -11 94.55 4.18 -1 4 11 95.88 4.02 -1 4 10 186.34 9.49 1 -4 -10 202.53 7.44 -1 4 10 207.40 7.06 1 -4 -10 209.39 7.54 -1 4 10 202.67 9.91 1 -4 -9 16.23 1.69 1 -4 -9 14.81 1.53 1 -4 -9 15.23 1.75 -1 4 9 15.03 1.56 -1 4 9 17.71 2.60 1 -4 -9 18.53 1.93 1 -4 -8 206.61 7.21 -1 4 8 215.78 9.58 1 -4 -8 197.28 6.89 -1 4 8 211.22 6.90 1 -4 -8 218.68 7.58 1 -4 -8 214.74 7.62 1 -4 -7 24.96 2.04 1 -4 -7 20.67 1.62 -1 4 7 21.41 2.58 1 -4 -7 20.49 1.80 -1 4 7 21.60 1.69 1 -4 -7 24.26 2.05 1 -4 -7 22.52 2.03 1 -4 -6 1.57 0.53 1 -4 -6 1.75 0.56 1 -4 -6 1.82 0.47 1 -4 -6 2.02 0.63 -1 4 6 1.78 0.46 1 -4 -6 1.50 0.47 1 -4 -6 1.92 0.73 1 -4 -6 0.66 0.39 -1 4 6 1.90 0.74 1 -4 -5 1.28 0.48 1 -4 -5 3.03 0.89 1 -4 -5 2.12 0.65 1 -4 -5 2.74 0.56 1 -4 -4 26.35 2.66 1 -4 -4 25.72 1.71 1 -4 -4 20.15 2.14 1 -4 -3 51.40 3.73 1 -4 -3 47.62 3.57 1 -4 -3 46.47 2.42 1 -4 -3 48.54 3.47 1 -4 -2 6.15 1.30 1 -4 -2 4.55 1.16 1 -4 -2 7.04 1.33 1 -4 -2 6.27 0.84 1 -4 -1 182.03 7.88 1 -4 -1 180.47 8.00 1 -4 -1 184.46 5.80 1 -4 -1 172.46 5.96 1 -4 -1 188.67 7.58 1 -4 0 189.38 8.42 1 -4 0 178.65 5.46 1 -4 0 192.98 5.91 1 -4 1 974.58 25.09 1 -4 1 945.22 25.92 1 -4 1 920.61 21.87 1 -4 1 981.04 24.78 1 -4 2 306.52 8.55 1 -4 2 317.58 11.04 1 -4 3 3.56 0.74 1 -4 3 2.95 1.16 1 -4 3 2.96 0.66 1 -4 3 3.93 0.76 1 -4 3 3.32 0.71 1 -4 3 3.96 0.65 1 -4 3 5.57 1.22 1 -4 3 3.23 0.78 1 -4 4 348.95 11.54 1 -4 4 331.28 10.06 1 -4 4 360.90 13.77 1 -4 4 354.92 10.14 1 -4 4 352.33 10.34 1 -4 4 335.44 9.61 1 -4 4 349.08 9.86 1 -4 4 339.38 10.08 1 -4 4 354.90 9.99 1 -4 4 341.74 9.84 1 -4 4 356.39 9.79 1 -4 4 369.35 9.94 1 -4 4 345.75 10.03 1 -4 4 359.11 10.30 1 -4 4 353.30 9.27 1 -4 5 3.98 0.76 1 -4 5 1.93 0.58 1 -4 5 4.50 0.86 1 -4 5 2.36 0.75 1 -4 5 3.88 0.76 1 -4 5 6.42 1.08 1 -4 5 1.59 0.56 1 -4 5 2.04 0.63 1 -4 5 3.61 0.66 1 -4 5 2.74 0.61 1 -4 5 2.05 0.54 1 -4 5 1.95 1.04 1 -4 5 1.58 0.55 1 -4 5 3.78 0.83 1 -4 5 2.14 0.64 1 -4 5 2.79 0.70 1 -4 5 4.00 0.73 1 -4 5 4.52 0.99 1 -4 5 2.17 0.68 1 -4 5 3.56 0.75 1 -4 6 2.96 0.73 1 -4 6 3.54 0.74 1 -4 6 2.58 0.67 1 -4 6 4.07 0.87 1 -4 6 4.72 0.96 1 -4 6 3.18 1.33 1 -4 6 3.55 0.91 1 -4 6 3.37 0.88 1 -4 6 4.17 0.85 1 -4 6 3.28 0.83 1 -4 6 4.15 0.80 1 -4 6 7.41 1.19 1 -4 6 4.11 0.82 1 -4 6 4.24 0.88 1 -4 6 3.10 0.67 1 -4 6 2.81 0.71 1 -4 6 3.08 0.86 1 -4 7 6.73 1.19 1 -4 7 7.43 1.12 1 -4 7 6.93 1.19 1 -4 7 6.56 1.10 1 -4 7 7.82 1.12 1 -4 7 5.17 0.95 1 -4 7 6.33 1.17 1 -4 7 8.26 1.19 1 -4 7 6.86 1.25 1 -4 7 7.35 1.15 1 -4 7 5.81 1.02 1 -4 8 8.10 1.23 1 -4 8 7.61 1.13 1 -4 8 8.08 1.30 1 -4 8 9.27 1.23 1 -4 8 7.04 1.25 1 -4 8 8.82 1.23 1 -4 8 6.83 1.06 1 -4 8 6.28 1.12 1 -4 8 7.57 1.21 1 -4 9 14.91 1.69 1 -4 9 16.07 1.59 1 -4 9 14.57 1.70 1 -4 9 13.71 1.72 1 -4 9 14.64 1.60 1 -4 9 18.25 1.72 1 -4 9 13.90 1.49 1 -4 9 15.34 1.76 1 -4 9 17.34 1.83 1 -4 9 16.51 1.60 1 -4 10 81.94 3.47 1 -4 10 81.66 4.04 1 -4 10 79.68 3.64 1 -4 10 88.39 4.07 1 -4 10 77.64 4.06 1 -4 11 2.71 0.77 1 -4 11 4.72 0.84 1 -4 11 4.32 0.80 1 -4 11 5.89 0.94 1 -4 12 0.88 0.36 1 -4 12 1.51 0.42 1 -4 12 0.99 0.34 1 -3 -14 15.70 1.03 1 -3 -14 21.10 1.48 -1 3 14 19.80 1.29 1 -3 -14 19.68 1.33 1 -3 -13 5.12 0.79 1 -3 -13 6.30 0.98 -1 3 13 5.31 0.83 1 -3 -13 5.62 0.88 1 -3 -12 9.52 1.24 -1 3 12 10.16 1.26 1 -3 -12 8.48 1.26 -1 3 11 191.42 9.68 -1 3 11 190.95 6.24 1 -3 -11 179.07 6.88 -1 3 11 171.31 9.29 1 -3 -11 193.74 6.88 -1 3 10 118.62 7.35 1 -3 -10 116.10 5.10 1 -3 -10 125.43 5.33 -1 3 10 115.76 7.31 1 -3 -10 107.54 4.56 -1 3 9 309.70 12.64 1 -3 -9 320.53 9.81 -1 3 9 315.87 9.36 -1 3 9 287.52 12.16 1 -3 -9 303.63 9.21 -1 3 8 423.44 11.26 1 -3 -8 415.89 11.72 -1 3 8 411.44 14.54 1 -3 -8 389.01 11.19 1 -3 -7 28.86 2.12 -1 3 7 28.57 1.91 1 -3 -7 29.34 2.07 1 -3 -7 28.87 2.17 -1 3 7 34.55 3.23 1 -3 -6 3.28 0.74 1 -3 -5 989.42 22.43 1 -3 -5 1045.56 24.80 1 -3 -4 1267.50 28.37 1 -3 -4 1343.63 30.99 1 -3 -3 1300.71 30.12 1 -3 -3 1240.04 27.87 1 -3 -3 1296.58 30.34 1 -3 -2 668.12 15.93 1 -3 -2 702.44 17.91 1 -3 -2 690.02 15.97 1 -3 -2 714.67 18.36 1 -3 -2 719.02 18.43 1 -3 -1 475.75 11.87 1 -3 -1 506.42 11.96 1 -3 -1 494.36 13.78 1 -3 -1 516.04 14.45 1 -3 -1 506.77 14.20 1 -3 0 53.03 2.50 1 -3 0 59.89 3.76 1 -3 1 67.52 3.69 1 -3 1 61.28 2.51 1 -3 1 63.35 2.55 1 -3 1 60.22 2.49 1 -3 1 62.79 3.66 1 -3 2 2110.43 47.27 1 -3 2 2135.58 47.45 1 -3 2 2060.23 44.82 1 -3 3 486.29 13.76 1 -3 3 505.63 15.50 1 -3 3 480.37 11.66 1 -3 4 0.71 0.39 1 -3 4 -0.20 0.48 1 -3 4 0.67 0.26 1 -3 5 27.78 3.09 1 -3 5 22.13 1.92 1 -3 6 692.36 17.34 1 -3 6 677.35 16.97 1 -3 6 706.26 17.19 1 -3 6 729.77 21.18 1 -3 6 700.10 17.72 1 -3 6 658.90 17.00 1 -3 6 689.03 17.03 1 -3 6 703.86 17.05 1 -3 6 680.38 17.08 1 -3 6 711.53 17.30 1 -3 6 676.63 17.02 1 -3 6 681.24 17.62 1 -3 6 684.78 16.77 1 -3 6 679.10 17.19 1 -3 7 313.51 9.44 1 -3 7 311.66 9.10 1 -3 7 305.86 9.21 1 -3 7 291.19 9.27 1 -3 7 303.83 9.31 1 -3 7 301.99 9.63 1 -3 7 303.55 9.21 1 -3 7 308.78 9.32 1 -3 7 307.26 9.70 1 -3 7 318.64 9.26 1 -3 7 310.99 9.50 1 -3 8 54.93 3.29 1 -3 8 54.74 3.20 1 -3 8 58.97 3.24 1 -3 8 51.24 3.46 1 -3 8 53.37 3.33 1 -3 8 54.02 3.36 1 -3 8 61.93 3.29 1 -3 8 53.76 3.13 1 -3 8 62.42 3.35 1 -3 8 53.82 3.28 1 -3 9 22.54 2.04 1 -3 9 21.97 2.03 1 -3 9 21.41 1.86 1 -3 9 21.32 1.97 1 -3 9 19.92 1.82 1 -3 9 22.41 2.24 1 -3 9 23.53 2.16 1 -3 9 20.48 2.04 1 -3 9 20.92 2.01 1 -3 10 28.87 1.99 1 -3 10 28.60 2.51 1 -3 10 30.73 2.40 1 -3 10 31.21 2.40 1 -3 10 30.01 2.37 1 -3 10 28.03 2.23 1 -3 10 30.31 2.35 1 -3 11 59.99 3.51 1 -3 11 55.64 3.12 1 -3 11 56.78 3.19 1 -3 11 58.62 3.14 1 -3 11 59.57 3.11 1 -3 11 59.27 3.19 1 -3 12 5.65 0.85 1 -3 12 5.58 0.84 1 -3 12 4.56 0.84 1 -3 13 4.12 0.63 1 -3 13 4.04 0.62 1 -3 13 4.02 0.55 1 -2 -15 2.65 0.39 -1 2 15 2.60 0.37 -1 2 14 17.24 1.14 1 -2 -14 19.94 1.42 1 -2 -14 21.05 1.48 1 -2 -13 65.03 2.90 -1 2 13 74.71 3.27 1 -2 -13 66.01 3.31 -1 2 12 32.31 2.24 1 -2 -12 33.61 2.46 -1 2 12 29.78 1.96 1 -2 -12 30.96 2.17 -1 2 11 1.28 0.54 1 -2 -11 2.66 0.70 1 -2 -11 1.43 0.60 -1 2 11 1.51 0.45 -1 2 11 1.47 0.92 1 -2 -10 59.87 3.35 -1 2 10 60.04 5.18 -1 2 10 62.57 3.08 1 -2 -10 61.79 3.55 -1 2 10 59.78 3.32 -1 2 9 983.54 28.29 1 -2 -9 974.35 23.81 -1 2 9 984.42 23.68 1 -2 -9 1026.72 24.18 -1 2 8 18.17 2.48 1 -2 -8 19.17 1.69 1 -2 -8 18.69 1.72 1 -2 -7 85.45 3.73 -1 2 7 89.45 5.30 -1 2 6 434.26 10.71 1 -2 -5 125.79 4.63 1 -2 -4 122.07 4.67 1 -2 -3 352.80 9.90 1 -2 -2 47.01 2.63 1 -2 -2 45.33 2.52 1 -2 -1 5.78 0.90 1 -2 -1 6.34 0.90 1 -2 0 32.90 1.78 1 -2 1 1.03 0.43 1 -2 1 2.12 0.54 1 -2 1 1.44 0.37 1 -2 2 79.86 3.60 1 -2 2 86.74 4.32 1 -2 3 88.08 3.74 1 -2 3 89.92 4.55 1 -2 3 83.06 3.64 1 -2 4 2301.51 50.27 1 -2 4 2370.30 52.67 1 -2 4 2260.27 50.95 1 -2 5 211.81 6.47 1 -2 5 227.11 7.91 1 -2 5 221.47 8.61 1 -2 6 3.79 0.97 1 -2 6 3.41 1.04 1 -2 7 273.97 8.29 1 -2 7 280.33 8.22 1 -2 7 277.83 8.45 1 -2 7 276.46 8.05 1 -2 7 271.64 8.24 1 -2 7 278.57 10.48 1 -2 7 278.29 10.64 1 -2 8 102.27 6.13 1 -2 8 94.93 4.08 1 -2 8 104.55 4.31 1 -2 8 93.32 4.15 1 -2 8 94.44 4.62 1 -2 8 101.34 4.39 1 -2 8 96.08 4.33 1 -2 9 85.32 4.18 1 -2 9 82.90 3.73 1 -2 9 76.22 5.53 1 -2 9 82.22 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7.06 -1 -8 3 214.01 6.98 -1 -8 2 46.38 2.77 -1 -8 2 40.96 2.39 -1 -8 2 43.72 2.67 -1 -8 2 46.31 2.86 -1 -8 2 46.87 2.77 -1 -8 1 2.20 0.72 -1 -8 1 1.09 0.62 -1 -8 1 1.92 0.67 -1 -8 1 2.35 0.76 -1 -8 1 0.54 0.44 -1 -8 1 0.68 0.47 -1 -8 1 1.05 0.44 -1 -8 1 0.35 0.43 -1 -8 1 0.66 0.47 -1 -8 1 1.39 0.55 -1 -8 1 0.88 0.48 -1 -8 0 47.95 2.81 -1 -8 0 45.63 2.77 -1 -8 0 51.65 3.15 -1 -8 0 47.50 2.89 -1 -8 0 52.75 3.28 -1 -8 0 49.19 3.02 -1 -8 0 47.65 3.00 -1 -8 0 46.30 2.89 -1 -8 0 52.23 3.25 -1 -8 0 48.67 2.85 -1 -8 -1 0.85 0.47 -1 -8 -1 0.21 0.47 -1 -8 -1 0.62 0.58 -1 -8 -1 1.63 0.65 -1 -8 -1 1.50 0.57 -1 -8 -1 1.42 0.61 -1 -8 -1 0.87 0.55 -1 -8 -1 1.23 0.50 -1 -8 -1 1.39 0.61 -1 -8 -1 0.89 0.45 -1 -8 -1 0.73 0.46 -1 -8 -2 12.50 1.60 -1 -8 -2 14.32 1.54 -1 -8 -2 15.45 1.72 -1 -8 -2 13.04 2.41 -1 -8 -2 13.77 1.52 -1 -8 -2 13.80 1.45 -1 -8 -2 11.34 1.38 -1 -8 -2 14.36 1.52 -1 -8 -2 11.64 1.43 -1 -8 -2 12.06 1.53 -1 -8 -2 12.44 1.47 -1 -8 -3 46.18 2.91 -1 -8 -3 45.32 2.77 -1 -8 -3 43.17 2.67 -1 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18.39 1.60 -1 -9 -5 18.66 1.57 -1 -9 -5 20.33 1.62 -1 -9 -5 19.30 1.74 -1 -9 -6 1.50 0.42 -1 -9 -6 2.20 0.54 -1 -9 -6 1.35 0.47 -1 -9 -6 1.45 0.56 -1 -9 -6 1.02 0.49 -1 -9 -6 1.18 0.50 -1 -9 -7 38.98 2.05 -1 -9 -7 38.15 2.31 -1 -9 -7 41.01 2.44 -1 -9 -7 43.20 2.34 -1 -9 -7 38.25 2.01 -1 -9 -8 4.95 0.73 -1 -9 -8 3.46 0.50 -1 -9 -8 3.92 0.76 -1 -9 -9 34.04 2.00 -1 -9 -9 38.14 2.02 -1 -9 -9 35.41 1.78 -1 -9 -9 35.84 2.05 -1 -9 -10 0.33 0.24 -1 -9 -10 0.30 0.18 -1 -9 -11 14.12 0.90 -1 -10 0 73.29 2.50 -1 -10 -1 0.78 0.29 -1 -10 -2 46.02 1.94 -1 -10 -2 43.60 1.89 -1 -10 -3 79.38 3.04 -1 -10 -3 74.83 2.65 -1 -10 -3 81.81 2.93 -1 -10 -4 11.59 0.97 -1 -10 -4 12.13 1.06 -1 -10 -4 10.63 0.77 -1 -10 -4 12.30 1.04 -1 -10 -4 12.66 0.98 -1 -10 -5 0.16 0.26 -1 -10 -5 0.34 0.24 -1 -10 -6 31.10 1.64 -1 -10 -6 28.60 1.37 -1 -10 -6 32.79 1.61 -1 -10 -7 22.74 1.26 -1 -10 -7 21.22 1.20 -1 -10 -8 6.20 0.54 2 -9 -5 22.54 1.22 2 -9 -4 11.57 0.91 2 -9 -4 11.96 0.77 2 -9 -4 9.30 0.66 2 -9 -3 31.30 1.64 2 -9 -3 32.46 1.48 2 -9 -3 31.05 1.43 2 -9 -2 16.24 1.14 2 -9 -2 17.25 1.05 2 -9 -2 16.18 1.04 2 -9 -1 19.77 1.25 2 -9 -1 21.21 1.22 2 -9 -1 19.39 1.11 2 -9 -1 20.22 1.17 2 -9 0 24.36 1.30 2 -9 0 24.70 1.25 2 -9 0 23.34 1.25 2 -9 0 21.77 1.10 2 -9 1 3.94 0.46 2 -8 -9 5.47 0.57 2 -8 -8 3.86 0.52 2 -8 -8 2.79 0.49 -2 8 8 2.67 0.38 2 -8 -7 3.08 0.57 -2 8 7 3.46 0.48 2 -8 -7 3.71 0.64 2 -8 -6 0.78 0.30 2 -8 -6 1.00 0.43 2 -8 -6 0.66 0.28 -2 8 6 0.57 0.25 2 -8 -6 0.54 0.25 2 -8 -6 0.23 0.34 2 -8 -5 193.73 6.18 2 -8 -5 197.54 5.79 2 -8 -5 179.36 5.62 2 -8 -5 187.38 5.53 2 -8 -5 183.55 6.35 2 -8 -5 177.03 5.51 2 -8 -5 189.02 6.23 2 -8 -4 6.09 0.95 2 -8 -4 4.97 0.80 2 -8 -4 5.12 0.81 2 -8 -4 5.28 0.70 2 -8 -4 5.78 0.81 2 -8 -4 5.99 1.01 2 -8 -4 3.64 0.69 2 -8 -4 5.80 0.95 2 -8 -3 3.30 0.72 2 -8 -3 1.49 0.49 2 -8 -3 2.53 0.60 2 -8 -3 1.84 0.47 2 -8 -3 2.05 0.69 2 -8 -3 2.45 0.62 2 -8 -3 3.44 0.77 2 -8 -2 96.43 3.93 2 -8 -2 79.18 3.78 2 -8 -2 89.95 3.85 2 -8 -2 86.15 3.50 2 -8 -2 89.90 3.79 2 -8 -2 90.71 3.68 2 -8 -2 89.08 3.94 2 -8 -2 86.74 4.09 2 -8 -1 26.90 1.94 2 -8 -1 27.40 1.80 2 -8 -1 25.17 1.94 2 -8 -1 26.73 1.94 2 -8 -1 30.53 2.24 2 -8 0 1.38 0.46 2 -8 0 1.15 0.42 2 -8 0 0.92 0.47 2 -8 0 0.51 0.40 2 -8 0 0.79 0.40 2 -8 0 0.75 0.46 2 -8 1 76.46 3.30 2 -8 1 90.46 3.67 2 -8 1 82.04 3.27 2 -8 1 80.81 3.47 2 -8 1 80.73 3.63 2 -8 1 78.00 3.28 2 -8 2 69.54 3.05 2 -8 2 64.15 2.89 2 -8 2 66.52 3.07 2 -8 3 36.37 2.00 2 -8 3 36.05 1.96 2 -8 3 35.28 1.91 2 -8 3 33.28 1.82 2 -8 4 8.78 0.81 2 -7 -11 16.90 0.99 -2 7 11 19.53 0.97 -2 7 10 23.22 1.34 -2 7 10 22.63 1.27 2 -7 -10 21.60 1.45 2 -7 -9 30.63 1.72 -2 7 9 37.37 1.91 2 -7 -8 57.82 2.74 2 -7 -8 58.64 2.85 -2 7 8 62.14 2.75 2 -7 -7 0.30 0.25 2 -7 -7 1.03 0.47 2 -7 -7 0.28 0.35 2 -7 -7 0.06 0.24 2 -7 -6 14.09 1.33 2 -7 -6 13.08 1.59 2 -7 -6 15.02 1.54 2 -7 -6 15.90 1.32 2 -7 -6 15.75 1.62 2 -7 -6 13.80 1.32 2 -7 -5 57.84 3.11 2 -7 -5 61.74 3.69 2 -7 -5 63.17 3.43 2 -7 -5 61.34 3.49 2 -7 -5 62.04 3.18 2 -7 -5 65.41 3.09 2 -7 -4 180.18 6.87 2 -7 -4 192.81 6.78 2 -7 -4 188.91 6.94 2 -7 -4 192.76 6.53 2 -7 -4 180.86 6.48 2 -7 -4 177.95 6.98 2 -7 -4 170.78 6.07 2 -7 -4 168.68 6.04 2 -7 -3 24.11 2.03 2 -7 -3 24.83 2.23 2 -7 -3 26.47 2.19 2 -7 -3 20.96 2.16 2 -7 -3 21.90 1.85 2 -7 -3 22.29 1.88 2 -7 -3 23.41 2.07 2 -7 -3 25.82 2.29 2 -7 -2 68.43 3.89 2 -7 -2 65.47 3.67 2 -7 -2 70.59 3.75 2 -7 -2 65.17 3.56 2 -7 -2 64.65 3.62 2 -7 -2 67.34 3.43 2 -7 -2 67.13 3.99 2 -7 -2 68.93 3.95 2 -7 -2 63.16 3.39 2 -7 -1 10.71 1.16 2 -7 -1 6.57 1.07 2 -7 -1 9.74 1.46 2 -7 -1 9.21 1.33 2 -7 -1 9.09 1.37 2 -7 -1 9.07 1.30 2 -7 -1 8.69 1.35 2 -7 -1 9.68 1.42 2 -7 -1 9.22 1.33 2 -7 0 19.66 1.98 2 -7 0 19.15 1.64 2 -7 0 24.52 2.17 2 -7 0 19.55 1.89 2 -7 0 18.93 1.88 2 -7 0 21.16 1.82 2 -7 0 20.30 2.07 2 -7 0 15.87 1.78 2 -7 0 19.48 1.84 2 -7 1 0.92 0.53 2 -7 1 0.73 0.45 2 -7 1 0.43 0.48 2 -7 1 0.54 0.44 2 -7 1 0.71 0.51 2 -7 1 0.69 0.54 2 -7 1 0.96 0.49 2 -7 1 0.76 0.56 2 -7 1 1.28 0.58 2 -7 2 95.57 4.44 2 -7 2 87.12 3.95 2 -7 2 89.77 4.03 2 -7 2 81.90 3.74 2 -7 2 87.52 3.94 2 -7 2 83.79 4.15 2 -7 2 84.30 4.15 2 -7 2 90.06 4.12 2 -7 3 17.22 1.62 2 -7 3 16.24 1.40 2 -7 3 14.27 1.55 2 -7 3 12.92 1.49 2 -7 3 14.74 1.53 2 -7 3 13.48 1.40 2 -7 3 14.71 1.55 2 -7 3 14.10 1.53 2 -7 4 2.33 0.64 2 -7 4 2.67 0.69 2 -7 4 2.95 0.72 2 -7 4 1.70 0.59 2 -7 4 2.02 0.58 2 -7 4 1.62 0.54 2 -7 4 1.58 0.55 2 -7 5 139.26 4.94 2 -7 5 145.99 5.22 2 -7 5 146.92 5.12 2 -7 5 145.68 5.03 2 -7 5 144.03 5.07 2 -7 6 49.50 2.38 2 -7 6 45.81 2.23 2 -7 7 0.92 0.52 -2 6 12 0.59 0.20 -2 6 11 84.07 2.91 2 -6 -11 84.77 3.40 -2 6 11 86.39 3.13 2 -6 -10 127.72 4.63 -2 6 10 121.63 4.09 2 -6 -10 129.51 4.89 2 -6 -10 115.63 3.90 2 -6 -9 80.57 3.99 -2 6 9 80.71 3.48 2 -6 -9 68.45 3.23 2 -6 -9 80.86 3.76 -2 6 9 73.52 3.11 2 -6 -9 76.61 3.18 2 -6 -8 26.02 2.31 2 -6 -8 23.29 2.02 -2 6 8 24.36 1.67 2 -6 -8 20.93 1.84 2 -6 -8 22.62 1.80 2 -6 -7 4.56 0.89 2 -6 -7 4.69 0.97 2 -6 -7 3.27 0.66 2 -6 -7 4.32 0.91 -2 6 7 4.59 0.72 2 -6 -6 275.30 8.66 2 -6 -6 262.89 8.01 2 -6 -6 256.18 8.71 2 -6 -6 258.38 7.76 2 -6 -6 268.57 8.13 2 -6 -6 266.84 8.76 2 -6 -5 235.78 8.67 2 -6 -5 240.66 8.07 2 -6 -5 237.36 8.06 2 -6 -5 221.98 8.12 2 -6 -5 240.32 7.66 2 -6 -5 231.91 10.66 2 -6 -5 243.93 7.85 2 -6 -5 227.28 7.52 2 -6 -5 238.94 7.45 2 -6 -4 76.68 3.93 2 -6 -4 72.31 3.57 2 -6 -4 75.14 3.96 2 -6 -4 69.92 4.01 2 -6 -4 72.51 3.74 2 -6 -4 77.68 5.89 2 -6 -3 76.09 3.97 2 -6 -3 71.20 5.77 2 -6 -3 68.33 3.99 2 -6 -3 69.09 3.71 2 -6 -3 66.36 3.48 2 -6 -2 248.86 8.74 2 -6 -2 254.88 11.87 2 -6 -2 262.97 8.89 2 -6 -2 244.47 8.24 2 -6 -2 241.10 8.89 2 -6 -2 243.92 11.44 2 -6 -2 255.30 8.48 2 -6 -2 247.98 8.07 2 -6 -1 203.31 10.81 2 -6 -1 228.35 8.24 2 -6 -1 227.05 8.29 2 -6 -1 238.02 8.01 2 -6 -1 229.96 8.34 2 -6 -1 223.77 7.80 2 -6 -1 226.28 7.51 2 -6 -1 224.95 7.74 2 -6 -1 225.73 7.13 2 -6 0 2.87 0.82 2 -6 0 1.11 0.64 2 -6 0 0.86 0.46 2 -6 0 0.69 0.56 2 -6 0 1.81 0.70 2 -6 0 1.06 0.58 2 -6 0 1.23 0.60 2 -6 0 0.74 0.59 2 -6 0 1.98 0.66 2 -6 0 -0.14 0.55 2 -6 0 1.02 0.90 2 -6 0 1.36 0.50 2 -6 0 1.24 0.90 2 -6 1 39.50 2.89 2 -6 1 33.63 2.65 2 -6 1 31.21 3.82 2 -6 1 32.20 2.50 2 -6 1 35.61 2.79 2 -6 1 35.34 2.79 2 -6 1 32.03 2.35 2 -6 1 35.93 2.52 2 -6 1 31.51 2.66 2 -6 1 31.80 4.15 2 -6 1 35.23 2.51 2 -6 1 31.29 2.36 2 -6 1 31.05 2.52 2 -6 1 34.12 2.59 2 -6 1 34.58 2.59 2 -6 2 177.11 6.82 2 -6 2 170.08 9.20 2 -6 2 174.54 6.50 2 -6 2 165.71 6.78 2 -6 2 164.23 6.48 2 -6 2 172.67 6.38 2 -6 2 153.18 9.70 2 -6 2 176.41 6.89 2 -6 2 176.50 6.64 2 -6 2 172.28 6.19 2 -6 2 166.65 6.60 2 -6 2 175.98 6.58 2 -6 2 177.08 6.22 2 -6 2 183.15 6.72 2 -6 3 1.67 0.62 2 -6 3 1.57 0.82 2 -6 3 1.23 0.56 2 -6 3 0.77 0.57 2 -6 3 0.68 0.50 2 -6 3 1.69 0.60 2 -6 3 1.34 0.55 2 -6 3 1.42 0.67 2 -6 3 2.01 0.67 2 -6 3 0.36 0.74 2 -6 3 1.27 0.60 2 -6 3 1.38 0.66 2 -6 3 1.52 0.56 2 -6 4 54.07 3.29 2 -6 4 51.62 3.18 2 -6 4 53.66 3.18 2 -6 4 52.05 3.28 2 -6 4 48.48 2.71 2 -6 4 57.30 3.31 2 -6 4 50.83 3.06 2 -6 4 50.77 3.20 2 -6 4 52.74 2.77 2 -6 4 53.87 3.22 2 -6 4 51.97 3.26 2 -6 4 49.29 3.26 2 -6 5 3.00 0.77 2 -6 5 1.86 0.72 2 -6 5 2.71 0.71 2 -6 5 1.85 0.64 2 -6 5 1.80 0.62 2 -6 5 2.08 0.71 2 -6 5 1.07 0.54 2 -6 5 2.39 0.71 2 -6 6 28.98 2.13 2 -6 6 25.18 1.98 2 -6 6 27.72 2.11 2 -6 6 21.16 1.90 2 -6 6 25.35 1.99 2 -6 6 29.30 2.19 2 -6 7 41.38 2.59 2 -6 7 42.16 2.41 2 -6 7 39.73 2.46 2 -6 8 185.36 5.88 2 -6 8 176.72 5.44 2 -6 8 187.81 5.82 2 -6 9 2.05 0.44 -2 5 13 63.19 2.11 2 -5 -13 57.17 2.18 2 -5 -12 140.42 4.68 -2 5 12 142.53 4.41 2 -5 -12 130.21 4.45 -2 5 12 139.91 4.25 2 -5 -11 11.54 1.29 -2 5 11 9.82 1.06 2 -5 -11 9.46 1.17 -2 5 11 8.93 1.01 2 -5 -10 37.86 2.60 -2 5 10 39.98 2.37 2 -5 -10 39.36 2.67 -2 5 10 40.95 2.43 2 -5 -9 11.36 1.54 2 -5 -9 11.91 1.53 -2 5 9 10.52 1.24 2 -5 -9 10.94 1.24 2 -5 -9 14.38 1.31 2 -5 -8 182.39 6.23 2 -5 -8 186.04 7.26 2 -5 -8 188.94 7.11 -2 5 8 181.10 6.24 2 -5 -7 155.20 6.45 -2 5 7 142.67 5.20 2 -5 -7 156.35 6.24 2 -5 -7 140.20 5.30 2 -5 -7 137.34 5.44 2 -5 -6 14.18 1.79 2 -5 -6 11.12 1.97 2 -5 -6 11.81 1.23 2 -5 -6 11.31 1.24 2 -5 -6 12.43 1.45 2 -5 -6 12.02 1.59 -2 5 6 12.56 1.27 2 -5 -6 11.46 1.28 2 -5 -5 106.55 6.54 2 -5 -5 107.75 4.75 2 -5 -5 104.61 4.40 2 -5 -5 103.86 4.23 2 -5 -5 118.26 4.71 2 -5 -5 112.53 5.06 2 -5 -4 29.39 3.20 2 -5 -4 25.50 2.34 2 -5 -4 23.99 2.81 2 -5 -4 27.92 3.33 2 -5 -4 27.43 2.19 2 -5 -4 24.70 1.99 2 -5 -4 24.69 1.90 2 -5 -4 25.65 2.05 2 -5 -4 23.71 1.92 2 -5 -4 28.98 2.31 2 -5 -3 159.87 8.46 2 -5 -3 161.89 6.51 2 -5 -3 158.67 5.66 2 -5 -3 163.90 8.63 2 -5 -3 164.61 6.28 2 -5 -3 159.46 6.04 2 -5 -3 156.44 5.84 2 -5 -3 163.02 6.10 2 -5 -3 155.07 5.77 2 -5 -3 169.08 6.14 2 -5 -3 144.12 7.15 2 -5 -2 80.87 4.14 2 -5 -2 80.07 3.90 2 -5 -2 85.80 4.11 2 -5 -2 85.31 3.82 2 -5 -2 81.67 5.97 2 -5 -2 83.39 6.08 2 -5 -2 85.10 3.93 2 -5 -1 7.14 1.13 2 -5 -1 5.93 1.06 2 -5 -1 6.11 1.04 2 -5 -1 6.92 1.13 2 -5 -1 8.46 1.86 2 -5 -1 7.34 1.05 2 -5 -1 7.36 1.07 2 -5 -1 7.09 1.79 2 -5 0 1.40 0.57 2 -5 0 1.01 0.58 2 -5 0 1.91 0.55 2 -5 0 2.01 0.71 2 -5 0 1.06 0.42 2 -5 0 1.70 0.61 2 -5 0 2.50 0.67 2 -5 0 2.82 1.23 2 -5 0 2.15 0.59 2 -5 1 323.75 9.35 2 -5 1 324.92 9.86 2 -5 1 320.78 10.28 2 -5 1 343.05 10.48 2 -5 1 314.28 9.32 2 -5 1 319.57 10.22 2 -5 1 313.87 9.73 2 -5 1 354.50 14.57 2 -5 1 343.13 9.91 2 -5 1 322.89 9.55 2 -5 1 327.83 10.07 2 -5 1 333.94 9.94 2 -5 1 330.34 10.03 2 -5 1 330.07 13.34 2 -5 1 326.19 9.57 2 -5 2 193.68 6.89 2 -5 2 173.30 9.10 2 -5 2 185.30 6.64 2 -5 2 189.65 6.41 2 -5 2 182.24 6.57 2 -5 2 179.78 6.16 2 -5 2 180.50 6.45 2 -5 2 178.48 6.88 2 -5 2 177.55 6.77 2 -5 2 183.94 10.38 2 -5 2 184.05 6.26 2 -5 2 181.71 7.00 2 -5 2 191.66 7.12 2 -5 2 190.09 6.75 2 -5 2 184.62 6.41 2 -5 2 185.61 6.22 2 -5 2 202.89 7.01 2 -5 2 194.00 6.76 2 -5 3 213.98 7.28 2 -5 3 193.17 7.18 2 -5 3 209.48 9.74 2 -5 3 206.67 6.91 2 -5 3 205.23 6.71 2 -5 3 201.89 7.11 2 -5 3 193.31 6.49 2 -5 3 201.72 6.91 2 -5 3 205.44 7.35 2 -5 3 197.42 7.34 2 -5 3 200.44 6.52 2 -5 3 196.10 7.40 2 -5 3 190.51 6.43 2 -5 3 193.87 7.38 2 -5 3 196.07 6.92 2 -5 3 191.80 6.49 2 -5 3 200.62 7.10 2 -5 3 202.83 6.97 2 -5 4 25.89 2.07 2 -5 4 26.45 2.33 2 -5 4 29.18 1.99 2 -5 4 27.72 2.33 2 -5 4 26.19 2.35 2 -5 4 29.11 3.94 2 -5 4 28.29 2.29 2 -5 4 28.95 2.04 2 -5 4 29.12 2.18 2 -5 4 28.49 2.06 2 -5 4 23.91 1.90 2 -5 4 32.58 2.45 2 -5 4 29.85 2.31 2 -5 4 30.04 2.05 2 -5 4 28.73 2.30 2 -5 4 29.34 2.43 2 -5 4 27.40 2.31 2 -5 4 27.64 3.16 2 -5 5 78.86 4.02 2 -5 5 76.88 3.57 2 -5 5 76.73 4.27 2 -5 5 82.59 4.08 2 -5 5 69.56 3.43 2 -5 5 79.30 4.07 2 -5 5 85.60 4.17 2 -5 5 71.80 3.37 2 -5 5 78.99 3.72 2 -5 5 72.17 3.28 2 -5 5 79.21 6.53 2 -5 5 78.97 4.05 2 -5 5 73.01 3.25 2 -5 5 76.84 4.10 2 -5 5 75.35 3.87 2 -5 5 69.74 3.78 2 -5 5 73.81 3.25 2 -5 5 77.32 3.94 2 -5 6 5.12 1.01 2 -5 6 4.76 1.04 2 -5 6 4.73 0.98 2 -5 6 3.83 0.92 2 -5 6 3.86 0.88 2 -5 6 4.65 1.57 2 -5 6 6.15 1.18 2 -5 6 5.42 0.96 2 -5 6 5.32 0.91 2 -5 6 4.42 1.09 2 -5 6 5.93 1.07 2 -5 7 192.42 7.15 2 -5 7 190.25 6.89 2 -5 7 192.37 6.70 2 -5 7 185.70 6.96 2 -5 7 193.02 6.91 2 -5 7 188.77 6.52 2 -5 7 194.70 6.78 2 -5 8 2.67 0.75 2 -5 8 3.66 0.79 2 -5 8 3.22 0.81 2 -5 8 4.21 0.84 2 -5 8 4.51 0.87 2 -5 9 2.91 0.67 2 -5 9 2.30 0.79 2 -5 9 2.22 0.62 2 -5 9 3.11 0.67 2 -5 9 3.66 0.77 2 -5 10 31.93 1.93 2 -5 10 35.83 2.06 2 -5 10 32.77 1.83 2 -5 11 36.19 1.68 2 -5 11 33.30 1.62 2 -5 11 34.16 1.53 2 -4 -13 8.48 0.90 -2 4 13 8.72 0.84 2 -4 -13 6.29 0.60 -2 4 12 112.96 4.15 2 -4 -12 109.69 4.36 2 -4 -12 105.64 4.05 -2 4 11 2.85 0.66 2 -4 -11 3.74 0.79 2 -4 -11 1.39 0.50 -2 4 11 2.02 0.54 2 -4 -10 26.49 2.26 -2 4 10 29.33 2.17 -2 4 10 28.36 2.09 2 -4 -10 27.67 2.12 2 -4 -9 11.18 1.39 -2 4 9 9.81 1.26 2 -4 -9 9.55 1.42 2 -4 -9 10.14 1.45 -2 4 9 9.27 1.91 -2 4 9 9.28 1.96 2 -4 -8 125.72 5.60 2 -4 -8 119.39 5.09 -2 4 8 128.67 5.04 2 -4 -8 131.60 5.66 -2 4 8 111.42 6.93 -2 4 7 210.85 6.86 2 -4 -7 205.33 7.62 2 -4 -7 210.50 7.15 2 -4 -7 212.10 7.72 2 -4 -7 204.63 6.78 -2 4 7 222.45 9.75 2 -4 -6 41.47 2.54 2 -4 -6 39.37 2.54 2 -4 -6 44.19 3.01 2 -4 -6 41.94 2.32 -2 4 6 42.01 2.44 2 -4 -6 39.56 2.80 2 -4 -6 41.88 3.52 2 -4 -5 22.56 2.64 2 -4 -5 23.07 1.74 2 -4 -5 20.08 2.40 -2 4 5 24.70 1.71 2 -4 -5 22.17 2.01 2 -4 -5 21.56 1.75 2 -4 -5 21.20 1.59 2 -4 -5 20.80 1.98 2 -4 -5 21.32 1.78 2 -4 -5 24.79 1.74 2 -4 -4 424.72 14.41 2 -4 -4 430.81 11.63 2 -4 -4 422.83 12.22 2 -4 -4 418.52 11.16 2 -4 -4 433.26 11.51 2 -4 -4 438.39 14.60 2 -4 -4 427.09 11.97 2 -4 -3 24.75 2.84 2 -4 -3 22.65 1.80 2 -4 -3 24.52 1.82 2 -4 -3 23.70 1.92 2 -4 -3 22.13 1.79 2 -4 -3 23.59 1.71 2 -4 -3 24.11 2.87 2 -4 -2 133.46 5.25 2 -4 -2 137.75 5.02 2 -4 -2 122.26 6.04 2 -4 -2 142.90 7.22 2 -4 -2 124.74 4.61 2 -4 -2 131.04 7.20 2 -4 -2 127.17 4.87 2 -4 -2 118.68 4.87 2 -4 -2 129.82 4.77 2 -4 -2 133.57 4.83 2 -4 -1 637.04 15.73 2 -4 -1 640.77 19.82 2 -4 -1 608.62 17.00 2 -4 -1 625.95 15.30 2 -4 -1 619.13 19.09 2 -4 -1 601.46 15.73 2 -4 -1 604.59 15.40 2 -4 -1 623.94 15.40 2 -4 0 1304.43 29.52 2 -4 0 1308.61 30.23 2 -4 0 1264.06 30.71 2 -4 0 1346.69 35.34 2 -4 0 1277.97 29.76 2 -4 0 1316.08 30.04 2 -4 0 1327.28 29.80 2 -4 1 247.23 11.06 2 -4 1 239.80 7.79 2 -4 1 249.48 7.48 2 -4 1 238.85 7.18 2 -4 1 232.03 10.06 2 -4 1 227.94 7.44 2 -4 2 48.57 2.78 2 -4 2 50.23 2.91 2 -4 2 51.69 2.80 2 -4 2 51.46 4.22 2 -4 2 44.11 2.75 2 -4 2 47.78 2.49 2 -4 2 45.24 2.86 2 -4 2 52.11 2.74 2 -4 2 45.65 2.58 2 -4 2 53.03 2.91 2 -4 2 48.17 2.69 2 -4 2 48.29 2.57 2 -4 2 47.90 2.73 2 -4 3 447.07 12.06 2 -4 3 438.62 12.36 2 -4 3 442.76 11.88 2 -4 3 423.62 11.23 2 -4 3 436.40 11.71 2 -4 3 453.98 14.92 2 -4 3 431.46 16.22 2 -4 3 435.29 12.02 2 -4 3 420.70 11.18 2 -4 3 424.07 11.72 2 -4 3 415.64 11.18 2 -4 3 436.37 11.62 2 -4 3 441.24 11.96 2 -4 3 428.30 11.65 2 -4 3 444.16 11.66 2 -4 3 424.05 11.32 2 -4 4 213.61 9.04 2 -4 4 192.98 6.22 2 -4 4 218.87 10.73 2 -4 4 212.07 7.15 2 -4 4 221.90 7.14 2 -4 4 206.10 6.45 2 -4 4 203.49 6.70 2 -4 4 208.06 6.53 2 -4 4 209.92 7.02 2 -4 4 212.22 7.08 2 -4 4 225.10 7.48 2 -4 4 195.67 6.40 2 -4 4 212.71 6.61 2 -4 4 202.52 7.45 2 -4 4 202.48 6.41 2 -4 5 6.96 1.08 2 -4 5 5.68 1.01 2 -4 5 6.24 1.78 2 -4 5 6.62 1.15 2 -4 5 9.29 1.28 2 -4 5 5.77 0.92 2 -4 5 6.24 0.89 2 -4 5 8.47 1.32 2 -4 5 5.40 0.92 2 -4 5 6.74 0.89 2 -4 5 6.60 1.34 2 -4 5 6.03 0.90 2 -4 5 6.47 1.07 2 -4 5 6.37 1.06 2 -4 6 119.73 4.69 2 -4 6 116.07 7.74 2 -4 6 125.10 5.18 2 -4 6 125.57 5.50 2 -4 6 118.81 4.65 2 -4 6 121.82 5.35 2 -4 6 127.15 5.75 2 -4 6 135.43 5.21 2 -4 6 105.47 5.28 2 -4 6 126.28 5.10 2 -4 6 128.03 5.40 2 -4 6 122.32 4.64 2 -4 7 493.97 14.15 2 -4 7 512.36 13.61 2 -4 7 483.19 13.99 2 -4 7 492.81 18.09 2 -4 7 499.42 14.48 2 -4 7 498.98 13.66 2 -4 7 486.24 13.77 2 -4 7 511.40 14.04 2 -4 7 502.20 13.55 2 -4 7 477.71 13.84 2 -4 7 466.05 12.97 2 -4 8 276.76 9.32 2 -4 8 298.38 9.03 2 -4 8 291.64 9.31 2 -4 8 264.27 8.54 2 -4 8 291.73 9.73 2 -4 8 292.03 9.23 2 -4 8 296.46 9.36 2 -4 8 294.25 9.18 2 -4 8 287.49 9.57 2 -4 9 56.61 3.34 2 -4 9 55.24 2.98 2 -4 9 59.43 3.55 2 -4 9 57.45 3.26 2 -4 9 56.40 3.20 2 -4 9 61.51 3.26 2 -4 9 53.90 3.36 2 -4 10 43.10 2.81 2 -4 10 47.09 2.75 2 -4 10 51.20 3.02 2 -4 10 46.60 2.57 2 -4 11 15.41 1.35 2 -4 11 15.03 1.37 2 -4 11 16.02 1.48 2 -4 12 14.97 1.12 2 -4 12 13.99 1.11 -2 3 14 3.35 0.41 2 -3 -14 3.06 0.43 2 -3 -13 0.20 0.31 2 -3 -13 0.18 0.25 -2 3 13 0.24 0.28 2 -3 -12 202.91 6.39 2 -3 -12 214.22 6.79 2 -3 -12 225.05 7.11 2 -3 -11 60.08 3.24 -2 3 11 63.72 3.36 2 -3 -11 71.17 3.75 2 -3 -11 64.51 3.40 -2 3 11 67.97 3.21 -2 3 10 3.95 0.75 2 -3 -10 4.54 0.93 2 -3 -10 4.03 0.93 -2 3 10 4.06 1.40 -2 3 10 2.50 1.04 -2 3 10 4.44 0.92 -2 3 10 2.63 0.69 2 -3 -10 5.11 1.00 -2 3 9 92.66 4.18 2 -3 -9 86.98 4.26 -2 3 9 79.41 5.99 2 -3 -9 94.56 4.62 -2 3 9 92.95 4.29 2 -3 -9 87.30 4.32 -2 3 9 91.82 6.25 -2 3 8 152.69 8.16 -2 3 8 157.08 8.17 2 -3 -8 144.83 6.06 -2 3 8 167.62 5.91 2 -3 -8 143.51 5.94 -2 3 7 194.23 6.55 2 -3 -7 202.17 7.10 2 -3 -7 194.61 6.79 2 -3 -6 117.39 4.68 -2 3 6 121.60 4.50 2 -3 -6 114.99 4.88 2 -3 -6 115.95 4.30 2 -3 -6 116.17 5.49 2 -3 -5 85.36 3.41 2 -3 -5 92.96 4.09 2 -3 -5 95.80 5.02 2 -3 -5 93.03 4.11 2 -3 -4 853.51 20.03 2 -3 -4 876.39 19.98 2 -3 -4 859.14 22.86 2 -3 -3 87.76 3.45 2 -3 -3 88.53 3.42 2 -3 -3 88.85 4.95 2 -3 -2 241.90 6.93 2 -3 -2 241.08 6.88 2 -3 -2 224.44 8.99 2 -3 -1 306.82 8.44 2 -3 -1 308.97 8.46 2 -3 -1 320.51 10.07 2 -3 -1 318.07 10.93 2 -3 0 33.02 3.18 2 -3 0 26.58 2.21 2 -3 1 8.56 0.96 2 -3 1 7.20 0.88 2 -3 1 8.51 1.16 2 -3 1 7.19 1.45 2 -3 2 53.92 2.60 2 -3 2 55.88 3.04 2 -3 2 54.13 4.36 2 -3 2 54.30 2.61 2 -3 2 56.39 3.93 2 -3 3 15.53 1.31 2 -3 3 17.90 1.42 2 -3 3 16.43 2.39 2 -3 3 20.22 2.27 2 -3 4 59.36 2.69 2 -3 4 56.16 3.85 2 -3 4 61.26 4.84 2 -3 5 146.66 6.49 2 -3 5 151.21 5.47 2 -3 5 156.65 8.27 2 -3 5 149.72 5.42 2 -3 5 162.30 5.59 2 -3 5 147.77 4.82 2 -3 5 156.27 5.48 2 -3 5 146.97 5.54 2 -3 5 152.52 5.51 2 -3 5 144.90 5.35 2 -3 6 18.91 1.67 2 -3 6 17.11 1.71 2 -3 6 19.23 1.66 2 -3 6 20.45 2.86 2 -3 6 19.96 1.73 2 -3 6 21.94 1.94 2 -3 6 21.56 2.04 2 -3 6 19.76 1.76 2 -3 6 21.65 1.89 2 -3 6 18.98 1.47 2 -3 7 300.17 8.94 2 -3 7 308.97 9.84 2 -3 7 300.47 9.21 2 -3 7 303.29 9.22 2 -3 7 316.36 12.85 2 -3 7 308.66 9.65 2 -3 7 305.46 9.97 2 -3 7 312.62 10.04 2 -3 7 311.49 9.42 2 -3 7 313.02 9.53 2 -3 8 217.51 7.08 2 -3 8 209.62 7.79 2 -3 8 208.42 7.23 2 -3 8 197.40 6.88 2 -3 8 216.63 7.52 2 -3 8 202.16 9.96 2 -3 8 208.70 7.44 2 -3 8 213.98 7.79 2 -3 8 216.41 7.29 2 -3 8 213.56 7.86 2 -3 8 213.54 7.33 2 -3 9 432.22 12.24 2 -3 9 448.43 12.61 2 -3 9 474.17 12.74 2 -3 9 441.10 13.23 2 -3 9 445.48 12.43 2 -3 9 474.36 13.39 2 -3 9 473.99 13.22 2 -3 9 416.08 12.09 2 -3 9 455.38 12.57 2 -3 10 7.85 1.15 2 -3 10 8.54 1.27 2 -3 10 9.28 1.25 2 -3 10 9.43 1.36 2 -3 10 9.39 1.40 2 -3 10 8.97 1.17 2 -3 10 7.49 1.19 2 -3 11 0.30 0.41 2 -3 11 0.54 0.32 2 -3 11 0.27 0.30 2 -3 11 0.21 0.33 2 -3 11 0.43 0.55 2 -3 12 117.22 4.35 2 -3 12 113.21 4.19 2 -3 12 117.94 4.28 2 -3 12 111.44 4.37 2 -3 12 118.82 4.17 2 -3 13 68.59 2.69 2 -3 13 66.19 2.56 2 -2 -14 1.44 0.30 2 -2 -14 2.66 0.44 2 -2 -13 36.75 2.07 -2 2 13 33.83 1.93 2 -2 -13 31.24 1.95 -2 2 12 81.47 3.63 2 -2 -12 77.53 3.69 2 -2 -12 76.90 3.66 -2 2 11 41.57 2.40 2 -2 -11 38.93 2.43 -2 2 11 40.40 2.67 2 -2 -11 47.82 2.98 2 -2 -10 17.86 1.85 -2 2 10 15.34 2.56 2 -2 -10 16.36 1.64 -2 2 10 15.51 1.54 -2 2 10 18.55 2.85 -2 2 10 19.77 1.60 2 -2 -9 305.04 9.61 -2 2 9 286.25 12.41 2 -2 -9 293.06 9.19 -2 2 9 308.15 9.10 -2 2 9 287.10 12.52 -2 2 9 303.31 8.83 -2 2 8 19.01 1.72 2 -2 -8 21.94 1.90 -2 2 8 20.46 2.87 -2 2 8 21.19 2.83 2 -2 -8 23.23 2.05 -2 2 8 21.15 1.85 2 -2 -7 47.72 2.80 -2 2 7 52.26 2.56 2 -2 -7 50.60 2.99 -2 2 7 51.10 2.80 2 -2 -6 2.13 0.60 -2 2 6 1.75 0.43 -2 2 6 1.63 0.50 2 -2 -5 1.51 0.55 -2 2 5 2.53 0.45 2 -2 -4 30.52 2.41 2 -2 -4 30.93 1.59 2 -2 -4 29.67 1.60 2 -2 -3 537.40 12.72 2 -2 -3 531.07 12.76 2 -2 -2 94.94 3.29 2 -2 -2 113.39 4.96 2 -2 -1 6.94 0.72 2 -2 -1 6.70 1.12 -2 2 1 6.86 0.87 2 -2 0 17.27 1.17 2 -2 0 17.11 1.68 -2 2 0 19.40 1.30 2 -2 1 19.89 1.75 2 -2 1 18.36 1.21 -2 2 -1 18.20 1.13 2 -2 2 77.79 3.57 2 -2 2 72.77 2.74 2 -2 2 79.17 4.58 -2 2 -2 68.06 2.39 2 -2 2 72.79 3.97 2 -2 3 815.16 18.75 2 -2 3 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140.69 9.10 4 -4 -1 150.29 5.61 4 -4 -1 142.21 5.19 4 -4 -1 147.99 8.60 4 -4 -1 139.54 7.74 4 -4 -1 145.54 5.82 4 -4 -1 138.76 5.73 4 -4 -1 136.65 5.99 4 -4 -1 153.74 5.89 4 -4 0 109.56 4.98 4 -4 0 106.97 4.60 4 -4 0 108.75 4.47 4 -4 0 111.33 8.24 4 -4 0 103.51 7.23 4 -4 0 98.10 6.14 4 -4 0 115.65 5.00 4 -4 0 106.91 4.82 4 -4 0 105.11 4.83 4 -4 0 105.55 5.11 4 -4 1 141.27 5.57 4 -4 1 138.48 9.40 4 -4 1 141.29 8.50 4 -4 1 154.95 5.66 4 -4 1 148.15 6.11 4 -4 1 144.64 5.77 4 -4 1 146.88 6.34 4 -4 1 147.15 6.43 4 -4 2 7.10 1.83 4 -4 2 4.25 0.87 4 -4 2 4.84 0.92 4 -4 2 3.79 0.86 4 -4 2 2.91 0.89 4 -4 2 4.69 0.87 4 -4 2 5.26 1.11 4 -4 2 4.51 0.98 4 -4 2 4.20 0.91 4 -4 2 4.28 1.02 4 -4 2 4.04 0.92 4 -4 3 351.37 10.24 4 -4 3 358.08 16.22 4 -4 3 358.45 10.88 4 -4 3 346.00 14.48 4 -4 3 367.21 11.51 4 -4 3 360.82 11.29 4 -4 3 360.82 10.62 4 -4 3 358.72 10.41 4 -4 3 346.10 9.90 4 -4 3 365.87 11.06 4 -4 3 347.82 10.65 4 -4 4 22.39 1.83 4 -4 4 18.55 3.38 4 -4 4 19.97 1.90 4 -4 4 19.05 2.91 4 -4 4 22.40 2.14 4 -4 4 19.77 2.10 4 -4 4 20.60 1.94 4 -4 4 19.84 1.74 4 -4 4 18.91 1.84 4 -4 4 17.85 1.69 4 -4 4 18.80 1.90 4 -4 4 18.36 1.94 4 -4 5 5.04 0.86 4 -4 5 4.44 1.75 4 -4 5 3.91 0.84 4 -4 5 5.09 1.38 4 -4 5 4.61 0.99 4 -4 5 4.60 0.92 4 -4 5 3.99 0.90 4 -4 5 3.72 0.93 4 -4 5 3.91 0.90 4 -4 5 5.56 0.91 4 -4 6 39.95 2.95 4 -4 6 43.62 3.09 4 -4 6 43.74 2.78 4 -4 6 39.15 2.71 4 -4 6 43.49 2.86 4 -4 6 46.47 3.04 4 -4 6 38.84 2.36 4 -4 7 0.11 0.37 4 -4 7 0.61 0.47 4 -4 7 0.60 0.41 4 -4 7 0.37 0.34 4 -4 7 0.48 0.45 4 -4 7 -0.11 0.43 4 -4 7 0.92 0.64 4 -4 8 10.98 1.24 4 -4 8 12.46 1.43 4 -4 8 12.86 1.38 4 -4 8 11.63 1.45 4 -4 8 14.51 1.43 4 -4 8 11.56 1.38 4 -4 9 124.58 4.64 4 -4 9 116.37 4.41 4 -4 9 117.46 4.70 4 -4 9 128.37 4.47 4 -4 9 119.91 4.75 4 -4 10 37.94 1.96 4 -4 10 36.91 1.87 4 -4 10 35.91 2.01 4 -4 11 2.61 0.38 4 -4 11 3.03 0.50 4 -3 -11 141.53 4.15 -4 3 11 133.55 4.09 -4 3 10 103.60 3.88 4 -3 -10 106.04 4.03 4 -3 -10 103.33 4.13 -4 3 10 101.22 3.87 4 -3 -10 113.04 4.02 4 -3 -9 214.75 6.98 -4 3 9 221.56 6.85 -4 3 9 205.92 6.60 4 -3 -9 207.45 7.15 -4 3 9 212.05 6.74 4 -3 -8 1.66 0.60 4 -3 -8 1.46 0.64 -4 3 8 0.38 0.44 -4 3 8 0.75 0.49 -4 3 7 3.97 0.82 4 -3 -7 2.28 0.83 -4 3 7 1.25 0.55 4 -3 -7 3.25 0.80 -4 3 7 2.12 0.69 4 -3 -7 1.22 0.61 -4 3 6 364.91 10.45 4 -3 -6 349.95 10.73 4 -3 -6 348.45 10.69 -4 3 6 321.87 12.30 4 -3 -6 316.78 14.05 4 -3 -6 343.42 11.07 -4 3 6 353.08 10.12 4 -3 -5 24.89 2.37 -4 3 5 25.36 1.96 4 -3 -5 22.08 3.25 4 -3 -5 23.01 2.16 4 -3 -5 25.07 1.87 -4 3 5 27.11 2.14 4 -3 -5 25.14 2.24 4 -3 -4 0.09 0.35 4 -3 -4 0.47 0.56 4 -3 -4 1.65 0.52 4 -3 -4 0.12 0.36 -4 3 4 0.69 0.41 -4 3 4 1.65 0.52 4 -3 -4 0.09 0.28 4 -3 -4 1.20 0.79 4 -3 -3 3.05 0.70 4 -3 -3 2.01 1.02 4 -3 -3 4.04 0.79 4 -3 -3 3.43 0.76 4 -3 -3 2.98 1.10 4 -3 -3 3.94 0.90 -4 3 3 3.77 0.75 4 -3 -3 2.86 0.70 4 -3 -3 2.35 0.63 4 -3 -2 172.09 6.01 4 -3 -2 156.53 8.51 4 -3 -2 159.86 5.70 4 -3 -2 162.82 5.91 4 -3 -2 161.97 5.78 -4 3 2 158.06 5.52 4 -3 -2 152.15 5.62 4 -3 -2 162.16 8.38 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0.44 0.27 5 -6 2 0.58 0.33 5 -6 2 0.31 0.31 5 -6 3 4.57 0.71 5 -6 3 4.14 0.64 5 -6 3 4.31 0.57 5 -6 3 4.41 0.64 5 -6 4 46.90 2.18 5 -6 4 47.60 2.14 5 -6 4 44.69 1.87 5 -6 4 47.30 2.04 5 -6 5 20.56 1.19 5 -6 5 17.77 1.13 5 -6 5 19.23 1.09 -5 5 8 0.38 0.16 -5 5 7 44.06 1.79 -5 5 7 48.59 1.97 -5 5 6 15.97 1.09 -5 5 6 13.82 1.09 5 -5 -6 12.44 1.06 -5 5 5 51.61 2.27 -5 5 5 54.48 2.48 5 -5 -5 56.73 2.67 5 -5 -4 14.09 1.22 5 -5 -4 16.09 1.46 -5 5 4 14.22 1.12 -5 5 4 16.32 1.31 5 -5 -3 144.02 4.96 5 -5 -3 136.05 4.64 5 -5 -3 131.22 5.05 -5 5 3 132.75 4.54 5 -5 -3 137.99 5.52 5 -5 -2 8.60 1.10 5 -5 -2 7.68 0.98 5 -5 -2 8.74 1.19 -5 5 2 6.33 0.81 5 -5 -2 8.03 1.26 5 -5 -1 8.17 1.07 5 -5 -1 8.86 1.20 5 -5 -1 8.03 1.13 5 -5 -1 9.50 1.38 5 -5 0 198.02 6.44 5 -5 0 197.05 6.73 5 -5 0 200.16 7.15 5 -5 0 197.74 7.26 5 -5 0 185.40 6.62 5 -5 1 10.66 1.32 5 -5 1 15.37 1.73 5 -5 1 14.30 1.65 5 -5 2 3.74 0.76 5 -5 2 5.24 0.91 5 -5 2 5.45 0.93 5 -5 2 5.20 0.83 5 -5 2 5.49 1.03 5 -5 2 7.33 1.14 5 -5 3 116.61 4.39 5 -5 3 117.38 4.63 5 -5 3 116.68 4.64 5 -5 3 114.92 4.35 5 -5 4 93.16 4.14 5 -5 4 102.21 3.74 5 -5 4 88.33 3.77 5 -5 4 89.13 4.13 5 -5 4 94.23 3.74 5 -5 4 96.23 3.95 5 -5 5 91.15 3.63 5 -5 5 88.71 3.49 5 -5 5 88.52 3.68 5 -5 5 92.86 3.85 5 -5 6 58.68 2.61 5 -5 6 60.63 2.75 5 -5 6 57.03 2.72 5 -5 7 112.77 3.63 5 -5 7 109.18 3.87 5 -5 7 117.66 3.78 5 -5 7 114.77 3.91 5 -5 8 7.06 0.61 5 -5 8 8.67 0.72 -5 4 9 7.48 0.64 -5 4 8 124.02 3.64 -5 4 8 141.40 4.01 5 -4 -7 20.10 1.41 -5 4 7 21.79 1.45 -5 4 7 21.37 1.52 -5 4 7 24.36 1.62 5 -4 -6 3.12 0.66 -5 4 6 3.32 0.61 -5 4 6 3.34 0.64 -5 4 6 2.84 0.60 5 -4 -5 122.85 4.90 -5 4 5 134.12 4.91 -5 4 5 131.83 4.65 -5 4 5 133.00 4.80 5 -4 -5 133.26 5.12 5 -4 -4 102.54 4.51 5 -4 -4 108.67 4.24 -5 4 4 101.81 4.23 -5 4 4 99.41 3.98 -5 4 4 102.96 4.13 5 -4 -4 115.72 4.76 5 -4 -3 6.38 1.07 5 -4 -3 4.36 0.80 5 -4 -3 7.33 1.06 -5 4 3 5.79 0.91 -5 4 3 5.20 0.79 -5 4 3 5.36 0.84 5 -4 -3 7.16 1.14 5 -4 -2 0.11 0.33 5 -4 -2 0.55 0.41 5 -4 -2 0.58 0.43 -5 4 2 0.30 0.28 5 -4 -2 0.57 0.47 -5 4 2 0.59 0.39 5 -4 -1 163.36 6.12 5 -4 -1 164.37 5.86 5 -4 -1 148.86 6.01 -5 4 1 149.34 5.26 5 -4 -1 154.79 6.10 5 -4 0 457.47 12.94 5 -4 0 473.30 12.57 5 -4 0 443.07 12.78 5 -4 0 423.98 16.53 5 -4 0 455.21 13.39 5 -4 0 444.39 12.81 5 -4 1 29.38 2.60 5 -4 1 27.98 2.46 5 -4 1 28.14 2.28 5 -4 1 27.68 1.91 5 -4 1 30.45 2.38 5 -4 2 118.16 5.36 5 -4 2 122.13 5.60 5 -4 2 115.30 5.13 5 -4 2 110.85 4.91 5 -4 2 122.85 5.16 5 -4 2 118.48 4.85 5 -4 2 122.39 4.66 5 -4 3 15.67 1.75 5 -4 3 15.28 1.80 5 -4 3 12.36 1.39 5 -4 3 15.23 1.66 5 -4 3 13.74 1.54 5 -4 3 15.51 1.56 5 -4 4 40.74 2.50 5 -4 4 39.09 2.84 5 -4 4 37.54 2.42 5 -4 4 39.30 2.62 5 -4 4 41.73 2.68 5 -4 4 43.35 2.68 5 -4 5 149.11 5.23 5 -4 5 152.93 5.60 5 -4 5 151.87 5.46 5 -4 5 149.87 5.71 5 -4 5 149.10 5.45 5 -4 6 13.06 1.35 5 -4 6 11.98 1.42 5 -4 6 12.30 1.49 5 -4 6 13.77 1.34 5 -4 6 12.87 1.41 5 -4 7 21.84 1.63 5 -4 7 21.91 1.85 5 -4 7 21.72 1.86 5 -4 7 20.84 1.67 5 -4 8 0.66 0.33 5 -4 8 0.25 0.25 5 -4 8 0.58 0.42 5 -4 8 0.31 0.35 5 -4 9 17.58 1.11 5 -4 9 18.17 1.36 5 -4 10 9.25 0.75 5 -4 10 8.29 0.67 -5 3 10 104.99 3.00 5 -3 -9 4.17 0.63 -5 3 9 4.75 0.59 5 -3 -9 4.67 0.63 -5 3 9 4.84 0.63 -5 3 8 55.73 2.60 -5 3 8 51.20 2.56 5 -3 -8 52.26 2.52 -5 3 8 52.54 2.41 -5 3 8 49.70 2.50 -5 3 7 78.44 3.47 -5 3 7 68.54 3.07 5 -3 -7 69.71 3.28 -5 3 7 74.92 3.37 -5 3 6 1.20 0.46 -5 3 6 0.75 0.45 5 -3 -6 0.28 0.34 -5 3 6 0.47 0.35 -5 3 6 1.04 0.49 -5 3 5 1.18 0.48 -5 3 5 2.08 0.61 5 -3 -5 1.32 0.54 -5 3 5 1.37 0.46 -5 3 5 2.31 0.67 -5 3 4 16.28 1.60 5 -3 -4 16.18 1.62 -5 3 4 16.56 1.62 5 -3 -4 14.39 1.45 -5 3 4 14.61 1.53 5 -3 -4 16.24 1.83 5 -3 -3 48.36 3.26 -5 3 3 46.89 2.77 -5 3 3 44.39 2.74 -5 3 3 43.75 2.71 5 -3 -3 42.05 4.13 5 -3 -3 47.01 2.70 5 -3 -3 45.93 2.83 5 -3 -3 47.22 4.74 5 -3 -3 43.45 2.69 5 -3 -3 49.37 2.88 5 -3 -2 18.48 1.86 5 -3 -2 25.48 3.43 5 -3 -2 19.27 1.80 5 -3 -2 18.01 1.69 5 -3 -2 18.19 1.72 -5 3 2 21.56 1.78 5 -3 -2 19.21 1.70 5 -3 -2 16.66 1.90 -5 3 2 18.16 1.67 -5 3 2 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4.09 -8 -5 -6 29.37 2.11 8 5 6 28.53 2.03 -8 -5 -6 29.87 2.16 8 5 6 26.89 1.97 8 5 6 27.85 1.81 8 5 7 1.66 0.46 8 5 7 1.58 0.57 -8 -5 -7 1.58 0.51 8 5 7 3.11 0.69 -8 -5 -7 1.20 0.48 8 5 8 15.41 1.40 -8 -5 -8 17.96 1.55 -8 -5 -8 15.68 1.38 8 5 8 15.69 1.22 -8 -5 -8 15.38 1.36 8 5 8 14.69 1.36 -8 -5 -9 31.15 1.94 -8 -5 -9 31.80 1.87 -8 -5 -9 28.87 1.84 8 5 9 33.14 1.99 -8 -5 -9 28.25 1.60 8 5 9 29.77 1.86 8 5 10 7.16 0.82 -8 -5 -10 6.56 0.79 -8 -5 -10 6.73 0.79 8 5 10 6.00 0.78 -8 -5 -11 0.38 0.21 -8 -5 -11 0.14 0.21 8 5 11 0.51 0.23 8 5 11 0.13 0.20 8 6 -1 18.56 1.11 -8 -6 0 2.06 0.37 8 6 0 2.99 0.53 8 6 1 128.24 4.08 8 6 1 116.06 3.52 8 6 2 0.48 0.25 -8 -6 -2 0.77 0.33 8 6 2 0.47 0.36 -8 -6 -2 0.75 0.37 8 6 2 0.60 0.32 8 6 3 2.88 0.62 -8 -6 -3 3.39 0.70 8 6 3 2.00 0.50 8 6 3 2.46 0.51 8 6 4 17.46 1.45 8 6 4 13.60 1.17 8 6 4 18.20 1.41 8 6 5 10.42 1.14 -8 -6 -5 10.48 1.24 8 6 5 8.19 0.99 8 6 5 8.09 0.90 8 6 6 44.41 2.35 8 6 6 44.24 2.38 -8 -6 -6 43.21 2.50 -8 -6 -6 43.54 2.41 -8 -6 -7 8.45 1.03 8 6 7 8.26 0.98 8 6 7 7.06 0.81 8 6 7 7.42 0.94 -8 -6 -7 8.06 1.01 8 6 8 56.34 2.58 -8 -6 -8 54.40 2.55 8 6 8 60.12 2.65 8 6 8 55.04 2.33 8 6 9 33.58 1.80 8 6 9 33.92 1.82 8 6 9 32.69 1.82 -8 -6 -9 34.93 1.94 -8 -6 -9 30.98 1.55 8 6 10 1.57 0.40 -8 -6 -10 2.07 0.46 8 6 10 2.21 0.44 -8 -6 -11 35.41 1.50 8 6 11 36.99 1.56 8 7 1 93.03 2.90 8 7 2 2.66 0.47 8 7 3 34.03 1.70 -8 -7 -3 31.94 1.75 8 7 4 141.75 4.11 -8 -7 -4 137.47 4.36 8 7 5 412.00 10.01 -8 -7 -5 419.88 10.48 8 7 5 385.43 9.48 8 7 6 121.00 3.74 -8 -7 -6 118.95 3.96 8 7 6 128.42 4.00 -8 -7 -6 131.48 4.37 -8 -7 -7 17.62 1.28 8 7 7 14.92 1.03 8 7 7 17.48 1.15 -8 -7 -7 14.83 0.99 -8 -7 -7 17.00 1.21 8 7 8 71.00 2.49 -8 -7 -8 74.25 2.78 8 7 8 70.16 2.48 -8 -7 -8 72.95 2.65 8 7 9 0.99 0.30 8 7 9 1.00 0.25 -8 -7 -10 2.39 0.37 -8 -8 -5 2.14 0.35 -8 -8 -5 2.86 0.42 -8 -8 -6 91.15 2.90 -8 -8 -6 91.89 2.87 -8 -8 -7 50.92 1.97 -9 0 -3 92.64 2.79 -9 0 -3 93.94 2.79 -9 0 -4 25.19 1.17 -9 0 -4 25.66 1.17 9 1 1 8.87 0.72 9 1 2 8.22 0.77 -9 -1 -2 7.87 0.73 -9 -1 -2 8.40 0.72 9 1 3 9.54 0.85 -9 -1 -3 9.67 0.82 -9 -1 -4 33.70 1.63 -9 -1 -4 28.28 1.51 -9 -1 -5 57.85 2.22 -9 -1 -5 57.81 2.24 -9 -1 -6 1.50 0.34 -9 -1 -6 1.10 0.27 -9 -1 -6 0.98 0.26 -9 -1 -6 0.85 0.26 -9 -1 -7 40.16 1.55 -9 -1 -7 39.83 1.56 9 2 0 33.65 1.38 9 2 0 32.16 1.48 9 2 1 51.87 2.01 9 2 1 58.67 2.29 9 2 2 1.98 0.44 -9 -2 -2 2.17 0.42 9 2 3 16.43 1.24 -9 -2 -3 16.41 1.15 9 2 4 55.48 2.50 -9 -2 -4 58.28 2.40 -9 -2 -5 7.52 0.79 -9 -2 -5 8.37 0.84 -9 -2 -5 7.01 0.78 -9 -2 -6 8.27 0.79 -9 -2 -6 8.18 0.80 -9 -2 -7 12.75 0.95 -9 -2 -7 10.16 0.74 -9 -2 -7 13.51 0.94 -9 -2 -7 13.60 0.92 -9 -2 -8 31.39 1.39 -9 -2 -8 29.53 1.33 9 3 0 19.63 1.05 9 3 1 10.85 0.88 9 3 2 53.59 2.31 9 3 2 55.34 2.29 -9 -3 -2 57.59 2.30 9 3 3 0.27 0.27 9 3 3 0.46 0.29 -9 -3 -3 0.50 0.29 -9 -3 -4 23.00 1.43 9 3 4 21.49 1.44 -9 -3 -4 22.50 1.48 9 3 4 21.65 1.37 -9 -3 -5 16.28 1.15 -9 -3 -5 17.50 1.28 -9 -3 -5 17.13 1.26 9 3 5 14.76 1.10 -9 -3 -6 0.61 0.29 -9 -3 -6 0.26 0.23 -9 -3 -6 0.05 0.22 -9 -3 -7 23.18 1.36 -9 -3 -7 20.68 1.22 -9 -3 -7 25.07 1.42 -9 -3 -8 9.50 0.78 -9 -3 -9 2.35 0.34 9 4 1 56.05 2.10 9 4 2 5.09 0.62 9 4 2 3.48 0.46 9 4 3 1.30 0.33 9 4 3 1.35 0.38 -9 -4 -3 2.27 0.46 9 4 4 15.81 1.09 9 4 4 16.24 1.09 -9 -4 -5 0.90 0.32 9 4 5 0.55 0.29 -9 -4 -5 0.98 0.38 -9 -4 -6 130.94 4.10 9 4 6 120.00 3.83 -9 -4 -6 131.86 4.11 9 4 6 120.66 3.93 -9 -4 -7 31.88 1.56 -9 -4 -7 30.84 1.53 9 4 7 28.70 1.48 -9 -4 -7 30.23 1.62 9 4 7 29.47 1.48 9 4 7 28.94 1.52 -9 -4 -8 7.92 0.71 -9 -4 -8 10.02 0.82 9 4 8 8.14 0.69 9 4 8 7.44 0.67 9 4 8 9.03 0.75 9 4 9 0.34 0.18 9 5 2 23.03 1.14 9 5 2 25.09 1.18 9 5 3 5.30 0.57 -9 -5 -3 5.07 0.60 9 5 3 6.36 0.63 9 5 4 12.28 0.92 9 5 4 12.48 0.95 9 5 5 6.83 0.69 -9 -5 -5 6.65 0.75 9 5 5 6.93 0.73 -9 -5 -6 58.69 2.33 -9 -5 -6 51.67 2.15 9 5 6 58.90 2.27 -9 -5 -7 3.18 0.46 -9 -5 -7 3.29 0.49 9 5 7 3.28 0.48 9 5 7 3.69 0.49 9 5 8 28.27 1.33 9 6 4 30.11 1.29 9 6 5 27.79 1.27 9 6 6 22.44 1.11 -9 -6 -6 22.32 1.15 0 0 0 0.00 0.00 TITL 23SAI_R048_2_g in P-1 REM P-1 (#2 in standard setting) CELL 1.54184 7.456809 8.417374 12.892761 74.0382 73.7634 72.7034 ZERR 2.00 0.000129 0.000103 0.000202 0.0012 0.0014 0.0013 LATT 1 SFAC C H N O F Cl UNIT 30.00 28.00 4.00 4.00 2.00 2.00 REM CrysAlisPro recorded range (K): Min=99.8; max=100.2; aver:100.0 TEMP -173 SIZE 0.15 0.19 0.33 TREF HKLF 4 END _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' ; _shelx_hkl_checksum 29193 _shelx_res_file ; TITL 23sai_r048_2_g_a.res in P-1 23sai_r048_2_g.res created by SHELXL-2018/3 at 18:26:35 on 05-Jun-2023 REM Old TITL 23SAI_R048_2_g in P-1 REM SHELXT solution in P-1 REM R1 0.092, Rweak 0.007, Alpha 0.046, Orientation as input REM Formula found by SHELXT: C15 N2 O2 F Cl CELL 1.54184 7.45681 8.41737 12.8928 74.0382 73.7634 72.7034 ZERR 2 0.00013 0.0001 0.0002 0.0012 0.0014 0.0013 LATT 1 SFAC C H Cl F N O UNIT 30 28 2 2 4 4 EQIV $1 1+X,1+Y,+Z EQIV $2 1-X,1-Y,1-Z EQIV $3 -1+X,+Y,+Z L.S. 11 PLAN 5 SIZE 0.15 0.19 0.33 TEMP -173 CONF HTAB O18 Cl1_$1 HTAB O18 Cl1_$2 HTAB N1 O18_$3 BOND $H list 4 MORE -1 fmap 2 53 acta REM REM REM WGHT 0.041500 0.403800 FVAR 0.87131 CL1 3 0.015424 0.110965 0.646998 11.00000 0.02505 0.02388 = 0.02491 -0.00495 -0.00593 -0.00803 F1 4 0.560452 -0.350981 1.028781 11.00000 0.04550 0.02801 = 0.02835 0.00549 -0.01202 -0.00338 O18 6 0.907229 0.804668 0.610016 11.00000 0.02837 0.01974 = 0.02405 -0.00447 -0.00577 -0.00534 N4 5 0.371561 0.274223 0.621145 11.00000 0.02000 0.01768 = 0.01959 -0.00465 -0.00354 -0.00502 N1 5 0.141817 0.497672 0.657944 11.00000 0.02213 0.01883 = 0.02168 -0.00505 -0.00518 -0.00114 C8A 1 0.262897 0.426546 0.575374 11.00000 0.01952 0.01745 = 0.02279 -0.00484 -0.00461 -0.00511 C11 1 0.378847 0.087408 0.811511 11.00000 0.02314 0.02030 = 0.01888 -0.00565 -0.00393 -0.00312 C5 1 0.510117 0.172101 0.555689 11.00000 0.02008 0.01781 = 0.02646 -0.00680 -0.00318 -0.00465 AFIX 43 H5 2 0.586532 0.067821 0.587952 11.00000 -1.20000 AFIX 0 C12 1 0.571399 0.033016 0.818462 11.00000 0.02364 0.02320 = 0.02158 -0.00596 -0.00303 -0.00412 AFIX 43 H12 2 0.660070 0.098082 0.773040 11.00000 -1.20000 AFIX 0 C3 1 0.308856 0.246180 0.735819 11.00000 0.02137 0.02148 = 0.02047 -0.00481 -0.00454 -0.00598 C7 1 0.419165 0.378122 0.394482 11.00000 0.02674 0.02254 = 0.02198 -0.00483 -0.00225 -0.01258 C2 1 0.168991 0.387882 0.756891 11.00000 0.02178 0.02228 = 0.02019 -0.00365 -0.00469 -0.00439 C8 1 0.285240 0.481183 0.460324 11.00000 0.02451 0.01869 = 0.02269 -0.00314 -0.00636 -0.00705 AFIX 43 H8 2 0.209704 0.586666 0.428855 11.00000 -1.20000 AFIX 0 C14 1 0.501453 -0.206443 0.956268 11.00000 0.03562 0.02165 = 0.01940 -0.00259 -0.00767 -0.00154 C16 1 0.248224 -0.008870 0.877090 11.00000 0.02487 0.02858 = 0.02613 -0.00316 -0.00509 -0.00679 AFIX 43 H16 2 0.117247 0.027457 0.871462 11.00000 -1.20000 AFIX 0 C6 1 0.535092 0.223421 0.444494 11.00000 0.02422 0.02183 = 0.02469 -0.00944 -0.00061 -0.00729 AFIX 43 H6 2 0.631903 0.154967 0.398747 11.00000 -1.20000 AFIX 0 C13 1 0.634316 -0.115840 0.891464 11.00000 0.02601 0.02505 = 0.02351 -0.00753 -0.00690 0.00072 AFIX 43 H13 2 0.765513 -0.154250 0.896619 11.00000 -1.20000 AFIX 0 C17 1 0.440603 0.422183 0.271520 11.00000 0.03755 0.03009 = 0.02190 -0.00541 -0.00207 -0.01347 AFIX 137 H17A 2 0.374708 0.355153 0.250243 11.00000 -1.50000 H17B 2 0.577414 0.396555 0.235805 11.00000 -1.50000 H17C 2 0.383705 0.543651 0.248116 11.00000 -1.50000 AFIX 0 C15 1 0.310255 -0.157767 0.950512 11.00000 0.03304 0.03053 = 0.02436 0.00065 -0.00364 -0.01133 AFIX 43 H15 2 0.223073 -0.224471 0.995677 11.00000 -1.20000 AFIX 0 C9 1 0.071881 0.432004 0.864029 11.00000 0.03063 0.03207 = 0.02272 -0.00726 -0.00393 0.00104 AFIX 43 H9 2 0.092957 0.349329 0.929217 11.00000 -1.20000 AFIX 0 H18A 2 0.937496 0.886606 0.624307 11.00000 0.04610 H18B 2 0.925978 0.829880 0.537999 11.00000 0.04503 H1 2 0.058673 0.602367 0.646572 11.00000 0.04233 O10 6 -0.033628 0.568911 0.872792 11.00000 0.06983 0.04665 = 0.03038 -0.01521 -0.00818 0.02630 HKLF 4 REM 23sai_r048_2_g_a.res in P-1 REM wR2 = 0.0858, GooF = S = 1.028, Restrained GooF = 1.028 for all data REM R1 = 0.0334 for 3033 Fo > 4sig(Fo) and 0.0338 for all 3082 data REM 203 parameters refined using 0 restraints END WGHT 0.0415 0.4057 REM Highest difference peak 0.336, deepest hole -0.239, 1-sigma level 0.049 Q1 1 0.1043 0.5762 0.8804 11.00000 0.05 0.34 Q2 1 -0.1400 0.4676 0.8661 11.00000 0.05 0.30 Q3 1 0.0416 0.3162 0.9415 11.00000 0.05 0.30 Q4 1 0.4615 0.2964 0.4227 11.00000 0.05 0.26 Q5 1 0.2481 0.3144 0.7485 11.00000 0.05 0.23 ; _shelx_res_checksum 57772 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Cl Cl1 0.01542(4) 0.11097(4) 0.64700(3) 0.02403(11) Uani d 1 . . F F1 0.56045(14) -0.35098(11) 1.02878(8) 0.0367(2) Uani d 1 . . O O18 0.90723(15) 0.80467(12) 0.61002(9) 0.0241(2) Uani d 1 . . N N4 0.37156(15) 0.27422(14) 0.62115(9) 0.0190(2) Uani d 1 . . N N1 0.14182(17) 0.49767(15) 0.65794(10) 0.0215(2) Uani d 1 . . C C8A 0.26290(18) 0.42655(16) 0.57537(11) 0.0196(3) Uani d 1 . . C C11 0.37885(19) 0.08741(17) 0.81151(11) 0.0210(3) Uani d 1 . . C C5 0.51012(19) 0.17210(16) 0.55569(12) 0.0214(3) Uani d 1 . . H H5 0.586532 0.067821 0.587952 0.026 Uiso calc 1 . . C C12 0.5714(2) 0.03302(17) 0.81846(11) 0.0233(3) Uani d 1 . . H H12 0.660070 0.098082 0.773040 0.028 Uiso calc 1 . . C C3 0.30886(19) 0.24618(17) 0.73582(11) 0.0208(3) Uani d 1 . . C C7 0.4192(2) 0.37812(17) 0.39448(11) 0.0228(3) Uani d 1 . . C C2 0.16899(19) 0.38788(17) 0.75689(11) 0.0217(3) Uani d 1 . . C C8 0.28524(19) 0.48118(17) 0.46032(11) 0.0215(3) Uani d 1 . . H H8 0.209704 0.586666 0.428855 0.026 Uiso calc 1 . . C C14 0.5015(2) -0.20644(18) 0.95627(12) 0.0267(3) Uani d 1 . . C C16 0.2482(2) -0.00887(19) 0.87709(12) 0.0271(3) Uani d 1 . . H H16 0.117247 0.027457 0.871462 0.032 Uiso calc 1 . . C C6 0.5351(2) 0.22342(17) 0.44449(12) 0.0232(3) Uani d 1 . . H H6 0.631903 0.154967 0.398747 0.028 Uiso calc 1 . . C C13 0.6343(2) -0.11584(18) 0.89146(12) 0.0256(3) Uani d 1 . . H H13 0.765513 -0.154250 0.896619 0.031 Uiso calc 1 . . C C17 0.4406(2) 0.4222(2) 0.27152(12) 0.0295(3) Uani d 1 . . H H17A 0.374708 0.355153 0.250243 0.044 Uiso calc 1 . . H H17B 0.577414 0.396555 0.235805 0.044 Uiso calc 1 . . H H17C 0.383705 0.543651 0.248116 0.044 Uiso calc 1 . . C C15 0.3103(2) -0.1578(2) 0.95051(12) 0.0303(3) Uani d 1 . . H H15 0.223073 -0.224471 0.995677 0.036 Uiso calc 1 . . C C9 0.0719(2) 0.4320(2) 0.86403(12) 0.0305(3) Uani d 1 . . H H9 0.092957 0.349329 0.929217 0.037 Uiso calc 1 . . H H18A 0.937(3) 0.887(3) 0.6243(19) 0.046(6) Uiso d 1 . . H H18B 0.926(3) 0.830(3) 0.538(2) 0.045(6) Uiso d 1 . . H H1 0.059(3) 0.602(3) 0.6466(17) 0.042(5) Uiso d 1 . . O O10 -0.0336(2) 0.56891(18) 0.87279(11) 0.0572(4) Uani d 1 . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Cl1 0.02505(17) 0.02388(17) 0.02491(17) -0.00803(12) -0.00593(12) -0.00495(12) F1 0.0455(6) 0.0280(5) 0.0283(5) -0.0034(4) -0.0120(4) 0.0055(4) O18 0.0284(5) 0.0197(5) 0.0241(5) -0.0053(4) -0.0058(4) -0.0045(4) N4 0.0200(5) 0.0177(5) 0.0196(5) -0.0050(4) -0.0035(4) -0.0047(4) N1 0.0221(5) 0.0188(5) 0.0217(6) -0.0011(4) -0.0052(4) -0.0050(4) C8A 0.0195(6) 0.0174(6) 0.0228(6) -0.0051(5) -0.0046(5) -0.0048(5) C11 0.0231(6) 0.0203(6) 0.0189(6) -0.0031(5) -0.0039(5) -0.0057(5) C5 0.0201(6) 0.0178(6) 0.0265(7) -0.0047(5) -0.0032(5) -0.0068(5) C12 0.0236(6) 0.0232(6) 0.0216(6) -0.0041(5) -0.0030(5) -0.0060(5) C3 0.0214(6) 0.0215(6) 0.0205(6) -0.0060(5) -0.0045(5) -0.0048(5) C7 0.0267(7) 0.0225(6) 0.0220(6) -0.0126(5) -0.0023(5) -0.0048(5) C2 0.0218(6) 0.0223(6) 0.0202(6) -0.0044(5) -0.0047(5) -0.0036(5) C8 0.0245(6) 0.0187(6) 0.0227(6) -0.0070(5) -0.0064(5) -0.0031(5) C14 0.0356(8) 0.0216(7) 0.0194(6) -0.0015(6) -0.0077(6) -0.0026(5) C16 0.0249(7) 0.0286(7) 0.0261(7) -0.0068(6) -0.0051(5) -0.0032(6) C6 0.0242(6) 0.0218(6) 0.0247(7) -0.0073(5) -0.0006(5) -0.0094(5) C13 0.0260(7) 0.0250(7) 0.0235(7) 0.0007(5) -0.0069(5) -0.0075(5) C17 0.0375(8) 0.0301(7) 0.0219(7) -0.0135(6) -0.0021(6) -0.0054(6) C15 0.0330(8) 0.0305(8) 0.0244(7) -0.0113(6) -0.0036(6) 0.0006(6) C9 0.0306(7) 0.0321(8) 0.0227(7) 0.0010(6) -0.0039(6) -0.0073(6) O10 0.0698(10) 0.0467(8) 0.0304(6) 0.0263(7) -0.0082(6) -0.0152(6) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _exptl_crystal_face_index_h _exptl_crystal_face_index_k _exptl_crystal_face_index_l _exptl_crystal_face_perp_dist -1 0 0 0.0693 1 0 0 0.0862 0 -1 -1 0.1082 0 1 1 0.0851 0 0 1 0.0923 0 0 -1 0.0612 loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag H18A O18 H18B . . 103(2) ? C8A N4 C5 . . 121.11(12) ? C8A N4 C3 . . 108.76(11) ? C5 N4 C3 . . 130.04(11) ? C8A N1 C2 . . 108.37(11) ? C8A N1 H1 . . 123.1(13) ? C2 N1 H1 . . 128.5(13) ? N4 C8A C8 . . 121.05(12) ? N1 C8A N4 . . 108.00(11) ? N1 C8A C8 . . 130.92(12) ? C12 C11 C3 . . 121.05(12) ? C12 C11 C16 . . 120.14(13) ? C16 C11 C3 . . 118.81(12) ? N4 C5 H5 . . 120.7 ? C6 C5 N4 . . 118.69(12) ? C6 C5 H5 . . 120.7 ? C11 C12 H12 . . 119.9 ? C13 C12 C11 . . 120.26(13) ? C13 C12 H12 . . 119.9 ? N4 C3 C11 . . 123.90(11) ? C2 C3 N4 . . 105.71(11) ? C2 C3 C11 . . 130.28(12) ? C8 C7 C6 . . 119.34(13) ? C8 C7 C17 . . 121.11(13) ? C6 C7 C17 . . 119.51(13) ? N1 C2 C9 . . 122.80(12) ? C3 C2 N1 . . 109.06(12) ? C3 C2 C9 . . 127.88(13) ? C8A C8 H8 . . 120.9 ? C7 C8 C8A . . 118.26(12) ? C7 C8 H8 . . 120.9 ? F1 C14 C13 . . 118.85(13) ? F1 C14 C15 . . 118.03(13) ? C13 C14 C15 . . 123.12(13) ? C11 C16 H16 . . 120.1 ? C15 C16 C11 . . 119.86(13) ? C15 C16 H16 . . 120.1 ? C5 C6 C7 . . 121.48(12) ? C5 C6 H6 . . 119.3 ? C7 C6 H6 . . 119.3 ? C12 C13 H13 . . 120.9 ? C14 C13 C12 . . 118.22(13) ? C14 C13 H13 . . 120.9 ? C7 C17 H17A . . 109.5 ? C7 C17 H17B . . 109.5 ? C7 C17 H17C . . 109.5 ? H17A C17 H17B . . 109.5 ? H17A C17 H17C . . 109.5 ? H17B C17 H17C . . 109.5 ? C14 C15 C16 . . 118.39(14) ? C14 C15 H15 . . 120.8 ? C16 C15 H15 . . 120.8 ? C2 C9 H9 . . 118.8 ? O10 C9 C2 . . 122.45(14) ? O10 C9 H9 . . 118.8 ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag F1 C14 . 1.3542(16) ? O18 H18A . 0.86(2) ? O18 H18B . 0.87(2) ? N4 C8A . 1.3719(17) ? N4 C5 . 1.3791(17) ? N4 C3 . 1.3955(17) ? N1 C8A . 1.3411(17) ? N1 C2 . 1.3811(17) ? N1 H1 . 0.92(2) ? C8A C8 . 1.4042(19) ? C11 C12 . 1.3920(19) ? C11 C3 . 1.4709(18) ? C11 C16 . 1.3973(19) ? C5 H5 . 0.9500 ? C5 C6 . 1.354(2) ? C12 H12 . 0.9500 ? C12 C13 . 1.387(2) ? C3 C2 . 1.3654(19) ? C7 C8 . 1.3734(19) ? C7 C6 . 1.428(2) ? C7 C17 . 1.4988(19) ? C2 C9 . 1.4605(19) ? C8 H8 . 0.9500 ? C14 C13 . 1.377(2) ? C14 C15 . 1.379(2) ? C16 H16 . 0.9500 ? C16 C15 . 1.389(2) ? C6 H6 . 0.9500 ? C13 H13 . 0.9500 ? C17 H17A . 0.9800 ? C17 H17B . 0.9800 ? C17 H17C . 0.9800 ? C15 H15 . 0.9500 ? C9 H9 . 0.9500 ? C9 O10 . 1.2011(19) ? loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_site_symmetry_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_publ_flag N1 H1 O18 1_455 0.91(2) 1.77(2) 2.6754(16) 174(2) yes O18 H18A Cl1 1_665 0.87(2) 2.24(2) 3.1070(11) 175(2) yes O18 H18B Cl1 2_666 0.87(2) 2.24(2) 3.1142(11) 178.0(19) yes C8 H8 Cl1 2_566 0.95 2.69 3.6431(15) 176.00 yes C12 H12 Cl1 1_655 0.95 2.71 3.5610(16) 150.00 yes C13 H13 O10 1_645 0.95 2.41 3.057(2) 125.00 yes loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion _geom_torsion_publ_flag F1 C14 C13 C12 . . . . -179.27(12) ? F1 C14 C15 C16 . . . . 179.42(13) ? N4 C8A C8 C7 . . . . -0.07(19) ? N4 C5 C6 C7 . . . . -1.2(2) ? N4 C3 C2 N1 . . . . 1.89(15) ? N4 C3 C2 C9 . . . . -172.39(14) ? N1 C8A C8 C7 . . . . -177.93(13) ? N1 C2 C9 O10 . . . . -2.3(3) ? C8A N4 C5 C6 . . . . -1.22(18) ? C8A N4 C3 C11 . . . . 173.45(12) ? C8A N4 C3 C2 . . . . -3.04(14) ? C8A N1 C2 C3 . . . . -0.05(15) ? C8A N1 C2 C9 . . . . 174.58(13) ? C11 C12 C13 C14 . . . . -0.2(2) ? C11 C3 C2 N1 . . . . -174.29(13) ? C11 C3 C2 C9 . . . . 11.4(2) ? C11 C16 C15 C14 . . . . -0.1(2) ? C5 N4 C8A N1 . . . . -179.80(11) ? C5 N4 C8A C8 . . . . 1.90(18) ? C5 N4 C3 C11 . . . . -3.3(2) ? C5 N4 C3 C2 . . . . -179.83(13) ? C12 C11 C3 N4 . . . . 62.54(18) ? C12 C11 C3 C2 . . . . -121.88(16) ? C12 C11 C16 C15 . . . . 1.0(2) ? C3 N4 C8A N1 . . . . 3.08(14) ? C3 N4 C8A C8 . . . . -175.22(12) ? C3 N4 C5 C6 . . . . 175.22(12) ? C3 C11 C12 C13 . . . . 179.08(12) ? C3 C11 C16 C15 . . . . -178.93(13) ? C3 C2 C9 O10 . . . . 171.26(17) ? C2 N1 C8A N4 . . . . -1.87(15) ? C2 N1 C8A C8 . . . . 176.21(13) ? C8 C7 C6 C5 . . . . 3.0(2) ? C16 C11 C12 C13 . . . . -0.8(2) ? C16 C11 C3 N4 . . . . -117.56(15) ? C16 C11 C3 C2 . . . . 58.0(2) ? C6 C7 C8 C8A . . . . -2.29(19) ? C13 C14 C15 C16 . . . . -1.0(2) ? C17 C7 C8 C8A . . . . 175.47(12) ? C17 C7 C6 C5 . . . . -174.78(13) ? C15 C14 C13 C12 . . . . 1.2(2) ? _cod_database_fobs_code 2022859