#------------------------------------------------------------------------------ #$Date: 2014-03-11 15:13:38 +0000 (Tue, 11 Mar 2014) $ #$Revision: 104804 $ #$URL: svn://www.crystallography.net/cod/cif/2/23/89/2238972.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_2238972 loop_ _publ_author_name 'Ullah, Nisar' 'Stoeckli-Evans, Helen' _publ_section_title ; 8-{1-[(4'-Fluoro-[1,1'-biphenyl]-4-yl)methyl]piperidin-4-yl}-3,4-dihydroquinolin-2(1H)-one chloroform 0.25-solvate ; _journal_coeditor_code LR2120 _journal_issue 2 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first o103 _journal_page_last o104 _journal_paper_doi 10.1107/S160053681303448X _journal_volume 70 _journal_year 2014 _chemical_formula_iupac 'C27 H27 F N2 O, 0.25C H Cl3' _chemical_formula_moiety 'C27 H27 F N2 O, 0.25(C H Cl3)' _chemical_formula_sum 'C27.25 H27.25 Cl0.75 F N2 O' _chemical_formula_weight 444.35 _chemical_name_systematic '8-{1-[(4'-Fluoro-[1,1'-biphenyl]-4-yl)methyl]piperidin-4-yl}-3,4-dihydroquinolin-2(1H)-one chloroform 0.25-solvate' _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _atom_sites_solution_hydrogens mixed _audit_creation_method SHELXL-2013 _cell_angle_alpha 79.206(9) _cell_angle_beta 87.563(9) _cell_angle_gamma 83.976(9) _cell_formula_units_Z 4 _cell_length_a 7.6955(8) _cell_length_b 16.618(2) _cell_length_c 18.224(2) _cell_measurement_reflns_used 8114 _cell_measurement_temperature 173(2) _cell_measurement_theta_max 26.03 _cell_measurement_theta_min 1.53 _cell_volume 2276.1(4) _computing_cell_refinement 'X-AREA (Stoe & Cie, 2009)' _computing_data_collection 'X-AREA (Stoe & Cie, 2009)' _computing_data_reduction 'X-RED32 (Stoe & Cie, 2009)' _computing_molecular_graphics 'Mercury (Macrae et al., 2008)' _computing_publication_material ; SHELXL2013 (Sheldrick, 2008), PLATON (Spek, 2009) and publCIF (Westrip, 2010) ; _computing_structure_refinement 'SHELXL2013 (Sheldrick, 2008)' _computing_structure_solution 'SHELXS97 (Sheldrick, 2008)' _diffrn_ambient_temperature 173(2) _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 0.993 _diffrn_measurement_device '2-circle goniometer' _diffrn_measurement_device_type 'Stoe IPDS 2' _diffrn_measurement_method '\f + \w scans' _diffrn_radiation_monochromator 'plane graphite' _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0930 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_h_min -9 _diffrn_reflns_limit_k_max 20 _diffrn_reflns_limit_k_min -20 _diffrn_reflns_limit_l_max 22 _diffrn_reflns_limit_l_min -22 _diffrn_reflns_number 27043 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 25.693 _diffrn_reflns_theta_min 1.530 _exptl_absorpt_coefficient_mu 0.169 _exptl_absorpt_correction_T_max 1.0000 _exptl_absorpt_correction_T_min 0.7641 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details '(MULscanABS in PLATON; Spek, 2009)' _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 1.297 _exptl_crystal_description rod _exptl_crystal_F_000 938 _exptl_crystal_size_max 0.45 _exptl_crystal_size_mid 0.30 _exptl_crystal_size_min 0.15 _refine_diff_density_max 0.628 _refine_diff_density_min -0.604 _refine_ls_extinction_coef 0.0034(5) _refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^ _refine_ls_extinction_method 'SHELXL2013 (Sheldrick, 2008)' _refine_ls_goodness_of_fit_ref 0.692 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 595 _refine_ls_number_reflns 8614 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 0.692 _refine_ls_R_factor_all 0.1212 _refine_ls_R_factor_gt 0.0499 _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^)+(0.0494P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1036 _refine_ls_wR_factor_ref 0.1153 _reflns_number_gt 3481 _reflns_number_total 8614 _reflns_threshold_expression I>2\s(I) _[local]_cod_data_source_file lr2120sup1.cif _[local]_cod_data_source_block I _cod_database_code 2238972 _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_hkl_checksum 79687 _shelx_hkl_file ; 9 7 -1 5.01 17.92 9 7 -1 1.11 18.28 9 6 -1 0.09 17.15 9 6 -1 5.31 18.12 9 6 -1 2.98 17.84 9 6 -2 1.56 17.71 9 6 -2 3.67 18.14 9 6 -2 4.04 18.19 9 5 -1 6.35 21.94 9 5 -1 9.92 21.73 9 5 -1 6.20 12.35 9 5 -2 16.40 17.91 9 5 -2 18.78 17.83 9 5 -2 11.74 17.95 9 5 -3 3.63 22.12 9 5 -3 0.33 17.41 9 5 -3 4.68 17.94 9 4 -1 -1.76 17.29 9 4 -1 1.19 21.58 9 4 -1 3.32 21.28 9 4 -2 4.12 18.12 9 4 -2 3.91 17.62 9 4 -2 3.04 17.58 9 4 -3 3.27 18.00 9 4 -3 1.91 17.71 9 4 -3 0.89 17.86 9 4 -4 3.17 22.28 9 4 -4 0.00 18.71 9 4 -4 0.20 22.51 9 3 -1 12.65 12.60 9 3 -1 6.86 22.50 9 3 -1 8.67 21.44 9 3 -2 -3.31 17.71 9 3 -2 4.17 22.01 9 3 -2 0.82 22.38 9 3 -3 5.76 17.74 9 3 -3 1.26 17.81 9 3 -3 1.64 17.48 9 3 -4 -2.68 18.34 9 3 -4 -0.09 17.54 9 3 -4 3.87 21.88 9 2 -1 18.15 28.55 9 2 -1 12.97 12.69 9 2 -1 21.03 32.32 9 2 -2 14.26 17.41 9 2 -2 10.85 25.27 9 2 -2 9.07 22.66 9 2 -3 24.98 18.19 9 2 -3 35.52 21.82 9 2 -3 27.45 22.25 9 2 -4 1.87 18.08 9 2 -4 -0.26 18.29 9 2 -4 -0.54 22.64 9 2 -5 5.89 18.59 9 2 -5 6.17 18.17 9 2 -5 7.30 18.43 9 1 -1 28.66 17.64 9 1 -2 36.41 17.64 9 1 -3 -0.24 26.01 9 1 -3 -4.25 18.08 9 1 -3 1.41 25.20 9 1 -4 12.74 25.42 9 1 -4 12.52 22.18 9 1 -4 11.17 18.66 9 1 -5 1.78 21.94 9 1 -5 2.55 22.20 9 1 -5 0.42 18.81 9 0 -1 40.34 17.51 9 0 -2 4.45 17.39 9 0 -3 93.22 18.92 9 0 -4 20.15 32.44 9 0 -4 15.30 32.64 9 0 -4 18.31 19.00 9 0 -5 2.36 25.94 9 0 -5 1.93 25.87 9 0 -5 1.84 18.84 9 -1 0 0.44 17.57 -9 1 0 -5.32 17.84 -9 1 1 1.51 18.25 9 -1 -1 1.86 17.88 9 -1 -2 0.70 18.08 -9 1 2 -3.54 18.41 9 -1 -3 20.85 18.60 9 -1 -4 144.01 19.52 9 -2 0 42.09 18.06 -9 2 0 14.72 13.08 -9 2 1 21.38 18.41 9 -2 -1 28.62 18.31 -9 2 2 3.24 18.44 9 -2 -2 -6.39 18.29 -9 2 3 46.83 19.01 9 -2 -3 52.58 19.12 9 -2 -4 46.72 19.03 9 -3 0 61.20 13.44 -9 3 0 62.21 19.16 9 -3 -1 -2.98 18.91 9 -3 -2 67.92 18.86 9 -3 -3 -1.83 18.85 8 11 -1 -0.84 12.95 8 11 -1 6.47 18.93 8 11 -1 2.87 17.17 8 11 -2 -2.68 18.32 8 11 -2 8.21 17.04 8 11 -2 3.18 19.15 8 10 -1 7.51 11.60 8 10 -1 13.24 17.73 8 10 -1 10.80 18.09 8 10 -2 0.82 18.23 8 10 -2 -6.66 18.24 8 10 -2 -3.93 11.94 8 10 -3 -2.39 12.98 8 10 -3 0.92 11.32 8 10 -3 3.70 18.75 8 10 -4 10.11 18.71 8 10 -4 12.57 16.36 8 10 -4 3.70 12.69 8 9 -1 0.35 18.39 8 9 -1 12.42 16.18 8 9 -1 17.39 17.56 8 9 -2 83.11 18.00 8 9 -2 92.57 16.86 8 9 -2 74.76 18.05 8 9 -3 5.46 18.57 8 9 -3 3.34 17.77 8 9 -3 1.32 16.39 8 9 -4 17.05 18.09 8 9 -4 8.36 18.64 8 9 -4 10.49 16.47 8 9 -5 -5.02 17.19 8 9 -5 2.39 18.85 8 9 -5 1.76 18.24 8 9 -6 0.62 18.31 8 8 -1 0.47 15.47 8 8 -1 4.67 12.54 8 8 -1 -2.55 16.67 8 8 -2 0.09 15.93 8 8 -2 0.00 17.13 8 8 -2 -5.32 17.93 8 8 -3 11.65 17.63 8 8 -3 9.92 17.83 8 8 -3 14.30 15.79 8 8 -4 -0.96 17.72 8 8 -4 7.20 16.56 8 8 -4 -1.51 12.85 8 8 -5 8.69 18.52 8 8 -5 4.15 16.74 8 8 -5 7.12 17.56 8 8 -6 -4.86 18.42 8 8 -6 3.07 12.44 8 8 -6 5.46 18.76 8 8 -7 2.62 17.84 8 8 -7 0.91 17.30 8 8 -7 -3.33 18.69 8 8 -7 -1.38 17.29 8 7 -1 2.37 16.05 8 7 -1 -2.82 10.63 8 7 -1 0.54 17.23 8 7 -2 8.18 17.09 8 7 -2 5.21 17.12 8 7 -2 11.36 15.47 8 7 -3 12.62 17.27 8 7 -3 6.39 16.88 8 7 -3 18.78 15.85 8 7 -4 9.13 17.09 8 7 -4 5.23 16.26 8 7 -4 7.16 17.40 8 7 -5 1.90 11.84 8 7 -5 3.33 17.89 8 7 -5 0.56 17.50 8 7 -6 4.15 12.63 8 7 -6 2.58 17.61 8 7 -6 0.38 17.98 8 7 -7 -4.25 17.90 8 7 -7 4.43 22.52 8 7 -7 0.80 20.47 8 7 -7 -10.65 17.64 8 7 -8 3.40 18.02 8 6 -1 4.74 16.69 8 6 -1 4.44 15.09 8 6 -1 1.87 16.11 8 6 -2 8.27 16.23 8 6 -2 6.72 16.57 8 6 -2 9.04 15.54 8 6 -3 15.36 17.07 8 6 -3 11.67 17.13 8 6 -3 15.86 16.28 8 6 -4 2.00 16.04 8 6 -4 8.10 17.19 8 6 -4 4.72 16.64 8 6 -5 2.63 11.89 8 6 -5 0.77 17.09 8 6 -5 0.98 17.20 8 6 -6 3.45 17.52 8 6 -6 3.29 16.96 8 6 -6 3.02 16.64 8 6 -7 28.20 12.85 8 6 -7 34.06 17.49 8 6 -7 20.76 17.79 8 6 -8 -1.73 17.87 8 6 -8 -1.22 18.11 8 6 -8 0.24 17.17 8 6 -8 2.39 22.64 8 5 -1 -3.52 16.23 8 5 -1 0.67 15.73 8 5 -1 -2.35 15.42 8 5 -2 6.19 15.31 8 5 -2 5.94 16.41 8 5 -2 11.62 19.79 8 5 -3 8.84 19.92 8 5 -3 9.52 15.94 8 5 -3 13.04 16.40 8 5 -4 7.08 16.64 8 5 -4 -0.24 15.84 8 5 -4 -2.23 16.38 8 5 -5 -0.95 16.30 8 5 -5 0.03 17.24 8 5 -5 -6.73 16.42 8 5 -6 2.56 17.03 8 5 -6 5.67 20.93 8 5 -6 5.03 17.10 8 5 -7 -4.40 17.31 8 5 -7 1.39 17.11 8 5 -7 4.42 17.46 8 5 -8 99.75 17.60 8 5 -8 85.20 17.93 8 5 -8 107.57 17.98 8 5 -8 78.47 18.65 8 5 -9 -2.16 18.61 8 5 -9 1.76 24.44 8 5 -9 2.44 22.64 8 5 -9 0.90 18.15 8 4 -1 6.78 18.88 8 4 -1 4.71 15.83 8 4 -1 4.25 15.76 8 4 -2 -1.97 15.93 8 4 -2 1.20 16.04 8 4 -2 1.98 19.63 8 4 -3 1.77 10.87 8 4 -3 1.26 15.70 8 4 -3 1.87 16.25 8 4 -4 0.44 15.85 8 4 -4 3.16 16.11 8 4 -4 2.64 16.41 8 4 -5 6.05 16.39 8 4 -5 6.62 16.55 8 4 -5 4.99 16.38 8 4 -6 18.16 16.68 8 4 -6 15.29 17.13 8 4 -6 20.35 16.31 8 4 -7 12.41 17.22 8 4 -7 6.83 17.43 8 4 -7 7.12 16.94 8 4 -8 5.21 21.82 8 4 -8 6.64 17.43 8 4 -8 6.16 17.16 8 4 -9 35.62 23.11 8 4 -9 39.43 21.57 8 4 -9 43.93 17.91 8 4 -9 43.58 17.91 8 3 -1 5.58 19.21 8 3 -1 5.33 15.58 8 3 -1 3.86 19.25 8 3 -2 4.14 15.93 8 3 -2 8.26 10.95 8 3 -2 3.23 15.58 8 3 -3 3.57 10.92 8 3 -3 2.54 15.17 8 3 -3 -0.17 19.99 8 3 -4 8.24 15.95 8 3 -4 8.78 15.32 8 3 -4 7.92 16.52 8 3 -5 1.02 20.26 8 3 -5 4.08 15.91 8 3 -5 0.37 16.49 8 3 -6 0.46 16.42 8 3 -6 3.11 16.14 8 3 -6 3.50 16.29 8 3 -7 11.85 17.36 8 3 -7 7.16 16.48 8 3 -7 9.00 16.61 8 3 -8 5.55 25.44 8 3 -8 9.37 16.71 8 3 -8 8.46 17.02 8 3 -9 2.09 16.92 8 3 -9 -3.10 12.35 8 3 -9 1.92 26.06 8 3 -9 1.76 24.07 8 3 -10 9.36 18.18 8 3 -10 9.09 17.55 8 2 -1 11.20 19.19 8 2 -1 9.93 19.74 8 2 -1 15.42 15.44 8 2 -2 4.71 19.44 8 2 -2 5.23 19.46 8 2 -2 8.17 15.37 8 2 -3 34.77 15.17 8 2 -3 31.07 15.83 8 2 -3 32.07 15.59 8 2 -4 6.63 15.83 8 2 -4 2.10 16.03 8 2 -4 3.46 16.25 8 2 -5 35.97 16.32 8 2 -5 39.92 19.48 8 2 -5 39.52 16.75 8 2 -6 0.80 16.19 8 2 -6 5.51 20.59 8 2 -6 3.28 15.93 8 2 -7 -5.16 16.47 8 2 -7 -3.30 16.55 8 2 -7 1.47 17.52 8 2 -8 35.54 16.76 8 2 -8 41.80 16.81 8 2 -8 34.73 25.27 8 2 -9 10.99 17.44 8 2 -9 14.82 27.10 8 2 -9 5.63 16.82 8 2 -9 14.85 31.45 8 2 -10 4.87 17.78 8 2 -10 -0.10 17.39 8 1 -1 28.39 15.26 8 1 -1 21.97 22.53 8 1 -1 24.39 25.86 8 1 -2 9.96 15.47 8 1 -2 8.06 22.27 8 1 -2 5.96 22.32 8 1 -3 20.15 15.31 8 1 -3 16.82 19.37 8 1 -3 15.63 19.29 8 1 -4 102.26 20.21 8 1 -4 93.68 16.60 8 1 -4 90.57 16.52 8 1 -5 19.37 19.64 8 1 -5 24.06 15.78 8 1 -5 18.73 16.07 8 1 -6 2.29 15.96 8 1 -6 1.13 16.12 8 1 -6 1.68 17.18 8 1 -7 38.71 21.73 8 1 -7 37.09 16.72 8 1 -7 41.16 20.35 8 1 -8 6.67 21.15 8 1 -8 11.32 16.34 8 1 -8 9.69 16.19 8 1 -9 32.53 17.17 8 1 -9 37.76 32.45 8 1 -9 34.36 17.20 8 1 -9 32.10 30.43 8 1 -10 6.65 17.59 8 1 -10 17.22 17.03 8 0 -1 0.47 15.30 -8 0 1 1.03 15.11 8 0 -2 18.58 32.05 8 0 -2 16.37 15.62 -8 0 2 12.71 15.67 8 0 -2 15.11 28.85 8 0 -3 -0.65 22.16 8 0 -3 4.59 15.43 8 0 -3 1.07 22.64 8 0 -4 54.25 20.49 8 0 -4 45.11 16.49 8 0 -4 55.38 20.45 8 0 -5 9.80 16.05 8 0 -5 6.43 20.09 8 0 -5 8.16 19.85 8 0 -6 87.62 16.92 8 0 -6 85.68 20.42 8 0 -6 91.94 17.90 8 0 -7 6.20 19.80 8 0 -7 3.98 21.50 8 0 -7 -2.14 19.53 8 0 -8 14.95 16.75 8 0 -8 14.23 16.58 8 0 -8 13.77 21.09 8 0 -9 26.44 20.65 8 0 -9 33.43 17.08 8 0 -9 34.31 34.71 8 0 -10 19.55 17.45 8 0 -10 24.64 17.40 -8 1 0 9.30 10.74 8 -1 0 17.86 15.37 -8 1 1 62.54 11.62 8 -1 -1 95.94 15.99 8 -1 -2 27.77 15.69 -8 1 2 30.08 16.00 8 -1 -3 16.75 15.75 -8 1 3 17.36 16.18 8 -1 -4 5.14 22.56 8 -1 -4 5.92 16.49 8 -1 -4 5.17 23.23 8 -1 -5 6.61 20.00 8 -1 -5 7.38 16.51 8 -1 -5 1.06 19.94 8 -1 -6 35.35 17.32 8 -1 -6 36.33 17.28 8 -1 -6 31.35 20.07 8 -1 -7 14.92 21.14 8 -1 -7 9.66 20.26 8 -1 -7 10.83 20.93 8 -1 -8 -0.46 16.74 8 -1 -8 4.62 23.53 8 -1 -8 2.37 19.92 8 -1 -9 5.55 36.04 8 -1 -9 7.32 17.43 8 -1 -9 6.72 16.84 8 -1 -10 0.50 21.72 -8 2 0 12.00 11.50 8 -2 0 18.84 11.02 -8 2 1 40.03 16.38 8 -2 -1 46.10 15.81 -8 2 2 34.77 16.41 8 -2 -2 50.76 16.13 8 -2 -3 15.14 16.19 -8 2 3 9.07 16.64 8 -2 -4 33.41 20.37 -8 2 4 35.70 16.87 8 -2 -5 9.24 23.48 8 -2 -5 10.51 16.33 8 -2 -5 11.79 24.18 8 -2 -6 -0.22 19.85 8 -2 -6 0.05 20.76 8 -2 -6 -1.99 20.29 8 -2 -7 29.69 16.74 8 -2 -7 25.56 19.92 8 -2 -7 33.53 17.56 8 -2 -8 1.10 19.99 8 -2 -8 1.83 16.29 8 -2 -8 -0.10 17.42 8 -2 -9 -0.37 17.52 8 -2 -9 0.87 29.18 8 -2 -10 3.06 22.59 -8 3 0 0.92 16.79 8 -3 0 19.19 16.21 -8 3 1 44.94 16.98 8 -3 -1 55.87 16.42 8 -3 -2 1.76 16.14 -8 3 2 3.90 16.54 8 -3 -3 19.05 16.36 -8 3 3 12.27 16.86 8 -3 -4 1.37 16.32 -8 3 4 1.43 16.61 8 -3 -5 39.34 16.67 8 -3 -5 39.98 35.56 8 -3 -5 37.85 34.94 -8 3 5 32.91 21.04 -8 3 6 5.39 17.81 8 -3 -6 4.39 23.15 8 -3 -6 5.24 16.76 8 -3 -6 6.19 24.47 8 -3 -7 5.00 20.23 8 -3 -7 1.40 21.65 8 -3 -7 2.36 16.42 8 -3 -8 -1.88 20.10 8 -3 -8 4.49 17.82 8 -3 -8 1.62 20.19 8 -3 -9 9.77 26.90 8 -3 -9 14.57 22.80 -8 3 10 1.37 17.26 8 -3 -10 -3.51 18.62 8 -4 0 5.22 16.23 -8 4 0 6.95 17.52 8 -4 -1 3.30 11.74 -8 4 1 10.67 17.27 8 -4 -2 13.22 11.61 -8 4 2 6.48 17.28 -8 4 3 5.88 16.92 8 -4 -3 12.50 16.59 -8 4 4 54.63 17.72 8 -4 -4 69.25 16.41 -8 4 5 2.10 17.19 8 -4 -5 -4.54 16.43 8 -4 -6 6.92 16.31 8 -4 -6 9.12 26.93 8 -4 -6 10.82 28.93 -8 4 6 8.89 17.91 8 -4 -7 19.11 20.10 -8 4 7 12.29 18.61 8 -4 -7 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14.96 4 15 -2 24.16 15.16 4 15 -2 21.27 15.10 4 15 -2 31.05 15.42 4 15 -3 -3.18 10.82 4 15 -3 3.79 11.02 4 15 -3 -1.90 16.01 4 15 -4 9.10 15.64 4 15 -4 2.75 15.13 4 15 -4 8.28 11.29 4 15 -5 35.35 16.17 4 15 -5 43.52 15.81 4 15 -5 43.11 11.19 4 15 -6 17.87 15.98 4 15 -6 12.41 11.48 4 15 -6 17.48 11.68 4 15 -7 -2.31 16.07 4 15 -7 2.36 16.51 4 15 -7 -1.12 16.40 4 15 -8 -2.69 11.68 4 15 -8 4.21 11.65 4 15 -8 -6.17 16.44 4 15 -9 10.85 11.82 4 15 -9 4.08 17.89 4 15 -9 1.31 16.80 4 14 -1 11.37 14.58 4 14 -1 15.95 14.01 4 14 -1 1.77 14.21 4 14 -2 0.92 10.11 4 14 -2 -0.16 9.77 4 14 -2 6.14 10.66 4 14 -3 36.06 14.62 4 14 -3 26.76 14.36 4 14 -3 31.70 14.61 4 14 -4 17.30 14.81 4 14 -4 9.64 10.35 4 14 -4 14.25 14.53 4 14 -5 3.76 10.78 4 14 -5 3.24 10.77 4 14 -5 -9.89 14.66 4 14 -6 4.17 15.43 4 14 -6 7.67 14.97 4 14 -6 6.16 15.37 4 14 -7 11.79 15.56 4 14 -7 -1.35 11.08 4 14 -7 -6.28 15.28 4 14 -8 5.91 16.27 4 14 -8 2.24 15.98 4 14 -8 3.34 16.48 4 14 -9 3.64 16.55 4 14 -9 3.27 15.97 4 14 -9 7.62 12.08 4 14 -10 -3.27 16.62 4 14 -10 0.06 17.83 4 14 -10 -2.64 11.79 4 13 -1 0.46 13.63 4 13 -1 0.90 13.83 4 13 -1 -0.63 9.63 4 13 -2 39.51 14.13 4 13 -2 25.84 13.96 4 13 -2 41.24 13.69 4 13 -3 3.09 14.04 4 13 -3 2.84 10.03 4 13 -3 -3.63 13.98 4 13 -4 6.37 14.42 4 13 -4 5.61 14.07 4 13 -4 7.61 14.28 4 13 -5 40.80 10.30 4 13 -5 48.60 14.51 4 13 -5 42.08 10.64 4 13 -6 16.54 10.35 4 13 -6 17.39 14.55 4 13 -6 13.16 14.34 4 13 -7 4.92 14.50 4 13 -7 13.83 14.97 4 13 -7 8.07 10.76 4 13 -8 13.08 15.11 4 13 -8 9.18 15.81 4 13 -8 14.87 15.21 4 13 -9 -1.98 16.07 4 13 -9 7.77 15.54 4 13 -9 7.68 15.66 4 13 -10 -2.40 15.58 4 13 -10 -0.93 17.13 4 13 -10 3.62 16.21 4 13 -11 -3.64 16.14 4 13 -11 -0.99 11.45 4 13 -11 3.34 17.89 4 12 -1 12.14 13.37 4 12 -1 22.22 13.24 4 12 -1 19.45 13.63 4 12 -2 35.39 13.39 4 12 -2 34.31 9.60 4 12 -2 35.80 13.26 4 12 -3 -2.66 13.36 4 12 -3 1.22 13.36 4 12 -3 -1.58 13.44 4 12 -4 2.70 13.54 4 12 -4 5.00 9.35 4 12 -4 3.10 13.49 4 12 -5 65.93 10.07 4 12 -5 60.63 10.11 4 12 -5 62.10 13.91 4 12 -6 75.38 10.64 4 12 -6 79.45 14.58 4 12 -6 84.47 10.68 4 12 -7 2.03 14.13 4 12 -7 7.80 14.63 4 12 -7 -5.40 9.66 4 12 -8 24.22 10.27 4 12 -8 24.21 15.18 4 12 -8 19.60 14.55 4 12 -9 -5.86 15.50 4 12 -9 5.33 10.21 4 12 -9 11.59 15.34 4 12 -10 7.73 15.22 4 12 -10 -4.72 15.15 4 12 -10 3.43 11.33 4 12 -11 9.28 16.97 4 12 -11 19.21 16.15 4 12 -11 4.36 10.99 4 12 -12 3.67 11.45 4 12 -12 2.73 16.37 4 12 -12 -2.08 17.99 4 11 -1 0.55 12.79 4 11 -1 10.40 12.85 4 11 -2 36.87 9.55 4 11 -2 45.49 13.21 4 11 -2 43.84 12.74 4 11 -3 3.72 13.04 4 11 -3 9.38 12.92 4 11 -3 13.42 9.11 4 11 -4 95.37 13.81 4 11 -4 104.29 10.13 4 11 -4 106.75 10.04 4 11 -5 18.69 9.60 4 11 -5 13.39 9.10 4 11 -5 17.18 9.39 4 11 -6 16.51 13.39 4 11 -6 10.30 13.62 4 11 -6 14.28 13.35 4 11 -7 5.26 14.02 4 11 -7 7.35 13.79 4 11 -7 6.95 14.04 4 11 -8 49.14 10.53 4 11 -8 57.66 14.62 4 11 -8 50.17 14.40 4 11 -9 7.38 9.83 4 11 -9 1.90 15.24 4 11 -9 0.70 14.12 4 11 -10 -1.01 10.28 4 11 -10 -0.85 10.11 4 11 -10 -1.47 15.87 4 11 -11 -10.45 16.50 4 11 -11 2.85 10.84 4 11 -11 4.86 15.05 4 11 -12 1.05 17.01 4 11 -12 3.42 16.15 4 11 -12 6.79 16.18 4 11 -13 8.47 16.79 4 11 -13 4.99 17.82 4 11 -13 13.18 16.74 4 10 -1 3.53 12.27 4 10 -1 0.98 8.61 4 10 -2 12.39 9.05 4 10 -2 11.94 12.50 4 10 -3 119.01 13.18 4 10 -3 125.89 12.96 4 10 -3 143.45 13.42 4 10 -4 2.14 12.46 4 10 -4 -2.30 12.51 4 10 -4 -0.80 12.81 4 10 -5 32.09 9.15 4 10 -5 25.11 12.83 4 10 -5 27.63 12.64 4 10 -6 32.53 13.32 4 10 -6 31.20 9.61 4 10 -6 36.06 9.57 4 10 -7 -1.16 13.20 4 10 -7 3.60 13.16 4 10 -7 5.64 12.91 4 10 -8 13.86 13.37 4 10 -8 17.01 9.51 4 10 -8 18.48 14.08 4 10 -9 17.00 9.61 4 10 -9 22.14 9.57 4 10 -9 22.65 14.24 4 10 -10 12.46 14.62 4 10 -10 10.84 15.46 4 10 -10 9.47 10.33 4 10 -11 14.35 10.72 4 10 -11 12.51 15.64 4 10 -11 15.62 10.78 4 10 -12 -1.12 10.70 4 10 -12 -0.66 10.60 4 10 -12 10.05 16.64 4 10 -13 6.75 11.15 4 10 -13 10.76 16.38 4 10 -13 9.09 20.71 4 10 -14 0.72 17.96 4 10 -14 0.42 16.83 4 10 -14 5.56 11.98 4 9 -1 24.57 12.79 4 9 -1 30.08 12.53 4 9 -2 25.18 8.84 4 9 -2 26.79 12.27 4 9 -3 7.29 11.92 4 9 -3 2.40 12.28 4 9 -4 1.17 12.17 4 9 -4 -0.77 8.70 4 9 -4 -6.09 12.07 4 9 -5 10.87 12.64 4 9 -5 8.55 11.83 4 9 -5 9.07 8.52 4 9 -6 44.12 12.64 4 9 -6 42.72 13.01 4 9 -6 46.03 12.39 4 9 -7 5.33 9.20 4 9 -7 4.26 9.38 4 9 -7 -0.97 9.03 4 9 -8 6.40 8.94 4 9 -8 7.51 13.59 4 9 -8 7.96 12.93 4 9 -9 2.06 14.26 4 9 -9 4.81 9.47 4 9 -9 8.38 13.07 4 9 -10 3.52 14.45 4 9 -10 4.29 14.05 4 9 -10 2.11 13.61 4 9 -11 7.51 10.57 4 9 -11 -3.32 18.61 4 9 -11 0.23 14.30 4 9 -12 6.41 15.76 4 9 -12 9.23 10.98 4 9 -12 7.43 10.10 4 9 -13 -4.53 10.99 4 9 -13 3.29 16.28 4 9 -14 1.23 17.17 4 9 -14 0.62 16.41 4 9 -15 7.14 12.13 4 9 -15 6.96 21.77 4 8 -1 145.49 9.71 4 8 -1 133.60 9.94 4 8 -2 73.19 8.86 4 8 -2 93.76 12.61 4 8 -3 7.19 12.01 4 8 -3 12.36 12.30 4 8 -4 3.58 11.96 4 8 -4 3.06 12.27 4 8 -4 2.34 11.61 4 8 -5 0.45 12.51 4 8 -5 6.53 12.64 4 8 -5 1.45 8.68 4 8 -6 13.64 12.31 4 8 -6 13.21 12.69 4 8 -6 16.22 12.30 4 8 -7 16.25 8.64 4 8 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15.36 -4 -6 14 12.00 14.94 4 6 -14 5.38 18.59 4 6 -15 26.13 11.34 4 6 -15 15.79 20.64 -4 -6 15 26.14 15.63 4 6 -16 5.15 25.61 4 6 -16 9.56 16.69 -4 -6 16 -2.69 11.82 4 6 -17 2.98 17.47 4 6 -17 3.22 31.27 -4 -6 17 -3.99 12.59 4 5 -1 1.97 12.00 4 5 -1 0.55 7.65 4 5 -1 -2.52 11.88 4 5 -2 0.85 11.75 4 5 -2 0.95 12.26 4 5 -2 2.09 7.79 4 5 -3 40.54 8.77 4 5 -3 50.13 11.14 4 5 -3 47.68 8.50 4 5 -4 67.28 11.70 4 5 -4 62.69 11.70 4 5 -5 23.99 11.49 4 5 -5 25.33 10.94 4 5 -6 8.62 11.48 4 5 -6 3.47 8.60 4 5 -7 21.57 14.30 -4 -5 7 27.86 12.05 4 5 -7 25.57 11.85 4 5 -8 157.25 9.72 4 5 -8 185.12 16.41 -4 -5 8 190.13 13.24 4 5 -9 27.98 8.67 -4 -5 9 34.25 12.66 4 5 -9 28.64 13.63 4 5 -10 333.18 11.16 4 5 -10 324.29 19.53 -4 -5 10 347.12 11.01 -4 -5 11 -2.14 9.88 4 5 -11 -0.80 14.23 4 5 -11 -0.25 13.49 4 5 -12 2.30 16.97 4 5 -12 3.89 13.57 -4 -5 12 4.76 9.68 -4 -5 13 46.89 10.77 4 5 -13 35.89 14.07 4 5 -13 34.06 20.95 -4 -5 14 9.65 14.93 4 5 -14 8.64 19.40 4 5 -14 6.89 10.45 4 5 -15 29.23 15.43 4 5 -15 26.01 27.81 -4 -5 15 30.67 15.47 -4 -5 16 50.12 11.41 4 5 -16 47.51 32.96 4 5 -16 60.53 16.91 -4 -5 17 10.28 11.76 4 5 -17 12.42 17.25 4 4 -1 339.19 11.00 4 4 -1 437.01 12.31 4 4 -1 393.19 12.81 4 4 -2 78.01 8.73 4 4 -2 74.44 9.45 4 4 -2 89.18 11.67 4 4 -3 59.84 12.51 4 4 -3 59.29 12.03 4 4 -3 49.01 8.49 4 4 -4 53.37 8.29 4 4 -4 57.38 12.82 4 4 -4 62.86 11.90 4 4 -5 67.14 13.12 4 4 -5 79.49 11.85 4 4 -6 91.35 12.34 -4 -4 6 91.63 12.06 4 4 -6 90.93 14.91 4 4 -6 71.62 13.55 -4 -4 7 9.61 8.67 4 4 -7 11.38 8.30 4 4 -7 6.99 15.80 4 4 -7 13.35 11.66 4 4 -8 45.18 8.48 4 4 -8 40.29 12.75 4 4 -8 34.01 13.52 -4 -4 8 40.27 12.37 4 4 -9 8.56 16.03 -4 -4 9 10.04 8.69 4 4 -9 12.30 9.15 4 4 -10 278.42 19.42 4 4 -10 295.25 10.90 -4 -4 10 297.19 14.16 -4 -4 11 631.12 16.15 4 4 -11 632.90 15.91 4 4 -11 503.51 22.19 -4 -4 12 109.24 13.98 4 4 -12 78.14 20.57 4 4 -12 96.20 10.13 4 4 -13 3.86 20.45 4 4 -13 6.52 23.47 4 4 -13 6.66 14.09 -4 -4 13 11.05 10.21 4 4 -14 6.04 38.19 4 4 -14 5.79 14.79 -4 -4 14 4.44 14.57 4 4 -14 4.44 31.99 4 4 -15 -1.61 15.35 -4 -4 15 8.36 14.94 4 4 -16 1.47 15.71 -4 -4 16 3.18 15.54 -4 -4 17 3.60 16.05 4 4 -17 1.39 16.31 4 4 -18 10.48 17.33 -4 -4 18 9.92 16.39 4 3 -1 200.10 14.25 4 3 -1 213.28 12.85 4 3 -1 232.52 13.38 4 3 -2 2.47 8.98 4 3 -2 1.82 11.29 4 3 -2 5.03 11.10 4 3 -3 178.78 12.32 4 3 -3 185.96 12.04 4 3 -3 155.29 13.90 4 3 -4 3.05 15.76 4 3 -4 3.16 10.86 4 3 -5 23.36 13.00 -4 -3 5 30.98 11.73 4 3 -5 30.45 11.54 4 3 -6 0.85 11.68 4 3 -6 0.21 13.12 -4 -3 6 -4.24 11.63 4 3 -7 11.43 16.33 4 3 -7 12.51 14.20 -4 -3 7 11.81 8.73 4 3 -7 14.62 8.54 4 3 -8 62.18 15.54 4 3 -8 48.89 16.86 -4 -3 8 62.67 12.60 4 3 -8 52.29 8.94 4 3 -9 103.13 20.31 -4 -3 9 113.95 9.57 4 3 -9 90.40 17.56 4 3 -9 109.21 12.78 4 3 -10 124.37 24.29 4 3 -10 128.29 20.42 -4 -3 10 159.93 13.55 4 3 -10 150.85 13.43 4 3 -11 21.88 28.69 4 3 -11 19.80 26.22 4 3 -11 15.13 9.34 -4 -3 11 26.00 13.13 -4 -3 12 8.63 9.42 4 3 -12 14.55 9.30 4 3 -13 10.01 13.90 -4 -3 13 10.23 13.56 -4 -3 14 16.27 14.69 4 3 -14 20.85 14.22 4 3 -15 7.46 14.27 -4 -3 15 4.14 14.67 -4 -3 16 24.84 15.19 4 3 -16 16.46 10.94 4 3 -17 9.84 11.34 -4 -3 17 11.93 15.90 4 3 -18 0.70 16.72 -4 -3 18 5.54 16.12 4 2 -1 6.21 11.39 4 2 -1 4.03 10.99 4 2 -1 3.82 12.60 4 2 -2 90.26 12.03 4 2 -2 81.18 13.46 4 2 -2 79.23 11.68 4 2 -3 524.37 14.85 4 2 -3 450.67 16.90 -4 -2 4 15.56 10.76 4 2 -4 9.72 13.01 4 2 -4 12.78 10.86 4 2 -5 13.93 16.60 -4 -2 5 21.48 11.70 4 2 -5 17.51 10.80 4 2 -6 40.04 11.57 4 2 -6 31.45 16.49 -4 -2 6 40.30 11.71 4 2 -7 203.80 12.79 4 2 -7 165.55 20.57 4 2 -7 205.50 18.72 -4 -2 7 192.74 12.90 4 2 -8 2.55 20.44 4 2 -8 7.35 11.97 -4 -2 8 3.99 11.99 4 2 -8 2.15 18.89 -4 -2 9 119.04 9.45 4 2 -9 104.87 9.31 4 2 -10 77.44 12.96 -4 -2 10 85.45 9.54 4 2 -11 383.36 14.58 -4 -2 11 376.74 11.44 4 2 -12 85.75 13.32 -4 -2 12 82.20 13.31 -4 -2 13 0.65 9.81 4 2 -13 2.52 13.34 -4 -2 14 -4.26 9.88 4 2 -14 6.24 13.57 4 2 -15 41.51 10.37 -4 -2 15 40.00 10.29 4 2 -16 -6.13 10.53 -4 -2 16 4.75 10.73 -4 -2 17 1.99 15.35 4 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7.52 16.56 -4 15 4 -1.22 16.00 4 -15 -5 21.65 16.79 -4 15 5 22.43 16.61 -4 15 5 19.16 17.32 4 -15 -6 45.40 17.49 -4 15 6 33.04 12.25 -4 15 6 44.12 16.41 -4 15 7 0.88 17.90 4 -15 -7 2.20 17.38 -4 15 7 -3.00 16.05 -4 15 8 8.63 17.76 -4 15 8 4.82 16.16 4 -15 -8 4.75 17.51 -4 15 9 24.80 16.77 4 -15 -9 32.26 18.34 -4 15 9 42.96 18.23 -4 15 10 5.11 16.69 -4 15 10 2.82 13.37 4 -15 -10 10.28 12.86 -4 15 11 0.98 17.11 4 -15 -11 4.88 18.37 -4 15 11 -3.45 19.08 -4 15 12 3.03 19.51 4 -15 -12 9.88 18.90 -4 15 12 7.10 17.52 -4 16 0 7.19 16.76 4 -16 0 1.48 15.66 -4 16 0 24.71 16.97 -4 16 0 7.81 18.57 -4 16 1 11.40 12.14 -4 16 1 18.07 18.48 -4 16 1 18.73 17.20 4 -16 -1 20.61 15.58 -4 16 2 19.34 18.19 -4 16 2 17.39 17.11 4 -16 -2 16.59 11.44 -4 16 2 -0.76 12.36 4 -16 -3 8.56 16.69 -4 16 3 6.16 18.00 -4 16 3 5.13 17.54 4 -16 -4 29.72 17.48 -4 16 4 30.78 17.64 -4 16 4 37.31 17.54 -4 16 5 10.63 17.35 -4 16 5 6.41 12.77 4 -16 -5 16.58 17.57 -4 16 6 10.72 13.36 4 -16 -6 10.87 12.57 -4 16 6 16.90 17.22 -4 16 7 8.63 19.06 4 -16 -7 0.23 12.81 -4 16 7 4.41 17.35 -4 16 8 4.19 17.28 -4 16 8 5.23 19.03 4 -16 -8 8.39 18.26 -4 16 9 15.88 17.49 4 -16 -9 20.00 13.18 -4 16 9 14.32 19.20 4 -16 -10 10.85 19.19 -4 16 10 13.35 13.25 -4 16 10 9.66 17.68 -4 17 0 3.27 20.04 4 -17 0 -6.55 11.55 -4 17 1 0.64 19.33 -4 17 1 0.94 12.98 -4 17 1 1.62 17.86 -4 17 2 3.95 17.85 -4 17 2 -2.35 13.20 -4 17 2 -5.29 19.78 -4 17 3 8.25 18.96 -4 17 3 9.10 13.32 -4 17 4 13.65 13.49 4 -17 -4 7.65 17.98 -4 17 4 4.84 18.82 4 -17 -5 13.24 18.70 -4 17 5 -0.63 13.65 -4 17 5 7.59 18.63 -4 17 6 4.70 19.38 4 -17 -6 2.17 13.59 -4 17 6 -1.29 18.40 3 19 -1 6.20 17.69 3 19 -1 9.32 17.69 3 19 -1 4.75 13.05 3 18 -1 -0.12 16.89 3 18 -1 5.85 16.25 3 18 -1 6.13 16.36 3 18 -2 3.89 16.39 3 18 -2 1.68 17.31 3 18 -2 1.91 11.47 3 18 -3 -0.47 11.90 3 18 -3 5.78 11.95 3 18 -3 3.61 17.30 3 18 -4 34.38 12.64 3 18 -4 37.89 18.29 3 18 -4 31.77 12.97 3 17 -1 32.08 15.97 3 17 -1 19.78 10.80 3 17 -1 18.20 15.58 3 17 -2 36.91 15.88 3 17 -2 45.21 15.81 3 17 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15 -5 13.81 14.93 3 15 -6 40.08 10.93 3 15 -6 43.18 15.30 3 15 -6 42.01 15.46 3 15 -7 8.16 15.47 3 15 -7 8.43 11.23 3 15 -7 13.50 10.93 3 15 -8 79.19 17.04 3 15 -8 59.50 11.68 3 15 -8 69.11 16.29 3 15 -9 -0.55 11.48 3 15 -9 -5.08 17.21 3 15 -9 9.66 16.48 3 15 -10 -1.88 11.64 3 15 -10 -1.03 12.85 3 15 -10 -0.28 11.76 3 14 -1 6.18 13.86 3 14 -1 6.79 13.33 3 14 -1 0.73 9.51 3 14 -2 17.66 13.67 3 14 -2 20.64 9.94 3 14 -2 13.17 9.86 3 14 -3 36.41 14.28 3 14 -3 25.32 14.20 3 14 -3 47.73 14.03 3 14 -4 44.46 10.08 3 14 -4 52.94 10.32 3 14 -4 74.69 10.30 3 14 -5 40.39 14.28 3 14 -5 51.14 14.26 3 14 -5 54.97 10.41 3 14 -6 8.87 14.50 3 14 -6 6.26 15.02 3 14 -6 9.36 10.18 3 14 -7 1.16 14.59 3 14 -7 -3.90 10.45 3 14 -7 0.34 15.08 3 14 -8 11.36 14.77 3 14 -8 9.39 15.86 3 14 -8 6.67 14.94 3 14 -9 54.94 16.32 3 14 -9 47.95 11.15 3 14 -9 55.02 15.51 3 14 -10 0.89 16.05 3 14 -10 7.54 15.87 3 14 -10 2.91 17.24 3 14 -11 1.17 16.24 3 14 -11 -0.93 12.79 3 14 -11 -1.69 11.47 3 13 -1 61.69 13.50 3 13 -1 47.77 13.46 3 13 -1 32.52 9.73 3 13 -2 34.70 13.46 3 13 -2 47.06 13.37 3 13 -2 39.12 13.47 3 13 -3 3.25 13.15 3 13 -3 12.55 13.53 3 13 -3 5.86 13.15 3 13 -4 19.19 13.59 3 13 -4 26.49 9.77 3 13 -4 18.54 9.58 3 13 -5 2.30 9.82 3 13 -5 7.64 13.83 3 13 -5 4.10 13.70 3 13 -6 -0.12 9.97 3 13 -6 4.50 9.66 3 13 -6 8.22 9.77 3 13 -7 7.20 14.51 3 13 -7 11.61 13.86 3 13 -7 9.91 9.76 3 13 -8 6.09 14.23 3 13 -8 2.56 10.19 3 13 -8 9.07 15.12 3 13 -9 12.22 14.53 3 13 -9 9.55 15.92 3 13 -9 11.25 14.47 3 13 -10 30.26 10.65 3 13 -10 24.97 15.13 3 13 -10 27.81 11.59 3 13 -11 -3.63 17.40 3 13 -11 4.62 15.93 3 13 -11 4.05 15.69 3 13 -12 9.45 17.79 3 13 -12 3.59 16.16 3 13 -12 8.45 16.12 3 12 -1 14.19 9.10 3 12 -1 22.12 9.14 3 12 -1 22.46 12.52 3 12 -2 64.92 12.94 3 12 -2 70.75 9.51 3 12 -2 75.73 13.24 3 12 -3 1.28 12.98 3 12 -3 2.75 12.77 3 12 -3 2.03 9.09 3 12 -4 58.71 13.07 3 12 -4 68.53 9.66 3 12 -4 62.09 13.44 3 12 -5 32.38 13.20 3 12 -5 37.77 9.55 3 12 -5 29.54 9.32 3 12 -6 26.95 13.58 3 12 -6 33.50 13.34 3 12 -6 28.51 13.39 3 12 -7 2.02 13.46 3 12 -7 4.95 13.97 3 12 -7 -0.34 13.41 3 12 -8 5.53 9.60 3 12 -8 8.69 14.49 3 12 -8 6.25 13.56 3 12 -9 -0.10 13.92 3 12 -9 1.85 15.38 3 12 -9 3.19 13.92 3 12 -10 4.48 10.02 3 12 -10 4.16 15.40 3 12 -10 7.00 14.47 3 12 -11 8.15 14.66 3 12 -11 9.87 16.88 3 12 -11 6.74 10.39 3 12 -12 1.86 10.83 3 12 -12 -2.63 17.45 3 12 -12 -2.37 15.41 3 12 -13 10.80 11.62 3 12 -13 19.16 17.65 3 12 -13 11.44 11.48 3 11 -1 17.86 12.31 3 11 -1 17.55 9.10 3 11 -2 19.09 12.59 3 11 -2 32.43 12.58 3 11 -2 27.15 8.77 3 11 -3 148.25 13.13 3 11 -3 147.12 13.06 3 11 -3 161.60 9.69 3 11 -4 3.64 8.84 3 11 -4 6.30 9.18 3 11 -4 15.22 12.51 3 11 -5 24.43 12.74 3 11 -5 15.98 12.73 3 11 -5 15.73 8.95 3 11 -6 83.42 9.46 3 11 -6 92.59 13.54 3 11 -6 87.90 13.28 3 11 -7 10.93 12.71 3 11 -7 8.52 12.70 3 11 -7 9.72 13.35 3 11 -8 -0.17 9.29 3 11 -8 2.48 13.17 3 11 -8 -2.11 13.94 3 11 -9 32.73 9.64 3 11 -9 25.50 9.74 3 11 -9 26.29 14.72 3 11 -10 7.10 13.50 3 11 -10 0.69 9.57 3 11 -10 7.75 15.27 3 11 -11 20.96 10.15 3 11 -11 18.79 16.06 3 11 -11 19.35 10.07 3 11 -12 19.86 10.54 3 11 -12 17.30 16.34 3 11 -12 22.26 10.44 3 11 -13 -1.07 11.07 3 11 -13 2.10 17.02 3 11 -13 1.30 10.87 3 11 -14 1.13 17.77 3 11 -14 3.60 16.05 3 11 -14 -2.00 11.36 3 10 -1 7.22 8.17 3 10 -1 6.94 12.08 3 10 -2 36.42 12.27 3 10 -2 38.80 8.83 3 10 -2 34.22 8.74 3 10 -3 0.92 8.52 3 10 -3 4.41 12.28 3 10 -3 4.08 8.65 3 10 -4 3.35 12.14 3 10 -4 3.78 12.23 3 10 -4 4.88 12.37 3 10 -5 3.15 11.95 3 10 -5 -4.97 11.95 3 10 -5 1.24 12.17 3 10 -6 46.38 8.88 3 10 -6 54.25 12.27 3 10 -6 44.42 9.14 3 10 -7 29.24 12.40 3 10 -7 19.86 12.40 3 10 -7 28.30 13.03 3 10 -8 19.68 12.61 3 10 -8 20.96 13.18 3 10 -8 16.52 12.82 3 10 -9 37.85 9.26 3 10 -9 42.15 13.90 3 10 -9 45.12 9.20 3 10 -10 13.72 13.53 3 10 -10 13.33 13.67 3 10 -10 14.08 14.90 3 10 -11 3.76 15.43 3 10 -11 -4.83 9.74 3 10 -11 -1.76 13.68 3 10 -12 -4.72 10.22 3 10 -12 5.43 9.90 3 10 -12 -1.25 16.07 3 10 -13 5.04 10.51 3 10 -13 2.93 16.81 3 10 -13 3.00 10.45 3 10 -14 11.34 16.74 3 10 -14 7.18 15.70 3 10 -15 -3.54 16.94 3 10 -15 7.17 11.53 3 9 -1 39.58 8.64 3 9 -2 34.51 8.78 3 9 -2 34.40 8.61 3 9 -2 29.05 12.31 3 9 -3 96.94 12.51 3 9 -3 101.25 12.48 3 9 -3 100.42 12.27 3 9 -4 7.61 8.28 3 9 -4 12.14 11.87 3 9 -4 7.64 8.39 3 9 -5 50.90 8.69 3 9 -5 55.24 12.03 3 9 -5 51.26 11.88 3 9 -6 37.37 8.61 3 9 -6 46.60 12.08 3 9 -6 40.78 12.03 3 9 -7 9.02 12.07 3 9 -7 9.32 12.58 3 9 -7 8.62 11.85 3 9 -8 52.77 12.20 3 9 -8 45.98 8.75 3 9 -8 52.08 13.03 3 9 -9 39.82 12.71 3 9 -9 37.05 13.74 3 9 -9 42.82 12.97 3 9 -10 2.33 14.48 3 9 -10 -1.71 12.95 3 9 -10 8.52 13.00 3 9 -11 5.82 13.40 3 9 -11 3.49 15.27 3 9 -12 4.45 15.13 3 9 -12 10.61 13.59 3 9 -13 30.84 15.76 3 9 -13 32.15 14.60 -3 -9 13 32.10 10.42 3 9 -14 5.95 16.01 -3 -9 14 -12.39 15.00 3 9 -14 -2.25 10.65 3 9 -15 18.59 16.02 3 9 -15 15.12 16.48 -3 -9 15 17.93 11.13 3 9 -16 3.19 17.53 3 9 -16 9.44 11.75 -3 -9 16 4.83 16.93 3 8 -1 4.47 8.05 3 8 -2 11.26 11.53 3 8 -2 13.36 11.49 3 8 -3 25.85 8.25 3 8 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9 -9 5.67 8.54 2 9 -9 4.33 8.53 2 9 -9 6.65 13.46 2 9 -10 6.58 12.50 2 9 -10 6.75 14.18 2 9 -11 56.95 14.55 2 9 -11 56.73 13.00 2 9 -12 12.55 13.57 2 9 -12 4.61 15.04 -2 -9 12 10.22 13.31 2 9 -13 1.58 10.73 -2 -9 13 9.99 13.98 2 9 -13 1.44 13.81 2 9 -14 10.60 15.49 2 9 -14 7.28 10.46 -2 -9 14 9.43 14.79 2 9 -15 52.46 16.12 2 9 -15 75.47 16.04 -2 -9 15 71.02 15.81 2 9 -16 13.91 16.53 -2 -9 16 13.54 12.14 2 9 -16 10.67 15.96 2 9 -17 0.14 17.75 2 9 -17 8.68 17.81 -2 -9 17 3.41 17.62 2 8 -1 61.12 8.22 2 8 -1 56.35 11.96 -2 -8 1 62.07 8.69 2 8 -2 66.39 8.16 2 8 -2 57.72 8.78 2 8 -2 56.14 11.80 2 8 -3 3.85 8.00 2 8 -3 6.54 11.59 2 8 -3 9.48 10.91 2 8 -4 22.93 11.11 2 8 -4 24.67 11.40 2 8 -4 22.50 8.08 2 8 -5 88.85 8.78 2 8 -5 86.13 11.90 2 8 -5 94.01 12.14 2 8 -6 1.62 8.45 2 8 -6 2.81 11.55 2 8 -6 5.06 8.01 2 8 -7 3.37 11.37 2 8 -7 0.18 11.94 2 8 -7 3.27 7.97 2 8 -8 24.10 12.65 2 8 -8 21.38 8.25 2 8 -9 183.06 12.50 2 8 -9 170.65 10.69 -2 -8 9 175.74 12.52 2 8 -10 111.66 10.66 -2 -8 10 125.85 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209.15 14.65 2 7 -11 246.52 10.03 2 7 -12 141.38 9.73 2 7 -12 117.42 14.29 -2 -7 12 150.80 13.18 2 7 -13 50.03 14.36 2 7 -13 60.56 13.42 -2 -7 13 63.06 13.67 2 7 -14 15.71 14.34 2 7 -14 20.97 13.84 -2 -7 14 18.40 9.84 -2 -7 15 20.49 14.46 2 7 -15 14.33 10.25 2 7 -15 11.45 14.99 2 7 -16 42.18 16.24 2 7 -16 65.75 15.23 -2 -7 16 78.03 15.13 2 7 -17 19.99 16.70 2 7 -17 31.04 15.95 -2 -7 17 21.46 15.95 2 7 -18 36.51 22.11 2 7 -18 40.83 11.88 -2 -7 18 46.53 17.04 -2 -6 1 7.84 11.07 2 6 -1 2.32 7.82 2 6 -2 216.79 12.58 2 6 -2 197.95 9.67 2 6 -3 201.11 9.43 2 6 -3 180.27 12.28 2 6 -3 204.72 12.82 2 6 -4 1.19 8.03 2 6 -4 4.10 10.37 2 6 -4 4.21 11.14 2 6 -5 59.14 11.08 2 6 -5 66.62 11.44 2 6 -6 45.23 11.21 2 6 -6 48.09 7.95 -2 -6 6 49.22 11.18 2 6 -7 45.44 8.46 -2 -6 7 43.43 8.32 2 6 -7 46.03 11.39 2 6 -8 25.20 11.38 2 6 -8 25.95 12.51 -2 -6 8 23.39 11.45 2 6 -9 36.43 12.35 -2 -6 9 31.88 8.28 2 6 -9 30.88 8.31 -2 -6 10 21.15 11.85 2 6 -10 17.30 13.24 2 6 -10 19.80 8.31 2 6 -11 -0.50 13.73 -2 -6 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10.53 13.53 1 9 -13 18.56 15.09 -1 -9 13 18.71 14.67 1 9 -13 18.20 9.83 -1 -9 13 20.19 13.89 1 9 -14 42.56 15.61 1 9 -14 53.21 10.82 -1 -9 14 53.17 15.26 -1 -9 14 50.53 14.53 -1 -9 15 32.33 15.95 1 9 -15 27.57 15.99 1 9 -15 29.02 14.81 -1 -9 15 29.11 15.49 -1 -9 16 30.79 16.59 1 9 -16 31.16 16.90 -1 -9 16 33.03 11.59 1 9 -16 24.16 16.87 1 9 -17 -1.95 17.27 1 9 -17 9.93 17.14 -1 -9 17 0.36 17.37 -1 -9 17 -2.58 17.34 1 8 -1 15.47 7.54 -1 -8 1 10.86 8.46 1 8 -1 15.38 8.44 1 8 -2 99.93 12.17 1 8 -2 112.08 10.85 1 8 -2 125.12 12.09 1 8 -3 -1.06 11.49 1 8 -3 2.70 10.48 1 8 -3 5.99 11.49 1 8 -4 129.95 8.68 1 8 -4 125.91 12.07 1 8 -4 130.49 8.61 1 8 -5 30.62 11.11 -1 -8 5 28.70 10.67 1 8 -5 32.78 11.04 1 8 -5 34.79 11.18 -1 -8 6 45.22 11.46 1 8 -6 39.49 8.72 1 8 -6 43.46 7.90 1 8 -6 33.57 11.31 1 8 -7 30.56 11.30 -1 -8 7 32.57 11.73 1 8 -7 26.63 12.49 1 8 -8 58.06 11.54 -1 -8 8 59.70 12.17 1 8 -8 48.64 9.17 -1 -8 9 36.60 8.97 1 8 -9 32.97 8.45 1 8 -9 31.23 13.37 -1 -8 9 30.92 11.63 1 8 -10 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11 -9 16.81 13.55 0 11 -10 -0.58 9.38 0 -11 10 4.36 14.37 0 11 -10 4.52 14.94 0 11 -10 1.18 9.18 0 -11 11 8.64 10.34 0 11 -11 11.20 13.69 0 11 -11 15.60 14.08 0 11 -11 4.41 15.10 0 11 -12 25.12 14.80 0 11 -12 14.97 15.45 0 -11 12 25.06 15.51 0 11 -12 29.02 14.72 0 11 -13 0.49 15.38 0 11 -13 -1.59 16.14 0 11 -13 3.32 15.17 0 -11 13 5.78 15.56 0 11 -14 15.90 15.87 0 11 -14 17.16 11.27 0 11 -14 -0.20 16.24 0 -11 14 12.56 11.91 0 -11 15 4.32 16.87 0 11 -15 9.44 11.71 0 11 -15 5.23 11.81 0 11 -15 16.35 17.48 0 11 -16 23.63 17.75 0 -10 1 5.00 8.04 0 10 -1 8.04 7.58 0 10 -1 7.41 11.84 0 10 -2 37.58 11.61 0 10 -2 35.17 12.04 0 -10 2 38.65 11.12 0 10 -2 37.97 11.30 0 -10 3 -0.09 11.28 0 10 -3 3.52 8.01 0 10 -3 7.83 7.97 0 10 -3 3.59 8.23 0 10 -4 20.09 11.72 0 -10 4 16.65 11.36 0 10 -4 16.37 11.63 0 10 -4 21.31 8.53 0 10 -5 7.09 11.80 0 -10 5 -3.51 11.50 0 10 -5 1.51 8.07 0 10 -5 7.52 12.56 0 10 -6 10.52 8.90 0 -10 6 22.89 12.28 0 10 -6 11.18 11.89 0 10 -6 9.26 12.07 0 -10 7 84.41 9.27 0 10 -7 69.10 12.68 0 10 -7 64.99 12.91 0 10 -7 60.18 8.75 0 10 -8 6.66 8.83 0 10 -8 8.61 13.29 0 -10 8 -2.50 9.31 0 10 -8 2.95 12.27 0 10 -9 11.07 12.67 0 10 -9 9.39 9.09 0 10 -9 6.52 10.01 0 -10 9 11.70 13.43 0 10 -10 4.92 9.97 0 10 -10 1.18 9.64 0 -10 10 -4.83 13.46 0 10 -10 -7.54 13.39 0 10 -11 3.17 9.44 0 -10 11 -0.24 14.20 0 10 -11 2.51 13.44 0 10 -11 5.48 14.42 0 -10 12 2.91 14.64 0 10 -12 10.84 14.77 0 10 -12 1.23 14.69 0 10 -13 2.26 15.30 0 10 -13 12.47 14.93 0 -10 13 10.20 15.14 0 -10 14 10.84 15.98 0 10 -14 3.56 15.95 0 10 -14 12.89 15.73 0 -10 14 8.49 10.85 0 10 -15 5.99 16.45 0 10 -15 -0.17 11.19 0 -10 15 2.20 16.53 0 -10 15 -0.04 15.92 0 -10 16 5.06 11.84 0 -10 16 4.41 12.05 0 10 -16 -3.64 11.87 0 10 -16 -0.53 17.28 0 9 -1 74.01 8.08 0 9 -1 69.58 11.93 0 -9 1 77.18 8.56 0 9 -2 132.85 9.16 0 -9 2 157.01 11.65 0 9 -2 95.49 8.47 0 9 -2 162.26 12.08 0 9 -3 190.14 12.13 0 9 -3 218.37 12.36 0 -9 3 202.93 9.26 0 9 -3 181.80 9.64 0 9 -4 10.63 11.62 0 -9 4 14.27 7.80 0 9 -4 16.03 11.37 0 9 -4 12.77 8.00 0 9 -5 65.38 11.86 0 9 -5 69.37 8.38 0 -9 5 78.39 8.63 0 9 -5 62.72 8.87 0 9 -6 41.28 11.96 0 9 -6 43.63 11.75 0 -9 6 51.30 11.78 0 9 -6 41.00 11.58 0 9 -7 14.32 8.59 0 9 -7 18.05 8.38 0 9 -7 18.96 11.47 0 -9 7 20.92 12.72 0 -9 8 60.10 12.64 0 9 -8 57.69 13.19 0 9 -8 55.50 12.29 0 9 -8 58.36 12.73 0 -9 9 70.55 13.12 0 9 -9 65.14 8.53 0 9 -9 34.82 9.43 0 9 -10 36.42 13.58 0 9 -10 45.22 12.44 0 -9 10 37.56 9.61 0 -9 11 11.28 14.01 0 9 -11 7.45 13.74 0 9 -11 3.72 9.26 0 -9 11 13.85 9.17 0 9 -12 3.11 14.21 0 9 -12 4.99 9.62 0 -9 12 3.18 13.87 0 -9 12 4.15 9.39 0 9 -13 47.10 10.60 0 9 -13 48.11 10.28 0 -9 13 70.52 10.08 0 -9 13 66.43 14.75 0 9 -14 75.70 15.62 0 -9 14 92.57 15.53 0 -9 14 113.13 15.04 0 9 -14 96.42 15.37 0 -9 15 13.46 11.50 0 9 -15 11.70 15.53 0 9 -15 18.00 16.04 0 -9 15 7.12 11.00 0 -9 16 -0.28 16.40 0 -9 16 -1.35 16.07 0 9 -16 -1.33 11.51 0 9 -16 6.65 16.64 0 -9 17 119.61 13.05 0 9 -17 119.47 17.50 0 9 -17 90.40 17.85 0 -9 17 128.25 18.02 0 8 -1 74.23 8.60 0 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14 1.53 14.70 0 8 -15 10.11 15.16 0 8 -15 11.54 10.34 0 -8 15 14.23 11.10 0 -8 15 10.59 15.39 0 8 -16 149.14 16.75 0 -8 16 164.38 16.71 0 -8 16 155.94 11.71 0 8 -16 125.99 16.50 0 8 -17 4.14 11.84 0 -8 17 -2.77 16.85 0 8 -17 -6.11 17.02 0 -8 17 -1.30 11.91 0 8 -18 20.45 12.53 0 8 -18 13.61 17.81 0 -8 18 8.96 12.24 0 -8 18 16.42 12.95 0 7 -1 2.56 11.27 0 7 -1 0.40 10.29 0 -7 1 5.34 7.93 0 -7 1 3.59 7.25 0 -7 2 29.02 10.72 0 7 -2 26.75 7.81 0 7 -2 27.29 7.89 0 7 -2 30.52 11.27 0 7 -3 99.79 11.94 0 7 -3 93.24 11.80 0 -7 3 108.65 11.61 0 7 -3 96.82 8.89 0 7 -4 351.14 10.52 0 -7 4 373.34 13.08 0 7 -4 388.53 12.97 0 7 -4 350.97 10.75 0 -7 5 387.38 13.28 0 7 -5 380.31 10.60 0 7 -5 353.74 10.49 0 7 -5 369.43 13.43 0 7 -6 87.90 11.94 0 -7 6 96.89 11.73 0 7 -6 104.33 11.36 0 7 -7 30.95 7.88 0 -7 7 31.48 8.20 0 -7 7 31.75 10.82 0 7 -7 29.31 12.21 0 7 -8 4.12 12.59 0 -7 8 5.71 8.64 0 7 -8 6.44 7.83 0 -7 8 8.04 10.87 0 -7 9 220.30 13.52 0 7 -9 214.94 9.35 0 7 -9 186.65 13.77 0 -7 9 212.81 12.43 0 7 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140.59 11.18 0 6 -4 142.51 11.71 0 6 -5 42.67 8.02 0 6 -5 56.83 10.59 0 -6 5 51.32 7.78 0 -6 5 55.04 7.95 0 6 -6 77.80 11.62 0 -6 6 84.08 8.54 0 6 -6 77.33 8.20 0 -6 6 81.28 8.14 0 6 -7 322.15 12.49 0 6 -7 296.46 13.46 0 -6 7 323.90 13.59 0 -6 7 319.04 12.29 0 -6 8 5.14 11.46 0 6 -8 -0.20 11.97 0 6 -8 2.40 7.73 0 -6 8 3.04 7.60 0 6 -9 5.12 12.46 0 6 -9 -0.39 10.99 0 -6 9 1.70 7.80 0 -6 9 4.10 12.52 0 6 -10 46.13 12.59 0 -6 10 54.50 11.69 0 6 -10 51.03 8.49 0 -6 10 52.44 9.29 0 -6 11 19.11 13.15 0 -6 11 9.93 11.95 0 6 -11 15.56 9.04 0 6 -11 14.46 12.03 0 6 -12 91.25 9.52 0 6 -12 74.94 13.11 0 -6 12 84.77 13.66 0 -6 12 95.49 12.59 0 6 -13 108.33 10.18 0 -6 13 129.46 14.41 0 6 -13 84.35 9.62 0 -6 13 128.34 13.64 0 6 -14 57.66 13.79 0 -6 14 58.44 10.47 0 6 -14 69.59 13.70 0 -6 14 66.11 9.79 0 6 -15 95.05 14.76 0 6 -15 85.46 10.18 0 -6 15 127.68 14.79 0 -6 15 112.91 15.22 0 -6 16 47.37 15.55 0 6 -16 48.69 10.29 0 6 -16 35.26 15.00 0 -6 16 62.04 14.93 0 6 -17 55.01 15.44 0 6 -17 36.56 11.55 0 -6 17 60.53 16.30 0 -6 17 62.37 11.56 0 6 -18 1.61 16.89 0 6 -18 8.30 16.09 0 -6 18 -2.61 11.84 0 -6 18 -7.84 16.57 0 6 -19 -7.21 16.45 0 -6 19 2.35 17.23 0 6 -19 -0.80 18.36 0 -6 19 0.78 17.68 0 5 -1 -1.87 10.44 0 -5 1 1.62 11.46 0 -5 1 2.46 10.52 0 5 -1 -0.43 8.18 0 5 -2 1002.93 18.98 0 -5 2 973.91 16.37 0 5 -2 902.39 18.51 0 5 -2 884.09 17.30 0 5 -3 74.91 8.38 0 5 -3 63.72 11.01 0 -5 3 81.44 8.34 0 5 -3 63.54 8.54 0 -5 4 562.89 14.92 0 5 -4 571.99 14.41 0 5 -4 547.03 12.74 0 -5 4 573.67 12.67 0 5 -5 280.46 13.15 0 -5 5 291.76 10.57 0 5 -5 267.50 9.77 0 -5 5 288.59 9.92 0 5 -6 28.44 7.96 0 -5 6 30.43 10.86 0 5 -6 30.27 10.65 0 -5 6 25.64 11.32 0 -5 7 1.55 10.08 0 5 -7 3.65 11.17 0 -5 7 3.33 11.50 0 5 -7 2.60 7.11 0 5 -8 7.41 8.15 0 5 -8 12.31 7.60 0 -5 8 13.26 8.45 0 -5 8 17.28 10.61 0 5 -9 18.87 11.10 0 5 -9 14.40 8.35 0 -5 9 20.88 12.32 0 -5 9 17.24 7.67 0 -5 10 35.24 11.28 0 5 -10 37.25 8.23 0 -5 10 31.49 12.73 0 5 -10 27.74 12.02 0 5 -11 5.49 8.23 0 -5 11 9.05 12.66 0 -5 11 7.51 8.13 0 5 -11 5.19 12.14 0 5 -12 18.51 8.76 0 5 -12 16.23 8.72 0 -5 12 28.23 13.33 0 -5 12 24.61 12.05 0 5 -13 1.84 12.54 0 5 -13 2.31 12.15 0 -5 13 1.75 8.66 0 -5 13 1.14 13.21 0 5 -14 4.53 13.31 0 -5 14 8.33 13.76 0 5 -14 4.48 9.69 0 -5 14 3.87 9.16 0 -5 15 5.31 10.28 0 5 -15 5.24 9.51 0 5 -15 3.35 9.87 0 -5 15 9.07 10.02 0 5 -16 11.70 14.55 0 -5 16 9.69 14.48 0 -5 16 4.26 9.90 0 5 -16 7.69 14.73 0 5 -17 1.85 15.95 0 -5 17 4.42 15.26 0 5 -17 10.42 14.37 0 -5 17 -0.34 15.71 0 5 -18 17.71 16.68 0 5 -18 16.31 15.51 0 -5 18 21.05 15.52 0 -5 18 24.44 16.39 0 5 -19 5.77 18.03 0 5 -19 6.07 16.20 0 -5 19 1.19 16.70 0 -5 19 5.81 12.48 0 -5 20 7.73 17.51 0 5 -20 12.47 19.86 0 -5 20 16.34 18.12 0 -4 1 322.85 11.77 0 4 -1 294.39 15.37 0 -4 1 295.25 15.41 0 4 -1 278.89 11.32 0 -4 2 459.64 15.03 0 4 -2 439.93 15.91 0 4 -2 462.65 13.04 0 4 -2 482.02 16.08 0 -4 3 256.22 13.43 0 4 -3 255.57 10.85 0 -4 3 256.31 13.33 0 4 -3 242.37 10.86 0 4 -4 -0.48 7.98 0 -4 4 2.65 11.04 0 4 -4 -0.53 7.16 0 -4 4 0.79 7.23 0 4 -5 112.23 11.94 0 -4 5 115.58 11.00 0 4 -5 124.92 11.03 0 -4 5 132.91 9.36 0 4 -6 128.71 11.30 0 -4 6 143.66 12.25 0 4 -6 104.76 8.94 0 -4 6 137.70 8.60 0 -4 7 7.91 7.76 0 4 -7 8.03 10.87 0 4 -7 8.15 7.35 0 -4 7 12.02 11.22 0 4 -8 32.65 7.80 0 -4 8 32.02 8.66 0 4 -8 28.12 8.26 0 -4 8 28.45 10.63 0 4 -9 58.61 12.01 0 -4 9 69.17 12.45 0 4 -9 66.28 11.24 0 -4 9 66.73 11.25 0 4 -10 10.76 8.36 0 -4 10 19.33 8.73 0 4 -10 16.80 11.62 0 -4 10 18.17 11.07 0 4 -11 95.46 11.79 0 -4 11 92.70 9.59 0 4 -11 72.42 12.06 0 -4 11 106.05 8.80 0 4 -12 28.14 8.37 0 -4 12 34.78 13.33 0 -4 12 32.50 11.90 0 4 -12 28.76 12.33 0 4 -13 8.33 12.40 0 -4 13 0.11 13.26 0 -4 13 -1.28 12.03 0 4 -13 3.80 12.55 0 4 -14 21.51 13.14 0 4 -14 30.83 12.91 0 -4 14 27.00 13.66 0 -4 14 29.16 12.90 0 4 -15 21.15 14.06 0 4 -15 27.03 13.11 0 -4 15 24.64 10.23 0 -4 15 28.80 13.89 0 4 -16 12.37 10.43 0 4 -16 16.91 14.34 0 -4 16 12.66 10.62 0 -4 16 17.08 10.56 0 4 -17 38.17 14.19 0 -4 17 40.17 15.28 0 -4 17 30.80 15.04 0 4 -17 19.67 11.26 0 4 -18 7.04 14.95 0 4 -18 1.71 16.64 0 -4 18 -0.51 15.91 0 -4 18 -0.29 11.21 0 4 -19 2.79 17.79 0 4 -19 -5.74 15.82 0 -4 19 -1.37 16.94 0 -4 19 1.86 16.48 0 4 -20 4.15 18.80 0 4 -20 12.14 16.44 0 -4 20 7.79 17.68 0 -4 20 -1.77 17.50 0 -3 1 5.55 8.39 0 -3 1 4.21 11.22 0 3 -1 4.58 8.31 0 3 -1 3.98 8.40 0 3 -2 369.99 13.47 0 -3 2 377.48 15.86 0 3 -2 388.87 16.08 0 -3 2 386.96 16.23 0 3 -3 132.06 11.25 0 -3 3 171.12 14.20 0 3 -3 113.02 9.87 0 -3 3 122.18 9.92 0 3 -4 0.26 7.56 0 3 -4 3.92 8.46 0 -3 4 5.89 11.79 0 -3 4 1.96 7.60 0 -3 5 36.17 11.99 0 3 -5 39.26 7.72 0 -3 5 35.76 10.65 0 3 -5 28.45 8.57 0 3 -6 19.32 11.00 0 -3 6 20.38 11.43 0 3 -6 21.18 7.26 0 -3 6 17.44 10.17 0 3 -7 252.62 12.88 0 3 -7 302.31 9.97 0 -3 7 292.53 11.46 0 -3 7 292.23 12.33 0 3 -8 43.72 10.91 0 3 -8 38.48 11.16 0 -3 8 37.46 10.80 0 -3 8 43.70 8.42 0 -3 9 -1.27 12.36 0 3 -9 -1.72 11.12 0 3 -9 1.07 10.73 0 -3 9 -1.25 10.75 0 -3 10 224.48 13.43 0 3 -10 245.62 12.45 0 -3 10 245.31 9.62 0 3 -10 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3 499.23 16.62 0 -2 3 471.83 14.13 0 2 -4 1472.89 25.70 0 -2 4 1662.95 27.93 0 2 -4 1612.21 22.15 0 -2 4 1651.96 23.72 0 -2 5 34.88 8.79 0 2 -5 36.07 11.01 0 2 -5 25.40 8.25 0 -2 5 35.32 11.06 0 2 -6 1.89 10.78 0 2 -6 1.89 10.56 0 -2 6 3.77 11.80 0 -2 6 -0.96 10.57 0 -2 7 3.00 10.26 0 2 -7 -1.85 10.78 0 2 -7 -0.03 7.33 0 -2 7 1.54 11.69 0 -2 8 142.86 11.89 0 -2 8 137.16 13.03 0 2 -8 144.35 9.50 0 2 -8 113.43 11.86 0 2 -9 45.51 11.35 0 2 -9 48.18 11.27 0 -2 9 55.84 12.29 0 -2 9 51.44 11.31 0 -2 10 103.40 11.74 0 -2 10 102.57 12.28 0 2 -10 111.79 8.63 0 2 -10 78.88 11.56 0 -2 11 39.00 11.45 0 2 -11 26.46 11.49 0 2 -11 40.57 8.23 0 -2 11 35.91 12.05 0 2 -12 34.75 12.29 0 -2 12 35.78 12.32 0 2 -12 38.12 8.37 0 -2 12 36.56 11.91 0 -2 13 59.83 12.03 0 2 -13 50.41 8.39 0 -2 13 51.48 13.48 0 2 -13 37.13 9.56 0 -2 14 5.95 8.52 0 2 -14 5.15 8.28 0 -2 14 5.14 13.16 0 2 -14 6.56 13.48 0 -2 15 4.07 12.85 0 2 -15 -4.25 12.25 0 2 -15 5.96 14.05 0 -2 15 1.66 9.71 0 2 -16 12.96 12.66 0 2 -16 7.43 14.70 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55.13 13.19 0 6 11 63.06 8.39 0 -6 -11 56.87 11.68 0 6 12 93.63 13.72 0 6 12 107.06 12.01 0 -6 -12 107.92 8.85 0 6 13 106.42 14.32 0 6 13 129.14 12.45 0 -6 -13 138.40 9.14 0 6 14 1.08 13.88 0 -6 -14 3.61 12.36 0 6 14 1.96 8.67 0 6 15 34.11 14.16 0 -6 -15 38.88 12.70 0 6 15 26.13 12.73 0 6 16 98.44 15.18 0 6 16 133.51 13.60 0 -6 -16 129.05 13.60 0 6 17 27.47 14.58 0 6 17 30.52 14.00 0 -6 -17 43.29 14.02 0 6 18 20.12 14.52 0 6 18 25.84 9.98 0 -6 -18 30.16 14.07 0 6 19 3.38 18.65 0 6 19 2.46 10.35 0 -6 -19 4.11 14.68 0 6 20 16.00 19.54 0 6 20 8.49 10.93 0 -6 -20 9.18 10.96 0 6 21 9.19 20.78 0 6 21 2.36 11.50 0 -6 -21 4.21 11.78 0 6 22 28.26 12.00 0 -7 0 5.74 7.57 0 7 0 4.34 7.97 0 7 0 1.43 7.23 0 7 1 9.51 7.15 0 7 1 10.49 7.99 0 -7 -1 8.95 7.93 0 -7 -2 129.34 9.30 0 7 2 129.71 10.99 0 7 2 126.05 9.28 0 7 3 346.96 10.73 0 7 3 324.14 13.48 0 -7 -3 318.69 13.43 0 7 4 412.04 11.77 0 -7 -4 399.04 14.05 0 -7 -5 74.94 12.08 0 7 5 70.38 11.32 0 -7 -6 1356.73 17.62 0 7 6 1387.41 17.90 0 -7 -7 79.29 11.68 0 7 7 89.00 11.77 0 -7 -8 238.79 9.89 0 7 8 251.08 12.63 0 -7 -9 0.51 7.83 0 7 9 3.64 7.76 0 7 10 61.08 11.23 0 -7 -10 64.24 11.84 0 7 10 48.25 15.33 0 7 11 0.41 8.06 0 -7 -11 0.89 11.46 0 7 11 -0.45 9.18 0 7 12 95.32 13.60 0 7 12 109.91 12.15 0 -7 -12 104.02 12.08 0 7 13 99.74 12.28 0 7 13 82.46 14.72 0 -7 -13 101.26 12.09 0 -7 -14 293.35 13.51 0 7 14 250.42 15.71 0 7 14 322.92 13.57 0 7 15 123.75 15.22 0 7 15 149.72 13.60 0 -7 -15 145.13 13.55 0 -7 -16 15.16 13.56 0 7 16 26.79 9.37 0 7 16 11.54 15.07 0 7 17 5.85 13.89 0 7 17 12.45 15.37 0 -7 -17 5.73 9.84 0 7 18 25.84 15.42 0 7 18 35.90 10.33 0 -7 -18 9.25 10.37 0 7 19 35.50 15.14 0 7 19 32.07 16.31 0 -7 -19 45.44 15.19 0 7 20 26.56 16.22 0 -7 -20 30.00 10.97 0 7 20 35.94 15.84 0 7 21 54.44 21.41 0 7 21 69.87 16.78 0 -7 -21 62.77 12.13 0 8 0 38.64 11.68 0 8 0 38.66 7.85 0 -8 0 33.96 11.44 0 8 1 14.23 7.82 0 -8 -1 11.89 11.03 0 8 1 9.12 11.23 0 8 2 36.23 11.25 0 -8 -2 34.59 8.01 0 8 2 38.29 7.86 0 8 3 49.70 7.68 0 8 3 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-7 -13 -9 19.53 17.60 7 13 9 -9.02 19.44 7 13 9 1.39 11.96 7 13 10 14.97 19.23 -7 -13 -10 8.71 18.18 7 13 10 12.68 17.68 7 14 0 -1.43 13.45 7 14 0 9.39 17.04 7 14 0 8.55 18.04 7 14 1 32.43 13.59 7 14 1 48.67 12.68 7 14 1 53.93 17.21 7 14 2 -3.27 13.15 7 14 2 1.09 12.32 7 14 2 5.30 16.91 7 14 3 40.51 18.72 7 14 3 32.23 17.71 7 14 3 34.14 11.95 7 14 4 4.36 18.40 7 14 4 -3.29 17.29 7 14 5 4.35 18.25 -7 -14 -5 10.67 11.74 7 14 5 7.84 17.56 7 14 6 6.03 13.51 -7 -14 -6 5.85 17.24 7 14 6 3.29 12.17 7 14 7 -4.84 19.35 -7 -14 -7 3.08 17.56 7 14 7 12.16 17.42 7 14 8 2.70 13.62 7 14 8 1.02 17.61 -7 -14 -8 -2.48 12.42 -8 8 -1 -3.45 20.14 8 -8 1 12.37 16.95 -8 8 -2 5.28 20.05 8 -8 2 10.29 17.35 -8 7 -1 0.37 19.55 8 -7 1 2.26 17.05 -8 7 -2 0.77 19.50 8 -7 2 1.94 11.79 -8 7 -3 32.59 19.88 8 -7 3 25.70 12.46 -8 7 -4 48.96 20.16 8 -7 4 34.94 17.94 8 -7 5 19.04 18.35 -8 6 -1 -1.45 19.02 8 -6 1 0.25 16.52 -8 6 -2 1.69 19.10 8 -6 2 -2.82 16.94 -8 6 -3 7.00 13.52 8 -6 3 11.34 16.92 -8 6 -4 21.92 20.14 8 -6 4 23.98 12.21 -8 6 -5 2.28 14.25 8 -6 5 -0.21 18.13 -8 6 -6 -2.47 14.31 8 -6 6 -0.22 13.07 -8 5 -1 13.19 18.10 8 -5 1 3.98 11.75 -8 5 -2 4.88 13.34 8 -5 2 7.77 11.52 -8 5 -3 20.22 18.39 8 -5 3 21.36 11.90 -8 5 -4 15.45 19.40 8 -5 4 20.75 17.21 -8 5 -5 27.02 19.33 8 -5 5 28.98 17.33 -8 5 -6 31.52 20.15 8 -5 6 48.89 18.64 -8 5 -7 4.45 20.34 8 -5 7 -3.99 18.39 8 -5 8 5.56 19.38 -8 4 -1 11.38 17.41 8 -4 1 12.85 11.58 -8 4 -2 4.08 12.66 8 -4 2 9.37 11.67 -8 4 -3 6.14 17.86 8 -4 3 -1.66 16.60 -8 4 -4 3.67 12.96 8 -4 4 0.33 17.02 -8 4 -5 7.90 18.41 8 -4 5 -5.34 17.29 -8 4 -6 -1.37 19.63 8 -4 6 1.12 12.40 -8 4 -7 8.98 13.45 8 -4 7 13.84 12.88 -8 4 -8 9.36 14.25 8 -4 8 1.45 13.43 8 -4 9 26.15 13.89 -8 3 -1 46.62 11.98 8 -3 1 70.90 11.63 -8 3 -2 21.37 12.24 8 -3 2 31.56 16.46 -8 3 -3 13.26 17.25 8 -3 3 4.10 16.36 -8 3 -4 14.54 12.67 8 -3 4 33.80 12.14 -8 3 -5 19.12 17.99 8 -3 5 14.33 17.01 -8 3 -6 2.81 18.98 8 -3 6 -0.79 17.86 -8 3 -7 15.00 18.79 8 -3 7 27.98 17.86 -8 3 -8 80.38 19.86 8 -3 8 85.81 19.22 -8 3 -9 2.79 19.95 8 -3 9 -0.73 19.17 -8 2 -1 7.83 15.88 8 -2 1 14.42 11.02 -8 2 -2 17.63 16.61 8 -2 2 19.85 15.87 -8 2 -3 48.18 17.09 8 -2 3 60.68 16.25 -8 2 -4 6.39 11.83 8 -2 4 -0.04 11.51 -8 2 -5 10.61 17.36 8 -2 5 8.71 11.87 -8 2 -6 40.26 18.09 8 -2 6 35.01 12.31 -8 2 -7 6.55 12.80 8 -2 7 2.72 12.37 -8 2 -8 6.39 13.68 8 -2 8 3.28 13.27 -8 2 -9 27.32 13.19 8 -2 9 28.16 19.08 -8 2 -10 17.03 19.66 8 -2 10 4.17 19.33 -8 1 -1 15.42 15.85 8 -1 1 15.92 15.08 -8 1 -2 41.43 15.73 8 -1 2 39.56 11.35 -8 1 -3 1.39 11.44 8 -1 3 -9.97 15.73 -8 1 -4 30.35 16.19 8 -1 4 27.84 15.85 -8 1 -5 7.23 16.66 8 -1 5 -1.95 11.70 -8 1 -6 2.74 17.16 8 -1 6 6.10 12.26 -8 1 -7 -5.23 12.30 8 -1 7 8.23 17.13 -8 1 -8 -3.53 12.55 8 -1 8 8.72 18.30 -8 1 -9 -4.77 13.17 8 -1 9 1.04 13.37 -8 1 -10 -4.98 13.54 8 -1 10 -11.04 18.69 8 -1 11 2.77 14.02 8 0 0 20.34 15.72 -8 0 0 16.51 15.18 8 0 1 7.75 15.40 -8 0 -1 12.41 15.20 -8 0 -2 2.80 11.02 8 0 2 8.94 11.07 -8 0 -3 8.75 15.83 8 0 3 5.09 15.73 -8 0 -4 5.78 15.16 8 0 4 -2.37 15.84 -8 0 -5 -3.83 11.51 8 0 5 1.75 16.18 -8 0 -6 15.95 16.60 8 0 6 7.92 16.65 -8 0 -7 4.83 11.96 8 0 7 10.69 17.11 -8 0 -8 -0.27 16.92 8 0 8 13.55 12.03 -8 0 -9 8.63 18.13 8 0 9 8.55 18.09 -8 0 -10 4.88 18.58 8 0 10 -2.10 12.95 -8 0 -11 3.07 13.45 8 0 11 4.71 13.35 8 1 0 3.93 15.51 -8 -1 0 0.28 15.63 8 1 1 10.88 10.98 -8 -1 -1 3.08 15.52 8 1 2 13.05 15.56 -8 -1 -2 8.09 15.26 8 1 3 19.83 15.83 -8 -1 -3 1.28 15.21 8 1 4 12.18 15.66 -8 -1 -4 11.53 15.08 -8 -1 -5 -0.48 16.00 8 1 5 4.69 16.54 -8 -1 -6 6.20 16.00 8 1 6 3.38 11.52 -8 -1 -7 8.03 11.68 8 1 7 12.79 16.70 -8 -1 -8 10.96 12.45 8 1 8 16.76 17.19 -8 -1 -9 -11.00 17.47 8 1 9 -1.37 17.46 -8 -1 -10 22.86 18.24 8 1 10 15.88 12.66 8 1 10 22.06 29.48 -8 -1 -11 8.88 18.49 8 1 11 7.18 18.59 -8 -1 -11 -0.06 26.43 8 1 11 -0.96 23.86 8 1 12 -0.27 24.35 8 2 0 11.55 15.45 8 2 0 9.05 22.41 8 2 0 10.61 23.10 8 2 1 5.46 15.41 8 2 1 0.91 22.05 8 2 1 2.50 25.35 8 2 2 5.20 15.58 8 2 2 7.26 27.66 -8 -2 -2 0.74 15.37 8 2 2 5.93 26.90 8 2 3 -2.40 15.29 -8 -2 -3 5.63 10.99 8 2 4 -0.22 15.72 -8 -2 -4 6.99 10.49 8 2 5 10.95 11.62 -8 -2 -5 6.42 11.15 8 2 6 19.06 16.31 -8 -2 -6 24.92 11.17 8 2 7 25.18 16.57 8 2 7 13.37 36.89 8 2 7 13.90 31.97 -8 -2 -7 6.64 16.02 8 2 8 -0.81 16.79 8 2 8 0.71 26.05 8 2 8 -2.57 28.04 -8 -2 -8 -6.02 11.61 8 2 9 18.84 12.14 8 2 9 23.40 24.47 -8 -2 -9 32.19 17.13 8 2 10 -1.15 17.90 8 2 10 3.52 24.76 -8 -2 -10 2.01 25.43 -8 -2 -10 -1.98 17.92 -8 -2 -11 0.54 23.58 8 2 11 -7.77 18.07 8 2 11 -1.62 25.09 -8 -2 -11 5.75 18.27 8 2 12 8.80 19.00 8 2 12 4.24 22.39 8 3 0 1.11 15.77 8 3 0 1.40 16.04 8 3 0 1.26 15.33 8 3 1 6.18 15.61 8 3 1 6.30 19.80 8 3 1 1.63 18.51 8 3 2 -0.92 15.73 8 3 2 2.79 18.28 8 3 2 0.21 19.37 8 3 3 5.16 15.78 8 3 3 2.24 21.11 8 3 3 4.34 22.26 8 3 4 2.13 21.79 8 3 4 0.74 15.87 8 3 4 2.89 21.08 8 3 5 2.25 22.13 8 3 5 4.87 16.27 8 3 5 3.58 21.47 -8 -3 -5 8.93 15.87 8 3 6 1.82 22.99 8 3 6 4.94 16.43 8 3 6 3.67 21.62 -8 -3 -6 8.63 15.77 8 3 7 2.20 24.19 8 3 7 2.71 16.74 8 3 7 1.63 22.33 -8 -3 -7 9.25 16.29 8 3 8 5.18 12.13 8 3 8 -1.79 21.20 -8 -3 -8 -3.24 11.50 8 3 9 -4.33 17.55 8 3 9 0.20 25.19 -8 -3 -9 3.02 24.33 -8 -3 -9 1.00 16.86 8 3 10 21.08 17.56 8 3 10 34.09 22.48 -8 -3 -10 26.07 22.85 -8 -3 -10 28.10 17.66 -8 -3 -11 0.34 24.11 8 3 11 10.94 18.32 8 3 11 0.92 22.81 -8 -3 -11 5.68 18.23 8 3 12 8.16 18.45 8 3 12 -0.12 19.17 -8 -3 -12 4.12 25.60 -8 -3 -12 14.43 13.19 8 4 0 4.57 16.07 8 4 0 7.01 15.79 8 4 0 3.35 15.35 8 4 1 11.40 15.31 8 4 1 2.26 15.96 8 4 1 4.78 18.66 8 4 2 13.40 15.81 8 4 2 6.72 19.35 8 4 2 10.32 17.98 8 4 3 5.84 16.18 8 4 3 1.72 19.76 8 4 3 0.53 18.59 8 4 4 -0.67 11.67 8 4 4 -1.78 18.26 8 4 4 1.35 19.38 8 4 5 0.39 16.76 8 4 5 0.60 18.09 8 4 5 1.86 19.07 8 4 6 12.91 19.18 8 4 6 14.75 11.84 8 4 6 12.32 18.91 8 4 7 10.87 19.76 8 4 7 12.59 11.71 8 4 7 14.47 19.84 8 4 8 0.46 20.74 -8 -4 -8 2.78 20.76 8 4 8 -2.19 17.11 8 4 9 26.93 21.29 8 4 9 25.32 17.59 -8 -4 -9 26.77 21.73 -8 -4 -9 23.35 16.68 8 4 10 20.97 17.89 8 4 10 15.37 21.73 -8 -4 -10 2.81 17.44 -8 -4 -10 12.97 18.81 8 4 11 -1.76 18.32 8 4 11 0.46 18.16 -8 -4 -11 2.14 24.41 -8 -4 -11 -0.98 12.74 8 4 12 16.65 17.96 8 4 12 8.09 19.10 -8 -4 -12 5.60 20.60 -8 -4 -12 -0.19 13.17 8 5 0 5.63 15.60 8 5 0 8.60 16.23 8 5 0 4.71 18.57 8 5 1 -1.63 16.27 8 5 1 1.54 16.33 8 5 1 -0.54 15.64 8 5 2 0.35 16.08 8 5 2 -2.27 16.53 8 5 2 -0.08 18.82 8 5 3 14.16 11.87 8 5 3 26.23 20.25 8 5 3 27.46 15.13 8 5 4 0.82 16.12 8 5 4 -0.42 16.50 8 5 4 5.11 18.41 8 5 5 -0.54 11.87 8 5 5 -2.30 19.63 8 5 5 -0.61 18.68 8 5 6 1.16 16.51 8 5 6 6.34 19.12 8 5 6 7.67 19.24 8 5 7 0.51 16.08 8 5 7 6.69 17.17 8 5 8 8.68 16.22 8 5 8 10.20 17.06 -8 -5 -8 2.54 21.66 8 5 9 0.85 16.87 8 5 9 -2.97 17.63 -8 -5 -9 3.27 22.35 -8 -5 -10 18.76 19.41 8 5 10 14.41 17.41 8 5 10 12.56 17.76 8 5 11 3.02 17.86 8 5 11 -3.95 18.52 -8 -5 -11 4.03 19.89 8 5 12 11.33 18.52 8 5 12 -3.16 18.63 8 6 0 -0.80 15.92 8 6 0 2.58 16.66 8 6 0 3.91 15.26 8 6 1 0.78 16.44 8 6 1 -3.02 15.74 8 6 1 -2.04 18.21 8 6 2 11.66 12.06 8 6 2 7.46 16.01 8 6 2 8.13 18.89 8 6 3 -7.19 16.98 8 6 3 1.68 16.30 8 6 3 7.69 18.24 8 6 4 27.45 11.54 8 6 4 33.73 16.63 8 6 4 44.05 15.54 8 6 5 2.66 17.14 8 6 5 5.53 16.84 8 6 5 0.02 19.56 8 6 6 1.62 16.83 8 6 6 11.90 20.63 8 6 6 5.00 16.39 8 6 7 42.41 17.66 8 6 7 43.25 16.65 8 6 8 2.65 16.90 8 6 8 8.06 17.38 -8 -6 -8 4.83 17.66 8 6 9 2.03 20.63 8 6 9 23.10 17.89 -8 -6 -9 11.46 18.41 -8 -6 -10 4.24 19.03 8 6 10 -0.66 17.54 8 6 10 5.48 18.43 8 6 11 6.29 17.71 8 6 11 6.40 18.71 -8 -6 -11 4.17 19.55 8 6 12 23.62 19.32 8 6 12 35.00 19.28 8 7 0 -0.10 16.10 8 7 0 4.45 17.07 8 7 0 7.29 15.53 8 7 1 3.15 15.85 8 7 1 5.51 12.38 8 7 1 5.90 15.38 8 7 2 2.68 16.94 8 7 2 2.20 15.77 8 7 2 2.71 15.55 8 7 3 18.82 17.08 8 7 3 2.24 16.37 8 7 3 7.38 15.53 8 7 4 1.95 11.82 8 7 4 -4.46 16.69 8 7 4 2.62 16.01 8 7 5 20.59 17.59 8 7 5 30.01 17.31 8 7 5 23.67 19.53 8 7 6 10.10 17.95 8 7 6 10.48 16.39 8 7 7 28.74 17.68 -8 -7 -7 62.71 17.74 8 7 7 53.21 16.89 8 7 8 13.64 18.53 -8 -7 -8 1.86 17.66 8 7 8 3.24 16.64 8 7 9 1.64 16.89 8 7 9 -10.45 18.11 -8 -7 -9 -3.60 22.51 -8 -7 -10 36.24 19.50 8 7 10 26.83 17.38 8 7 10 33.99 18.57 8 7 11 16.89 17.73 8 7 11 17.42 13.41 -8 -7 -11 19.92 19.55 8 8 0 -1.18 16.15 8 8 0 4.96 17.56 8 8 0 -0.57 15.10 8 8 1 1.15 16.15 8 8 1 16.02 17.18 8 8 1 8.01 15.57 8 8 2 -10.13 17.62 8 8 2 -0.96 16.26 8 8 2 9.76 15.85 8 8 3 -1.10 12.39 8 8 3 4.30 16.28 8 8 3 -2.46 15.96 8 8 4 5.35 17.73 8 8 4 7.43 16.68 8 8 4 9.46 16.35 8 8 5 4.58 17.58 8 8 5 5.16 16.88 8 8 5 -0.91 16.22 8 8 6 2.43 17.62 8 8 6 1.95 17.13 8 8 7 1.62 18.18 -8 -8 -7 1.57 12.57 8 8 7 2.04 17.07 8 8 8 52.93 18.98 -8 -8 -8 59.24 18.71 8 8 8 53.11 17.51 8 8 9 13.77 18.36 -8 -8 -9 14.23 19.06 8 8 9 17.44 17.93 8 8 10 3.63 17.43 -8 -8 -10 17.17 19.06 8 8 10 -4.81 13.81 8 8 11 1.92 18.49 8 8 11 0.63 19.43 8 9 0 -2.05 16.75 8 9 0 7.03 17.89 8 9 0 1.99 15.94 8 9 1 1.94 16.60 8 9 1 9.55 17.83 8 9 1 5.93 15.81 8 9 2 13.63 18.05 8 9 2 8.04 16.33 8 9 2 16.58 16.43 8 9 3 37.12 13.06 8 9 3 36.93 12.11 8 9 3 39.87 16.48 8 9 4 10.72 12.61 8 9 4 -2.60 16.53 8 9 4 6.36 16.26 8 9 5 -5.10 12.68 8 9 5 0.22 17.09 8 9 5 4.69 17.04 8 9 6 -0.31 13.06 8 9 6 7.61 17.30 8 9 7 7.10 13.02 -8 -9 -7 5.80 17.67 8 9 7 5.78 17.27 8 9 8 16.02 13.30 8 9 8 18.83 17.50 -8 -9 -8 7.99 18.31 8 9 9 -0.03 13.54 -8 -9 -9 -2.68 18.57 8 9 9 -4.35 17.41 -8 -9 -10 -0.92 13.23 8 9 10 7.24 19.23 8 9 10 7.75 17.89 8 10 0 2.25 17.32 8 10 0 1.88 18.24 8 10 0 -1.71 16.34 8 10 1 8.85 12.15 8 10 1 12.44 12.69 8 10 1 3.83 16.67 8 10 2 8.03 18.70 8 10 2 8.78 17.03 8 10 2 -2.88 16.84 8 10 3 5.14 18.50 8 10 3 -0.32 17.06 8 10 3 1.98 12.05 8 10 4 38.06 18.54 8 10 4 28.57 12.27 8 10 4 31.11 17.10 8 10 5 16.22 18.95 8 10 5 17.63 16.92 8 10 5 11.82 17.09 8 10 6 -4.54 19.00 8 10 6 -0.37 17.43 8 10 7 5.98 18.75 -8 -10 -7 4.07 18.22 8 10 7 6.81 17.64 8 10 8 -2.06 19.35 8 10 8 0.21 17.78 -8 -10 -8 13.99 18.81 8 10 9 36.79 19.60 -8 -10 -9 38.52 18.63 8 10 9 46.91 18.17 8 11 0 5.70 18.05 8 11 0 12.52 19.14 8 11 0 10.43 16.82 8 11 1 12.66 17.52 8 11 1 9.49 18.69 8 11 1 7.40 17.11 8 11 2 19.81 13.30 8 11 2 12.37 17.46 8 11 2 5.19 17.01 8 11 3 8.83 13.72 8 11 3 16.61 12.45 8 11 3 10.90 17.35 8 11 4 5.77 13.49 8 11 4 9.21 17.47 8 11 4 6.82 17.69 8 11 5 3.38 13.67 8 11 5 8.89 17.67 8 11 5 5.44 12.60 8 11 6 7.37 13.84 8 11 6 -5.07 17.96 8 11 7 2.57 13.73 -8 -11 -7 0.51 18.48 8 11 7 -0.85 18.17 8 11 8 9.91 19.89 8 11 8 6.98 17.95 8 12 1 10.59 18.34 8 12 1 2.48 13.57 8 12 1 11.33 12.75 8 12 2 9.33 13.91 8 12 2 3.28 12.86 8 12 2 -2.61 12.35 8 12 3 16.49 19.20 8 12 3 14.35 18.35 8 12 3 10.40 12.51 8 12 4 9.59 19.59 8 12 4 -3.74 17.89 8 12 4 -0.68 12.41 8 12 5 30.62 19.55 8 12 5 26.66 18.21 8 12 5 23.18 12.88 -9 3 -1 19.00 19.36 9 -3 1 22.46 18.55 9 -3 2 -3.71 18.41 -9 2 -1 7.40 18.50 9 -2 1 3.35 12.68 -9 2 -2 5.73 18.60 9 -2 2 2.82 12.90 -9 2 -3 -3.56 18.81 9 -2 3 1.81 18.44 9 -2 4 10.01 13.14 9 -1 1 5.22 17.78 -9 1 -1 3.74 12.77 -9 1 -2 41.03 18.11 9 -1 2 55.16 18.29 -9 1 -3 6.74 18.03 9 -1 3 2.83 17.96 -9 1 -4 -3.39 18.57 9 -1 4 -0.90 18.32 9 -1 5 11.02 18.41 9 0 0 26.65 17.63 -9 0 0 13.29 17.69 9 0 1 72.36 18.28 -9 0 -1 53.94 17.66 9 0 2 18.58 18.14 -9 0 -2 11.03 12.57 9 0 3 5.41 17.67 -9 0 -3 6.16 17.60 9 0 4 7.26 12.64 -9 0 -4 6.04 17.79 -9 0 -5 4.71 18.37 9 0 5 4.29 18.15 9 0 6 -1.92 18.70 9 1 0 28.52 17.56 9 1 1 0.62 17.30 9 1 2 8.99 12.64 -9 -1 -2 10.90 17.11 9 1 3 23.59 17.64 -9 -1 -3 14.02 12.39 9 1 4 11.55 17.44 -9 -1 -4 15.86 17.08 9 1 5 2.40 18.09 -9 -1 -5 -2.56 12.70 9 1 6 7.60 18.42 -9 -1 -6 -2.24 12.84 9 2 0 7.09 17.25 9 2 1 1.28 17.27 9 2 2 10.12 17.20 9 2 3 -1.50 12.28 9 2 4 9.59 12.10 -9 -2 -4 -3.27 12.32 9 2 5 19.00 12.89 -9 -2 -5 11.75 12.35 9 2 6 5.51 13.14 -9 -2 -6 2.36 12.59 9 3 0 11.33 17.22 9 3 0 0.56 24.67 9 3 0 -1.41 22.45 9 3 1 -1.15 17.32 9 3 1 5.06 28.52 9 3 1 -0.61 28.20 9 3 2 7.94 37.55 9 3 2 7.22 38.74 9 3 2 9.12 17.37 9 3 3 1.48 17.46 9 3 4 -4.94 17.98 9 3 5 14.40 17.82 9 3 6 2.55 13.03 9 3 7 -5.84 18.25 9 4 0 11.97 17.32 9 4 0 5.10 18.96 9 4 0 6.75 20.84 9 4 1 8.05 12.29 9 4 1 12.84 20.87 9 4 1 10.85 22.87 9 4 2 -1.43 11.83 9 4 2 2.94 20.83 9 4 2 -1.22 21.58 9 4 3 1.74 12.37 9 4 3 2.11 21.55 9 4 3 4.06 25.74 9 4 4 10.20 25.01 9 4 4 9.38 12.35 9 4 4 13.14 23.95 9 4 5 5.02 25.31 9 4 5 2.02 17.88 9 4 5 1.79 24.00 9 4 6 3.68 25.98 9 4 6 7.64 18.48 9 4 6 0.41 26.75 9 4 7 28.64 30.73 9 4 7 27.29 25.14 9 5 0 3.53 17.56 9 5 0 9.89 22.11 9 5 0 4.09 20.85 9 5 1 4.38 17.78 9 5 1 2.47 18.68 9 5 1 5.63 16.62 9 5 2 -0.23 17.69 9 5 2 10.87 22.36 9 5 2 5.83 20.62 9 5 3 3.25 17.83 9 5 3 -2.12 21.42 9 5 3 2.40 22.69 9 5 4 36.35 17.67 9 5 4 36.46 21.46 9 5 4 39.69 22.35 9 5 5 4.18 21.99 9 5 5 7.34 13.33 9 5 5 4.06 20.94 9 5 6 11.25 21.98 9 5 6 7.97 18.54 9 5 6 6.73 21.50 9 6 0 16.92 22.04 9 6 0 13.98 12.77 9 6 0 15.00 21.33 9 6 1 -0.68 12.73 9 6 1 3.16 18.23 9 6 1 3.05 20.97 9 6 2 6.39 13.12 9 6 2 8.28 18.26 9 6 2 4.66 16.89 9 6 3 8.41 18.37 9 6 3 15.71 18.86 9 6 3 16.55 21.04 9 6 4 0.89 18.40 9 6 4 2.78 21.15 9 6 4 4.80 18.53 9 6 5 1.75 13.11 9 6 5 5.68 21.51 9 6 5 1.43 22.64 9 6 6 6.62 22.33 9 6 6 1.01 22.69 9 7 0 8.39 18.22 9 7 0 8.81 18.33 9 7 0 3.22 17.96 9 7 1 3.82 18.74 9 7 1 8.47 22.11 9 7 1 5.41 17.39 9 7 2 1.63 18.18 9 7 2 2.78 17.98 9 7 2 -0.12 16.95 9 7 3 27.20 13.45 9 7 3 37.22 19.10 9 7 3 34.92 21.31 9 7 4 27.74 19.14 9 7 4 28.16 19.01 9 7 4 21.14 17.82 ; _shelx_res_checksum 7305 _shelx_res_file ; TITL SA21 IPDS2 -100DEGC CELL 0.71073 7.69550 16.61810 18.22410 79.20600 87.56300 83.97600 ZERR 4 0.00080 0.00200 0.00200 0.00900 0.00900 0.00900 LATT 1 SFAC C H CL F N O UNIT 109 109 3 4 8 4 TEMP -100 L.S. 7 FMAP 2 PLAN 20 ACTA BOND $H CONF HTAB EQIV $1 -X, -Y, -Z+1 HTAB N2 O1_$1 HTAB C14 CL1 EQIV $2 X-1, Y-1, Z HTAB C25 F2_$2 EQIV $3 -X+1, -Y+1, -Z HTAB N4 O2_$3 EQIV $4 -X+2, -Y+1, -Z+1 HTAB C34 F1_$4 EQIV $5 -X+1, -Y, -Z HTAB C41 CL2_$5 WGHT 0.049400 EXTI 0.003449 FVAR 0.39036 F1 4 0.783349 0.467739 0.437606 11.00000 0.06992 0.04170 = 0.04720 -0.01526 -0.00376 -0.00413 O1 6 -0.205423 0.000853 0.537544 11.00000 0.03445 0.04369 = 0.04310 -0.02308 0.01460 -0.00941 N1 5 0.453228 -0.075905 0.256457 11.00000 0.02058 0.02857 = 0.02389 -0.00392 0.00342 -0.00273 N2 5 -0.087096 -0.096654 0.474415 11.00000 0.02137 0.02782 = 0.02139 -0.00533 0.00586 -0.00799 H2N 2 0.008671 -0.071245 0.471218 11.00000 0.03354 C2 1 0.756572 0.399297 0.409037 11.00000 0.03355 0.02920 = 0.03784 -0.01429 0.00508 -0.00411 C3 1 0.809234 0.322818 0.449416 11.00000 0.03627 0.04201 = 0.02481 -0.00504 -0.00183 -0.00149 AFIX 43 H3 2 0.862357 0.316902 0.496489 11.00000 -1.20000 AFIX 0 C4 1 0.782604 0.255004 0.419519 11.00000 0.02788 0.03042 = 0.02559 0.00239 0.00037 -0.00002 AFIX 43 H4 2 0.818556 0.201731 0.446766 11.00000 -1.20000 AFIX 0 C5 1 0.704629 0.261841 0.350578 11.00000 0.01433 0.02739 = 0.02717 0.00083 0.00458 -0.00160 C6 1 0.653952 0.341850 0.311977 11.00000 0.02254 0.03418 = 0.02520 -0.00066 -0.00132 0.00053 AFIX 43 H6 2 0.601318 0.348978 0.264678 11.00000 -1.20000 AFIX 0 C7 1 0.679386 0.410187 0.341643 11.00000 0.03131 0.02852 = 0.03261 0.00164 0.00263 0.00088 AFIX 43 H7 2 0.643555 0.463956 0.315409 11.00000 -1.20000 AFIX 0 C8 1 0.674475 0.188623 0.319099 11.00000 0.02242 0.02731 = 0.02077 0.00369 0.00572 -0.00375 C9 1 0.779847 0.114019 0.337801 11.00000 0.02275 0.03208 = 0.03257 0.00074 -0.00102 -0.00134 AFIX 43 H9 2 0.872589 0.110104 0.371464 11.00000 -1.20000 AFIX 0 C10 1 0.751001 0.046037 0.308053 11.00000 0.02391 0.02546 = 0.03247 0.00043 0.00405 0.00126 AFIX 43 H10 2 0.823311 -0.003916 0.322660 11.00000 -1.20000 AFIX 0 C11 1 0.619339 0.048474 0.257370 11.00000 0.01990 0.02936 = 0.02522 0.00080 0.00668 -0.00461 C12 1 0.594322 -0.025445 0.223476 11.00000 0.02244 0.03555 = 0.02877 -0.00470 0.00560 -0.00004 AFIX 23 H12A 2 0.571185 -0.006146 0.169701 11.00000 -1.20000 H12B 2 0.705696 -0.061496 0.227076 11.00000 -1.20000 AFIX 0 C13 1 0.278773 -0.038464 0.235583 11.00000 0.02759 0.03423 = 0.02241 -0.00077 0.00037 -0.00372 AFIX 23 H13A 2 0.274637 -0.020692 0.180660 11.00000 -1.20000 H13B 2 0.250266 0.010765 0.258780 11.00000 -1.20000 AFIX 0 C14 1 0.144746 -0.099953 0.261399 11.00000 0.02547 0.03463 = 0.02409 -0.00377 -0.00083 -0.00088 AFIX 23 H14A 2 0.172828 -0.149283 0.238307 11.00000 -1.20000 H14B 2 0.026639 -0.074761 0.245755 11.00000 -1.20000 AFIX 0 C15 1 0.148169 -0.124604 0.346400 11.00000 0.02622 0.02174 = 0.02215 -0.00363 0.00207 -0.00382 AFIX 13 H15 2 0.124413 -0.072956 0.367363 11.00000 -1.20000 AFIX 0 C16 1 0.011815 -0.181777 0.380469 11.00000 0.02074 0.02535 = 0.01908 -0.00216 -0.00236 -0.00262 C17 1 -0.096409 -0.167650 0.441647 11.00000 0.02197 0.02229 = 0.02338 -0.00281 -0.00492 -0.00118 C18 1 -0.216881 -0.064706 0.515500 11.00000 0.02370 0.03290 = 0.02365 -0.00511 0.00286 -0.00307 C19 1 -0.373211 -0.111995 0.533511 11.00000 0.02359 0.03880 = 0.02898 -0.00765 0.00764 -0.00570 AFIX 23 H19A 2 -0.459214 -0.094255 0.493348 11.00000 -1.20000 H19B 2 -0.429315 -0.100307 0.580795 11.00000 -1.20000 AFIX 0 C20 1 -0.320213 -0.203881 0.541195 11.00000 0.03142 0.03735 = 0.03020 -0.00020 0.00855 -0.01059 AFIX 23 H20A 2 -0.250043 -0.223278 0.586542 11.00000 -1.20000 H20B 2 -0.426293 -0.233648 0.547017 11.00000 -1.20000 AFIX 0 C21 1 -0.215887 -0.222717 0.474332 11.00000 0.02267 0.02939 = 0.02129 0.00109 -0.00073 -0.00574 C22 1 -0.229603 -0.292387 0.444205 11.00000 0.03027 0.03205 = 0.03392 -0.00120 -0.00292 -0.01292 AFIX 43 H22 2 -0.311799 -0.329665 0.465125 11.00000 -1.20000 AFIX 0 C23 1 -0.125005 -0.308075 0.384135 11.00000 0.04279 0.02849 = 0.03888 -0.00940 -0.00182 -0.00990 AFIX 43 H23 2 -0.134255 -0.356180 0.364016 11.00000 -1.20000 AFIX 0 C24 1 -0.005907 -0.253007 0.353212 11.00000 0.03371 0.03447 = 0.02872 -0.00876 -0.00017 -0.00470 AFIX 43 H24 2 0.065835 -0.264548 0.311986 11.00000 -1.20000 AFIX 0 C25 1 0.333798 -0.161330 0.367969 11.00000 0.02976 0.02938 = 0.02802 0.00270 -0.00397 -0.00417 AFIX 23 H25A 2 0.340693 -0.174960 0.423093 11.00000 -1.20000 H25B 2 0.361265 -0.212955 0.348286 11.00000 -1.20000 AFIX 0 C26 1 0.467928 -0.101618 0.337154 11.00000 0.02617 0.02841 = 0.02606 0.00405 -0.00071 -0.00365 AFIX 23 H26A 2 0.449243 -0.052682 0.361316 11.00000 -1.20000 H26B 2 0.586997 -0.128500 0.348926 11.00000 -1.20000 AFIX 0 C27 1 0.513808 0.122677 0.239431 11.00000 0.02492 0.03536 = 0.02426 0.00282 -0.00079 -0.00230 AFIX 43 H27 2 0.421720 0.126542 0.205458 11.00000 -1.20000 AFIX 0 C28 1 0.539571 0.190867 0.269776 11.00000 0.02439 0.02796 = 0.02335 0.00226 0.00046 0.00004 AFIX 43 H28 2 0.463947 0.240057 0.256744 11.00000 -1.20000 AFIX 0 F2 4 1.361714 0.625443 0.385675 11.00000 0.07760 0.04166 = 0.06241 -0.02145 0.00629 -0.01256 O2 6 0.287716 0.540269 -0.013628 11.00000 0.02995 0.02773 = 0.06009 -0.02071 -0.00854 0.00200 N3 5 0.977051 0.201691 0.054224 11.00000 0.02415 0.02503 = 0.02848 0.00114 0.00102 0.00091 N4 5 0.409600 0.429112 -0.057953 11.00000 0.01981 0.02086 = 0.02791 -0.00418 -0.00490 -0.00037 H4N 2 0.502392 0.431102 -0.034378 11.00000 0.02192 C29 1 1.318823 0.568941 0.346159 11.00000 0.04254 0.03295 = 0.05009 -0.01581 0.00320 -0.00226 C30 1 1.344009 0.584124 0.270026 11.00000 0.03412 0.02843 = 0.05238 -0.00268 0.00150 0.00117 AFIX 43 H30 2 1.386350 0.634051 0.245236 11.00000 -1.20000 AFIX 0 C31 1 1.306428 0.525149 0.230025 11.00000 0.02799 0.02889 = 0.03340 0.00595 0.00200 0.00018 AFIX 43 H31 2 1.323534 0.535150 0.177292 11.00000 -1.20000 AFIX 0 C32 1 1.243747 0.451053 0.265522 11.00000 0.02284 0.03031 = 0.02774 0.00090 0.00244 0.00289 C33 1 1.217470 0.440660 0.342835 11.00000 0.03794 0.03077 = 0.03661 0.00108 0.00880 -0.00489 AFIX 43 H33 2 1.172073 0.391781 0.368365 11.00000 -1.20000 AFIX 0 C34 1 1.254568 0.498227 0.383545 11.00000 0.05266 0.03735 = 0.03655 -0.01124 0.00914 -0.00141 AFIX 43 H34 2 1.236209 0.489301 0.436205 11.00000 -1.20000 AFIX 0 C35 1 1.208823 0.386390 0.223192 11.00000 0.01880 0.03063 = 0.02675 0.00617 0.00071 0.00309 C36 1 1.292262 0.379955 0.154664 11.00000 0.02619 0.02891 = 0.03083 0.00160 0.00476 -0.00311 AFIX 43 H36 2 1.370821 0.418994 0.133662 11.00000 -1.20000 AFIX 0 C37 1 1.263388 0.318270 0.116705 11.00000 0.02565 0.03532 = 0.02420 0.00244 0.00351 0.00245 AFIX 43 H37 2 1.321234 0.316304 0.069880 11.00000 -1.20000 AFIX 0 C38 1 1.150966 0.258632 0.145600 11.00000 0.01758 0.02969 = 0.03099 0.00481 -0.00364 0.00268 C39 1 1.125152 0.189530 0.104793 11.00000 0.02427 0.03265 = 0.02975 -0.00050 -0.00029 0.00346 AFIX 23 H39A 2 1.233371 0.178729 0.075365 11.00000 -1.20000 H39B 2 1.111690 0.139292 0.142652 11.00000 -1.20000 AFIX 0 C40 1 0.806584 0.200817 0.092545 11.00000 0.02363 0.02765 = 0.02900 0.00376 0.00376 -0.00230 AFIX 23 H40A 2 0.784963 0.249388 0.117095 11.00000 -1.20000 H40B 2 0.805775 0.150752 0.131716 11.00000 -1.20000 AFIX 0 C41 1 0.663300 0.202121 0.038047 11.00000 0.02716 0.02618 = 0.03353 -0.00068 0.00456 -0.00104 AFIX 23 H41A 2 0.548956 0.200431 0.065030 11.00000 -1.20000 H41B 2 0.683356 0.153049 0.014116 11.00000 -1.20000 AFIX 0 C42 1 0.660887 0.280313 -0.021800 11.00000 0.02593 0.01735 = 0.03273 -0.00448 -0.00175 0.00136 AFIX 13 H42 2 0.642493 0.328358 0.004453 11.00000 -1.20000 AFIX 0 C43 1 0.516897 0.290272 -0.078194 11.00000 0.02546 0.02114 = 0.02996 -0.00612 0.00077 -0.00331 C44 1 0.400132 0.361892 -0.094893 11.00000 0.02245 0.02480 = 0.01973 -0.00505 0.00532 -0.00581 C45 1 0.273565 0.487455 -0.051822 11.00000 0.02745 0.01987 = 0.03119 -0.00155 0.00218 -0.00116 C46 1 0.113465 0.483806 -0.093041 11.00000 0.02434 0.02684 = 0.03764 -0.00637 -0.00483 0.00196 AFIX 23 H46A 2 0.051200 0.539676 -0.105501 11.00000 -1.20000 H46B 2 0.034760 0.448044 -0.060779 11.00000 -1.20000 AFIX 0 C47 1 0.157031 0.450467 -0.164403 11.00000 0.03107 0.03641 = 0.02825 0.00246 -0.00590 -0.00025 AFIX 23 H47A 2 0.047729 0.441350 -0.187028 11.00000 -1.20000 H47B 2 0.216975 0.491280 -0.200595 11.00000 -1.20000 AFIX 0 C48 1 0.273321 0.370452 -0.148471 11.00000 0.02318 0.02988 = 0.01953 -0.00383 0.00251 -0.00257 C49 1 0.257851 0.306594 -0.186007 11.00000 0.03424 0.04545 = 0.03061 -0.01304 -0.00459 -0.00649 AFIX 43 H49 2 0.168803 0.311262 -0.221532 11.00000 -1.20000 AFIX 0 C50 1 0.372942 0.235645 -0.171576 11.00000 0.04499 0.03761 = 0.04542 -0.02355 -0.00184 -0.00445 AFIX 43 H50 2 0.365049 0.192248 -0.198224 11.00000 -1.20000 AFIX 0 C51 1 0.498669 0.228417 -0.118452 11.00000 0.03565 0.03114 = 0.04500 -0.01528 -0.00279 0.00178 AFIX 43 H51 2 0.575845 0.179321 -0.108956 11.00000 -1.20000 AFIX 0 C52 1 0.842193 0.282306 -0.060147 11.00000 0.02912 0.03499 = 0.03526 0.00271 -0.00140 -0.00366 AFIX 23 H52A 2 0.863940 0.235855 -0.087406 11.00000 -1.20000 H52B 2 0.845981 0.334180 -0.096909 11.00000 -1.20000 AFIX 0 C53 1 0.983476 0.276262 -0.003408 11.00000 0.02580 0.03535 = 0.03054 0.00802 -0.00019 -0.00440 AFIX 23 H53A 2 1.099401 0.275171 -0.029128 11.00000 -1.20000 H53B 2 0.967972 0.325413 0.020520 11.00000 -1.20000 AFIX 0 C54 1 1.066825 0.265113 0.213712 11.00000 0.02528 0.03684 = 0.02841 0.00214 0.00608 -0.00864 AFIX 43 H54 2 0.988922 0.225812 0.234832 11.00000 -1.20000 AFIX 0 C55 1 1.094063 0.327255 0.251140 11.00000 0.02586 0.04035 = 0.02787 -0.00103 0.00511 -0.00423 AFIX 43 H55 2 1.033298 0.330084 0.297208 11.00000 -1.20000 AFIX 0 CL1 3 -0.013211 -0.035112 0.079149 11.00000 0.15677 0.10403 = 0.07548 -0.00628 -0.00639 -0.01217 CL2 3 0.309568 0.020010 0.008088 10.50000 0.15712 0.08266 = 0.08605 -0.03920 0.00290 0.00111 C61 1 0.079896 0.045571 -0.001382 10.50000 0.05529 0.07401 = 0.06465 -0.02687 -0.04654 0.03815 AFIX 13 H61 2 0.045818 0.102784 0.007448 10.50000 -1.20000 AFIX 0 HKLF 4 REM SA21 IPDS2 -100DEGC REM R1 = 0.0499 for 3481 Fo > 4sig(Fo) and 0.1212 for all 8614 data REM 595 parameters refined using 0 restraints END WGHT 0.0494 0.0000 REM Instructions for potential hydrogen bonds HTAB N2 O1_$1 HTAB N4 O2_$3 HTAB C34 F1_$4 HTAB C41 Cl2_$5 EQIV $6 x-1, y, z HTAB C61 N3_$6 REM Highest difference peak 0.628, deepest hole -0.604, 1-sigma level 0.051 Q1 1 0.5000 0.0000 0.0000 10.50000 0.05 0.63 Q2 1 0.4160 -0.0151 0.0473 11.00000 0.05 0.51 Q3 1 0.1255 0.0795 -0.0492 11.00000 0.05 0.43 Q4 1 0.1176 0.0395 0.0216 11.00000 0.05 0.24 Q5 1 -0.0617 0.0264 0.0124 11.00000 0.05 0.21 Q6 1 0.7518 0.1645 0.3120 11.00000 0.05 0.17 Q7 1 0.0266 0.0818 0.0184 11.00000 0.05 0.16 Q8 1 0.2284 0.4009 -0.1578 11.00000 0.05 0.15 Q9 1 -0.1957 -0.1912 0.4500 11.00000 0.05 0.15 Q10 1 0.9830 0.1631 0.0256 11.00000 0.05 0.15 Q11 1 1.2966 0.4362 0.2986 11.00000 0.05 0.15 Q12 1 0.7318 0.2273 0.3339 11.00000 0.05 0.14 Q13 1 0.3317 0.3596 -0.1156 11.00000 0.05 0.14 Q14 1 -0.3658 -0.3047 0.3794 11.00000 0.05 0.14 Q15 1 0.8636 0.1210 0.3510 11.00000 0.05 0.14 Q16 1 0.6803 0.3810 0.3867 11.00000 0.05 0.14 Q17 1 0.7726 0.2579 0.3695 11.00000 0.05 0.14 Q18 1 1.2221 0.5628 0.2915 11.00000 0.05 0.14 Q19 1 0.7111 0.2957 0.3401 11.00000 0.05 0.14 Q20 1 0.5945 0.2773 -0.0523 11.00000 0.05 0.14 ; _shelxl_version_number 2.013 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 F F1 0.7833(3) 0.46774(11) 0.43761(10) 0.0520(6) Uani d 1 O O1 -0.2054(3) 0.00085(13) 0.53754(12) 0.0385(6) Uani d 1 N N1 0.4532(3) -0.07591(14) 0.25646(12) 0.0246(6) Uani d 1 N N2 -0.0871(3) -0.09665(15) 0.47441(13) 0.0232(6) Uani d 1 H H2N 0.009(4) -0.0712(18) 0.4712(16) 0.034(9) Uiso d 1 C C2 0.7566(4) 0.39930(19) 0.40904(18) 0.0326(8) Uani d 1 C C3 0.8092(4) 0.32282(19) 0.44942(17) 0.0346(8) Uani d 1 H H3 0.8624 0.3169 0.4965 0.042 Uiso calc 1 C C4 0.7826(4) 0.25500(19) 0.41952(16) 0.0292(8) Uani d 1 H H4 0.8186 0.2017 0.4468 0.035 Uiso calc 1 C C5 0.7046(4) 0.26184(17) 0.35058(16) 0.0239(7) Uani d 1 C C6 0.6540(4) 0.34185(18) 0.31198(16) 0.0282(7) Uani d 1 H H6 0.6013 0.3490 0.2647 0.034 Uiso calc 1 C C7 0.6794(4) 0.41019(19) 0.34164(17) 0.0321(8) Uani d 1 H H7 0.6436 0.4640 0.3154 0.039 Uiso calc 1 C C8 0.6745(4) 0.18862(17) 0.31910(15) 0.0246(7) Uani d 1 C C9 0.7798(4) 0.11402(18) 0.33780(16) 0.0301(8) Uani d 1 H H9 0.8726 0.1101 0.3715 0.036 Uiso calc 1 C C10 0.7510(4) 0.04604(18) 0.30805(16) 0.0284(7) Uani d 1 H H10 0.8233 -0.0039 0.3227 0.034 Uiso calc 1 C C11 0.6193(4) 0.04847(18) 0.25737(16) 0.0256(7) Uani d 1 C C12 0.5943(4) -0.02544(18) 0.22348(16) 0.0295(8) Uani d 1 H H12A 0.5712 -0.0061 0.1697 0.035 Uiso calc 1 H H12B 0.7057 -0.0615 0.2271 0.035 Uiso calc 1 C C13 0.2788(4) -0.03846(18) 0.23558(16) 0.0286(7) Uani d 1 H H13A 0.2746 -0.0207 0.1807 0.034 Uiso calc 1 H H13B 0.2503 0.0108 0.2588 0.034 Uiso calc 1 C C14 0.1447(4) -0.09995(18) 0.26140(15) 0.0284(7) Uani d 1 H H14A 0.1728 -0.1493 0.2383 0.034 Uiso calc 1 H H14B 0.0266 -0.0748 0.2458 0.034 Uiso calc 1 C C15 0.1482(4) -0.12460(17) 0.34640(15) 0.0234(7) Uani d 1 H H15 0.1244 -0.0730 0.3674 0.028 Uiso calc 1 C C16 0.0118(4) -0.18178(17) 0.38047(15) 0.0219(7) Uani d 1 C C17 -0.0964(4) -0.16765(17) 0.44165(15) 0.0227(7) Uani d 1 C C18 -0.2169(4) -0.06471(19) 0.51550(16) 0.0268(7) Uani d 1 C C19 -0.3732(4) -0.11199(18) 0.53351(17) 0.0303(8) Uani d 1 H H19A -0.4592 -0.0943 0.4933 0.036 Uiso calc 1 H H19B -0.4293 -0.1003 0.5808 0.036 Uiso calc 1 C C20 -0.3202(4) -0.20388(18) 0.54119(17) 0.0335(8) Uani d 1 H H20A -0.2500 -0.2233 0.5865 0.040 Uiso calc 1 H H20B -0.4263 -0.2336 0.5470 0.040 Uiso calc 1 C C21 -0.2159(4) -0.22272(18) 0.47433(15) 0.0250(7) Uani d 1 C C22 -0.2296(4) -0.29239(19) 0.44420(17) 0.0319(8) Uani d 1 H H22 -0.3118 -0.3297 0.4651 0.038 Uiso calc 1 C C23 -0.1250(4) -0.30808(19) 0.38413(17) 0.0358(8) Uani d 1 H H23 -0.1343 -0.3562 0.3640 0.043 Uiso calc 1 C C24 -0.0059(4) -0.25301(18) 0.35321(17) 0.0318(8) Uani d 1 H H24 0.0658 -0.2645 0.3120 0.038 Uiso calc 1 C C25 0.3338(4) -0.16133(18) 0.36797(16) 0.0299(8) Uani d 1 H H25A 0.3407 -0.1750 0.4231 0.036 Uiso calc 1 H H25B 0.3613 -0.2130 0.3483 0.036 Uiso calc 1 C C26 0.4679(4) -0.10162(18) 0.33715(15) 0.0280(7) Uani d 1 H H26A 0.4492 -0.0527 0.3613 0.034 Uiso calc 1 H H26B 0.5870 -0.1285 0.3489 0.034 Uiso calc 1 C C27 0.5138(4) 0.12268(18) 0.23943(16) 0.0293(8) Uani d 1 H H27 0.4217 0.1265 0.2055 0.035 Uiso calc 1 C C28 0.5396(4) 0.19087(18) 0.26978(15) 0.0264(7) Uani d 1 H H28 0.4639 0.2401 0.2567 0.032 Uiso calc 1 F F2 1.3617(3) 0.62544(12) 0.38567(11) 0.0588(6) Uani d 1 O O2 0.2877(3) 0.54027(12) -0.01363(13) 0.0377(6) Uani d 1 N N3 0.9771(3) 0.20169(14) 0.05422(13) 0.0270(6) Uani d 1 N N4 0.4096(3) 0.42911(14) -0.05795(14) 0.0229(6) Uani d 1 H H4N 0.502(4) 0.4311(17) -0.0344(15) 0.022(8) Uiso d 1 C C29 1.3188(5) 0.5689(2) 0.3462(2) 0.0410(9) Uani d 1 C C30 1.3440(4) 0.5841(2) 0.27003(19) 0.0393(9) Uani d 1 H H30 1.3864 0.6341 0.2452 0.047 Uiso calc 1 C C31 1.3064(4) 0.52515(18) 0.23002(17) 0.0319(8) Uani d 1 H H31 1.3235 0.5351 0.1773 0.038 Uiso calc 1 C C32 1.2437(4) 0.45105(18) 0.26552(16) 0.0283(7) Uani d 1 C C33 1.2175(4) 0.44066(19) 0.34284(18) 0.0362(8) Uani d 1 H H33 1.1721 0.3918 0.3684 0.043 Uiso calc 1 C C34 1.2546(5) 0.4982(2) 0.38355(19) 0.0421(9) Uani d 1 H H34 1.2362 0.4893 0.4362 0.051 Uiso calc 1 C C35 1.2088(4) 0.38639(18) 0.22319(16) 0.0273(7) Uani d 1 C C36 1.2923(4) 0.37995(18) 0.15466(16) 0.0297(8) Uani d 1 H H36 1.3708 0.4190 0.1337 0.036 Uiso calc 1 C C37 1.2634(4) 0.31827(18) 0.11671(16) 0.0299(8) Uani d 1 H H37 1.3212 0.3163 0.0699 0.036 Uiso calc 1 C C38 1.1510(4) 0.25863(18) 0.14560(16) 0.0277(7) Uani d 1 C C39 1.1252(4) 0.18953(18) 0.10479(16) 0.0300(8) Uani d 1 H H39A 1.2334 0.1787 0.0754 0.036 Uiso calc 1 H H39B 1.1117 0.1393 0.1427 0.036 Uiso calc 1 C C40 0.8066(4) 0.20082(18) 0.09254(16) 0.0281(7) Uani d 1 H H40A 0.7850 0.2494 0.1171 0.034 Uiso calc 1 H H40B 0.8058 0.1508 0.1317 0.034 Uiso calc 1 C C41 0.6633(4) 0.20212(18) 0.03805(16) 0.0298(7) Uani d 1 H H41A 0.5490 0.2004 0.0650 0.036 Uiso calc 1 H H41B 0.6834 0.1530 0.0141 0.036 Uiso calc 1 C C42 0.6609(4) 0.28031(17) -0.02180(16) 0.0256(7) Uani d 1 H H42 0.6425 0.3284 0.0045 0.031 Uiso calc 1 C C43 0.5169(4) 0.29027(17) -0.07819(16) 0.0253(7) Uani d 1 C C44 0.4001(4) 0.36189(17) -0.09489(15) 0.0221(7) Uani d 1 C C45 0.2736(4) 0.48745(18) -0.05182(16) 0.0268(7) Uani d 1 C C46 0.1135(4) 0.48381(18) -0.09304(16) 0.0298(8) Uani d 1 H H46A 0.0512 0.5397 -0.1055 0.036 Uiso calc 1 H H46B 0.0348 0.4480 -0.0608 0.036 Uiso calc 1 C C47 0.1570(4) 0.45047(18) -0.16440(16) 0.0331(8) Uani d 1 H H47A 0.0477 0.4413 -0.1870 0.040 Uiso calc 1 H H47B 0.2170 0.4913 -0.2006 0.040 Uiso calc 1 C C48 0.2733(4) 0.37045(18) -0.14847(15) 0.0244(7) Uani d 1 C C49 0.2579(4) 0.3066(2) -0.18601(17) 0.0357(8) Uani d 1 H H49 0.1688 0.3113 -0.2215 0.043 Uiso calc 1 C C50 0.3729(5) 0.2356(2) -0.17158(18) 0.0406(9) Uani d 1 H H50 0.3650 0.1922 -0.1982 0.049 Uiso calc 1 C C51 0.4987(4) 0.22842(19) -0.11845(18) 0.0365(8) Uani d 1 H H51 0.5758 0.1793 -0.1090 0.044 Uiso calc 1 C C52 0.8422(4) 0.28231(19) -0.06015(17) 0.0343(8) Uani d 1 H H52A 0.8639 0.2359 -0.0874 0.041 Uiso calc 1 H H52B 0.8460 0.3342 -0.0969 0.041 Uiso calc 1 C C53 0.9835(4) 0.27626(19) -0.00341(16) 0.0323(8) Uani d 1 H H53A 1.0994 0.2752 -0.0291 0.039 Uiso calc 1 H H53B 0.9680 0.3254 0.0205 0.039 Uiso calc 1 C C54 1.0668(4) 0.26511(19) 0.21371(16) 0.0310(8) Uani d 1 H H54 0.9889 0.2258 0.2348 0.037 Uiso calc 1 C C55 1.0941(4) 0.32725(19) 0.25114(17) 0.0321(8) Uani d 1 H H55 1.0333 0.3301 0.2972 0.039 Uiso calc 1 Cl Cl1 -0.0132(2) -0.03511(9) 0.07915(8) 0.1134(6) Uani d 1 Cl Cl2 0.3096(5) 0.02001(16) 0.00809(15) 0.1066(10) Uani d 0.5 C C61 0.0799(10) 0.0456(5) -0.0014(4) 0.065(3) Uani d 0.5 H H61 0.0458 0.1028 0.0074 0.078 Uiso calc 0.5 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 F1 0.0699(16) 0.0417(12) 0.0472(12) -0.0041(11) -0.0038(11) -0.0153(9) O1 0.0344(15) 0.0437(14) 0.0431(13) -0.0094(11) 0.0146(11) -0.0231(11) N1 0.0206(15) 0.0286(14) 0.0239(13) -0.0027(11) 0.0034(11) -0.0039(11) N2 0.0214(16) 0.0278(14) 0.0214(13) -0.0080(12) 0.0059(12) -0.0053(11) C2 0.034(2) 0.0292(18) 0.0378(19) -0.0041(15) 0.0051(16) -0.0143(15) C3 0.036(2) 0.042(2) 0.0248(17) -0.0015(17) -0.0018(15) -0.0050(15) C4 0.028(2) 0.0304(18) 0.0256(17) 0.0000(15) 0.0004(15) 0.0024(14) C5 0.0143(17) 0.0274(17) 0.0272(16) -0.0016(13) 0.0046(13) 0.0008(13) C6 0.0225(19) 0.0342(18) 0.0252(16) 0.0005(14) -0.0013(14) -0.0007(14) C7 0.031(2) 0.0285(18) 0.0326(18) 0.0009(15) 0.0026(16) 0.0016(14) C8 0.0224(18) 0.0273(17) 0.0208(16) -0.0038(14) 0.0057(14) 0.0037(13) C9 0.0227(19) 0.0321(18) 0.0326(18) -0.0013(15) -0.0010(15) 0.0007(14) C10 0.0239(19) 0.0255(17) 0.0325(18) 0.0013(14) 0.0040(15) 0.0004(14) C11 0.0199(18) 0.0294(17) 0.0252(16) -0.0046(14) 0.0067(14) 0.0008(13) C12 0.0224(19) 0.0355(18) 0.0288(17) 0.0000(15) 0.0056(14) -0.0047(14) C13 0.0276(19) 0.0342(18) 0.0224(16) -0.0037(15) 0.0004(14) -0.0008(13) C14 0.0255(19) 0.0346(18) 0.0241(16) -0.0009(15) -0.0008(14) -0.0038(13) C15 0.0262(19) 0.0217(16) 0.0221(15) -0.0038(14) 0.0021(14) -0.0036(12) C16 0.0207(18) 0.0253(16) 0.0191(15) -0.0026(13) -0.0024(13) -0.0022(13) C17 0.0220(18) 0.0223(16) 0.0234(16) -0.0012(13) -0.0049(14) -0.0028(13) C18 0.0237(19) 0.0329(18) 0.0237(16) -0.0031(15) 0.0029(14) -0.0051(14) C19 0.0236(19) 0.0388(19) 0.0290(17) -0.0057(15) 0.0076(14) -0.0076(14) C20 0.031(2) 0.0373(19) 0.0302(18) -0.0106(16) 0.0086(15) -0.0002(14) C21 0.0227(19) 0.0294(17) 0.0213(16) -0.0057(14) -0.0007(14) 0.0011(13) C22 0.030(2) 0.0321(19) 0.0339(18) -0.0129(15) -0.0029(16) -0.0012(15) C23 0.043(2) 0.0285(18) 0.039(2) -0.0099(16) -0.0018(17) -0.0094(15) C24 0.034(2) 0.0345(19) 0.0287(17) -0.0047(16) -0.0002(15) -0.0088(15) C25 0.030(2) 0.0294(17) 0.0280(17) -0.0042(15) -0.0040(15) 0.0027(13) C26 0.0262(19) 0.0284(17) 0.0261(16) -0.0036(14) -0.0007(14) 0.0041(13) C27 0.025(2) 0.0354(19) 0.0243(16) -0.0023(15) -0.0008(14) 0.0028(14) C28 0.0244(19) 0.0280(17) 0.0234(16) 0.0000(14) 0.0005(14) 0.0023(13) F2 0.0776(17) 0.0417(12) 0.0624(14) -0.0126(11) 0.0063(12) -0.0215(11) O2 0.0299(14) 0.0277(12) 0.0601(15) 0.0020(10) -0.0085(12) -0.0207(12) N3 0.0241(15) 0.0250(14) 0.0285(14) 0.0009(12) 0.0010(12) 0.0011(11) N4 0.0198(16) 0.0209(14) 0.0279(14) -0.0004(12) -0.0049(12) -0.0042(11) C29 0.043(2) 0.033(2) 0.050(2) -0.0023(17) 0.0032(18) -0.0158(17) C30 0.034(2) 0.0284(18) 0.052(2) 0.0012(16) 0.0015(18) -0.0027(17) C31 0.028(2) 0.0289(18) 0.0334(18) 0.0002(15) 0.0020(15) 0.0059(15) C32 0.0228(19) 0.0303(17) 0.0277(17) 0.0029(14) 0.0024(14) 0.0009(14) C33 0.038(2) 0.0308(18) 0.0366(19) -0.0049(16) 0.0088(16) 0.0011(15) C34 0.053(3) 0.037(2) 0.037(2) -0.0014(18) 0.0091(18) -0.0112(17) C35 0.0188(18) 0.0306(18) 0.0267(17) 0.0031(14) 0.0007(14) 0.0062(14) C36 0.026(2) 0.0289(17) 0.0308(18) -0.0031(15) 0.0048(15) 0.0016(14) C37 0.0256(19) 0.0353(19) 0.0242(16) 0.0025(15) 0.0035(14) 0.0024(14) C38 0.0176(18) 0.0297(18) 0.0310(18) 0.0027(14) -0.0036(14) 0.0048(14) C39 0.0243(19) 0.0326(18) 0.0297(17) 0.0035(15) -0.0003(15) -0.0005(14) C40 0.0236(19) 0.0277(17) 0.0290(17) -0.0023(14) 0.0038(14) 0.0038(13) C41 0.0272(19) 0.0262(17) 0.0335(17) -0.0010(14) 0.0046(15) -0.0007(13) C42 0.0259(19) 0.0174(15) 0.0327(17) 0.0014(14) -0.0017(15) -0.0045(13) C43 0.0255(19) 0.0211(16) 0.0300(17) -0.0033(14) 0.0008(14) -0.0061(13) C44 0.0225(18) 0.0248(16) 0.0197(15) -0.0058(14) 0.0053(13) -0.0050(12) C45 0.027(2) 0.0199(16) 0.0312(17) -0.0012(14) 0.0022(15) -0.0016(14) C46 0.0243(19) 0.0268(17) 0.0376(18) 0.0020(14) -0.0048(15) -0.0064(14) C47 0.031(2) 0.0364(19) 0.0283(17) -0.0003(15) -0.0059(15) 0.0025(14) C48 0.0232(19) 0.0299(17) 0.0195(15) -0.0026(14) 0.0025(14) -0.0038(13) C49 0.034(2) 0.045(2) 0.0306(18) -0.0065(17) -0.0046(16) -0.0130(16) C50 0.045(2) 0.038(2) 0.045(2) -0.0045(18) -0.0018(18) -0.0236(17) C51 0.036(2) 0.0311(19) 0.045(2) 0.0018(16) -0.0028(17) -0.0153(16) C52 0.029(2) 0.0350(19) 0.0353(19) -0.0037(15) -0.0014(16) 0.0027(14) C53 0.0258(19) 0.0354(18) 0.0305(18) -0.0044(15) -0.0002(15) 0.0080(14) C54 0.025(2) 0.0368(19) 0.0284(17) -0.0086(15) 0.0061(15) 0.0021(15) C55 0.026(2) 0.040(2) 0.0279(17) -0.0042(16) 0.0051(15) -0.0010(15) Cl1 0.1568(15) 0.1040(11) 0.0755(9) -0.0122(10) -0.0064(9) -0.0063(8) Cl2 0.157(3) 0.0827(18) 0.0861(18) 0.0011(19) 0.0029(19) -0.0392(14) C61 0.055(6) 0.074(6) 0.065(5) 0.038(5) -0.047(5) -0.027(4) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 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 C13 N1 C26 . 112.0(2) C13 N1 C12 . 113.8(2) C26 N1 C12 . 112.2(2) C18 N2 C17 . 124.3(3) C18 N2 H2N . 114(2) C17 N2 H2N . 122(2) C7 C2 F1 . 118.5(3) C7 C2 C3 . 122.7(3) F1 C2 C3 . 118.8(3) C2 C3 C4 . 117.9(3) C2 C3 H3 . 121.0 C4 C3 H3 . 121.0 C3 C4 C5 . 122.3(3) C3 C4 H4 . 118.9 C5 C4 H4 . 118.9 C4 C5 C6 . 117.0(3) C4 C5 C8 . 122.0(3) C6 C5 C8 . 121.0(3) C7 C6 C5 . 121.1(3) C7 C6 H6 . 119.4 C5 C6 H6 . 119.4 C2 C7 C6 . 118.9(3) C2 C7 H7 . 120.5 C6 C7 H7 . 120.5 C28 C8 C9 . 117.1(3) C28 C8 C5 . 121.4(3) C9 C8 C5 . 121.5(3) C10 C9 C8 . 121.1(3) C10 C9 H9 . 119.5 C8 C9 H9 . 119.5 C9 C10 C11 . 122.1(3) C9 C10 H10 . 119.0 C11 C10 H10 . 119.0 C10 C11 C27 . 116.6(3) C10 C11 C12 . 121.2(3) C27 C11 C12 . 122.2(3) N1 C12 C11 . 116.8(2) N1 C12 H12A . 108.1 C11 C12 H12A . 108.1 N1 C12 H12B . 108.1 C11 C12 H12B . 108.1 H12A C12 H12B . 107.3 N1 C13 C14 . 110.1(2) N1 C13 H13A . 109.6 C14 C13 H13A . 109.6 N1 C13 H13B . 109.6 C14 C13 H13B . 109.6 H13A C13 H13B . 108.1 C13 C14 C15 . 109.1(2) C13 C14 H14A . 109.9 C15 C14 H14A . 109.9 C13 C14 H14B . 109.9 C15 C14 H14B . 109.9 H14A C14 H14B . 108.3 C16 C15 C14 . 114.7(2) C16 C15 C25 . 111.9(2) C14 C15 C25 . 108.0(2) C16 C15 H15 . 107.3 C14 C15 H15 . 107.3 C25 C15 H15 . 107.3 C24 C16 C17 . 116.7(3) C24 C16 C15 . 120.5(3) C17 C16 C15 . 122.8(3) C21 C17 C16 . 122.0(3) C21 C17 N2 . 116.8(3) C16 C17 N2 . 121.1(3) O1 C18 N2 . 120.9(3) O1 C18 C19 . 122.0(3) N2 C18 C19 . 117.0(3) C18 C19 C20 . 110.5(3) C18 C19 H19A . 109.5 C20 C19 H19A . 109.5 C18 C19 H19B . 109.5 C20 C19 H19B . 109.5 H19A C19 H19B . 108.1 C21 C20 C19 . 111.1(2) C21 C20 H20A . 109.4 C19 C20 H20A . 109.4 C21 C20 H20B . 109.4 C19 C20 H20B . 109.4 H20A C20 H20B . 108.0 C22 C21 C17 . 118.8(3) C22 C21 C20 . 123.2(3) C17 C21 C20 . 118.0(3) C23 C22 C21 . 120.6(3) C23 C22 H22 . 119.7 C21 C22 H22 . 119.7 C22 C23 C24 . 119.6(3) C22 C23 H23 . 120.2 C24 C23 H23 . 120.2 C16 C24 C23 . 122.3(3) C16 C24 H24 . 118.8 C23 C24 H24 . 118.8 C26 C25 C15 . 111.4(2) C26 C25 H25A . 109.3 C15 C25 H25A . 109.3 C26 C25 H25B . 109.3 C15 C25 H25B . 109.3 H25A C25 H25B . 108.0 N1 C26 C25 . 110.8(2) N1 C26 H26A . 109.5 C25 C26 H26A . 109.5 N1 C26 H26B . 109.5 C25 C26 H26B . 109.5 H26A C26 H26B . 108.1 C28 C27 C11 . 121.9(3) C28 C27 H27 . 119.1 C11 C27 H27 . 119.1 C27 C28 C8 . 121.2(3) C27 C28 H28 . 119.4 C8 C28 H28 . 119.4 C40 N3 C39 . 113.9(2) C40 N3 C53 . 110.8(2) C39 N3 C53 . 112.0(2) C45 N4 C44 . 124.0(3) C45 N4 H4N . 117.3(19) C44 N4 H4N . 118.5(19) F2 C29 C30 . 118.6(3) F2 C29 C34 . 119.2(3) C30 C29 C34 . 122.2(3) C29 C30 C31 . 118.7(3) C29 C30 H30 . 120.7 C31 C30 H30 . 120.7 C30 C31 C32 . 121.6(3) C30 C31 H31 . 119.2 C32 C31 H31 . 119.2 C33 C32 C31 . 116.6(3) C33 C32 C35 . 121.6(3) C31 C32 C35 . 121.8(3) C34 C33 C32 . 122.7(3) C34 C33 H33 . 118.7 C32 C33 H33 . 118.7 C29 C34 C33 . 118.3(3) C29 C34 H34 . 120.9 C33 C34 H34 . 120.9 C36 C35 C55 . 116.5(3) C36 C35 C32 . 121.9(3) C55 C35 C32 . 121.6(3) C37 C36 C35 . 121.6(3) C37 C36 H36 . 119.2 C35 C36 H36 . 119.2 C36 C37 C38 . 121.5(3) C36 C37 H37 . 119.3 C38 C37 H37 . 119.3 C54 C38 C37 . 117.0(3) C54 C38 C39 . 121.9(3) C37 C38 C39 . 121.0(3) N3 C39 C38 . 117.5(2) N3 C39 H39A . 107.9 C38 C39 H39A . 107.9 N3 C39 H39B . 107.9 C38 C39 H39B . 107.9 H39A C39 H39B . 107.2 N3 C40 C41 . 110.7(2) N3 C40 H40A . 109.5 C41 C40 H40A . 109.5 N3 C40 H40B . 109.5 C41 C40 H40B . 109.5 H40A C40 H40B . 108.1 C40 C41 C42 . 109.9(2) C40 C41 H41A . 109.7 C42 C41 H41A . 109.7 C40 C41 H41B . 109.7 C42 C41 H41B . 109.7 H41A C41 H41B . 108.2 C43 C42 C41 . 114.7(2) C43 C42 C52 . 111.6(2) C41 C42 C52 . 108.1(2) C43 C42 H42 . 107.4 C41 C42 H42 . 107.4 C52 C42 H42 . 107.4 C51 C43 C44 . 116.4(3) C51 C43 C42 . 120.5(3) C44 C43 C42 . 123.1(3) C48 C44 C43 . 121.9(3) C48 C44 N4 . 117.2(3) C43 C44 N4 . 120.8(3) O2 C45 N4 . 120.0(3) O2 C45 C46 . 123.0(3) N4 C45 C46 . 117.0(3) C45 C46 C47 . 111.3(3) C45 C46 H46A . 109.4 C47 C46 H46A . 109.4 C45 C46 H46B . 109.4 C47 C46 H46B . 109.4 H46A C46 H46B . 108.0 C48 C47 C46 . 110.7(2) C48 C47 H47A . 109.5 C46 C47 H47A . 109.5 C48 C47 H47B . 109.5 C46 C47 H47B . 109.5 H47A C47 H47B . 108.1 C49 C48 C44 . 119.6(3) C49 C48 C47 . 122.0(3) C44 C48 C47 . 118.3(3) C48 C49 C50 . 119.8(3) C48 C49 H49 . 120.1 C50 C49 H49 . 120.1 C51 C50 C49 . 119.8(3) C51 C50 H50 . 120.1 C49 C50 H50 . 120.1 C50 C51 C43 . 122.5(3) C50 C51 H51 . 118.7 C43 C51 H51 . 118.7 C53 C52 C42 . 110.9(2) C53 C52 H52A . 109.5 C42 C52 H52A . 109.5 C53 C52 H52B . 109.5 C42 C52 H52B . 109.5 H52A C52 H52B . 108.1 N3 C53 C52 . 111.1(3) N3 C53 H53A . 109.4 C52 C53 H53A . 109.4 N3 C53 H53B . 109.4 C52 C53 H53B . 109.4 H53A C53 H53B . 108.0 C55 C54 C38 . 121.4(3) C55 C54 H54 . 119.3 C38 C54 H54 . 119.3 C54 C55 C35 . 121.9(3) C54 C55 H55 . 119.1 C35 C55 H55 . 119.1 C61 Cl1 C61 2 69.6(5) Cl1 C61 Cl2 2 112.9(5) Cl1 C61 Cl1 2 110.4(5) Cl2 C61 Cl1 . 101.8(3) Cl1 C61 H61 2 110.5 Cl2 C61 H61 . 110.5 Cl1 C61 H61 . 110.5 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance F1 C2 . 1.374(3) O1 C18 . 1.242(3) N1 C13 . 1.454(4) N1 C26 . 1.458(3) N1 C12 . 1.480(4) N2 C18 . 1.347(4) N2 C17 . 1.428(4) N2 H2N . 0.88(3) C2 C7 . 1.360(4) C2 C3 . 1.374(4) C3 C4 . 1.377(4) C3 H3 . 0.9500 C4 C5 . 1.396(4) C4 H4 . 0.9500 C5 C6 . 1.407(4) C5 C8 . 1.482(4) C6 C7 . 1.381(4) C6 H6 . 0.9500 C7 H7 . 0.9500 C8 C28 . 1.395(4) C8 C9 . 1.402(4) C9 C10 . 1.383(4) C9 H9 . 0.9500 C10 C11 . 1.392(4) C10 H10 . 0.9500 C11 C27 . 1.396(4) C11 C12 . 1.507(4) C12 H12A . 0.9900 C12 H12B . 0.9900 C13 C14 . 1.526(4) C13 H13A . 0.9900 C13 H13B . 0.9900 C14 C15 . 1.527(4) C14 H14A . 0.9900 C14 H14B . 0.9900 C15 C16 . 1.524(4) C15 C25 . 1.531(4) C15 H15 . 1.0000 C16 C24 . 1.388(4) C16 C17 . 1.403(4) C17 C21 . 1.401(4) C18 C19 . 1.497(4) C19 C20 . 1.520(4) C19 H19A . 0.9900 C19 H19B . 0.9900 C20 C21 . 1.495(4) C20 H20A . 0.9900 C20 H20B . 0.9900 C21 C22 . 1.386(4) C22 C23 . 1.379(4) C22 H22 . 0.9500 C23 C24 . 1.391(4) C23 H23 . 0.9500 C24 H24 . 0.9500 C25 C26 . 1.524(4) C25 H25A . 0.9900 C25 H25B . 0.9900 C26 H26A . 0.9900 C26 H26B . 0.9900 C27 C28 . 1.386(4) C27 H27 . 0.9500 C28 H28 . 0.9500 F2 C29 . 1.359(4) O2 C45 . 1.234(3) N3 C40 . 1.460(4) N3 C39 . 1.470(4) N3 C53 . 1.470(3) N4 C45 . 1.366(4) N4 C44 . 1.417(4) N4 H4N . 0.86(3) C29 C30 . 1.372(5) C29 C34 . 1.372(4) C30 C31 . 1.386(4) C30 H30 . 0.9500 C31 C32 . 1.403(4) C31 H31 . 0.9500 C32 C33 . 1.396(4) C32 C35 . 1.487(4) C33 C34 . 1.374(4) C33 H33 . 0.9500 C34 H34 . 0.9500 C35 C36 . 1.397(4) C35 C55 . 1.401(4) C36 C37 . 1.380(4) C36 H36 . 0.9500 C37 C38 . 1.398(4) C37 H37 . 0.9500 C38 C54 . 1.392(4) C38 C39 . 1.514(4) C39 H39A . 0.9900 C39 H39B . 0.9900 C40 C41 . 1.511(4) C40 H40A . 0.9900 C40 H40B . 0.9900 C41 C42 . 1.531(4) C41 H41A . 0.9900 C41 H41B . 0.9900 C42 C43 . 1.519(4) C42 C52 . 1.534(4) C42 H42 . 1.0000 C43 C51 . 1.391(4) C43 C44 . 1.407(4) C44 C48 . 1.388(4) C45 C46 . 1.482(4) C46 C47 . 1.518(4) C46 H46A . 0.9900 C46 H46B . 0.9900 C47 C48 . 1.510(4) C47 H47A . 0.9900 C47 H47B . 0.9900 C48 C49 . 1.383(4) C49 C50 . 1.389(4) C49 H49 . 0.9500 C50 C51 . 1.378(4) C50 H50 . 0.9500 C51 H51 . 0.9500 C52 C53 . 1.515(4) C52 H52A . 0.9900 C52 H52B . 0.9900 C53 H53A . 0.9900 C53 H53B . 0.9900 C54 C55 . 1.377(4) C54 H54 . 0.9500 C55 H55 . 0.9500 Cl1 C61 2 1.573(7) Cl1 C61 . 1.960(9) Cl2 C61 . 1.782(8) C61 Cl1 2 1.573(7) C61 H61 . 1.0000 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 N2 H2N O1 2_556 0.88(3) 1.99(3) 2.869(3) 173(3) yes N4 H4N O2 2_665 0.85(3) 2.01(3) 2.854(3) 169(3) yes C15 H15 O1 2_556 1.00 2.42 3.286(4) 145 yes C34 H34 F1 2_766 0.95 2.53 3.406(4) 154 yes C42 H42 O2 2_665 1.00 2.34 3.233(4) 148 yes C61 H61 N3 1_455 1.00 2.00 2.978(9) 164 yes C3 H3 Cg3 2_656 0.95 2.65 3.483(3) 147 yes C7 H7 Cg4 1_455 0.95 2.82 3.366(3) 117 yes C19 H19B Cg2 2_556 0.99 2.84 3.779(3) 159 yes C26 H26B Cg5 1_655 0.99 2.94 3.903(3) 165 yes C28 H28 Cg5 1_455 0.95 2.71 3.567(3) 150 yes C30 H30 Cg6 2_765 0.95 2.78 3.593(4) 144 yes C46 H46A Cg5 2_665 0.99 2.93 3.871(3) 159 yes C53 H53A Cg6 1_655 0.99 2.86 3.825(3) 166 yes C55 H55 Cg1 1_555 0.95 2.72 3.580(3) 151 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 C7 C2 C3 C4 0.3(5) F1 C2 C3 C4 -179.4(3) C2 C3 C4 C5 -0.1(5) C3 C4 C5 C6 0.2(5) C3 C4 C5 C8 -179.3(3) C4 C5 C6 C7 -0.5(4) C8 C5 C6 C7 179.0(3) F1 C2 C7 C6 179.2(3) C3 C2 C7 C6 -0.6(5) C5 C6 C7 C2 0.7(5) C4 C5 C8 C28 152.9(3) C6 C5 C8 C28 -26.6(4) C4 C5 C8 C9 -26.8(4) C6 C5 C8 C9 153.7(3) C28 C8 C9 C10 0.4(4) C5 C8 C9 C10 -179.9(3) C8 C9 C10 C11 1.3(5) C9 C10 C11 C27 -1.7(4) C9 C10 C11 C12 177.7(3) C13 N1 C12 C11 75.3(3) C26 N1 C12 C11 -53.1(3) C10 C11 C12 N1 100.2(3) C27 C11 C12 N1 -80.3(4) C26 N1 C13 C14 -60.6(3) C12 N1 C13 C14 170.9(2) N1 C13 C14 C15 61.2(3) C13 C14 C15 C16 176.2(2) C13 C14 C15 C25 -58.2(3) C14 C15 C16 C24 50.7(4) C25 C15 C16 C24 -72.8(3) C14 C15 C16 C17 -131.7(3) C25 C15 C16 C17 104.8(3) C24 C16 C17 C21 0.5(4) C15 C16 C17 C21 -177.2(3) C24 C16 C17 N2 179.3(3) C15 C16 C17 N2 1.6(4) C18 N2 C17 C21 -23.1(4) C18 N2 C17 C16 158.0(3) C17 N2 C18 O1 -174.4(3) C17 N2 C18 C19 6.1(4) O1 C18 C19 C20 -147.6(3) N2 C18 C19 C20 31.9(4) C18 C19 C20 C21 -52.3(3) C16 C17 C21 C22 -1.3(4) N2 C17 C21 C22 179.8(3) C16 C17 C21 C20 177.6(3) N2 C17 C21 C20 -1.3(4) C19 C20 C21 C22 -143.2(3) C19 C20 C21 C17 38.0(4) C17 C21 C22 C23 1.3(4) C20 C21 C22 C23 -177.5(3) C21 C22 C23 C24 -0.6(5) C17 C16 C24 C23 0.3(4) C15 C16 C24 C23 178.0(3) C22 C23 C24 C16 -0.3(5) C16 C15 C25 C26 -176.8(3) C14 C15 C25 C26 55.9(3) C13 N1 C26 C25 57.2(3) C12 N1 C26 C25 -173.5(2) C15 C25 C26 N1 -55.2(3) C10 C11 C27 C28 0.7(4) C12 C11 C27 C28 -178.8(3) C11 C27 C28 C8 0.9(5) C9 C8 C28 C27 -1.4(4) C5 C8 C28 C27 178.8(3) F2 C29 C30 C31 177.6(3) C34 C29 C30 C31 -1.3(5) C29 C30 C31 C32 0.0(5) C30 C31 C32 C33 1.4(5) C30 C31 C32 C35 -177.9(3) C31 C32 C33 C34 -1.7(5) C35 C32 C33 C34 177.7(3) F2 C29 C34 C33 -177.9(3) C30 C29 C34 C33 1.1(5) C32 C33 C34 C29 0.5(5) C33 C32 C35 C36 -155.2(3) C31 C32 C35 C36 24.1(4) C33 C32 C35 C55 23.0(4) C31 C32 C35 C55 -157.7(3) C55 C35 C36 C37 -0.2(4) C32 C35 C36 C37 178.0(3) C35 C36 C37 C38 -0.9(5) C36 C37 C38 C54 1.2(4) C36 C37 C38 C39 -177.8(3) C40 N3 C39 C38 -70.1(3) C53 N3 C39 C38 56.6(3) C54 C38 C39 N3 86.9(4) C37 C38 C39 N3 -94.1(3) C39 N3 C40 C41 -172.4(2) C53 N3 C40 C41 60.3(3) N3 C40 C41 C42 -60.4(3) C40 C41 C42 C43 -177.6(3) C40 C41 C42 C52 57.1(3) C41 C42 C43 C51 -54.7(4) C52 C42 C43 C51 68.7(4) C41 C42 C43 C44 127.7(3) C52 C42 C43 C44 -108.9(3) C51 C43 C44 C48 0.1(4) C42 C43 C44 C48 177.8(3) C51 C43 C44 N4 -178.9(3) C42 C43 C44 N4 -1.2(4) C45 N4 C44 C48 23.1(4) C45 N4 C44 C43 -157.8(3) C44 N4 C45 O2 174.1(3) C44 N4 C45 C46 -6.3(4) O2 C45 C46 C47 148.1(3) N4 C45 C46 C47 -31.5(4) C45 C46 C47 C48 51.3(3) C43 C44 C48 C49 1.2(4) N4 C44 C48 C49 -179.7(3) C43 C44 C48 C47 -178.2(3) N4 C44 C48 C47 0.9(4) C46 C47 C48 C49 143.6(3) C46 C47 C48 C44 -37.0(4) C44 C48 C49 C50 -2.1(5) C47 C48 C49 C50 177.2(3) C48 C49 C50 C51 1.8(5) C49 C50 C51 C43 -0.5(5) C44 C43 C51 C50 -0.5(5) C42 C43 C51 C50 -178.3(3) C43 C42 C52 C53 177.4(2) C41 C42 C52 C53 -55.5(3) C40 N3 C53 C52 -58.3(3) C39 N3 C53 C52 173.4(3) C42 C52 C53 N3 56.6(3) C37 C38 C54 C55 -0.4(4) C39 C38 C54 C55 178.6(3) C38 C54 C55 C35 -0.7(5) C36 C35 C55 C54 1.0(4) C32 C35 C55 C54 -177.2(3) _cod_database_fobs_code 2238972