#------------------------------------------------------------------------------ #$Date: 2019-12-18 08:29:46 +0200 (Wed, 18 Dec 2019) $ #$Revision: 245307 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/24/32/2243215.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_2243215 loop_ _publ_author_name 'Shaibah, Mohammed A. E.' 'Yathirajan, Hemmige S.' 'Manju, Nagaraj' 'Kalluraya, Balakrishna' 'Rathore, Ravindranath S.' 'Glidewell, Christopher' _publ_section_title ; Two isostructural 3-(5-aryloxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-1-(thiophen-2-yl)prop-2-en-1-ones: disorder and supramolecular assembly ; _journal_coeditor_code ZL2765 _journal_issue 1 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first 48 _journal_page_last 52 _journal_paper_doi 10.1107/S205698901901658X _journal_volume 76 _journal_year 2020 _chemical_formula_iupac 'C24 H20 N2 O2 S' _chemical_formula_moiety 'C24 H20 N2 O2 S' _chemical_formula_sum 'C24 H20 N2 O2 S' _chemical_formula_weight 400.48 _chemical_name_systematic 3-[3-Methyl-5-(2-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]-1-(thiophen-2-yl)prop-2-en-1-one _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2ybc' _space_group_name_H-M_alt 'P 1 21/c 1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary difmap _audit_creation_method SHELXL-2014 _cell_angle_alpha 90 _cell_angle_beta 93.106(2) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 9.4336(4) _cell_length_b 20.6071(9) _cell_length_c 10.5866(4) _cell_measurement_reflns_used 5216 _cell_measurement_temperature 296(2) _cell_measurement_theta_max 28.545 _cell_measurement_theta_min 1.976 _cell_volume 2055.00(15) _computing_cell_refinement ; SAINT (Bruker, 2017) ; _computing_data_collection ; APEX2 (Bruker, 2012) ; _computing_data_reduction ; SAINT (Bruker, 2017) ; _computing_molecular_graphics ; PLATON (Spek, 2009) ; _computing_publication_material ; SHELXL2014 (Sheldrick, 2015b) and PLATON (Spek, 2009) ; _computing_structure_refinement ; SHELXL2014 (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXT (Sheldrick, 2015a) ; _diffrn_ambient_temperature 296(2) _diffrn_detector_area_resol_mean 7.3910 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 1.000 _diffrn_measurement_device_type ; Bruker Kappa APEXII CCD ; _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_monochromator graphite _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0401 _diffrn_reflns_av_unetI/netI 0.0305 _diffrn_reflns_limit_h_max 11 _diffrn_reflns_limit_h_min -12 _diffrn_reflns_limit_k_max 26 _diffrn_reflns_limit_k_min -26 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_limit_l_min -13 _diffrn_reflns_number 35938 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.549 _diffrn_reflns_theta_min 1.976 _diffrn_source 'fine-focus sealed tube' _diffrn_standards_decay_% 0 _diffrn_standards_interval_count 0 _diffrn_standards_interval_time 0 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 0.180 _exptl_absorpt_correction_T_max 0.973 _exptl_absorpt_correction_T_min 0.926 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (SADABS; Bruker, 2012) ; _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 1.294 _exptl_crystal_description block _exptl_crystal_F_000 840 _exptl_crystal_size_max 0.300 _exptl_crystal_size_mid 0.200 _exptl_crystal_size_min 0.150 _refine_diff_density_max 0.189 _refine_diff_density_min -0.229 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.019 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 277 _refine_ls_number_reflns 4735 _refine_ls_number_restraints 10 _refine_ls_restrained_S_all 1.019 _refine_ls_R_factor_all 0.0912 _refine_ls_R_factor_gt 0.0446 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0624P)^2^+0.5761P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1105 _refine_ls_wR_factor_ref 0.1417 _reflns_number_gt 2877 _reflns_number_total 4735 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file zl2765sup1.cif _cod_data_source_block II _cod_original_sg_symbol_H-M 'P 21/c' _cod_database_code 2243215 _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 0.948 _shelx_estimated_absorpt_t_max 0.974 _shelx_hkl_file ; 1 0 0 96.99 2.20 1 0 0 99.59 2.30 2 0 0 1669.43 37.70 2 0 0 1625.64 30.90 -2 0 0 1635.84 31.00 -2 0 0 1649.33 30.90 2 0 0 1660.23 32.60 -2 0 0 1631.04 32.60 2 0 0 1596.34 30.10 2 0 0 1635.64 31.00 -2 0 0 1650.53 30.60 -2 0 0 1645.64 37.70 -3 0 0 12.40 1.10 3 0 0 12.50 0.50 -3 0 0 13.10 0.60 -3 0 0 12.60 1.00 -3 0 0 15.10 0.90 3 0 0 14.80 1.00 -3 0 0 13.60 1.40 3 0 0 14.00 1.00 3 0 0 13.70 1.00 -3 0 0 12.70 0.80 4 0 0 8.30 1.00 -4 0 0 7.10 1.00 -4 0 0 7.90 0.50 -4 0 0 8.30 0.80 4 0 0 7.40 0.90 4 0 0 8.10 0.80 -4 0 0 10.00 0.90 -4 0 0 5.70 1.00 -5 0 0 1.50 0.80 5 0 0 4.90 1.00 5 0 0 2.70 0.70 -5 0 0 2.50 1.00 -5 0 0 2.40 0.30 5 0 0 3.10 0.70 -5 0 0 3.40 0.80 -5 0 0 2.30 0.60 -6 0 0 52.09 1.40 6 0 0 48.50 2.50 -6 0 0 53.49 3.70 -6 0 0 52.79 2.70 -6 0 0 52.79 2.70 -6 0 0 57.09 2.50 6 0 0 50.79 2.10 -7 0 0 17.00 1.70 7 0 0 13.50 1.30 -7 0 0 11.50 1.70 -7 0 0 14.50 0.60 -7 0 0 9.90 1.80 7 0 0 13.60 1.80 8 0 0 22.10 1.60 8 0 0 18.80 2.20 -8 0 0 16.20 2.50 -8 0 0 21.90 2.40 -8 0 0 22.20 2.00 -9 0 0 64.99 5.40 9 0 0 65.19 3.60 -9 0 0 56.99 3.70 -9 0 0 59.19 3.20 -9 0 0 58.69 4.00 -10 0 0 -0.70 1.30 -10 0 0 -0.40 1.40 -10 0 0 0.90 1.40 -11 0 0 16.90 2.90 -11 0 0 14.50 3.00 -11 0 0 18.40 3.50 -12 0 0 -0.50 2.30 -12 0 0 -2.20 1.90 -12 0 0 1.60 2.50 0 -1 0 -0.30 0.10 0 -1 0 -0.20 0.10 0 -1 0 -0.30 0.10 0 -1 0 -0.30 0.10 0 -1 0 -0.30 0.10 0 -1 0 -0.30 0.10 0 1 0 -0.30 0.10 0 1 0 -0.30 0.10 0 1 0 -0.30 0.10 0 1 0 -0.20 0.10 0 1 0 -0.20 0.10 0 1 0 -0.20 0.10 1 -1 0 51.39 1.50 1 -1 0 70.59 2.10 -1 -1 0 68.99 1.70 1 -1 0 70.29 1.60 1 -1 0 66.19 1.80 -1 -1 0 60.69 1.60 1 1 0 71.49 1.80 -1 1 0 54.99 1.50 1 1 0 50.89 1.50 1 1 0 70.19 1.60 -1 1 0 59.19 1.40 -2 -1 0 318.47 6.60 2 -1 0 318.17 8.20 2 -1 0 315.47 6.60 -2 -1 0 318.07 7.10 2 -1 0 313.97 6.10 2 -1 0 316.57 6.20 2 -1 0 315.87 6.60 -2 -1 0 313.07 6.90 -2 -1 0 313.47 6.70 2 -1 0 314.97 6.60 2 1 0 316.67 6.90 -2 1 0 316.17 6.60 2 1 0 318.67 6.60 -2 1 0 315.47 6.60 -2 1 0 313.87 6.10 -2 1 0 317.57 8.30 2 1 0 322.97 6.70 -2 1 0 321.27 6.60 3 -1 0 334.47 7.20 -3 -1 0 338.17 9.10 -3 -1 0 330.57 7.80 3 -1 0 330.07 7.20 3 -1 0 332.27 9.10 3 -1 0 326.17 6.50 -3 -1 0 327.67 7.50 3 -1 0 336.07 7.20 3 -1 0 334.07 6.80 -3 -1 0 334.87 6.10 -3 -1 0 337.77 7.40 -3 -1 0 333.17 7.20 -3 1 0 322.47 9.10 -3 1 0 336.07 7.30 3 1 0 328.77 7.20 -3 1 0 335.77 6.50 3 1 0 337.67 7.60 3 1 0 335.07 7.30 -3 1 0 328.97 7.20 -3 1 0 342.17 7.20 4 -1 0 137.19 3.30 4 -1 0 141.49 3.10 -4 -1 0 136.29 3.80 -4 -1 0 137.89 5.00 -4 -1 0 136.49 2.70 -4 -1 0 141.29 4.00 4 -1 0 138.79 3.70 -4 -1 0 139.49 3.90 4 -1 0 138.59 3.80 4 1 0 137.49 3.80 -4 1 0 135.49 3.60 -4 1 0 131.59 5.00 -4 1 0 139.29 3.80 4 1 0 137.49 4.00 -4 1 0 135.59 3.90 -4 1 0 141.99 3.20 -5 -1 0 8.50 1.10 -5 -1 0 4.80 1.20 5 -1 0 7.90 0.80 5 -1 0 7.40 1.10 -5 -1 0 6.80 1.10 5 -1 0 8.00 0.90 -5 -1 0 6.10 0.90 -5 1 0 7.90 1.20 -5 1 0 7.60 1.10 5 1 0 8.50 1.10 5 1 0 6.20 1.10 -5 1 0 6.10 0.80 -5 1 0 5.70 1.10 -5 1 0 7.50 0.60 -6 -1 0 1.00 0.70 6 -1 0 0.90 0.90 6 -1 0 1.10 0.70 -6 -1 0 -0.30 0.90 -6 -1 0 0.40 0.80 6 -1 0 0.90 0.60 6 1 0 2.30 1.10 -6 1 0 1.30 0.90 -6 1 0 1.20 0.80 -6 1 0 0.80 0.80 -6 1 0 1.10 0.40 6 1 0 1.30 0.60 -6 1 0 1.80 0.70 -7 -1 0 31.20 2.20 -7 -1 0 40.70 3.30 7 -1 0 36.50 1.80 -7 -1 0 42.40 2.50 7 -1 0 37.20 2.40 -7 1 0 38.90 1.40 -7 1 0 38.20 2.60 -7 1 0 35.60 2.00 -7 1 0 37.30 3.00 7 1 0 38.40 2.00 7 1 0 39.60 2.50 -7 1 0 39.80 3.30 -8 -1 0 5.90 1.40 8 -1 0 9.30 1.80 -8 -1 0 12.30 2.10 -8 -1 0 6.40 1.90 -8 1 0 8.00 1.90 -8 1 0 9.30 1.30 8 1 0 11.10 1.80 -8 1 0 12.70 2.00 -8 1 0 7.80 2.00 8 1 0 9.50 1.30 -9 -1 0 34.30 3.10 9 -1 0 31.60 2.90 -9 -1 0 30.50 2.60 -9 -1 0 19.10 3.00 -9 1 0 38.90 3.70 -9 1 0 31.50 2.30 -9 1 0 27.30 3.60 9 1 0 28.50 2.00 -9 1 0 30.50 2.90 9 1 0 28.70 2.70 -10 -1 0 1.60 1.30 -10 -1 0 -1.10 1.20 -10 -1 0 2.10 2.10 -10 -1 0 1.10 1.70 -10 1 0 -1.90 1.10 -10 1 0 -1.00 1.80 -10 1 0 -2.10 1.40 -11 -1 0 3.40 1.80 -11 -1 0 4.00 2.00 -11 -1 0 2.80 2.40 -11 1 0 2.20 2.30 -11 1 0 2.10 2.00 -11 1 0 0.00 2.10 -12 -1 0 -1.30 2.10 -12 -1 0 0.70 2.20 -12 -1 0 1.10 2.30 -12 1 0 3.90 2.60 -12 1 0 -0.60 2.30 -12 1 0 -0.50 2.00 0 -2 0 178.78 3.70 0 2 0 161.68 3.40 1 -2 0 372.36 9.00 1 -2 0 358.96 7.30 1 -2 0 366.76 7.30 -1 -2 0 363.86 7.80 1 -2 0 365.36 7.10 1 -2 0 378.26 7.80 -1 -2 0 366.46 6.80 -1 -2 0 359.96 7.80 -1 -2 0 367.66 7.40 -1 2 0 373.16 7.80 -1 2 0 372.36 9.00 1 2 0 369.76 7.80 -1 2 0 368.26 7.30 1 2 0 377.06 7.40 -1 2 0 370.36 7.10 1 2 0 367.56 6.80 1 2 0 357.46 7.80 -1 2 0 364.36 7.30 -2 -2 0 1277.47 23.90 2 -2 0 1267.87 24.00 2 -2 0 1268.47 25.40 -2 -2 0 1246.08 25.40 2 -2 0 1252.27 23.10 2 -2 0 1263.47 29.20 -2 -2 0 1263.67 25.80 -2 -2 0 1238.98 24.10 2 -2 0 1253.77 23.90 2 -2 0 1264.57 25.40 -2 2 0 1246.68 23.10 -2 2 0 1233.18 23.50 2 2 0 1281.07 24.10 -2 2 0 1259.27 25.50 2 2 0 1227.08 23.90 2 2 0 1211.28 25.80 -2 2 0 1265.77 23.90 2 2 0 1272.07 25.50 -2 2 0 1251.47 24.00 -2 2 0 1252.77 29.20 -2 2 0 1250.07 25.40 -3 -2 0 1.00 0.50 3 -2 0 0.80 0.50 -3 -2 0 1.10 0.50 3 -2 0 1.40 0.50 3 -2 0 1.30 0.40 -3 -2 0 1.00 0.50 3 -2 0 1.60 0.30 -3 -2 0 1.30 0.50 3 -2 0 2.20 0.60 3 2 0 1.30 0.50 -3 2 0 1.00 0.30 -3 2 0 0.90 0.60 3 2 0 0.80 0.50 -3 2 0 1.60 0.40 -3 2 0 1.80 0.50 3 2 0 0.70 0.50 -3 2 0 0.70 0.50 -3 2 0 0.80 0.50 -4 -2 0 11.90 1.10 4 -2 0 14.50 0.90 -4 -2 0 15.00 1.20 -4 -2 0 8.90 1.30 4 -2 0 14.20 1.20 4 -2 0 11.60 0.80 -4 -2 0 13.60 1.10 -4 2 0 14.20 1.20 -4 2 0 9.20 1.30 4 2 0 12.70 1.20 -4 2 0 12.50 0.80 -4 2 0 13.40 1.10 -4 2 0 17.00 0.90 4 2 0 12.90 1.10 -4 2 0 12.20 1.20 -5 -2 0 8.40 1.20 -5 -2 0 7.30 1.00 5 -2 0 8.00 1.20 -5 -2 0 5.60 1.30 5 -2 0 5.40 0.80 -5 -2 0 7.70 1.10 -5 2 0 5.40 1.10 -5 2 0 5.40 1.10 -5 2 0 8.40 1.10 -5 2 0 8.20 0.70 5 2 0 7.60 1.20 -5 2 0 5.40 1.10 -5 2 0 6.50 0.70 -6 -2 0 6.80 1.10 -6 -2 0 5.70 1.20 6 -2 0 6.10 1.30 6 -2 0 6.90 0.90 -6 -2 0 6.00 1.50 -6 2 0 7.30 0.80 -6 2 0 6.00 1.30 -6 2 0 2.10 1.10 -6 2 0 6.60 1.60 6 2 0 6.10 1.30 -6 2 0 6.80 0.90 7 -2 0 0.70 0.70 -7 -2 0 0.70 0.90 -7 -2 0 1.10 1.20 -7 -2 0 1.30 0.90 7 -2 0 0.80 1.10 -7 2 0 1.70 0.70 -7 2 0 1.00 1.20 7 2 0 -0.10 1.00 -7 2 0 1.70 1.10 -7 2 0 1.00 0.50 7 2 0 0.40 0.80 -7 2 0 1.80 1.20 -8 -2 0 7.90 1.80 8 -2 0 7.00 1.70 -8 -2 0 6.40 1.40 -8 -2 0 5.50 1.60 -8 2 0 4.80 1.00 8 2 0 6.90 1.60 -8 2 0 5.10 1.50 8 2 0 7.00 1.30 -8 2 0 2.80 1.60 -8 2 0 4.80 1.70 -9 -2 0 57.09 3.70 -9 -2 0 54.19 4.60 -9 -2 0 44.90 3.00 9 -2 0 47.20 3.20 9 2 0 54.29 3.40 -9 2 0 52.79 2.60 -9 2 0 56.09 5.00 -9 2 0 52.99 4.30 9 2 0 48.70 2.70 -9 2 0 52.99 3.50 -10 -2 0 -1.40 1.20 -10 -2 0 0.20 1.70 -10 -2 0 0.70 1.80 -10 2 0 0.30 1.40 -10 2 0 -0.60 1.40 -10 2 0 1.10 1.50 -11 -2 0 0.80 1.90 -11 -2 0 1.60 2.00 -11 -2 0 -0.50 2.00 -11 2 0 1.00 1.90 -11 2 0 1.00 2.10 -11 2 0 1.00 2.20 -12 -2 0 10.00 2.90 -12 -2 0 16.80 3.40 -12 -2 0 8.70 3.00 -12 2 0 11.30 2.70 -12 2 0 12.30 3.00 -12 2 0 7.30 2.50 0 -3 0 -0.20 0.20 0 -3 0 -0.20 0.20 0 -3 0 0.00 0.20 0 -3 0 -0.30 0.20 0 -3 0 -0.40 0.20 0 -3 0 0.00 0.20 0 3 0 -0.50 0.20 0 3 0 -0.50 0.20 0 3 0 -0.50 0.30 0 3 0 -0.50 0.20 0 3 0 0.20 0.30 0 3 0 -0.70 0.20 -1 -3 0 156.58 3.90 1 -3 0 161.88 3.80 -1 -3 0 153.68 3.60 1 -3 0 157.08 3.30 1 -3 0 157.18 3.50 1 -3 0 153.48 3.50 -1 -3 0 157.38 3.70 1 -3 0 160.08 4.40 -1 -3 0 164.88 3.70 -1 -3 0 156.68 3.30 1 -3 0 156.48 3.60 1 3 0 152.58 3.70 -1 3 0 157.28 3.50 1 3 0 157.58 3.30 -1 3 0 159.68 3.80 -1 3 0 156.88 3.30 -1 3 0 156.58 4.40 -1 3 0 154.78 3.60 1 3 0 159.68 3.90 1 3 0 156.78 3.60 2 -3 0 171.68 3.80 2 -3 0 174.38 4.40 -2 -3 0 168.88 4.10 2 -3 0 170.88 5.10 2 -3 0 164.88 4.00 -2 -3 0 165.18 4.40 2 -3 0 173.88 4.00 -2 -3 0 173.68 4.30 -2 3 0 171.98 4.00 -2 3 0 169.08 4.00 -2 3 0 169.08 5.10 -2 3 0 167.88 4.40 2 3 0 168.18 4.00 2 3 0 167.28 4.40 -2 3 0 167.58 3.80 2 3 0 165.78 4.10 2 3 0 169.18 3.40 2 3 0 168.18 4.30 3 -3 0 0.20 0.30 3 -3 0 0.90 0.60 3 -3 0 0.70 0.40 3 -3 0 0.30 0.20 -3 -3 0 1.10 0.40 -3 -3 0 1.20 0.40 3 -3 0 1.40 0.50 -3 -3 0 0.00 0.50 -3 3 0 0.50 0.40 -3 3 0 0.70 0.50 -3 3 0 0.50 0.30 3 3 0 0.20 0.50 -3 3 0 0.80 0.40 -3 3 0 0.80 0.50 3 3 0 1.40 0.60 3 3 0 0.00 0.50 3 3 0 0.40 0.50 -3 3 0 0.50 0.50 4 -3 0 0.50 0.30 4 -3 0 -0.30 0.50 -4 -3 0 0.90 0.70 4 -3 0 0.10 0.70 -4 -3 0 0.10 0.50 -4 -3 0 -0.50 0.40 -4 3 0 0.60 0.70 4 3 0 0.50 0.60 -4 3 0 -0.20 0.50 -4 3 0 0.30 0.70 -4 3 0 0.00 0.30 -4 3 0 0.10 0.60 -4 3 0 0.10 0.40 4 3 0 0.20 0.50 -5 -3 0 109.29 3.80 5 -3 0 107.49 3.60 -5 -3 0 108.99 3.50 -5 -3 0 110.99 4.90 -5 -3 0 102.69 3.70 5 -3 0 108.89 3.00 5 -3 0 104.89 3.00 -5 3 0 112.09 4.30 5 3 0 108.49 3.60 -5 3 0 115.09 3.10 -5 3 0 107.59 3.50 -5 3 0 111.49 2.90 -5 3 0 114.79 3.70 -5 3 0 106.09 4.80 -6 -3 0 65.99 3.10 -6 -3 0 71.59 3.20 -6 -3 0 63.19 3.80 6 -3 0 69.99 3.00 6 -3 0 70.49 2.40 -6 3 0 68.39 2.30 -6 3 0 70.19 3.60 -6 3 0 64.09 2.30 -6 3 0 64.89 3.00 6 3 0 70.49 3.00 -6 3 0 66.69 4.00 -7 -3 0 30.70 2.40 7 -3 0 32.20 1.70 7 -3 0 31.60 2.40 -7 -3 0 30.70 2.40 -7 -3 0 33.00 3.30 7 3 0 29.90 2.30 -7 3 0 27.70 2.50 -7 3 0 29.30 3.30 -7 3 0 32.70 1.60 -7 3 0 32.70 1.70 -7 3 0 33.30 2.40 -8 -3 0 6.60 1.70 -8 -3 0 6.60 1.40 -8 -3 0 5.10 1.80 8 -3 0 6.80 1.60 -8 3 0 5.60 1.70 8 3 0 6.00 1.60 8 3 0 6.80 1.30 -8 3 0 4.40 1.80 -8 3 0 5.00 1.60 -8 3 0 3.70 0.90 -9 -3 0 0.10 1.60 -9 -3 0 0.10 1.20 -9 -3 0 0.60 1.40 9 -3 0 0.00 1.30 -9 3 0 2.30 1.70 -9 3 0 1.50 1.70 9 3 0 0.20 1.00 -9 3 0 2.60 1.50 9 3 0 0.70 1.40 -10 -3 0 0.70 1.80 -10 -3 0 0.70 1.80 -10 -3 0 0.70 1.50 -10 3 0 3.40 1.90 -10 3 0 0.60 2.00 -10 3 0 0.30 1.40 -11 -3 0 9.10 2.50 -11 -3 0 16.50 3.10 -11 3 0 13.10 2.90 -11 3 0 14.60 3.00 -11 3 0 14.20 2.70 -12 -3 0 3.40 2.40 -12 -3 0 5.50 2.60 -12 -3 0 4.70 2.20 -12 3 0 4.50 2.60 -12 3 0 8.00 2.80 -12 3 0 7.80 2.80 0 -4 0 1205.28 24.40 0 -4 0 1194.28 24.20 0 -4 0 1208.58 22.30 0 -4 0 1192.78 24.10 0 -4 0 1197.08 27.50 0 -4 0 1203.38 23.00 0 4 0 1223.68 23.00 0 4 0 1178.08 24.00 0 4 0 1207.28 22.30 0 4 0 1186.18 27.50 0 4 0 1235.78 24.20 0 4 0 1183.78 24.40 1 -4 0 3.60 0.50 -1 -4 0 3.80 0.60 1 -4 0 4.20 0.60 1 -4 0 4.30 0.60 -1 -4 0 4.10 0.60 -1 -4 0 3.80 0.50 -1 -4 0 3.60 0.60 -1 -4 0 3.70 0.40 1 -4 0 4.50 0.40 1 -4 0 5.00 0.70 1 4 0 4.80 0.50 1 4 0 3.30 0.50 -1 4 0 4.30 0.40 -1 4 0 4.10 0.50 1 4 0 4.10 0.50 -1 4 0 6.90 0.70 1 4 0 4.80 0.60 1 4 0 4.40 0.60 -1 4 0 3.50 0.50 -1 4 0 5.40 0.60 -2 -4 0 316.27 6.70 -2 -4 0 292.77 5.70 2 -4 0 298.17 6.40 2 -4 0 297.87 8.00 -2 -4 0 297.67 6.90 2 -4 0 294.77 6.30 -2 -4 0 258.97 6.90 2 -4 0 296.77 6.90 2 -4 0 292.07 6.50 2 4 0 298.57 5.80 -2 4 0 299.67 6.30 -2 4 0 296.07 7.00 2 4 0 287.07 6.80 -2 4 0 268.07 7.90 2 4 0 302.17 6.60 -2 4 0 300.17 6.50 2 4 0 295.57 7.00 -2 4 0 292.77 6.50 3 -4 0 76.69 3.30 3 -4 0 76.79 2.50 3 -4 0 76.49 2.60 -3 -4 0 81.19 2.70 3 -4 0 79.99 2.40 -3 -4 0 77.59 2.90 3 -4 0 79.89 2.90 -3 -4 0 80.89 2.80 3 4 0 77.69 2.70 -3 4 0 78.19 3.30 -3 4 0 82.49 3.00 3 4 0 79.49 2.70 -3 4 0 81.39 2.40 -3 4 0 80.39 2.50 -3 4 0 78.09 2.60 3 4 0 77.49 2.80 3 4 0 77.69 1.80 3 4 0 78.49 2.60 4 -4 0 1.50 0.60 -4 -4 0 1.90 0.80 4 -4 0 1.80 0.30 -4 -4 0 1.80 0.60 4 -4 0 2.50 0.80 4 4 0 2.50 0.80 -4 4 0 1.30 0.50 -4 4 0 0.70 0.60 -4 4 0 1.70 0.50 4 4 0 2.30 0.80 -4 4 0 1.90 0.40 -4 4 0 1.50 0.60 -4 4 0 1.90 0.80 5 -4 0 14.20 1.50 5 -4 0 14.10 0.80 5 -4 0 14.00 1.10 -5 -4 0 18.00 1.60 -5 -4 0 15.60 1.60 -5 4 0 14.40 1.30 -5 4 0 15.80 1.20 -5 4 0 15.10 1.50 -5 4 0 10.90 1.50 5 4 0 13.30 1.40 -5 4 0 10.30 1.70 -6 -4 0 10.30 1.40 6 -4 0 11.80 1.00 6 -4 0 12.20 1.60 -6 -4 0 10.50 1.80 -6 -4 0 11.80 1.60 -6 4 0 11.70 1.60 -6 4 0 12.70 1.60 6 4 0 11.80 1.60 -6 4 0 9.20 1.70 -6 4 0 12.30 1.10 -7 -4 0 3.60 1.50 7 -4 0 3.90 0.70 -7 -4 0 2.70 1.20 7 -4 0 4.20 1.30 -7 -4 0 3.20 1.30 -7 4 0 3.10 1.30 -7 4 0 3.50 1.50 -7 4 0 2.60 1.20 7 4 0 1.70 1.10 8 -4 0 5.80 1.60 -8 -4 0 5.30 1.80 -8 -4 0 1.40 1.40 -8 -4 0 4.20 1.40 8 4 0 7.10 1.60 -8 4 0 3.90 1.70 -8 4 0 5.30 1.60 -8 4 0 6.40 1.60 -9 -4 0 5.00 1.50 -9 -4 0 2.20 1.40 9 -4 0 4.20 1.70 -9 -4 0 4.40 1.80 9 4 0 2.80 1.60 -9 4 0 3.50 1.70 -9 4 0 5.30 1.70 -9 4 0 4.10 1.70 9 4 0 4.40 1.20 -10 -4 0 0.80 1.80 -10 -4 0 -1.40 1.70 -10 -4 0 1.30 1.30 -10 4 0 1.00 1.80 -10 4 0 1.40 1.50 -10 4 0 0.30 1.50 -11 -4 0 1.30 2.10 -11 -4 0 -1.00 2.00 -11 4 0 0.30 1.50 -11 4 0 0.70 2.00 -11 4 0 3.80 2.10 -12 -4 0 9.70 2.90 -12 -4 0 7.70 3.00 -12 -4 0 8.70 2.60 -12 4 0 10.60 3.20 -12 4 0 11.50 3.10 -12 4 0 7.60 2.50 0 -5 0 0.10 0.40 0 -5 0 -0.10 0.30 0 -5 0 -0.40 0.20 0 -5 0 0.20 0.40 0 -5 0 0.20 0.30 0 -5 0 -0.30 0.40 0 5 0 0.30 0.40 0 5 0 -0.20 0.20 0 5 0 -0.40 0.40 0 5 0 -0.10 0.40 0 5 0 0.00 0.30 0 5 0 0.20 0.40 -1 -5 0 80.69 2.50 1 -5 0 78.89 2.40 -1 -5 0 82.89 2.60 1 -5 0 85.19 2.60 -1 -5 0 85.79 2.30 1 -5 0 84.29 2.20 1 -5 0 85.19 3.00 -1 -5 0 86.09 2.60 -1 -5 0 86.09 2.40 1 -5 0 81.79 2.40 -1 5 0 83.99 2.20 1 5 0 82.29 2.60 1 5 0 81.49 2.50 -1 5 0 82.39 2.90 1 5 0 84.59 2.30 1 5 0 83.29 2.50 -1 5 0 84.09 2.60 -1 5 0 82.29 2.40 -1 5 0 83.29 2.50 1 5 0 83.69 2.40 -2 -5 0 124.29 3.50 -2 -5 0 119.79 2.80 2 -5 0 123.69 4.20 2 -5 0 120.09 3.30 2 -5 0 120.89 2.70 -2 -5 0 120.99 3.70 2 -5 0 119.59 3.20 2 -5 0 116.99 3.30 -2 -5 0 122.29 3.50 2 -5 0 125.69 3.70 -2 -5 0 129.29 3.50 2 5 0 125.29 2.90 -2 5 0 127.59 3.40 -2 5 0 125.59 3.30 2 5 0 127.09 3.50 -2 5 0 121.99 3.60 -2 5 0 126.59 4.30 2 5 0 120.99 3.70 2 5 0 119.09 3.50 3 -5 0 0.90 0.70 3 -5 0 0.50 0.60 -3 -5 0 -0.10 0.50 -3 -5 0 0.20 0.60 -3 -5 0 0.10 0.60 3 5 0 -0.10 0.40 -3 5 0 0.30 0.40 3 5 0 0.10 0.60 -3 5 0 0.90 0.60 -3 5 0 0.00 0.50 -3 5 0 -0.80 0.40 -3 5 0 0.40 0.60 3 5 0 0.20 0.30 4 -5 0 60.39 2.50 -4 -5 0 61.69 2.60 -4 -5 0 64.19 2.80 4 -5 0 61.49 2.30 -4 5 0 61.19 2.80 -4 5 0 62.19 3.30 4 5 0 63.39 2.60 4 5 0 65.49 2.60 4 5 0 61.59 1.40 -4 5 0 60.89 2.40 -4 5 0 63.59 2.30 -4 5 0 62.49 1.90 -4 5 0 66.39 2.50 -5 -5 0 39.30 2.30 -5 -5 0 34.80 2.20 5 -5 0 40.10 2.20 5 -5 0 35.70 1.90 -5 5 0 36.90 2.40 -5 5 0 36.50 2.90 5 5 0 35.00 2.20 5 5 0 33.80 2.10 -5 5 0 33.90 2.10 -5 5 0 33.80 1.40 -5 5 0 34.30 1.90 -6 -5 0 1.90 1.00 6 -5 0 2.20 1.10 -6 -5 0 1.80 1.10 -6 -5 0 2.20 1.00 6 5 0 3.50 1.20 -6 5 0 2.40 1.00 -6 5 0 1.40 0.90 -6 5 0 1.20 1.00 -7 -5 0 5.40 1.60 7 -5 0 6.50 1.50 -7 -5 0 6.50 1.50 -7 -5 0 6.50 1.50 -7 5 0 4.70 1.50 -7 5 0 4.70 1.40 -7 5 0 2.40 1.20 7 5 0 8.00 1.60 -8 -5 0 15.30 2.10 -8 -5 0 20.00 2.50 -8 -5 0 15.10 2.50 8 -5 0 21.80 2.40 -8 5 0 14.90 2.40 -8 5 0 22.30 2.50 -8 5 0 16.40 2.40 8 5 0 17.20 2.20 -9 -5 0 1.10 1.50 9 -5 0 1.80 1.60 -9 -5 0 1.00 1.70 -9 -5 0 1.00 1.60 -9 5 0 2.10 1.60 -9 5 0 1.40 1.40 9 5 0 2.30 1.50 -9 5 0 3.90 1.50 -10 -5 0 1.50 1.80 -10 -5 0 0.70 1.40 -10 -5 0 1.40 1.90 -10 5 0 2.50 2.00 -10 5 0 4.80 2.10 -10 5 0 0.20 1.60 -11 -5 0 8.10 2.80 -11 -5 0 9.80 2.80 -11 -5 0 9.70 2.10 -11 5 0 5.90 2.60 -11 5 0 13.90 3.00 -11 5 0 10.60 2.60 -12 -5 0 -0.90 1.50 -12 -5 0 3.90 2.60 -12 5 0 3.70 2.10 -12 5 0 0.60 1.70 -12 5 0 4.30 2.20 0 -6 0 520.25 11.10 0 -6 0 511.25 11.00 0 -6 0 501.85 11.00 0 -6 0 485.35 10.20 0 -6 0 509.95 12.60 0 -6 0 495.35 10.70 0 6 0 524.35 11.10 0 6 0 524.25 10.70 0 6 0 518.45 12.60 0 6 0 505.55 11.10 0 6 0 518.45 10.30 0 6 0 510.75 11.00 -1 -6 0 21.70 1.40 -1 -6 0 22.30 1.40 1 -6 0 23.60 1.40 1 -6 0 22.40 1.20 -1 -6 0 25.10 1.40 1 -6 0 22.30 1.10 -1 -6 0 21.40 1.30 -1 -6 0 24.00 1.10 1 -6 0 24.30 1.30 1 -6 0 25.90 1.60 -1 -6 0 22.90 1.10 1 6 0 23.60 1.20 -1 6 0 21.90 1.20 -1 6 0 22.80 1.20 -1 6 0 23.30 1.10 1 6 0 21.90 1.10 1 6 0 23.40 1.30 1 6 0 23.20 1.30 -1 6 0 22.30 1.60 1 6 0 21.60 1.30 -1 6 0 21.60 1.30 2 -6 0 74.59 2.40 -2 -6 0 72.69 2.00 2 -6 0 72.29 2.50 -2 -6 0 74.29 2.50 2 -6 0 74.79 3.10 -2 -6 0 72.59 2.60 -2 -6 0 70.89 2.70 2 -6 0 73.29 2.70 -2 -6 0 71.89 2.40 2 -6 0 67.69 2.40 2 -6 0 72.19 1.90 -2 6 0 70.19 2.40 2 6 0 72.89 2.10 2 6 0 74.49 2.50 2 6 0 73.69 2.80 -2 6 0 73.39 3.10 -2 6 0 72.49 2.40 -2 6 0 74.99 2.70 -2 6 0 70.59 1.90 2 6 0 70.39 2.50 -3 -6 0 158.98 4.50 -3 -6 0 146.59 4.40 3 -6 0 152.68 4.30 3 -6 0 142.59 4.00 -3 -6 0 151.28 4.70 -3 6 0 149.99 4.00 -3 6 0 146.89 4.60 -3 6 0 147.69 4.20 -3 6 0 148.89 4.20 3 6 0 149.39 3.40 -3 6 0 150.38 5.40 3 6 0 148.79 4.40 4 -6 0 63.59 2.70 4 -6 0 66.89 2.50 -4 -6 0 69.19 3.10 -4 -6 0 69.99 2.90 -4 6 0 68.69 3.50 4 6 0 70.39 2.80 4 6 0 66.39 2.90 -4 6 0 68.69 2.70 4 6 0 66.39 1.80 -4 6 0 76.29 3.30 -4 6 0 70.19 2.70 -5 -6 0 41.80 2.50 5 -6 0 45.80 2.20 -5 -6 0 44.60 2.70 5 -6 0 43.40 2.40 -5 6 0 43.10 1.60 -5 6 0 44.90 3.10 -5 6 0 42.80 2.30 -5 6 0 46.80 2.70 5 6 0 43.50 2.60 5 6 0 50.89 2.50 6 -6 0 15.80 1.90 -6 -6 0 17.90 2.00 -6 -6 0 12.60 1.60 6 -6 0 18.60 1.50 6 6 0 17.70 1.80 -6 6 0 10.80 1.80 -6 6 0 13.80 1.90 -6 6 0 14.90 1.80 -7 -6 0 -1.50 1.10 -7 -6 0 0.10 1.20 -7 -6 0 -0.80 1.00 7 -6 0 0.40 1.10 -7 6 0 -0.90 1.00 -7 6 0 -1.20 0.70 7 6 0 1.00 1.10 -7 6 0 0.20 0.90 -8 -6 0 12.20 2.10 -8 -6 0 12.20 2.00 -8 -6 0 18.40 2.50 8 -6 0 16.40 2.20 8 6 0 16.40 2.20 -8 6 0 11.90 2.20 -8 6 0 12.00 2.00 -8 6 0 16.10 2.30 -9 -6 0 1.00 1.30 9 -6 0 2.90 1.60 -9 -6 0 -1.70 1.50 -9 -6 0 -0.10 1.30 9 6 0 3.10 1.70 -9 6 0 0.20 1.60 -9 6 0 -0.30 1.60 -9 6 0 3.10 1.70 -10 -6 0 6.50 1.80 -10 -6 0 4.40 2.20 -10 -6 0 4.90 2.20 -10 6 0 7.60 2.60 -10 6 0 5.20 2.20 -10 6 0 7.00 2.00 -11 -6 0 1.30 2.10 -11 -6 0 1.00 1.60 -11 -6 0 -3.50 1.70 -11 6 0 0.70 1.80 -11 6 0 0.60 2.20 -11 6 0 1.10 1.50 -12 -6 0 2.80 2.00 -12 -6 0 6.50 2.80 -12 6 0 4.10 2.60 -12 6 0 4.10 2.20 -12 6 0 0.90 2.20 0 -7 0 0.10 0.40 0 -7 0 0.80 0.50 0 -7 0 -0.20 0.50 0 -7 0 0.20 0.40 0 -7 0 0.50 0.50 0 -7 0 0.20 0.30 0 7 0 -0.50 0.30 0 7 0 0.40 0.60 0 7 0 0.50 0.40 0 7 0 2.20 0.60 0 7 0 0.10 0.30 0 7 0 0.20 0.40 -1 -7 0 485.05 10.60 -1 -7 0 462.95 10.40 -1 -7 0 480.75 10.70 1 -7 0 485.75 10.80 1 -7 0 479.35 10.30 1 -7 0 473.45 10.30 -1 -7 0 476.05 12.00 -1 -7 0 473.05 9.70 1 -7 0 483.65 12.30 1 -7 0 471.75 10.00 -1 -7 0 472.85 10.90 -1 7 0 480.15 10.80 -1 7 0 477.15 12.20 -1 7 0 477.85 10.30 -1 7 0 474.85 10.70 1 7 0 487.05 10.90 1 7 0 466.65 10.60 1 7 0 480.55 10.30 1 7 0 483.65 9.80 -1 7 0 482.35 10.30 1 7 0 479.55 10.70 -1 7 0 486.95 10.00 -2 -7 0 12.50 1.30 2 -7 0 12.30 1.10 -2 -7 0 11.70 1.00 2 -7 0 10.50 0.70 -2 -7 0 12.00 1.20 -2 -7 0 10.70 0.80 2 -7 0 12.30 1.20 2 7 0 11.90 0.90 -2 7 0 11.10 1.10 -2 7 0 11.80 1.30 -2 7 0 12.30 0.70 -2 7 0 10.90 1.40 2 7 0 11.80 1.10 3 -7 0 3.20 0.90 -3 -7 0 4.00 0.90 -3 -7 0 4.10 0.90 3 -7 0 3.80 1.10 3 -7 0 3.80 0.30 -3 7 0 4.00 0.80 -3 7 0 1.50 0.80 -3 7 0 3.80 0.80 3 7 0 4.20 0.90 3 7 0 3.70 0.60 4 -7 0 53.79 2.40 -4 -7 0 54.79 2.90 4 -7 0 55.29 2.60 -4 -7 0 50.39 2.60 -4 7 0 54.19 2.50 4 7 0 56.19 2.50 -4 7 0 52.69 2.40 4 7 0 57.19 1.70 -4 7 0 56.09 3.20 -4 7 0 53.39 2.70 4 7 0 51.59 2.60 5 -7 0 16.70 1.80 -5 -7 0 15.10 1.80 -5 -7 0 10.90 1.60 5 -7 0 15.90 1.60 5 7 0 15.20 0.70 -5 7 0 15.60 1.60 -5 7 0 11.80 1.60 5 7 0 13.50 1.60 5 7 0 13.00 1.60 -5 7 0 14.30 1.00 -5 7 0 11.30 1.80 -6 -7 0 27.50 2.50 6 -7 0 21.80 2.00 6 -7 0 17.50 1.60 -6 -7 0 23.10 2.20 -6 7 0 22.60 1.20 -6 7 0 14.20 2.00 -6 7 0 20.60 2.00 -6 7 0 22.00 2.80 6 7 0 21.40 2.00 -7 -7 0 26.10 2.50 -7 -7 0 30.50 3.00 7 -7 0 28.70 2.40 -7 -7 0 26.60 2.40 -7 7 0 29.90 3.10 -7 7 0 30.50 2.50 -7 7 0 27.80 3.00 7 7 0 27.40 2.40 8 -7 0 2.60 1.50 -8 -7 0 -1.20 1.30 -8 -7 0 0.40 1.30 -8 -7 0 2.70 1.50 -8 7 0 1.90 1.30 -8 7 0 0.90 1.10 -8 7 0 -0.20 1.00 8 7 0 0.20 1.10 -9 -7 0 2.50 1.80 -9 -7 0 4.60 2.00 9 -7 0 1.60 1.70 -9 -7 0 -0.70 1.40 -9 7 0 1.30 1.60 -9 7 0 -0.80 1.50 9 7 0 0.20 1.40 -9 7 0 2.50 1.50 -10 -7 0 3.80 1.90 -10 -7 0 4.60 2.20 -10 -7 0 4.60 2.10 -10 7 0 2.50 2.20 -10 7 0 4.50 2.20 -10 7 0 4.50 2.00 -11 -7 0 -0.20 2.00 -11 -7 0 -1.00 2.00 -11 -7 0 2.30 1.80 -11 7 0 -0.20 1.80 -11 7 0 1.20 2.10 -11 7 0 0.10 2.10 -12 -7 0 1.50 1.80 -12 -7 0 2.60 2.50 -12 7 0 1.20 2.60 -12 7 0 2.00 2.10 -12 7 0 0.90 2.50 0 -8 0 33.60 2.00 0 -8 0 33.00 1.50 0 -8 0 33.20 1.70 0 -8 0 33.90 1.60 0 -8 0 34.30 1.90 0 8 0 33.50 1.60 0 8 0 32.60 1.60 0 8 0 33.30 1.80 0 8 0 32.50 1.70 0 8 0 35.10 1.80 0 8 0 33.40 1.70 1 -8 0 141.79 3.80 1 -8 0 142.79 4.70 -1 -8 0 141.19 3.90 -1 -8 0 140.59 3.80 -1 -8 0 139.69 4.30 -1 -8 0 131.99 4.10 -1 -8 0 142.39 4.50 1 -8 0 138.49 4.10 1 -8 0 135.49 3.90 1 8 0 138.79 3.90 1 8 0 141.99 3.80 -1 8 0 138.09 4.00 1 8 0 137.99 4.20 -1 8 0 136.59 4.20 1 8 0 142.19 4.20 -1 8 0 141.49 4.00 -1 8 0 137.39 4.70 -1 8 0 140.99 3.80 -2 -8 0 1.00 0.50 2 -8 0 0.80 0.60 -2 -8 0 -0.30 0.70 -2 -8 0 1.00 0.50 2 -8 0 0.20 0.40 -2 -8 0 0.40 0.60 2 -8 0 1.80 0.90 2 8 0 -0.20 0.40 -2 8 0 0.50 0.30 -2 8 0 0.10 0.60 -2 8 0 0.30 0.50 -2 8 0 0.30 0.50 2 8 0 0.40 0.60 3 -8 0 3.10 0.40 3 -8 0 3.90 0.90 -3 -8 0 4.60 1.00 3 -8 0 4.10 1.10 -3 -8 0 4.10 1.10 -3 8 0 2.70 0.80 3 8 0 3.20 0.90 3 8 0 3.40 0.60 -3 8 0 2.50 0.90 -3 8 0 4.70 0.90 4 -8 0 69.99 3.00 -4 -8 0 65.79 3.10 -4 -8 0 68.69 3.30 4 -8 0 70.49 2.90 4 8 0 74.19 2.20 -4 8 0 70.29 3.90 4 8 0 67.49 2.90 4 8 0 68.49 2.80 -4 8 0 67.59 3.20 -5 -8 0 61.59 3.40 5 -8 0 60.29 3.00 -5 -8 0 62.39 3.20 5 -8 0 62.79 2.80 -5 8 0 61.09 2.90 5 8 0 61.49 1.80 5 8 0 61.99 3.00 -5 8 0 61.69 3.30 5 8 0 61.99 3.00 -5 8 0 65.59 3.90 6 -8 0 26.30 2.30 -6 -8 0 27.30 2.60 6 -8 0 26.40 2.00 -6 -8 0 22.10 2.20 6 8 0 23.90 2.10 -6 8 0 24.50 2.10 -6 8 0 23.80 1.30 -6 8 0 23.20 2.70 -6 8 0 20.40 2.20 6 8 0 24.90 2.40 -7 -8 0 4.90 1.70 7 -8 0 4.70 1.50 -7 -8 0 3.00 1.50 -7 8 0 4.60 1.40 7 8 0 4.00 1.50 -7 8 0 3.50 1.40 -7 8 0 4.70 1.50 8 -8 0 6.90 1.80 -8 -8 0 6.80 2.00 -8 -8 0 5.50 1.60 -8 -8 0 6.20 1.50 -8 8 0 8.00 2.00 -8 8 0 6.40 1.80 -8 8 0 5.80 1.90 8 8 0 9.60 1.90 -9 -8 0 6.90 2.00 -9 -8 0 11.50 2.40 -9 -8 0 7.70 2.30 9 -8 0 11.50 2.30 9 8 0 6.40 2.00 -9 8 0 5.00 1.90 -9 8 0 9.80 2.20 -9 8 0 7.80 2.30 -10 -8 0 -1.40 1.80 -10 -8 0 1.60 2.10 -10 -8 0 -1.80 1.40 -10 8 0 2.10 2.10 -10 8 0 0.80 1.90 -10 8 0 0.30 1.90 -11 -8 0 3.80 2.50 -11 -8 0 2.80 2.00 -11 -8 0 9.20 2.90 -11 8 0 6.40 2.30 -11 8 0 6.70 2.50 -11 8 0 6.30 2.20 -12 -8 0 1.80 2.30 -12 -8 0 2.70 2.60 -12 8 0 2.90 2.30 -12 8 0 1.00 2.30 -12 8 0 0.70 1.80 0 -9 0 0.20 0.60 0 -9 0 0.20 0.40 0 -9 0 -1.50 0.60 0 -9 0 -0.10 0.60 0 -9 0 0.10 0.80 0 9 0 -0.50 0.50 0 9 0 0.00 0.50 0 9 0 -0.10 0.50 0 9 0 0.00 0.40 1 -9 0 701.53 14.30 -1 -9 0 684.13 15.60 -1 -9 0 713.93 14.90 -1 -9 0 694.33 14.10 -1 -9 0 712.33 17.30 1 -9 0 697.63 14.80 -1 -9 0 693.93 15.20 1 -9 0 695.53 15.00 1 9 0 694.63 15.30 -1 9 0 717.63 15.00 1 9 0 690.43 15.20 -1 9 0 682.83 15.40 -1 9 0 692.03 15.30 -1 9 0 694.43 17.50 -2 -9 0 5.30 1.00 -2 -9 0 7.60 1.20 -2 -9 0 7.40 0.90 2 -9 0 5.40 0.70 2 -9 0 7.40 1.20 -2 -9 0 6.50 0.90 2 -9 0 5.80 1.00 -2 9 0 6.60 0.70 2 9 0 7.10 0.90 -2 9 0 4.20 0.90 -2 9 0 3.40 1.00 2 9 0 6.10 1.00 -3 -9 0 290.67 7.50 3 -9 0 287.07 6.20 3 -9 0 287.87 7.10 3 -9 0 283.17 7.30 -3 -9 0 273.37 7.90 -3 9 0 284.97 8.90 -3 9 0 291.67 7.90 3 9 0 284.17 7.50 3 9 0 299.17 6.50 -4 -9 0 4.50 1.10 4 -9 0 6.80 1.20 4 -9 0 7.30 1.20 -4 -9 0 4.30 1.10 -4 9 0 3.50 1.10 -4 9 0 5.20 1.20 4 9 0 5.80 1.20 4 9 0 6.30 0.90 5 -9 0 0.30 1.00 5 -9 0 0.90 1.00 -5 -9 0 0.10 1.00 -5 -9 0 0.90 1.10 5 9 0 0.40 0.90 -5 9 0 1.20 1.00 -5 9 0 0.70 1.10 5 9 0 0.20 0.40 5 9 0 0.50 0.90 6 -9 0 1.50 1.20 -6 -9 0 1.30 1.30 -6 -9 0 0.30 1.10 6 -9 0 1.30 1.00 -6 9 0 0.70 1.10 -6 9 0 0.50 0.90 6 9 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10 0 60.49 2.50 -1 10 0 58.09 2.50 -1 10 0 66.79 3.00 -1 10 0 55.49 2.90 -2 -10 0 170.28 4.50 2 -10 0 174.88 5.00 -2 -10 0 171.58 5.30 2 -10 0 167.68 5.10 2 -10 0 171.78 4.50 -2 -10 0 166.68 5.40 2 10 0 175.38 5.00 2 10 0 173.88 5.20 -2 10 0 172.38 6.10 -2 10 0 173.58 4.50 -2 10 0 173.88 5.50 3 -10 0 154.38 3.80 3 -10 0 149.09 4.70 -3 -10 0 150.38 5.20 3 -10 0 157.78 5.00 -3 -10 0 155.38 5.00 -3 10 0 155.98 5.20 -3 10 0 154.18 6.00 3 10 0 161.48 4.30 3 10 0 156.68 4.90 -4 -10 0 36.80 2.70 4 -10 0 36.00 2.40 4 -10 0 39.70 2.60 -4 -10 0 35.30 2.50 4 10 0 37.00 1.70 -4 10 0 34.40 2.40 4 10 0 35.50 2.40 -4 10 0 36.80 3.00 -5 -10 0 1.80 1.00 -5 -10 0 -0.10 0.80 5 -10 0 0.70 1.10 5 -10 0 1.50 0.90 -5 10 0 -0.20 0.70 5 10 0 2.10 0.60 -5 10 0 0.10 0.80 5 10 0 -0.10 1.00 5 10 0 -0.30 1.00 6 -10 0 4.20 1.30 6 -10 0 5.50 1.60 -6 -10 0 4.60 1.50 -6 -10 0 3.20 1.50 -6 10 0 2.50 1.20 6 10 0 4.10 0.60 -6 10 0 3.90 1.20 6 10 0 2.80 1.10 6 10 0 3.00 1.30 -7 -10 0 3.00 1.60 -7 -10 0 -1.00 1.40 7 -10 0 0.00 1.50 -7 10 0 0.80 1.30 7 10 0 1.20 1.30 -7 10 0 2.00 1.30 -7 10 0 -1.10 1.30 8 -10 0 45.30 3.40 -8 -10 0 50.39 4.00 -8 -10 0 51.39 4.70 -8 -10 0 53.19 3.90 -8 10 0 59.19 5.20 8 10 0 45.60 3.40 -8 10 0 52.39 3.70 -8 10 0 46.70 4.20 -9 -10 0 0.30 1.30 -9 -10 0 0.30 1.40 -9 -10 0 -1.50 1.10 9 10 0 -0.60 1.60 -9 10 0 -0.50 1.20 -9 10 0 0.60 1.70 -9 10 0 -1.10 1.60 -10 -10 0 16.00 3.10 -10 -10 0 12.00 2.60 -10 -10 0 16.20 3.10 -10 10 0 20.40 3.10 -10 10 0 18.40 3.30 -10 10 0 17.70 3.30 -11 -10 0 2.80 2.20 -11 -10 0 4.20 2.60 -11 -10 0 3.90 2.40 -11 10 0 3.20 2.40 -11 10 0 3.80 2.30 -11 10 0 2.70 2.20 0 -11 0 0.40 0.50 0 -11 0 1.50 0.70 0 -11 0 1.80 0.80 0 -11 0 1.10 0.80 0 11 0 1.00 0.70 0 11 0 0.90 0.80 0 11 0 0.20 0.60 -1 -11 0 17.70 1.60 1 -11 0 14.90 1.40 1 -11 0 13.90 1.50 -1 -11 0 14.40 1.40 -1 -11 0 14.80 1.50 1 -11 0 15.90 1.40 -1 11 0 16.40 1.30 -1 11 0 12.60 1.40 1 11 0 13.40 1.30 -1 11 0 13.80 1.80 -1 11 0 13.40 1.50 1 11 0 15.50 1.50 -2 -11 0 164.08 5.30 2 -11 0 165.68 5.00 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2.90 8 11 0 16.00 2.40 -8 11 0 16.30 2.70 -8 11 0 13.50 2.60 -9 -11 0 12.80 2.80 -9 -11 0 9.30 2.40 -9 -11 0 10.40 2.50 9 11 0 7.20 2.20 -9 11 0 10.50 2.60 -9 11 0 9.50 2.20 -10 -11 0 1.30 1.90 -10 -11 0 2.60 2.30 -10 -11 0 -0.60 1.40 -10 11 0 2.50 1.70 -10 11 0 0.20 1.60 -11 -11 0 -0.30 2.10 -11 -11 0 1.70 2.40 -11 -11 0 -1.00 2.00 -11 11 0 -0.20 2.00 -11 11 0 -0.20 2.40 0 -12 0 221.28 6.50 0 -12 0 210.48 5.90 0 -12 0 225.58 6.40 0 12 0 232.08 6.60 0 12 0 227.28 7.20 0 12 0 226.28 6.10 1 -12 0 32.00 2.30 -1 -12 0 34.30 2.20 1 -12 0 32.40 1.90 -1 -12 0 29.90 1.80 -1 -12 0 27.60 2.00 1 -12 0 29.00 2.10 -1 12 0 31.30 2.20 1 12 0 30.60 2.00 -1 12 0 32.30 2.50 -1 12 0 34.00 2.00 1 12 0 28.60 2.10 2 -12 0 11.10 1.60 -2 -12 0 9.50 1.40 2 -12 0 7.90 1.10 2 -12 0 10.00 1.70 -2 -12 0 9.60 1.20 -2 -12 0 10.20 1.60 -2 12 0 9.40 1.50 2 12 0 9.30 1.40 2 12 0 8.60 1.30 -2 12 0 6.60 1.40 -2 12 0 8.50 1.20 -2 12 0 13.10 1.20 3 -12 0 9.40 1.70 -3 -12 0 12.70 1.80 -3 -12 0 9.70 1.50 3 -12 0 12.20 1.60 3 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2.70 -11 -12 0 3.10 2.50 -11 12 0 5.00 2.30 -11 12 0 2.20 2.70 0 -13 0 1.90 1.00 0 -13 0 1.60 1.30 0 -13 0 1.50 0.70 0 13 0 1.60 0.90 0 13 0 2.80 1.00 0 13 0 2.80 1.10 -1 -13 0 57.59 3.20 -1 -13 0 55.79 2.70 1 -13 0 59.49 2.80 -1 -13 0 56.49 3.10 1 -13 0 56.39 3.20 1 -13 0 56.89 2.70 -1 13 0 63.39 3.50 1 13 0 57.19 2.70 1 13 0 58.19 3.10 -1 13 0 61.39 3.30 -1 13 0 55.29 2.70 2 -13 0 0.10 1.00 2 -13 0 -0.50 0.80 -2 -13 0 -0.50 0.70 2 -13 0 -0.10 0.70 -2 -13 0 0.70 0.90 -2 -13 0 -1.00 0.70 -2 13 0 0.40 1.00 -2 13 0 -0.30 0.50 -2 13 0 -0.50 0.70 2 13 0 0.30 0.70 2 13 0 -0.70 0.70 -2 13 0 1.00 0.80 3 -13 0 8.90 1.50 3 -13 0 8.30 1.00 -3 -13 0 9.40 1.70 3 -13 0 9.70 1.50 -3 -13 0 11.40 1.70 -3 13 0 9.90 1.70 -3 13 0 7.90 1.50 3 13 0 10.90 1.50 -3 13 0 11.60 1.00 4 -13 0 41.70 2.90 4 -13 0 43.40 2.60 4 -13 0 40.80 1.50 -4 -13 0 44.20 3.30 -4 -13 0 35.80 2.70 4 13 0 45.80 2.90 -4 13 0 41.50 3.20 -4 13 0 39.70 3.30 5 -13 0 1.20 1.40 -5 -13 0 1.10 1.10 5 -13 0 -0.80 1.30 -5 -13 0 0.20 1.10 -5 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230.18 6.50 1 14 0 214.68 6.90 1 14 0 220.58 6.40 -2 -14 0 72.99 3.10 2 -14 0 71.59 3.70 -2 -14 0 77.29 3.90 -2 -14 0 75.89 3.70 2 -14 0 75.99 3.40 2 -14 0 73.49 3.10 2 14 0 72.29 3.40 -2 14 0 76.69 3.40 2 14 0 72.69 3.50 -2 14 0 68.99 3.90 -2 14 0 78.09 4.00 -3 -14 0 35.60 2.90 3 -14 0 33.60 2.70 3 -14 0 31.20 2.70 3 -14 0 34.30 1.90 -3 -14 0 27.80 2.80 -3 14 0 30.80 2.80 -3 14 0 32.40 2.40 -3 14 0 36.50 1.80 -3 14 0 32.50 2.60 3 14 0 30.20 2.30 4 -14 0 34.90 2.90 4 -14 0 34.20 1.50 -4 -14 0 27.60 2.70 -4 -14 0 35.10 3.10 4 -14 0 41.40 3.00 4 14 0 37.40 2.70 -4 14 0 36.50 3.20 -4 14 0 33.80 3.20 5 -14 0 6.20 1.80 -5 -14 0 5.20 1.80 -5 -14 0 4.40 1.70 5 -14 0 7.00 1.90 -5 14 0 4.00 1.50 5 14 0 4.60 1.50 -5 14 0 4.40 1.70 6 -14 0 56.69 3.80 -6 -14 0 50.99 3.90 -6 -14 0 49.30 3.80 -6 14 0 43.00 4.10 6 14 0 51.49 3.50 -6 14 0 45.10 3.60 6 14 0 56.89 3.60 7 -14 0 3.60 1.80 -7 -14 0 1.70 1.90 -7 -14 0 1.40 1.90 -7 14 0 1.20 1.80 7 14 0 2.70 1.50 7 14 0 1.80 1.70 -7 14 0 0.60 1.70 -8 -14 0 15.50 2.60 -8 -14 0 17.00 3.10 -8 14 0 15.20 3.10 8 14 0 14.80 2.50 -8 14 0 16.40 2.90 -9 -14 0 -0.60 1.50 -9 -14 0 -1.80 1.60 -9 -14 0 -1.60 2.10 -9 14 0 1.60 2.30 -9 14 0 5.00 2.40 -10 -14 0 0.70 2.10 -10 -14 0 2.80 2.40 -10 -14 0 1.60 1.80 -10 14 0 0.50 2.60 -10 14 0 0.70 2.30 0 -15 0 0.20 1.00 0 -15 0 -0.40 0.70 0 -15 0 -1.80 1.10 0 15 0 -0.80 0.80 0 15 0 -0.20 0.80 -1 -15 0 3.90 1.50 1 -15 0 5.00 1.70 -1 -15 0 3.70 1.30 1 -15 0 3.90 1.10 1 -15 0 5.40 1.30 -1 15 0 6.70 1.50 1 15 0 5.40 1.20 -1 15 0 5.10 1.40 -1 15 0 5.80 1.20 1 15 0 6.00 1.20 -2 -15 0 16.20 2.10 2 -15 0 17.20 2.30 2 -15 0 15.30 1.60 -2 -15 0 17.50 1.60 -2 -15 0 15.40 2.10 2 -15 0 15.50 1.90 -2 15 0 16.30 1.80 2 15 0 13.60 1.70 2 15 0 14.00 1.70 -2 15 0 12.70 1.80 -2 15 0 13.30 2.00 3 -15 0 8.10 1.60 3 -15 0 7.80 1.90 3 -15 0 5.90 1.10 -3 -15 0 7.50 2.00 -3 -15 0 9.30 1.70 -3 15 0 5.60 0.90 -3 15 0 3.90 1.50 -3 15 0 8.40 1.50 -3 15 0 5.50 1.70 3 15 0 7.00 1.40 -4 -15 0 21.70 2.80 4 -15 0 21.80 1.40 4 -15 0 21.40 2.20 -4 -15 0 18.10 2.40 4 -15 0 22.00 2.70 -4 15 0 17.00 2.20 -4 15 0 13.10 2.20 4 15 0 23.70 2.40 -5 -15 0 47.90 3.60 -5 -15 0 55.59 4.00 5 -15 0 48.50 3.20 5 -15 0 49.50 3.50 -5 15 0 46.80 4.00 -5 15 0 48.50 4.10 5 15 0 44.90 3.20 -6 -15 0 41.40 3.40 -6 -15 0 40.30 3.60 6 -15 0 47.10 3.60 -6 15 0 35.60 3.40 6 15 0 43.00 3.40 -6 15 0 44.20 4.60 6 15 0 49.30 3.50 -7 -15 0 0.00 1.40 7 -15 0 -0.10 1.70 -7 -15 0 -1.60 1.70 7 15 0 -1.40 1.60 7 15 0 -0.30 1.30 -7 15 0 -0.30 1.70 -7 15 0 -0.90 1.20 -8 -15 0 -0.20 2.00 -8 -15 0 -0.20 2.10 8 15 0 2.10 1.90 -8 15 0 1.50 1.70 -8 15 0 0.30 1.40 -9 -15 0 -1.40 2.00 -9 -15 0 -0.80 2.10 -9 15 0 -3.90 1.70 -9 15 0 -2.80 1.90 -10 -15 0 -0.80 2.20 -10 -15 0 -1.80 2.30 -10 -15 0 -0.40 1.90 -10 15 0 -0.90 1.80 -10 15 0 -0.60 2.20 0 -16 0 22.10 2.30 0 -16 0 24.60 2.10 0 -16 0 17.50 2.50 0 16 0 16.40 2.00 0 16 0 23.00 2.20 1 -16 0 3.50 1.80 1 -16 0 2.30 1.10 -1 -16 0 1.80 1.50 -1 -16 0 1.80 1.30 1 -16 0 1.90 1.40 -1 -16 0 1.90 0.90 1 16 0 2.30 1.10 -1 16 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13 -3 37.30 3.00 -4 13 -3 44.60 3.10 -5 -13 -3 68.09 4.60 -5 -13 -3 75.19 3.00 -5 -13 -3 73.39 4.00 5 -13 3 73.29 3.50 -5 13 -3 72.49 4.80 -5 13 -3 81.59 4.70 -6 -13 -3 12.90 2.20 -6 -13 -3 10.90 1.30 -6 -13 -3 11.70 2.10 6 13 3 13.60 2.00 -6 13 -3 7.90 2.10 -6 13 -3 9.20 2.10 -7 -13 -3 -0.10 1.70 -7 -13 -3 1.20 1.50 -7 13 -3 0.70 1.50 -7 13 -3 2.00 1.70 -8 -13 -3 4.40 2.10 -8 -13 -3 7.00 2.10 -8 13 -3 1.80 1.80 -8 13 -3 5.50 2.10 -9 -13 -3 17.10 2.90 -9 -13 -3 12.30 2.70 -9 13 -3 12.00 2.70 -9 13 -3 11.50 2.80 -10 -13 -3 1.40 2.00 -10 -13 -3 2.50 1.80 -10 13 -3 0.90 2.20 -10 13 -3 0.20 1.60 -10 -14 3 -6.20 2.00 -10 -14 3 1.60 2.80 10 -14 -3 1.40 2.10 -10 14 3 -1.10 2.60 10 14 -3 2.10 2.60 -10 14 3 -3.90 2.00 9 -14 -3 -1.90 2.10 -9 -14 3 -2.80 2.10 9 -14 -3 0.40 1.80 -9 -14 3 1.70 2.30 -9 14 3 -1.90 2.30 9 14 -3 1.20 1.70 -9 14 3 -1.90 1.90 9 14 -3 0.00 1.40 8 -14 -3 2.60 1.50 8 -14 -3 2.90 2.40 -8 -14 3 0.70 1.70 -8 -14 3 1.20 2.20 -8 -14 3 0.00 1.30 8 14 -3 0.00 2.10 -8 14 3 -0.10 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2.20 2 -4 4 187.68 3.80 -2 -4 -4 190.08 4.50 -2 -4 -4 183.28 4.90 2 -4 4 189.08 3.80 -2 -4 -4 192.18 5.80 -2 4 -4 194.78 5.50 -2 4 -4 189.88 4.30 2 4 4 196.98 5.50 -2 4 -4 190.98 6.10 2 4 4 197.78 4.30 -3 -4 -4 4.40 0.80 -3 -4 -4 3.40 0.60 -3 -4 -4 3.20 1.00 -3 4 -4 4.30 0.50 3 4 4 4.90 0.60 -3 4 -4 4.70 1.10 3 4 4 5.30 1.10 3 4 4 4.10 0.60 -3 4 -4 3.00 0.90 -3 4 -4 2.50 0.80 -4 -4 -4 149.69 4.00 4 -4 4 142.89 2.80 -4 -4 -4 142.19 5.10 -4 -4 -4 144.69 3.90 4 -4 4 142.99 2.90 -4 4 -4 142.79 5.80 -4 4 -4 145.69 3.60 -4 4 -4 136.29 4.60 -4 4 -4 142.79 5.20 4 4 4 151.28 5.00 4 4 4 141.69 3.40 -5 -4 -4 104.79 3.20 5 -4 4 103.39 2.50 -5 -4 -4 103.69 4.40 -5 -4 -4 102.29 3.30 -5 4 -4 105.99 3.00 -5 4 -4 109.79 4.00 5 4 4 103.19 4.20 -5 4 -4 103.19 3.00 -5 4 -4 108.99 4.60 5 4 4 100.89 2.80 -5 4 -4 104.69 3.60 -5 4 -4 96.59 5.00 -6 -4 -4 2.00 0.80 6 -4 4 1.60 0.60 -6 -4 -4 1.40 1.10 -6 -4 -4 1.20 0.60 -6 4 -4 0.40 0.60 -6 4 -4 0.00 1.20 -6 4 -4 1.40 0.80 6 4 4 2.00 1.20 6 4 4 0.60 0.50 -6 4 -4 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4 32.10 2.20 -3 -8 4 34.30 1.40 -3 -8 4 39.30 2.70 3 8 -4 37.80 2.60 -3 8 4 35.80 3.00 -3 8 4 36.30 1.60 3 8 -4 33.40 2.20 -3 8 4 35.80 2.20 2 -8 -4 1.30 1.00 -2 -8 4 0.60 0.90 2 -8 -4 0.20 0.70 -2 -8 4 -0.10 0.90 -2 -8 4 0.80 0.60 -2 8 4 0.00 0.30 -2 8 4 0.90 0.70 2 8 -4 0.00 0.40 -2 8 4 -0.10 0.90 2 8 -4 0.40 0.70 -1 -8 4 65.79 2.50 1 -8 -4 63.59 2.90 1 -8 -4 62.59 2.90 1 -8 -4 65.29 2.90 -1 -8 4 62.69 2.80 -1 8 4 60.99 2.60 1 8 -4 64.99 2.70 1 8 -4 64.39 2.40 -1 8 4 64.39 3.50 1 8 -4 62.19 3.00 0 -8 -4 2.40 0.90 0 -8 -4 3.70 1.00 0 -8 4 3.90 0.90 0 -8 -4 3.20 0.90 0 -8 4 2.90 0.50 0 8 -4 2.90 0.50 0 8 4 2.10 0.70 0 8 -4 4.30 0.80 0 8 -4 4.10 0.90 0 8 -4 2.60 0.80 -1 -8 -4 117.09 4.50 -1 -8 -4 118.59 2.70 -1 -8 -4 117.89 3.90 1 -8 4 122.59 4.10 1 -8 4 116.59 3.60 -1 -8 -4 131.09 4.10 -1 8 -4 114.99 4.40 -1 8 -4 130.09 3.70 -1 8 -4 125.39 4.10 -1 8 -4 117.29 4.00 -2 -8 -4 62.09 2.60 2 -8 4 60.19 2.30 -2 -8 -4 64.79 3.40 -2 -8 -4 60.69 2.00 -2 -8 -4 61.89 2.60 -2 8 -4 62.29 2.40 -2 8 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1.80 -1 -9 4 26.20 1.90 1 -9 -4 23.90 2.00 1 -9 -4 24.50 2.10 -1 -9 4 24.20 1.10 -1 9 4 24.00 2.20 1 9 -4 25.70 1.80 1 9 -4 20.40 2.00 1 9 -4 23.70 1.60 -1 9 4 26.00 2.00 0 -9 -4 -0.90 0.80 0 -9 -4 -0.90 0.80 0 -9 4 -0.10 0.40 0 -9 4 0.30 0.70 0 -9 -4 0.70 0.90 0 9 -4 -0.10 0.70 0 9 -4 0.10 0.40 0 9 4 -0.10 0.70 0 9 -4 1.00 0.60 0 9 -4 0.40 0.70 -1 -9 -4 9.50 0.40 -1 -9 -4 8.20 1.30 1 -9 4 8.10 1.20 -1 -9 -4 8.30 1.20 1 -9 4 9.40 1.20 -1 -9 -4 7.20 1.30 -1 9 -4 7.20 1.10 -1 9 -4 9.00 1.20 -1 9 -4 8.70 1.50 -1 9 -4 9.80 1.20 -2 -9 -4 10.50 1.30 -2 -9 -4 9.40 0.80 -2 -9 -4 10.40 1.40 -2 -9 -4 9.60 1.60 2 -9 4 12.40 1.40 -2 9 -4 12.10 1.20 -2 9 -4 11.30 1.50 -2 9 -4 10.50 1.50 -2 9 -4 9.60 1.30 -3 -9 -4 190.08 5.00 3 -9 4 186.88 4.90 -3 -9 -4 187.58 5.50 -3 -9 -4 185.58 6.40 -3 -9 -4 190.78 5.30 -3 9 -4 186.28 5.10 -3 9 -4 191.58 5.10 -3 9 -4 189.08 6.60 -3 9 -4 180.28 6.20 -3 9 -4 183.08 6.00 4 -9 4 -0.50 0.70 -4 -9 -4 -1.10 0.70 -4 -9 -4 0.60 0.70 -4 -9 -4 0.40 1.20 -4 9 -4 -0.30 0.80 -4 9 -4 -0.80 0.50 -4 9 -4 0.20 0.70 -4 9 -4 -0.30 0.60 -5 -9 -4 149.49 6.10 5 -9 4 137.89 4.20 -5 -9 -4 143.29 4.90 -5 -9 -4 145.49 4.20 -5 9 -4 147.69 4.00 -5 9 -4 150.58 4.50 -5 9 -4 143.39 6.50 -5 9 -4 136.69 5.70 5 9 4 142.69 4.30 -6 -9 -4 4.90 1.30 -6 -9 -4 6.30 1.60 -6 -9 -4 6.30 1.00 6 9 4 9.80 1.50 -6 9 -4 4.60 1.40 -6 9 -4 3.70 1.60 -6 9 -4 6.70 0.80 -7 -9 -4 5.50 1.80 -7 -9 -4 6.90 1.60 -7 9 -4 7.00 2.00 -7 9 -4 2.40 1.60 -8 -9 -4 5.70 1.90 -8 -9 -4 3.20 1.50 -8 9 -4 -0.10 1.50 8 9 4 2.00 1.30 -8 9 -4 2.30 1.50 -9 -9 -4 2.10 1.60 -9 -9 -4 2.00 1.70 9 9 4 2.00 1.70 -9 9 -4 2.70 2.00 -9 9 -4 4.60 2.20 -10 -9 -4 -1.00 1.40 -10 -9 -4 0.40 1.50 -10 -9 -4 -0.40 1.50 10 9 4 -0.70 1.10 -10 9 -4 0.60 1.90 -10 9 -4 1.00 2.20 -11 -9 -4 1.30 1.90 -11 -9 -4 0.80 1.80 -11 -9 -4 1.60 2.30 -11 9 -4 1.10 2.30 -11 9 -4 -0.40 2.10 -11 -10 4 0.80 2.10 -11 -10 4 4.90 2.90 -11 10 4 1.00 2.20 11 10 -4 -3.20 2.40 -11 10 4 -0.80 1.90 -11 10 4 3.00 2.70 -10 -10 4 1.40 2.10 10 -10 -4 0.40 2.50 -10 -10 4 -0.70 2.50 -10 10 4 1.10 2.20 10 10 -4 0.00 2.40 -10 10 4 -0.90 1.90 -10 10 4 -1.10 2.30 -9 -10 4 -3.20 1.60 -9 -10 4 0.40 1.50 9 -10 -4 0.20 1.50 9 -10 -4 0.20 2.20 -9 -10 4 -0.10 2.10 9 10 -4 2.00 1.50 -9 10 4 -0.30 1.40 -9 10 4 -2.00 2.10 -9 10 4 0.50 1.60 9 10 -4 1.20 2.10 -8 -10 4 -1.40 1.60 -8 -10 4 -0.50 1.20 -8 -10 4 1.60 1.60 8 -10 -4 2.20 1.60 8 -10 -4 -0.40 1.40 8 10 -4 -1.30 1.50 -8 10 4 -0.80 1.80 -8 10 4 0.30 1.50 -8 10 4 -0.60 1.80 8 10 -4 0.80 1.50 -7 -10 4 -0.50 1.60 7 -10 -4 1.50 1.10 -7 -10 4 -0.20 1.80 -7 -10 4 1.10 1.00 7 -10 -4 0.90 1.80 -7 10 4 -0.80 1.10 -7 10 4 0.60 1.30 7 10 -4 -0.50 1.60 7 10 -4 -1.40 1.40 -7 10 4 0.60 1.30 6 -10 -4 11.10 2.30 -6 -10 4 9.20 1.90 -6 -10 4 6.00 2.00 6 -10 -4 11.50 1.80 -6 -10 4 6.20 1.30 -6 10 4 12.00 2.30 6 10 -4 12.40 2.00 -6 10 4 12.20 1.90 6 10 -4 7.70 1.80 -6 10 4 10.70 2.10 -5 -10 4 42.20 2.50 -5 -10 4 39.60 3.10 5 -10 -4 35.00 2.80 -5 -10 4 41.60 3.40 5 -10 -4 41.30 2.90 -5 10 4 39.00 1.60 5 10 -4 40.30 2.80 5 10 -4 35.00 2.80 -5 10 4 41.90 4.00 -5 10 4 38.20 2.90 -4 -10 4 120.29 4.90 -4 -10 4 107.39 4.90 4 -10 -4 105.59 4.30 4 -10 -4 116.79 4.80 -4 -10 4 109.19 3.80 4 10 -4 106.29 4.30 -4 10 4 102.79 4.40 4 10 -4 120.29 5.00 -4 10 4 119.79 5.80 -3 -10 4 32.70 1.50 -3 -10 4 35.10 2.60 3 -10 -4 35.80 2.30 3 -10 -4 34.90 2.40 3 -10 -4 31.90 2.20 -3 -10 4 31.30 2.70 -3 10 4 39.00 3.30 -3 10 4 33.20 2.40 -3 10 4 33.40 1.60 3 10 -4 31.90 2.70 2 -10 -4 43.30 2.60 2 -10 -4 50.59 2.80 2 -10 -4 38.10 2.60 -2 -10 4 44.60 1.60 -2 -10 4 43.20 2.70 -2 -10 4 46.50 2.80 2 10 -4 43.50 2.90 -2 10 4 44.60 2.70 -2 10 4 44.10 3.10 -2 10 4 43.60 1.50 2 10 -4 43.20 2.20 1 -10 -4 19.40 1.70 -1 -10 4 20.00 1.20 1 -10 -4 19.80 2.00 1 -10 -4 18.10 1.70 -1 -10 4 18.90 1.90 -1 -10 4 22.00 2.10 -1 10 4 21.90 2.00 1 10 -4 20.40 2.20 -1 10 4 20.20 2.10 1 10 -4 19.70 1.60 0 -10 4 8.10 1.40 0 -10 -4 6.00 1.20 0 -10 4 5.10 0.80 0 -10 -4 6.80 1.40 0 -10 -4 7.10 1.40 0 10 -4 6.00 0.80 0 10 4 7.60 1.20 0 10 -4 6.10 1.00 0 10 -4 8.90 1.30 0 10 -4 5.40 1.30 -1 -10 -4 233.58 6.60 -1 -10 -4 236.38 6.50 -1 -10 -4 237.28 7.40 1 -10 4 238.48 7.10 1 -10 4 238.58 6.30 -1 10 -4 247.78 7.40 -1 10 -4 246.18 6.80 -1 10 -4 239.18 6.30 -1 10 -4 233.98 6.90 -2 -10 -4 0.80 0.60 -2 -10 -4 -0.50 1.10 -2 -10 -4 0.60 0.40 2 -10 4 1.50 0.90 -2 -10 -4 0.20 0.80 -2 10 -4 0.80 0.70 -2 10 -4 1.30 0.70 -2 10 -4 1.00 0.80 -2 10 -4 -0.20 1.00 -3 -10 -4 11.00 1.50 -3 -10 -4 9.50 1.40 -3 -10 -4 9.60 1.10 3 -10 4 11.60 1.30 -3 -10 -4 10.00 1.80 -3 10 -4 10.80 1.30 -3 10 -4 8.30 1.40 -3 10 -4 7.70 1.10 -3 10 -4 8.20 1.30 -3 10 -4 9.10 1.70 -4 -10 -4 27.10 2.10 4 -10 4 27.50 1.90 -4 -10 -4 28.40 2.90 -4 -10 -4 25.40 1.90 -4 10 -4 23.50 1.50 -4 10 -4 27.20 2.60 -4 10 -4 24.20 2.50 -4 10 -4 21.00 1.70 -5 -10 -4 151.28 4.40 -5 -10 -4 140.39 5.90 5 -10 4 142.89 4.40 -5 -10 -4 142.19 5.10 -5 10 -4 138.19 6.40 5 10 4 138.89 4.50 -5 10 -4 141.39 6.00 -6 -10 -4 -0.30 0.70 -6 -10 -4 0.80 1.20 -6 -10 -4 0.40 1.00 6 10 4 -0.30 0.90 -6 10 -4 0.30 1.40 -6 10 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3.80 1.80 -8 -11 4 4.20 1.80 8 -11 -4 7.00 2.10 -8 -11 4 8.70 2.40 8 11 -4 4.90 2.00 8 11 -4 6.20 2.40 -8 11 4 3.00 1.90 -8 11 4 3.80 1.80 -8 11 4 4.90 2.40 -7 -11 4 1.60 1.10 7 -11 -4 1.40 1.90 7 -11 -4 2.00 1.50 -7 -11 4 3.10 1.70 -7 -11 4 0.60 1.40 7 11 -4 4.20 2.00 -7 11 4 2.30 1.90 7 11 -4 2.90 1.80 -7 11 4 2.10 1.40 -7 11 4 -1.20 1.80 -6 -11 4 20.60 2.80 -6 -11 4 19.70 2.70 6 -11 -4 20.40 2.50 6 -11 -4 18.10 2.50 6 -11 -4 19.50 1.80 -6 -11 4 20.60 2.20 -6 11 4 16.90 2.80 -6 11 4 26.20 2.90 6 11 -4 21.00 2.70 6 11 -4 20.50 2.60 -5 -11 4 74.69 4.50 5 -11 -4 75.29 3.70 5 -11 -4 78.79 4.30 -5 -11 4 73.79 4.30 5 -11 -4 73.99 3.20 -5 -11 4 72.79 3.40 -5 11 4 74.69 4.00 5 11 -4 68.89 4.00 -5 11 4 70.29 4.70 5 11 -4 73.89 4.30 -5 11 4 70.89 2.40 -4 -11 4 118.29 5.10 4 -11 -4 116.39 4.50 4 -11 -4 113.89 4.20 4 -11 -4 118.09 4.90 -4 -11 4 109.39 4.70 -4 -11 4 114.89 3.80 4 11 -4 121.89 4.80 -4 11 4 121.09 4.80 -4 11 4 123.79 6.10 4 11 -4 116.09 4.90 -3 -11 4 36.00 2.70 3 -11 -4 38.00 2.90 -3 -11 4 40.10 2.90 3 -11 -4 38.90 2.50 3 -11 -4 39.00 2.60 -3 -11 4 35.20 1.70 3 11 -4 40.70 2.80 -3 11 4 43.20 3.60 -3 11 4 38.60 1.70 -3 11 4 38.80 2.80 -2 -11 4 0.10 1.10 2 -11 -4 1.30 1.10 2 -11 -4 1.10 0.90 2 -11 -4 0.70 0.90 -2 -11 4 2.50 1.00 -2 -11 4 1.20 0.50 -2 11 4 2.10 0.40 2 11 -4 1.30 1.20 2 11 -4 2.20 0.80 -2 11 4 0.60 0.90 -2 11 4 2.00 0.40 -2 11 4 -0.10 1.00 1 -11 -4 98.59 4.10 -1 -11 4 95.09 3.20 1 -11 -4 90.49 4.00 1 -11 -4 91.59 3.90 -1 -11 4 95.29 3.90 -1 -11 4 98.69 4.10 1 11 -4 96.79 3.60 -1 11 4 102.99 4.10 1 11 -4 96.29 4.10 0 -11 4 23.60 2.00 0 -11 4 22.90 1.60 0 -11 -4 19.00 1.90 0 -11 -4 25.90 2.10 0 -11 -4 19.40 2.00 0 11 -4 24.90 2.00 0 11 -4 24.80 2.10 0 11 -4 23.20 1.50 0 11 4 24.60 2.20 1 -11 4 7.00 1.10 1 -11 4 8.70 1.40 -1 -11 -4 6.00 1.50 -1 -11 -4 6.70 1.40 -1 -11 -4 7.50 1.40 -1 11 -4 6.10 1.40 -1 11 -4 10.60 1.40 -1 11 -4 6.40 1.00 -1 11 -4 6.90 1.20 -2 -11 -4 67.39 3.00 -2 -11 -4 59.79 3.70 -2 -11 -4 62.89 3.20 -2 -11 -4 68.79 2.10 2 -11 4 61.69 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41.20 3.50 5 -14 -5 33.10 2.70 5 -14 -5 44.40 4.00 -5 -14 5 35.80 3.70 5 14 -5 37.20 3.10 -5 14 5 41.30 3.60 5 14 -5 31.70 3.20 -5 14 5 34.00 4.50 4 -14 -5 8.20 1.70 4 -14 -5 10.70 2.20 -4 -14 5 8.30 1.90 4 -14 -5 8.60 2.40 -4 -14 5 8.60 2.00 4 14 -5 6.50 1.70 -4 14 5 7.50 1.80 -4 14 5 6.70 1.90 4 14 -5 9.50 2.10 -3 -14 5 105.39 5.10 -3 -14 5 104.99 5.00 3 -14 -5 110.29 4.80 3 -14 -5 105.59 5.20 3 -14 -5 104.69 4.60 -3 14 5 111.39 6.20 -3 14 5 110.49 4.90 3 14 -5 100.89 5.00 -3 14 5 101.79 3.00 2 -14 -5 0.40 1.20 -2 -14 5 -0.40 1.40 2 -14 -5 1.00 1.60 2 -14 -5 1.60 1.20 -2 -14 5 -0.70 1.30 2 14 -5 0.00 1.50 2 14 -5 2.00 1.20 -2 14 5 0.60 1.30 -2 14 5 0.40 1.50 1 -14 -5 9.20 1.80 1 -14 -5 6.40 1.80 1 -14 -5 7.50 1.90 -1 -14 5 7.90 1.80 -1 14 5 6.60 1.60 1 14 -5 6.10 1.40 1 14 -5 5.80 1.50 0 -14 -5 2.20 1.50 0 -14 -5 0.00 1.00 0 -14 -5 0.30 1.30 0 -14 5 2.00 1.30 0 -14 5 0.60 0.70 0 14 5 0.50 0.90 0 14 -5 1.00 1.10 0 14 -5 0.30 1.10 0 14 -5 0.00 0.60 -1 -14 -5 71.89 3.80 -1 -14 -5 67.99 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2.90 1.70 -3 13 6 2.50 1.20 3 13 -6 2.70 1.30 3 13 -6 1.50 1.70 2 -13 -6 4.90 1.60 2 -13 -6 4.30 1.80 -2 -13 6 8.60 1.90 2 -13 -6 8.70 2.00 -2 13 6 7.90 1.60 2 13 -6 6.30 1.70 2 13 -6 7.10 1.30 1 -13 -6 4.40 1.70 1 -13 -6 1.20 1.40 -1 -13 6 2.50 1.30 1 -13 -6 1.00 1.50 1 13 -6 2.80 1.30 1 13 -6 3.20 1.40 -1 13 6 1.80 1.30 0 -13 6 0.30 1.10 0 -13 -6 1.00 1.10 0 -13 -6 2.00 1.60 0 -13 -6 1.60 1.40 0 13 -6 1.20 0.60 0 13 -6 0.40 1.00 0 13 -6 0.00 1.10 -1 -13 -6 11.80 2.10 -1 -13 -6 14.10 2.40 1 -13 6 12.00 1.80 -1 -13 -6 11.10 2.00 -1 13 -6 14.30 1.80 -1 13 -6 9.80 1.80 -1 13 -6 13.70 1.80 -2 -13 -6 105.39 4.60 -2 -13 -6 103.49 4.60 -2 -13 -6 109.29 5.40 2 -13 6 102.09 4.00 -2 13 -6 105.19 4.70 -2 13 -6 111.39 5.40 -2 13 -6 106.79 4.50 -3 -13 -6 28.60 2.50 -3 -13 -6 29.50 2.80 -3 -13 -6 34.90 3.80 -3 13 -6 23.60 3.00 -3 13 -6 33.40 2.90 -3 13 -6 33.80 3.00 -4 -13 -6 12.00 2.00 -4 -13 -6 9.50 2.20 -4 -13 -6 10.50 1.90 -4 13 -6 10.60 2.00 -4 13 -6 10.70 1.80 -4 13 -6 7.30 1.80 -5 -13 -6 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1.50 2.00 3 4 -13 -0.30 1.70 3 4 -13 1.70 2.00 3 4 -13 -1.00 1.70 2 -4 -13 4.90 1.90 2 -4 -13 6.90 2.80 2 4 -13 0.40 1.80 2 4 -13 2.50 2.50 2 4 -13 1.80 1.80 1 -4 -13 1.20 1.50 1 -4 -13 2.60 2.50 1 4 -13 -2.20 2.00 1 4 -13 -0.30 1.50 1 4 -13 -1.50 1.30 0 -4 -13 -1.00 1.30 0 -4 -13 -0.80 2.20 0 4 -13 1.10 2.30 0 4 -13 -1.40 1.50 0 4 -13 0.40 1.30 -1 -4 -13 5.70 2.50 -1 4 -13 1.40 1.70 -1 4 -13 2.30 2.50 -2 -4 -13 7.50 2.20 -2 4 -13 5.50 2.00 -2 4 -13 5.10 2.20 -3 -4 -13 8.80 2.30 -3 -4 -13 1.10 1.80 -3 4 -13 3.60 1.80 -3 4 -13 9.60 2.40 -4 -4 -13 6.90 2.30 -4 -4 -13 5.00 2.10 -4 4 -13 4.40 2.10 -4 4 -13 4.90 2.30 5 -5 -13 0.90 2.40 5 -5 -13 1.40 2.00 5 5 -13 -1.10 1.80 5 5 -13 0.80 2.30 5 5 -13 3.00 2.80 4 -5 -13 -0.40 2.00 4 -5 -13 2.70 2.20 4 5 -13 -0.50 2.50 4 5 -13 -2.10 1.60 4 5 -13 -1.50 1.80 3 -5 -13 -0.70 2.50 3 -5 -13 3.90 2.00 3 5 -13 1.80 2.00 3 5 -13 2.40 2.60 3 5 -13 3.20 2.20 2 -5 -13 -0.10 1.60 2 -5 -13 2.50 2.50 2 5 -13 -2.90 1.50 2 5 -13 -2.80 1.30 2 5 -13 -0.10 1.70 1 -5 -13 5.60 2.20 1 -5 -13 2.10 1.70 1 5 -13 5.50 2.10 1 5 -13 3.20 2.00 1 5 -13 1.60 1.60 0 -5 -13 1.10 1.40 0 -5 -13 -2.60 1.90 0 5 -13 1.50 1.80 0 5 -13 1.40 1.70 0 5 -13 0.60 1.30 -1 -5 -13 1.30 1.20 -1 -5 -13 0.80 1.70 -1 5 -13 0.80 1.70 -1 5 -13 0.10 1.60 -2 -5 -13 5.10 2.30 -2 5 -13 1.20 1.70 -2 5 -13 -0.70 2.10 -3 -5 -13 7.00 2.30 -3 -5 -13 6.30 2.80 -3 5 -13 4.00 2.00 -3 5 -13 9.50 2.80 -4 -5 -13 0.30 1.50 4 -6 -13 8.80 2.60 4 -6 -13 6.40 3.00 4 6 -13 2.10 2.10 4 6 -13 0.50 2.50 4 6 -13 2.40 2.30 3 -6 -13 0.10 1.90 3 -6 -13 0.90 1.70 3 6 -13 -0.20 2.50 3 6 -13 -0.60 1.70 3 6 -13 -2.90 1.70 2 -6 -13 1.20 1.90 2 -6 -13 0.70 1.70 2 6 -13 -2.10 1.70 2 6 -13 2.30 2.00 2 6 -13 0.70 1.60 1 -6 -13 3.70 2.20 1 -6 -13 4.10 1.80 1 6 -13 4.30 2.70 1 6 -13 3.20 2.00 1 6 -13 3.80 1.70 0 -6 -13 3.40 2.00 0 -6 -13 2.40 1.60 0 6 -13 2.60 1.40 0 6 -13 1.30 2.50 0 6 -13 5.30 2.10 -1 -6 -13 3.70 2.40 -1 -6 -13 2.00 1.40 -1 6 -13 0.60 1.80 -1 6 -13 4.10 2.00 -2 -6 -13 12.60 3.00 -2 -6 -13 14.60 3.10 -2 6 -13 11.00 2.50 -2 6 -13 4.90 2.60 -3 -6 -13 -2.70 2.10 -3 -6 -13 2.40 1.90 -3 6 -13 0.20 1.70 -3 6 -13 -1.70 2.00 4 -7 -13 3.90 2.30 4 -7 -13 -0.60 2.40 4 7 -13 -0.60 1.90 4 7 -13 -0.40 1.80 4 7 -13 -0.80 2.00 3 -7 -13 -4.20 2.40 3 -7 -13 1.80 1.90 3 7 -13 -2.30 1.90 3 7 -13 3.40 2.60 3 7 -13 -1.00 1.70 2 -7 -13 -0.40 1.80 2 -7 -13 -1.20 2.50 2 7 -13 1.90 2.50 2 7 -13 -3.20 1.90 2 7 -13 -0.20 1.50 1 -7 -13 4.80 2.80 1 -7 -13 0.00 1.50 1 7 -13 -0.10 1.50 1 7 -13 -0.60 1.80 1 7 -13 0.60 2.50 0 -7 -13 1.40 1.90 0 -7 -13 5.30 1.80 0 7 -13 6.80 2.90 0 7 -13 2.30 1.50 0 7 -13 0.10 1.80 -1 -7 -13 1.40 2.30 -1 -7 -13 0.00 1.30 -1 7 -13 2.30 1.90 -1 7 -13 0.30 2.40 -2 -7 -13 -2.30 1.40 -2 -7 -13 0.70 2.10 -2 7 -13 0.00 1.70 -2 7 -13 -0.50 1.70 -3 -7 -13 0.10 2.60 -3 -7 -13 1.40 1.90 -3 7 -13 -2.40 1.40 -3 7 -13 -0.80 1.80 4 -8 -13 2.60 2.30 4 -8 -13 -1.60 2.50 4 8 -13 -1.60 1.90 4 8 -13 1.20 2.20 4 8 -13 -1.00 1.70 3 -8 -13 4.70 2.90 3 -8 -13 0.90 1.90 3 8 -13 -1.30 2.00 3 8 -13 -0.50 1.80 3 8 -13 -1.60 1.60 2 -8 -13 2.70 2.10 2 -8 -13 6.30 2.20 2 8 -13 3.80 2.30 2 8 -13 8.10 3.10 2 8 -13 6.00 2.00 1 -8 -13 0.60 2.60 1 -8 -13 -1.90 1.30 1 8 -13 1.70 1.50 1 8 -13 -0.20 2.00 1 8 -13 -1.00 1.60 0 -8 -13 -1.40 1.40 0 -8 -13 -1.20 2.30 0 8 -13 2.10 1.90 0 8 -13 -0.10 1.40 0 8 -13 1.20 2.00 -1 -8 -13 1.00 1.90 -1 -8 -13 0.20 2.20 -1 -8 -13 0.30 1.30 -1 8 -13 -0.40 1.70 -2 -8 -13 -1.40 1.30 -2 -8 -13 -2.00 2.30 -2 8 -13 2.60 2.00 -3 -8 -13 4.20 2.40 3 -9 -13 -0.20 1.90 3 -9 -13 -1.30 1.80 3 9 -13 -1.40 2.20 3 9 -13 0.60 1.90 3 9 -13 1.70 2.10 2 -9 -13 4.00 2.90 2 -9 -13 5.60 2.20 2 9 -13 4.50 2.80 2 9 -13 3.40 2.00 2 9 -13 4.70 2.00 1 -9 -13 0.60 1.90 1 -9 -13 1.60 1.70 1 9 -13 4.20 2.20 1 9 -13 -0.70 2.00 1 9 -13 4.60 1.80 0 -9 -13 0.90 2.60 0 -9 -13 2.90 1.80 0 -9 -13 1.50 2.40 0 9 -13 -2.60 1.90 0 9 -13 -0.90 1.20 -1 -9 -13 2.00 2.60 -1 -9 -13 0.60 1.80 -1 -9 -13 -0.30 1.40 -1 9 -13 1.80 2.20 -2 -9 -13 -0.70 1.40 -2 -9 -13 0.90 2.60 -2 9 -13 -1.80 1.80 2 -10 -13 3.20 2.90 2 -10 -13 0.90 2.10 2 10 -13 1.80 1.90 2 10 -13 0.90 2.30 2 10 -13 2.50 2.70 1 -10 -13 1.50 2.20 1 -10 -13 3.80 2.80 1 -10 -13 2.20 1.80 1 10 -13 0.80 2.20 1 10 -13 2.90 1.70 0 -10 -13 -0.20 1.50 0 -10 -13 0.60 2.00 0 -10 -13 -0.30 1.70 0 10 -13 1.20 1.50 0 10 -13 -1.40 2.00 -1 -10 -13 0.50 1.50 -1 -10 -13 0.60 2.40 -1 -10 -13 3.30 2.10 -1 10 -13 -1.50 1.90 1 -11 -13 2.50 2.80 1 -11 -13 0.00 2.50 1 11 -13 0.30 1.60 1 11 -13 -0.50 1.70 0 -11 -13 -0.30 2.60 0 -11 -13 3.20 2.70 0 11 -13 -3.40 2.00 2 0 -14 7.70 2.20 2 0 -14 5.00 3.20 1 0 -14 0.80 1.50 1 0 -14 0.80 2.70 0 0 -14 1.70 2.60 -1 0 -14 3.00 2.60 2 -1 -14 0.60 1.70 2 -1 -14 -2.00 1.70 2 1 -14 2.80 2.90 2 1 -14 1.00 1.80 1 -1 -14 0.00 1.90 1 -1 -14 0.80 1.60 1 1 -14 0.10 1.50 1 1 -14 -2.60 1.60 0 -1 -14 2.00 2.70 0 1 -14 5.80 3.10 -1 -1 -14 1.10 2.50 -1 1 -14 -2.60 2.30 2 -2 -14 3.10 2.70 2 -2 -14 -0.10 1.70 2 2 -14 5.10 2.40 2 2 -14 1.40 1.90 1 -2 -14 -1.00 1.50 1 -2 -14 0.70 2.60 1 2 -14 0.50 1.50 1 2 -14 3.60 2.80 0 -2 -14 1.10 2.70 0 2 -14 0.40 2.10 -1 -2 -14 4.50 2.70 -1 2 -14 -0.80 2.30 2 -3 -14 -0.60 1.90 2 -3 -14 1.50 1.80 2 3 -14 1.70 2.70 2 3 -14 -1.90 1.60 1 -3 -14 -0.20 1.50 1 -3 -14 1.00 1.90 1 3 -14 0.10 2.40 1 3 -14 -0.80 1.40 0 -3 -14 1.10 2.40 0 3 -14 3.20 2.80 -1 -3 -14 7.10 3.00 -1 3 -14 2.30 2.10 1 -4 -14 -1.20 1.40 1 -4 -14 0.80 2.60 1 4 -14 -1.30 1.70 1 4 -14 -0.90 1.50 0 -4 -14 3.00 2.10 0 4 -14 1.70 2.60 _computing_structure_solution 'SHELXT 2014/4 (Sheldrick, 2014)' ; _shelx_hkl_checksum 72852 _shelx_res_file ; TITL a1cg CELL 0.71073 9.4336 20.6071 10.5866 90.000 93.106 90.000 ZERR 4.00 0.0004 0.0009 0.0004 0.000 0.002 0.000 LATT 1 SYMM - X, 1/2 + Y, 1/2 - Z SFAC C H N O S UNIT 96 80 8 8 4 MERG 2 FMAP 2 PLAN 10 OMIT -2 55.1 SIZE 0.150 0.200 0.300 ACTA BOND $H CONF HTAB L.S. 20 EXYZ C12 C22 EADP S11 C23 EADP C12 C22 EADP C13 S21 EADP C14 C25 EADP C15 C24 TEMP 23.00 MPLA N31 N32 C33 C34 C35 C3 C2 C1 C12 S11 C13 C14 C15 MPLA C311 > C316 MPLA N31 > C35 MPLA C351 > C356 MPLA N31 > C35 MPLA C12 C1 C2 C3 C34 MPLA S11 C12 C13 C14 C15 MPLA S21 C22 C23 C24 C25 MPLA 7 O35 C351 C352 C353 C354 C355 C356 C35 WGHT 0.062400 0.576100 FVAR 0.35553 0.88254 C1 1 0.683410 0.384948 0.490615 11.00000 0.05192 0.04831 = 0.04425 0.00229 -0.00445 -0.00316 O1 4 0.750058 0.427523 0.548337 11.00000 0.09200 0.05408 = 0.07344 0.00234 -0.03815 -0.00919 C2 1 0.579777 0.399812 0.386196 11.00000 0.04811 0.04819 = 0.04758 0.00205 -0.00872 -0.00232 AFIX 43 H2 2 0.530194 0.366111 0.345498 11.00000 -1.20000 AFIX 0 C3 1 0.555475 0.460608 0.348708 11.00000 0.04683 0.04811 = 0.04369 -0.00073 -0.00392 -0.00234 AFIX 43 H3 2 0.604672 0.492596 0.394946 11.00000 -1.20000 AFIX 0 PART 1 S11 5 0.814417 0.298026 0.655059 21.00000 0.08846 0.05551 = 0.05327 0.00571 -0.02829 0.00042 C12 1 0.706183 0.316659 0.524772 21.00000 0.04714 0.04920 = 0.03993 0.00231 -0.00363 0.00023 C13 1 0.660865 0.261696 0.468227 21.00000 0.07119 0.05558 = 0.05149 -0.00511 -0.01986 -0.00263 AFIX 43 H13 2 0.600098 0.261590 0.396058 21.00000 -1.20000 AFIX 0 C14 1 0.711829 0.204277 0.525900 21.00000 0.07948 0.04490 = 0.06771 -0.00023 -0.00365 -0.00141 AFIX 43 H14 2 0.691179 0.162694 0.496126 21.00000 -1.20000 AFIX 0 C15 1 0.794100 0.217578 0.629472 21.00000 0.08150 0.05602 = 0.06239 0.01122 -0.00783 0.00837 AFIX 43 H15 2 0.835733 0.185889 0.681880 21.00000 -1.20000 AFIX 0 PART 0 PART 2 SAME 0.01 0.02 S11 > C15 S21 5 0.633877 0.255335 0.438048 -21.00000 0.07119 0.05558 = 0.05149 -0.00511 -0.01986 -0.00263 C22 1 0.706183 0.316659 0.524772 -21.00000 0.04714 0.04920 = 0.03993 0.00231 -0.00363 0.00023 C23 1 0.784107 0.293271 0.623417 -21.00000 0.08846 0.05551 = 0.05327 0.00571 -0.02829 0.00042 AFIX 43 H23 2 0.839554 0.319543 0.677746 -21.00000 -1.20000 AFIX 0 C24 1 0.775454 0.225535 0.638460 -21.00000 0.08150 0.05602 = 0.06239 0.01122 -0.00783 0.00837 AFIX 43 H24 2 0.825240 0.201813 0.701053 -21.00000 -1.20000 AFIX 0 C25 1 0.685178 0.200128 0.549644 -21.00000 0.07948 0.04490 = 0.06771 -0.00023 -0.00365 -0.00141 AFIX 43 H25 2 0.654403 0.157251 0.549396 -21.00000 -1.20000 AFIX 0 PART 0 N31 3 0.307769 0.488650 0.081199 11.00000 0.04479 0.03501 = 0.04851 0.00326 -0.00535 -0.00005 N32 3 0.361189 0.550355 0.096991 11.00000 0.05277 0.03454 = 0.05914 0.00403 -0.00831 -0.00330 C33 1 0.452866 0.546596 0.195707 11.00000 0.04754 0.03770 = 0.05483 0.00046 -0.00215 -0.00090 C34 1 0.462687 0.483042 0.245674 11.00000 0.04218 0.03873 = 0.04766 0.00122 -0.00239 0.00134 C35 1 0.368668 0.448245 0.168709 11.00000 0.04128 0.03349 = 0.04665 0.00299 0.00078 0.00032 C311 1 0.207934 0.476034 -0.021744 11.00000 0.03908 0.04017 = 0.04578 -0.00218 -0.00268 0.00673 C312 1 0.109035 0.426636 -0.015770 11.00000 0.04791 0.04517 = 0.05464 0.00084 -0.00417 0.00269 AFIX 43 H312 2 0.106244 0.400919 0.056240 11.00000 -1.20000 AFIX 0 C313 1 0.014542 0.415969 -0.117955 11.00000 0.05056 0.05773 = 0.06431 -0.01090 -0.00909 -0.00002 AFIX 43 H313 2 -0.051516 0.382595 -0.114651 11.00000 -1.20000 AFIX 0 C314 1 0.016875 0.453929 -0.224142 11.00000 0.05550 0.07599 = 0.05410 -0.01268 -0.01301 0.00866 AFIX 43 H314 2 -0.046921 0.446227 -0.292568 11.00000 -1.20000 AFIX 0 C315 1 0.113984 0.503405 -0.228890 11.00000 0.06010 0.07761 = 0.04787 0.00719 -0.00393 0.00940 AFIX 43 H315 2 0.115383 0.529408 -0.300611 11.00000 -1.20000 AFIX 0 C316 1 0.209778 0.514826 -0.127661 11.00000 0.04700 0.05416 = 0.05046 0.00513 0.00076 0.00321 AFIX 43 H316 2 0.275061 0.548512 -0.131108 11.00000 -1.20000 AFIX 0 C331 1 0.535657 0.604930 0.238621 11.00000 0.06785 0.04131 = 0.07661 -0.00497 -0.01242 -0.00516 AFIX 137 H31A 2 0.631778 0.600799 0.214218 11.00000 -1.50000 H31B 2 0.534879 0.608502 0.328994 11.00000 -1.50000 H31C 2 0.493621 0.643049 0.200282 11.00000 -1.50000 AFIX 0 O35 4 0.345528 0.383506 0.162462 11.00000 0.04922 0.03405 = 0.05755 0.00315 0.00058 -0.00182 C351 1 0.255250 0.354501 0.246266 11.00000 0.03942 0.04853 = 0.05695 0.01739 -0.00990 -0.00336 C352 1 0.242891 0.287663 0.230143 11.00000 0.05546 0.04838 = 0.07703 0.02228 -0.02827 -0.01105 C353 1 0.151564 0.256126 0.305607 11.00000 0.07464 0.07289 = 0.11104 0.04052 -0.02905 -0.02862 AFIX 43 H353 2 0.140415 0.211446 0.297680 11.00000 -1.20000 AFIX 0 C354 1 0.076642 0.288760 0.392074 11.00000 0.06538 0.10766 = 0.11057 0.05874 -0.00639 -0.02335 AFIX 43 H354 2 0.014316 0.266094 0.440978 11.00000 -1.20000 AFIX 0 C355 1 0.091828 0.354659 0.408064 11.00000 0.06055 0.11609 = 0.08309 0.03114 0.01302 0.00651 AFIX 43 H355 2 0.041124 0.376299 0.468125 11.00000 -1.20000 AFIX 0 C356 1 0.184214 0.388948 0.333236 11.00000 0.05616 0.06874 = 0.07245 0.01929 0.00731 0.00456 AFIX 43 H356 2 0.196755 0.433497 0.342389 11.00000 -1.20000 AFIX 0 C357 1 0.327755 0.253257 0.135520 11.00000 0.10816 0.04119 = 0.09677 -0.00369 -0.02770 -0.00101 AFIX 137 H35A 2 0.426520 0.254600 0.162504 11.00000 -1.50000 H35B 2 0.314105 0.274161 0.054737 11.00000 -1.50000 H35C 2 0.297150 0.208911 0.128542 11.00000 -1.50000 AFIX 0 HKLF 4 REM a1cg REM R1 = 0.0446 for 2877 Fo > 4sig(Fo) and 0.0912 for all 4735 data REM 277 parameters refined using 10 restraints END WGHT 0.0624 0.5761 REM Instructions for potential hydrogen bonds HTAB C2 O35 EQIV $1 -x+1, y-1/2, -z+1/2 HTAB C14 N32_$1 HTAB C25 N32_$1 HTAB C312 O35 EQIV $2 -x+1, y+1/2, -z+1/2 HTAB C331 S21_$2 REM Highest difference peak 0.189, deepest hole -0.229, 1-sigma level 0.043 Q1 1 0.1081 0.3988 0.4620 11.00000 0.05 0.19 Q2 1 0.0346 0.3995 0.5175 11.00000 0.05 0.19 Q3 1 0.6487 0.5953 0.2806 11.00000 0.05 0.17 Q4 1 0.5704 0.6259 0.1596 11.00000 0.05 0.17 Q5 1 0.4465 0.6407 0.2786 11.00000 0.05 0.17 Q6 1 0.5785 0.6229 0.1193 11.00000 0.05 0.16 Q7 1 0.0712 0.3225 0.4560 11.00000 0.05 0.16 Q8 1 -0.0855 0.3888 -0.0792 11.00000 0.05 0.15 Q9 1 -0.0008 0.2886 0.5022 11.00000 0.05 0.15 Q10 1 0.5764 0.3527 0.2957 11.00000 0.05 0.15 ; _shelx_res_checksum 26338 _shelxl_version_number 2.014 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' loop_ _atom_site_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 C C1 0.6834(2) 0.38495(10) 0.49061(18) 0.0484(5) Uani d 1 . . O O1 0.75006(19) 0.42752(8) 0.54834(16) 0.0747(5) Uani d 1 . . C C2 0.5798(2) 0.39981(10) 0.38620(18) 0.0484(5) Uani d 1 . . H H2 0.5302 0.3661 0.3455 0.058 Uiso calc 1 . . C C3 0.5555(2) 0.46061(10) 0.34871(18) 0.0464(5) Uani d 1 . . H H3 0.6047 0.4926 0.3949 0.056 Uiso calc 1 . . S S11 0.81442(11) 0.29803(4) 0.65506(8) 0.0669(3) Uani d 0.883(2) A 1 C C12 0.7062(2) 0.31666(10) 0.52477(17) 0.0456(5) Uani d 0.883(2) A 1 C C13 0.6609(8) 0.2617(3) 0.4682(5) 0.0603(9) Uani d 0.883(2) A 1 H H13 0.6001 0.2616 0.3961 0.072 Uiso calc 0.883(2) A 1 C C14 0.7118(5) 0.20428(17) 0.5259(4) 0.0643(12) Uani d 0.883(2) A 1 H H14 0.6912 0.1627 0.4961 0.077 Uiso calc 0.883(2) A 1 C C15 0.7941(9) 0.21758(17) 0.6295(6) 0.0671(16) Uani d 0.883(2) A 1 H H15 0.8357 0.1859 0.6819 0.080 Uiso calc 0.883(2) A 1 S S21 0.6339(18) 0.2553(6) 0.4380(13) 0.0603(9) Uani d 0.117(2) A 2 C C22 0.7062(2) 0.31666(10) 0.52477(17) 0.0456(5) Uani d 0.117(2) A 2 C C23 0.784(3) 0.2933(10) 0.623(2) 0.0669(3) Uani d 0.117(2) A 2 H H23 0.8396 0.3195 0.6777 0.080 Uiso calc 0.117(2) A 2 C C24 0.775(8) 0.2255(11) 0.638(5) 0.0671(16) Uani d 0.117(2) A 2 H H24 0.8252 0.2018 0.7011 0.080 Uiso calc 0.117(2) A 2 C C25 0.685(5) 0.2001(8) 0.550(3) 0.0643(12) Uani d 0.117(2) A 2 H H25 0.6544 0.1573 0.5494 0.077 Uiso calc 0.117(2) A 2 N N31 0.30777(16) 0.48865(7) 0.08120(15) 0.0431(4) Uani d 1 . . N N32 0.36119(18) 0.55036(8) 0.09699(16) 0.0492(4) Uani d 1 . . C C33 0.4529(2) 0.54660(9) 0.19571(19) 0.0469(5) Uani d 1 . . C C34 0.4627(2) 0.48304(9) 0.24567(18) 0.0430(4) Uani d 1 . . C C35 0.36867(19) 0.44824(9) 0.16871(17) 0.0405(4) Uani d 1 . . C C311 0.20793(19) 0.47603(9) -0.02174(18) 0.0419(4) Uani d 1 . . C C312 0.1090(2) 0.42664(10) -0.0158(2) 0.0495(5) Uani d 1 . . H H312 0.1062 0.4009 0.0562 0.059 Uiso calc 1 . . C C313 0.0145(2) 0.41597(11) -0.1180(2) 0.0580(6) Uani d 1 . . H H313 -0.0515 0.3826 -0.1147 0.070 Uiso calc 1 . . C C314 0.0169(2) 0.45393(12) -0.2241(2) 0.0624(6) Uani d 1 . . H H314 -0.0469 0.4462 -0.2926 0.075 Uiso calc 1 . . C C315 0.1140(2) 0.50340(13) -0.2289(2) 0.0621(6) Uani d 1 . . H H315 0.1154 0.5294 -0.3006 0.075 Uiso calc 1 . . C C316 0.2098(2) 0.51483(11) -0.12766(19) 0.0506(5) Uani d 1 . . H H316 0.2751 0.5485 -0.1311 0.061 Uiso calc 1 . . C C331 0.5357(3) 0.60493(10) 0.2386(2) 0.0625(6) Uani d 1 . . H H31A 0.6318 0.6008 0.2142 0.094 Uiso calc 1 . . H H31B 0.5349 0.6085 0.3290 0.094 Uiso calc 1 . . H H31C 0.4936 0.6430 0.2003 0.094 Uiso calc 1 . . O O35 0.34553(14) 0.38351(6) 0.16246(12) 0.0470(3) Uani d 1 . . C C351 0.2552(2) 0.35450(10) 0.24627(19) 0.0488(5) Uani d 1 . . C C352 0.2429(2) 0.28766(11) 0.2301(2) 0.0614(6) Uani d 1 . . C C353 0.1516(3) 0.25613(15) 0.3056(3) 0.0874(10) Uani d 1 . . H H353 0.1404 0.2114 0.2977 0.105 Uiso calc 1 . . C C354 0.0766(3) 0.28876(19) 0.3921(3) 0.0949(11) Uani d 1 . . H H354 0.0143 0.2661 0.4410 0.114 Uiso calc 1 . . C C355 0.0918(3) 0.35466(17) 0.4081(3) 0.0862(9) Uani d 1 . . H H355 0.0411 0.3763 0.4681 0.103 Uiso calc 1 . . C C356 0.1842(2) 0.38895(13) 0.3332(2) 0.0656(6) Uani d 1 . . H H356 0.1968 0.4335 0.3424 0.079 Uiso calc 1 . . C C357 0.3278(3) 0.25326(12) 0.1355(3) 0.0832(9) Uani d 1 . . H H35A 0.4265 0.2546 0.1625 0.125 Uiso calc 1 . . H H35B 0.3141 0.2742 0.0547 0.125 Uiso calc 1 . . H H35C 0.2971 0.2089 0.1285 0.125 Uiso calc 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 C1 0.0519(12) 0.0483(12) 0.0442(11) -0.0032(10) -0.0045(9) 0.0023(9) O1 0.0920(12) 0.0541(9) 0.0734(10) -0.0092(9) -0.0381(9) 0.0023(8) C2 0.0481(11) 0.0482(12) 0.0476(11) -0.0023(9) -0.0087(9) 0.0021(9) C3 0.0468(11) 0.0481(12) 0.0437(11) -0.0023(9) -0.0039(9) -0.0007(9) S11 0.0885(6) 0.0555(4) 0.0533(5) 0.0004(4) -0.0283(3) 0.0057(3) C12 0.0471(11) 0.0492(11) 0.0399(10) 0.0002(9) -0.0036(8) 0.0023(9) C13 0.071(3) 0.0556(17) 0.051(3) -0.0026(16) -0.0199(18) -0.0051(17) C14 0.079(3) 0.0449(13) 0.068(2) -0.0014(13) -0.004(2) -0.0002(12) C15 0.081(3) 0.0560(16) 0.0624(19) 0.0084(19) -0.008(2) 0.0112(16) S21 0.071(3) 0.0556(17) 0.051(3) -0.0026(16) -0.0199(18) -0.0051(17) C22 0.0471(11) 0.0492(11) 0.0399(10) 0.0002(9) -0.0036(8) 0.0023(9) C23 0.0885(6) 0.0555(4) 0.0533(5) 0.0004(4) -0.0283(3) 0.0057(3) C24 0.081(3) 0.0560(16) 0.0624(19) 0.0084(19) -0.008(2) 0.0112(16) C25 0.079(3) 0.0449(13) 0.068(2) -0.0014(13) -0.004(2) -0.0002(12) N31 0.0448(9) 0.0350(8) 0.0485(9) -0.0001(7) -0.0054(7) 0.0033(7) N32 0.0528(10) 0.0345(9) 0.0591(10) -0.0033(7) -0.0083(8) 0.0040(8) C33 0.0475(11) 0.0377(10) 0.0548(12) -0.0009(9) -0.0022(9) 0.0005(9) C34 0.0422(10) 0.0387(10) 0.0477(11) 0.0013(8) -0.0024(8) 0.0012(8) C35 0.0413(10) 0.0335(10) 0.0467(11) 0.0003(8) 0.0008(8) 0.0030(8) C311 0.0391(10) 0.0402(10) 0.0458(11) 0.0067(8) -0.0027(8) -0.0022(8) C312 0.0479(11) 0.0452(11) 0.0546(12) 0.0027(9) -0.0042(9) 0.0008(9) C313 0.0506(12) 0.0577(13) 0.0643(14) 0.0000(11) -0.0091(10) -0.0109(11) C314 0.0555(13) 0.0760(16) 0.0541(14) 0.0087(12) -0.0130(10) -0.0127(12) C315 0.0601(14) 0.0776(16) 0.0479(12) 0.0094(12) -0.0039(10) 0.0072(11) C316 0.0470(11) 0.0542(13) 0.0505(12) 0.0032(10) 0.0008(9) 0.0051(10) C331 0.0679(15) 0.0413(12) 0.0766(15) -0.0052(10) -0.0124(12) -0.0050(11) O35 0.0492(8) 0.0340(7) 0.0575(8) -0.0018(6) 0.0006(6) 0.0031(6) C351 0.0394(10) 0.0485(12) 0.0570(12) -0.0034(9) -0.0099(9) 0.0174(10) C352 0.0555(13) 0.0484(13) 0.0770(15) -0.0111(11) -0.0283(12) 0.0223(12) C353 0.0746(18) 0.0729(19) 0.111(2) -0.0286(15) -0.0290(18) 0.0405(18) C354 0.0654(18) 0.108(3) 0.111(3) -0.0234(18) -0.0064(17) 0.059(2) C355 0.0606(16) 0.116(3) 0.0831(19) 0.0065(16) 0.0130(14) 0.0311(18) C356 0.0562(14) 0.0687(16) 0.0725(15) 0.0046(12) 0.0073(12) 0.0193(13) C357 0.108(2) 0.0412(13) 0.097(2) -0.0010(14) -0.0277(18) -0.0037(13) 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 O1 C1 C12 120.05(18) O1 C1 C2 121.99(19) C12 C1 C2 117.96(17) C3 C2 C1 121.21(18) C3 C2 H2 119.4 C1 C2 H2 119.4 C2 C3 C34 128.12(19) C2 C3 H3 115.9 C34 C3 H3 115.9 C15 S11 C12 91.91(14) C13 C12 C1 131.5(3) C13 C12 S11 109.4(3) C1 C12 S11 119.10(15) C12 C13 C14 115.1(3) C12 C13 H13 122.4 C14 C13 H13 122.4 C15 C14 C13 110.7(3) C15 C14 H14 124.6 C13 C14 H14 124.6 C14 C15 S11 112.9(3) C14 C15 H15 123.6 S11 C15 H15 123.6 C24 C23 H23 122.8 C25 C24 C23 110.3(12) C25 C24 H24 124.9 C23 C24 H24 124.9 C24 C25 S21 112.0(11) C24 C25 H25 124.0 S21 C25 H25 124.0 C35 N31 N32 110.33(15) C35 N31 C311 130.62(16) N32 N31 C311 118.98(15) C33 N32 N31 105.17(15) N32 C33 C34 112.14(17) N32 C33 C331 120.20(18) C34 C33 C331 127.61(18) C35 C34 C33 103.57(16) C35 C34 C3 129.00(18) C33 C34 C3 127.36(18) N31 C35 O35 120.86(16) N31 C35 C34 108.79(16) O35 C35 C34 129.88(17) C316 C311 C312 120.13(18) C316 C311 N31 118.65(18) C312 C311 N31 121.21(17) C313 C312 C311 119.3(2) C313 C312 H312 120.4 C311 C312 H312 120.4 C314 C313 C312 120.9(2) C314 C313 H313 119.6 C312 C313 H313 119.6 C313 C314 C315 119.6(2) C313 C314 H314 120.2 C315 C314 H314 120.2 C314 C315 C316 120.4(2) C314 C315 H315 119.8 C316 C315 H315 119.8 C311 C316 C315 119.7(2) C311 C316 H316 120.2 C315 C316 H316 120.2 C33 C331 H31A 109.5 C33 C331 H31B 109.5 H31A C331 H31B 109.5 C33 C331 H31C 109.5 H31A C331 H31C 109.5 H31B C331 H31C 109.5 C35 O35 C351 119.55(16) C356 C351 C352 123.8(2) C356 C351 O35 122.94(19) C352 C351 O35 113.3(2) C353 C352 C351 116.7(3) C353 C352 C357 122.8(3) C351 C352 C357 120.5(2) C354 C353 C352 121.5(3) C354 C353 H353 119.2 C352 C353 H353 119.2 C353 C354 C355 121.0(3) C353 C354 H354 119.5 C355 C354 H354 119.5 C354 C355 C356 119.5(3) C354 C355 H355 120.2 C356 C355 H355 120.2 C351 C356 C355 117.5(3) C351 C356 H356 121.2 C355 C356 H356 121.2 C352 C357 H35A 109.5 C352 C357 H35B 109.5 H35A C357 H35B 109.5 C352 C357 H35C 109.5 H35A C357 H35C 109.5 H35B C357 H35C 109.5 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance C1 O1 1.223(2) C1 C12 1.466(3) C1 C2 1.468(3) C2 C3 1.330(3) C2 H2 0.9300 C3 C34 1.437(3) C3 H3 0.9300 S11 C15 1.689(4) S11 C12 1.7146(19) C12 C13 1.340(5) C13 C14 1.404(6) C13 H13 0.9300 C14 C15 1.337(3) C14 H14 0.9300 C15 H15 0.9300 S21 C25 1.692(11) C23 C24 1.408(11) C23 H23 0.9300 C24 C25 1.340(9) C24 H24 0.9300 C25 H25 0.9300 N31 C35 1.351(2) N31 N32 1.375(2) N31 C311 1.425(2) N32 C33 1.322(2) C33 C34 1.414(3) C33 C331 1.491(3) C34 C35 1.373(3) C35 O35 1.353(2) C311 C316 1.378(3) C311 C312 1.385(3) C312 C313 1.382(3) C312 H312 0.9300 C313 C314 1.371(3) C313 H313 0.9300 C314 C315 1.373(3) C314 H314 0.9300 C315 C316 1.384(3) C315 H315 0.9300 C316 H316 0.9300 C331 H31A 0.9600 C331 H31B 0.9600 C331 H31C 0.9600 O35 C351 1.397(2) C351 C356 1.367(3) C351 C352 1.392(3) C352 C353 1.370(4) C352 C357 1.495(4) C353 C354 1.364(5) C353 H353 0.9300 C354 C355 1.375(4) C354 H354 0.9300 C355 C356 1.400(3) C355 H355 0.9300 C356 H356 0.9300 C357 H35A 0.9600 C357 H35B 0.9600 C357 H35C 0.9600 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 C14 H14 N32 2_645 0.93 2.55 3.483(4) 177 y C25 H25 N32 2_645 0.93 2.69 3.47(2) 142 y C314 H314 O1 1_454 0.93 2.51 3.432(3) 171 y 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 O1 C1 C2 C3 1.0(3) C12 C1 C2 C3 -178.86(19) C1 C2 C3 C34 177.23(19) O1 C1 C12 C13 -170.9(5) C2 C1 C12 C13 9.0(6) O1 C1 C12 S11 6.0(3) C2 C1 C12 S11 -174.22(15) C15 S11 C12 C13 -0.3(5) C15 S11 C12 C1 -177.8(4) C1 C12 C13 C14 176.4(4) S11 C12 C13 C14 -0.6(7) C12 C13 C14 C15 1.6(9) C13 C14 C15 S11 -1.8(9) C12 S11 C15 C14 1.3(7) C23 C24 C25 S21 9(8) C35 N31 N32 C33 -0.9(2) C311 N31 N32 C33 -178.00(16) N31 N32 C33 C34 0.6(2) N31 N32 C33 C331 178.19(19) N32 C33 C34 C35 0.0(2) C331 C33 C34 C35 -177.5(2) N32 C33 C34 C3 177.07(18) C331 C33 C34 C3 -0.4(4) C2 C3 C34 C35 6.2(4) C2 C3 C34 C33 -170.2(2) N32 N31 C35 O35 -171.96(16) C311 N31 C35 O35 4.7(3) N32 N31 C35 C34 0.9(2) C311 N31 C35 C34 177.56(18) C33 C34 C35 N31 -0.5(2) C3 C34 C35 N31 -177.55(18) C33 C34 C35 O35 171.48(19) C3 C34 C35 O35 -5.6(3) C35 N31 C311 C316 -150.6(2) N32 N31 C311 C316 25.9(3) C35 N31 C311 C312 30.5(3) N32 N31 C311 C312 -153.05(18) C316 C311 C312 C313 1.3(3) N31 C311 C312 C313 -179.78(18) C311 C312 C313 C314 -0.6(3) C312 C313 C314 C315 -0.3(3) C313 C314 C315 C316 0.4(3) C312 C311 C316 C315 -1.2(3) N31 C311 C316 C315 179.88(18) C314 C315 C316 C311 0.3(3) N31 C35 O35 C351 -105.1(2) C34 C35 O35 C351 83.7(2) C35 O35 C351 C356 2.2(3) C35 O35 C351 C352 -179.18(16) C356 C351 C352 C353 1.2(3) O35 C351 C352 C353 -177.45(18) C356 C351 C352 C357 -178.1(2) O35 C351 C352 C357 3.3(3) C351 C352 C353 C354 0.0(4) C357 C352 C353 C354 179.3(2) C352 C353 C354 C355 -1.0(4) C353 C354 C355 C356 0.9(4) C352 C351 C356 C355 -1.3(3) O35 C351 C356 C355 177.17(19) C354 C355 C356 C351 0.3(4) _cod_database_fobs_code 2243215