#------------------------------------------------------------------------------ #$Date: 2016-11-09 04:05:53 +0200 (Wed, 09 Nov 2016) $ #$Revision: 188334 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/24/19/2241940.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2241940 loop_ _publ_author_name 'Tabuchi, Yohei' 'Gotoh, Kazuma' 'Ishida, Hiroyuki' _publ_section_title ; Crystal structures of hydrogen-bonded co-crystals as liquid crystal precursors: 4-(n-pentyloxy)benzoic acid--(E)-1,2-bis(pyridin-4-yl)ethene (2/1) and 4-(n-hexyloxy)benzoic acid--(E)-1,2-bis(pyridin-4-yl)ethene (2/1) ; _journal_issue 12 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first 1771 _journal_page_last 1775 _journal_paper_doi 10.1107/S2056989016017655 _journal_volume 72 _journal_year 2016 _chemical_formula_iupac '2C13 H18 O3, C12 H10 N2' _chemical_formula_moiety '2(C13 H18 O3), C12 H10 N2' _chemical_formula_sum 'C38 H46 N2 O6' _chemical_formula_weight 626.79 _chemical_name_systematic '4-(n-Hexyloxy)benzoic acid--(E)-1,2-bis(pyridin-4-yl)ethene' _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 _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _cell_angle_alpha 81.584(16) _cell_angle_beta 88.416(15) _cell_angle_gamma 67.905(15) _cell_formula_units_Z 2 _cell_length_a 9.107(3) _cell_length_b 12.020(5) _cell_length_c 16.672(6) _cell_measurement_reflns_used 15048 _cell_measurement_temperature 93.0(10) _cell_measurement_theta_max 30.00 _cell_measurement_theta_min 3.29 _cell_volume 1672.0(11) _computing_cell_refinement ; RAPID-AUTO (Rigaku, 2006) ; _computing_data_collection ; RAPID-AUTO (Rigaku, 2006) ; _computing_data_reduction ; RAPID-AUTO (Rigaku, 2006) ; _computing_molecular_graphics ; ORTEP-3 for Windows (Farrugia, 2012) ; _computing_publication_material ; CrystalStructure (Rigaku, 2010) and PLATON (Spek, 2015) ; _computing_structure_refinement ; SHELXL2014 (Sheldrick, 2015) ; _computing_structure_solution ; Il Milione (Burla et al., 2007) ; _diffrn_ambient_temperature 93(2) _diffrn_detector_area_resol_mean 10.000 _diffrn_measured_fraction_theta_full 0.997 _diffrn_measured_fraction_theta_max 0.995 _diffrn_measurement_device_type 'Rigaku R-AXIS RAPIDII' _diffrn_measurement_method \w _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength 0.71075 _diffrn_reflns_av_R_equivalents 0.0312 _diffrn_reflns_limit_h_max 11 _diffrn_reflns_limit_h_min -11 _diffrn_reflns_limit_k_max 15 _diffrn_reflns_limit_k_min -15 _diffrn_reflns_limit_l_max 21 _diffrn_reflns_limit_l_min -21 _diffrn_reflns_number 16796 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.483 _diffrn_reflns_theta_min 3.297 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 0.084 _exptl_absorpt_correction_T_max 0.994 _exptl_absorpt_correction_T_min 0.819 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (ABSCOR; Higashi, 1995) ; _exptl_crystal_colour colorless _exptl_crystal_density_diffrn 1.245 _exptl_crystal_density_method 'not measured' _exptl_crystal_description platelet _exptl_crystal_F_000 672.00 _exptl_crystal_size_max 0.55 _exptl_crystal_size_mid 0.24 _exptl_crystal_size_min 0.07 _refine_diff_density_max 0.253 _refine_diff_density_min -0.288 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.014 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 482 _refine_ls_number_reflns 7635 _refine_ls_number_restraints 24 _refine_ls_restrained_S_all 1.015 _refine_ls_R_factor_all 0.0601 _refine_ls_R_factor_gt 0.0425 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0639P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1027 _refine_ls_wR_factor_ref 0.1101 _reflns_number_gt 5611 _reflns_number_total 7635 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file hb7630sup1.cif _cod_data_source_block II _cod_original_cell_volume 1672.2(11) _cod_database_code 2241940 _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_file ; 0 0 3 547.30 9.86 0 0 -3 529.22 10.02 0 0 4 418.45 9.47 0 0 -4 403.07 9.99 0 0 5 92.95 4.55 0 0 -5 96.23 4.92 0 0 6 1445.76 27.52 0 0 -6 1431.98 27.59 0 0 7 58.37 3.58 0 0 -7 62.20 3.84 0 0 8 323.67 7.34 0 0 -8 336.45 7.81 0 0 9 211.01 5.77 0 0 -9 224.61 6.19 0 0 10 251.80 6.32 0 0 -10 248.14 6.83 0 0 11 31.32 3.07 0 0 11 41.38 4.72 0 0 -11 34.90 3.87 0 0 12 179.67 8.09 0 0 12 184.18 5.75 0 0 -12 194.00 6.58 0 0 13 53.17 5.82 0 0 13 50.84 3.58 0 0 -13 53.77 4.49 0 0 14 208.46 9.07 0 0 14 201.50 6.16 0 0 -14 207.89 7.25 0 0 15 -3.10 3.86 0 0 15 1.55 2.25 0 0 -15 2.45 2.90 0 0 16 175.84 8.90 0 0 16 162.87 3.77 0 0 -16 188.68 6.56 0 0 17 71.92 6.81 0 0 -17 68.23 4.64 0 0 18 10.14 2.90 0 0 -18 10.19 3.23 0 0 19 9.44 5.22 0 0 -19 7.80 3.09 0 0 20 29.19 3.59 0 0 -20 27.28 3.58 0 0 21 17.25 6.08 0 -1 21 -1.71 4.84 0 -1 20 13.71 5.54 0 1 -19 13.76 3.07 0 -1 19 25.64 5.54 0 1 -18 45.63 3.62 0 -1 18 35.99 3.61 0 1 -17 28.49 3.45 0 -1 17 23.94 5.50 0 1 -16 7.37 2.81 0 -1 16 8.73 2.52 0 1 -15 123.73 5.05 0 -1 15 125.87 7.34 0 1 -14 364.31 9.28 0 -1 14 351.34 12.03 0 1 -13 383.42 7.03 0 -1 13 364.16 8.55 0 1 -12 808.20 16.48 0 -1 12 788.50 19.32 0 1 -11 105.64 4.38 0 -1 11 101.07 5.87 0 1 -10 60.80 3.37 0 -1 10 52.98 2.71 0 1 -9 57.06 3.16 0 -1 9 48.26 2.57 0 1 -8 102.06 2.39 0 -1 8 91.64 3.14 0 1 -7 1.97 1.92 0 -1 7 1.97 1.57 0 -1 7 0.35 1.03 0 1 -6 163.96 4.65 0 -1 6 151.32 6.38 0 1 -5 364.01 7.59 0 -1 5 344.27 9.67 0 1 -4 1284.39 22.90 0 1 -4 1335.65 24.51 0 -1 4 1291.73 27.36 0 1 -3 148.62 2.96 0 1 -3 181.00 6.47 0 -1 3 180.74 6.54 0 1 -2 8.40 1.82 0 1 -2 5.61 1.39 0 -1 2 7.50 2.60 0 1 3 2159.54 43.68 0 -1 -3 2028.45 42.73 0 1 4 634.43 11.81 0 -1 -4 694.80 18.75 0 1 5 479.45 12.40 0 -1 -5 496.99 13.68 0 1 6 440.68 10.75 0 -1 -6 446.35 11.57 0 1 7 1430.55 28.45 0 -1 -7 1391.32 24.62 0 1 8 1512.80 30.24 0 -1 -8 1525.37 31.37 0 1 9 77.13 4.32 0 -1 -9 90.22 5.08 0 1 10 16.90 1.73 0 -1 -10 26.67 3.90 0 1 11 371.73 7.00 0 -1 -11 400.86 10.87 0 1 12 54.76 2.45 0 -1 -12 65.31 5.23 0 1 13 0.53 1.33 0 -1 -13 -1.25 1.76 0 1 14 392.51 7.57 0 -1 -14 412.78 11.78 0 1 15 6.31 2.65 0 1 15 7.42 2.91 0 -1 -15 6.76 3.66 0 1 16 314.55 8.66 0 1 16 317.65 12.01 0 -1 -16 321.05 9.68 0 1 17 14.36 3.07 0 1 17 3.28 5.17 0 -1 -17 8.64 3.69 0 1 18 2.50 2.49 0 1 18 0.35 2.48 0 -1 -18 -0.07 3.05 0 1 19 21.56 3.39 0 1 19 5.01 5.88 0 -1 -19 20.72 2.22 0 1 20 32.57 3.55 0 -1 -20 15.96 3.97 0 1 21 1.85 4.76 0 -1 -21 -0.34 2.79 0 -2 20 97.56 8.04 0 2 -19 36.41 2.56 0 2 -19 31.84 3.14 0 -2 19 45.54 6.27 0 2 -18 -0.87 1.75 0 2 -18 -0.48 2.22 0 -2 18 -0.87 2.35 0 2 -17 68.26 3.80 0 2 -17 69.77 3.17 0 -2 17 74.38 6.70 0 2 -16 28.57 2.42 0 2 -16 21.41 3.04 0 -2 16 20.89 5.09 0 2 -15 18.03 2.77 0 2 -15 17.63 2.26 0 -2 15 17.42 2.72 0 2 -14 208.86 6.15 0 -2 14 210.20 8.72 0 2 -13 1.28 2.26 0 -2 13 0.28 3.54 0 2 -12 30.66 3.01 0 -2 12 30.07 4.75 0 2 -11 61.89 3.37 0 -2 11 54.56 5.23 0 2 -10 111.67 3.81 0 -2 10 108.57 5.76 0 2 -9 156.59 4.33 0 -2 9 155.13 6.26 0 2 -8 92.14 3.41 0 -2 8 81.06 3.00 0 2 -7 11.31 2.07 0 2 -7 9.26 2.17 0 -2 7 9.28 3.34 0 2 -6 266.21 5.44 0 2 -6 276.25 5.95 0 2 -6 272.52 5.92 0 -2 6 265.40 5.47 0 2 -5 62.39 2.73 0 2 -5 68.82 3.39 0 -2 5 59.31 2.78 0 2 -4 1322.35 24.74 0 2 -4 1298.88 27.24 0 -2 4 1307.60 27.09 0 2 -3 247.22 8.78 0 2 -3 252.64 7.71 0 -2 3 242.71 5.64 0 -2 3 259.33 7.59 0 2 -2 287.54 6.25 0 2 -2 300.53 9.08 0 -2 2 304.42 9.55 0 -2 2 292.70 5.84 0 2 -1 292.14 5.83 0 2 -1 294.03 5.86 0 -2 1 311.29 9.29 0 2 0 271.49 8.96 0 -2 0 260.83 5.66 0 2 1 7461.78 199.36 0 -2 -1 7208.05 186.21 0 2 242717.67 2066.06 0 -2 -239572.87 1897.74 0 2 3 4360.87 110.14 0 -2 -3 4018.34 93.10 0 2 4 675.20 14.09 0 -2 -4 717.87 21.73 0 2 5 188.10 8.70 0 -2 -5 192.37 5.87 0 2 6 15.17 2.40 0 -2 -6 12.82 4.91 0 2 7 10.70 3.80 0 -2 -7 11.35 2.38 0 2 8 371.15 10.18 0 -2 -8 378.81 11.29 0 2 9 626.66 14.32 0 2 10 1.91 1.60 0 -2 -10 0.92 3.70 0 2 11 273.92 8.44 0 -2 -11 294.06 10.19 0 2 12 6.03 3.12 0 -2 -12 3.61 2.34 0 2 13 50.77 4.60 0 -2 -13 51.61 6.08 0 2 14 52.11 4.73 0 -2 -14 57.02 6.15 0 2 15 39.52 4.07 0 -2 -15 26.33 2.88 0 2 16 26.60 2.25 0 -2 -16 23.42 4.78 0 2 17 24.42 2.30 0 -2 -17 24.81 2.73 0 2 18 36.16 2.48 0 2 18 39.73 3.90 0 -2 -18 44.72 5.04 0 2 19 15.52 2.12 0 2 19 18.41 6.00 0 -2 -19 17.41 4.24 0 2 20 6.34 3.14 0 2 20 3.11 5.57 0 -2 -20 5.92 3.73 0 2 21 4.54 3.04 0 2 21 4.76 3.13 0 -2 -21 5.84 3.67 0 -3 20 81.28 7.69 0 -3 19 -2.37 2.64 0 3 -18 16.42 3.65 0 3 -18 20.45 2.20 0 -3 18 18.97 3.20 0 3 -17 26.60 2.33 0 3 -17 21.61 2.83 0 -3 17 35.56 5.46 0 3 -16 2.78 1.77 0 3 -16 0.28 2.13 0 -3 16 2.75 3.99 0 3 -15 183.76 5.45 0 3 -15 183.51 4.69 0 -3 15 185.51 8.57 0 3 -14 -0.54 1.64 0 3 -14 2.67 1.91 0 -3 14 -1.31 1.94 0 3 -13 6.44 2.07 0 3 -13 4.55 2.34 0 -3 13 11.82 2.32 0 3 -12 2.94 1.90 0 3 -12 1.26 2.04 0 -3 12 1.66 2.04 0 3 -11 238.92 5.90 0 3 -11 236.84 5.72 0 -3 11 241.27 8.65 0 3 -10 52.59 2.91 0 3 -10 52.12 3.09 0 3 -9 0.48 0.95 0 3 -9 0.03 1.76 0 -3 9 0.89 1.64 0 3 -8 31.81 2.60 0 3 -8 33.69 2.61 0 3 -8 32.49 3.97 0 -3 8 33.33 4.09 0 3 -7 232.22 5.46 0 3 -7 225.40 6.98 0 3 -7 233.08 5.51 0 -3 7 220.89 4.89 0 3 -6 125.12 3.56 0 3 -6 132.41 4.33 0 -3 6 124.50 3.59 0 3 -5 71.77 3.80 0 3 -5 62.48 4.79 0 -3 5 61.21 4.88 0 3 -4 8.76 3.01 0 3 -4 14.40 2.00 0 -3 4 9.34 2.95 0 -3 4 8.67 2.01 0 3 -3 459.25 11.33 0 3 -3 456.87 8.59 0 -3 3 462.85 12.07 0 -3 3 472.38 11.08 0 3 -2 103.03 6.36 0 3 -2 95.41 6.48 0 -3 2 98.05 3.59 0 3 -1 563.55 10.89 0 3 -1 594.89 11.82 0 -3 1 650.21 16.79 0 3 0 960.79 26.29 0 -3 0 963.69 25.07 0 3 1 3.70 3.63 0 -3 -1 7.41 3.44 0 3 2 1426.65 29.67 0 -3 -2 1508.78 39.11 0 3 3 290.35 14.34 0 -3 -3 298.23 8.46 0 3 4 34.59 7.01 0 -3 -4 37.18 7.38 0 3 5 433.72 13.98 0 -3 -5 456.18 14.91 0 3 6 248.01 6.42 0 -3 -6 249.72 10.60 0 3 7 39.14 5.47 0 -3 -7 46.14 6.30 0 3 8 87.62 6.38 0 -3 -8 90.62 7.38 0 3 9 870.88 20.19 0 -3 -9 886.52 17.26 0 3 10 132.19 4.25 0 -3 -10 135.26 4.88 0 3 11 14.87 4.31 0 -3 -11 20.59 3.10 0 3 12 28.63 4.90 0 -3 -12 42.62 3.65 0 3 13 5.06 2.10 0 -3 -13 8.19 2.88 0 3 14 74.27 3.39 0 -3 -14 79.15 7.55 0 3 15 36.17 4.55 0 -3 -15 36.74 5.94 0 3 16 174.11 7.67 0 -3 -16 193.56 5.88 0 3 17 70.92 5.36 0 -3 -17 65.38 6.64 0 3 18 35.71 4.54 0 -3 -18 26.92 5.45 0 3 19 57.03 5.22 0 -3 -19 60.38 5.91 0 3 20 30.85 4.16 0 3 20 43.05 4.54 0 -3 -20 36.27 3.14 0 3 21 4.25 5.83 0 3 21 5.60 3.57 0 -3 -21 5.08 4.12 0 -4 19 3.02 2.65 0 -4 18 113.23 4.92 0 4 -17 31.48 2.79 0 4 -17 32.44 2.53 0 -4 17 36.28 5.68 0 4 -16 21.10 2.73 0 4 -16 35.13 2.46 0 -4 16 20.07 5.40 0 4 -15 18.09 2.50 0 4 -15 18.92 2.33 0 -4 15 21.24 4.84 0 4 -14 62.88 3.29 0 4 -14 64.40 3.13 0 -4 14 66.07 5.92 0 4 -13 13.53 2.28 0 4 -13 15.80 2.37 0 -4 13 15.15 4.46 0 4 -12 168.63 3.45 0 4 -12 171.23 5.07 0 -4 12 163.63 7.88 0 4 -11 2.37 2.12 0 4 -11 2.87 2.15 0 -4 11 2.43 2.09 0 4 -10 48.49 3.19 0 4 -10 54.73 3.33 0 -4 10 48.78 5.15 0 4 -9 124.78 4.47 0 4 -9 129.06 6.21 0 4 -9 126.19 2.81 0 -4 9 120.37 4.01 0 4 -8 28.93 3.99 0 4 -8 23.09 1.57 0 4 -8 28.39 2.93 0 -4 8 30.73 4.17 0 4 -7 3.47 2.33 0 4 -7 4.94 3.07 0 -4 7 0.20 3.17 0 4 -6 54.92 4.45 0 4 -6 52.19 2.14 0 -4 6 46.71 4.59 0 4 -5 22.61 3.43 0 4 -5 20.99 3.89 0 -4 5 25.69 3.95 0 -4 5 19.66 1.77 0 4 -4 78.99 4.85 0 4 -4 82.74 3.11 0 -4 4 80.36 4.64 0 -4 4 82.46 5.26 0 4 -3 33.73 2.41 0 4 -3 31.39 4.47 0 -4 3 34.66 4.13 0 4 -2 6.65 3.75 0 4 -2 4.99 3.97 0 -4 2 8.40 2.04 0 4 -1 676.39 17.37 0 -4 1 694.61 17.10 0 4 0 960.32 18.44 0 -4 0 987.16 23.33 0 4 1 34.46 3.76 0 -4 -1 40.97 3.58 0 4 2 499.78 16.77 0 -4 -2 522.05 16.26 0 4 3 895.18 24.21 0 -4 -3 928.53 18.30 0 4 4 511.68 11.19 0 -4 -4 549.75 16.71 0 4 5 92.37 7.88 0 -4 -5 92.84 8.16 0 4 6 1005.85 25.39 0 -4 -6 1071.17 27.03 0 4 7 3.01 4.47 0 -4 -7 0.41 2.64 0 4 8 84.57 6.98 0 -4 -8 98.54 8.00 0 4 9 79.07 6.83 0 -4 -9 85.18 4.56 0 4 10 150.91 5.06 0 -4 -10 166.30 6.08 0 4 11 121.67 7.68 0 -4 -11 132.79 9.68 0 4 12 80.98 6.95 0 -4 -12 90.31 8.87 0 4 13 3.89 4.20 0 -4 -13 0.19 5.59 0 4 14 307.78 11.06 0 -4 -14 330.38 8.94 0 4 15 138.43 4.79 0 -4 -15 153.69 5.64 0 4 16 76.46 3.69 0 -4 -16 84.67 7.69 0 4 17 149.63 7.65 0 -4 -17 158.38 9.32 0 4 18 3.51 3.56 0 -4 -18 -0.19 2.47 0 4 19 42.93 5.31 0 -4 -19 42.83 6.17 0 4 20 30.93 4.70 0 -4 -20 20.60 3.15 0 4 21 14.78 4.23 0 -4 -21 6.27 4.75 0 -5 18 9.03 4.94 0 5 -17 0.72 1.85 0 5 -17 0.19 2.50 0 -5 17 3.12 4.18 0 5 -16 22.95 2.46 0 5 -16 18.41 2.52 0 -5 16 21.36 5.28 0 5 -15 86.95 3.64 0 5 -15 86.22 3.63 0 -5 15 93.26 6.97 0 5 -14 18.91 2.59 0 -5 14 18.86 4.89 0 5 -13 145.01 4.76 0 5 -13 142.74 3.22 0 -5 13 152.99 4.98 0 5 -12 7.57 1.40 0 5 -12 7.89 2.35 0 -5 12 10.66 2.39 0 5 -11 178.09 5.11 0 5 -11 169.24 5.42 0 5 -11 175.08 5.64 0 -5 11 173.12 8.15 0 5 -10 46.39 5.14 0 5 -10 43.50 3.55 0 5 -10 35.10 3.23 0 -5 10 40.37 5.22 0 5 -9 30.96 1.91 0 5 -9 52.45 2.86 0 5 -9 55.76 3.79 0 -5 9 49.06 5.10 0 5 -8 30.07 4.53 0 5 -8 33.73 3.66 0 -5 8 30.15 2.67 0 5 -7 23.06 2.32 0 5 -7 21.93 1.95 0 -5 7 22.37 2.40 0 5 -6 40.92 2.53 0 5 -6 33.94 3.83 0 -5 6 28.51 2.53 0 -5 6 36.59 3.49 0 5 -5 41.55 2.57 0 5 -5 45.56 4.06 0 -5 5 36.55 3.70 0 -5 5 33.29 2.68 0 5 -4 103.79 5.67 0 5 -4 94.47 5.58 0 -5 4 96.62 5.18 0 5 -3 298.34 9.08 0 5 -3 300.74 9.56 0 -5 3 309.17 6.47 0 5 -2 28.99 2.81 0 5 -2 31.24 2.53 0 -5 2 25.20 2.56 0 5 -1 93.03 7.11 0 -5 1 95.06 3.82 0 5 0 596.47 16.77 0 -5 0 600.62 11.87 0 5 1 176.97 5.75 0 -5 -1 188.08 9.15 0 5 2 997.60 25.78 0 -5 -2 1013.85 25.00 0 5 3 -1.00 2.77 0 -5 -3 -1.90 4.87 0 5 4 586.59 18.50 0 -5 -4 624.95 18.57 0 5 5 28.55 6.72 0 -5 -5 21.87 6.60 0 5 6 6.30 3.01 0 -5 -6 8.44 5.61 0 5 7 9.92 5.37 0 -5 -7 7.01 3.12 0 5 8 49.12 4.04 0 -5 -8 52.71 7.72 0 5 9 373.96 9.22 0 -5 -9 411.24 10.56 0 5 10 634.43 19.18 0 -5 -10 678.82 22.01 0 5 11 624.59 19.27 0 -5 -11 676.92 22.42 0 5 12 2.74 5.14 0 -5 -12 4.75 6.39 0 5 13 440.79 10.61 0 -5 -13 427.10 17.58 0 5 14 2.56 2.45 0 -5 -14 -1.35 5.48 0 5 15 6.78 4.57 0 -5 -15 4.78 5.70 0 5 16 116.70 7.79 0 -5 -16 129.38 9.68 0 5 17 16.23 4.87 0 -5 -17 11.25 3.39 0 5 18 11.01 4.70 0 -5 -18 11.20 5.73 0 5 19 89.24 7.06 0 -5 -19 95.42 8.13 0 5 20 -0.94 3.99 0 -5 -20 1.91 2.57 0 5 21 3.04 4.03 0 -5 -21 -0.47 4.54 0 -6 18 21.21 5.61 0 -6 17 3.34 4.56 0 6 -16 50.24 3.14 0 6 -16 58.48 3.24 0 -6 16 70.67 6.50 0 6 -15 5.48 2.18 0 6 -15 4.82 2.21 0 -6 15 7.33 4.40 0 6 -14 109.32 4.34 0 6 -14 105.50 4.38 0 -6 14 124.86 7.39 0 6 -13 21.09 2.91 0 6 -13 21.91 2.84 0 -6 13 24.81 2.89 0 6 -12 0.99 2.26 0 6 -12 -1.13 2.18 0 6 -12 3.94 2.21 0 -6 12 0.14 3.78 0 6 -11 47.56 3.72 0 6 -11 47.65 2.10 0 6 -11 56.81 5.71 0 -6 11 55.24 5.64 0 6 -10 22.55 1.81 0 6 -10 29.50 4.83 0 6 -10 21.93 3.43 0 -6 10 22.88 2.79 0 6 -9 33.39 4.11 0 6 -9 33.84 2.95 0 -6 9 32.37 5.19 0 6 -8 19.26 3.86 0 6 -8 22.78 4.60 0 -6 8 26.32 4.76 0 6 -7 86.53 5.45 0 6 -7 85.09 5.88 0 -6 7 79.71 3.77 0 6 -6 22.99 4.28 0 6 -6 21.06 2.46 0 -6 6 20.81 3.65 0 6 -5 10.29 4.10 0 6 -5 12.02 2.19 0 -6 5 12.81 3.47 0 6 -4 -2.05 3.39 0 6 -4 0.50 1.73 0 -6 4 0.89 2.90 0 6 -3 34.78 5.20 0 6 -3 30.76 2.50 0 -6 3 32.75 4.53 0 6 -2 314.01 6.53 0 6 -2 327.70 11.35 0 -6 2 319.44 7.02 0 6 -1 801.11 14.76 0 6 -1 857.67 21.88 0 -6 1 843.25 16.10 0 6 0 334.25 12.52 0 -6 0 336.11 11.57 0 6 1 146.96 9.55 0 -6 -1 152.21 5.20 0 6 2 13.19 6.07 0 -6 -2 11.50 3.01 0 6 3 12.07 3.38 0 -6 -3 12.69 5.70 0 6 4 13.90 3.57 0 -6 -4 15.70 6.10 0 6 5 50.17 7.74 0 -6 -5 47.06 7.60 0 6 6 41.18 7.42 0 -6 -6 36.61 4.22 0 6 7 109.33 9.65 0 -6 -7 114.69 10.00 0 6 8 5.09 3.22 0 -6 -8 1.63 3.36 0 6 9 6.41 3.51 0 -6 -9 5.12 6.71 0 6 10 -0.01 2.79 0 -6 -10 0.00 3.13 0 6 11 11.07 6.31 0 -6 -11 6.90 4.03 0 6 12 293.79 14.00 0 -6 -12 314.62 15.94 0 6 13 63.15 7.89 0 -6 -13 61.64 9.11 0 6 14 587.02 18.86 0 -6 -14 573.88 20.20 0 6 15 22.61 6.27 0 -6 -15 25.27 7.20 0 6 16 239.56 7.56 0 -6 -16 262.80 8.51 0 6 17 27.38 3.42 0 -6 -17 25.60 3.99 0 6 18 5.86 2.74 0 -6 -18 3.82 5.68 0 6 19 26.57 3.33 0 -6 -19 23.54 6.75 0 6 20 20.72 5.20 0 -6 -20 9.06 3.47 0 -7 17 3.05 4.67 0 -7 16 7.03 4.87 0 7 -15 18.95 2.74 0 7 -15 10.61 2.68 0 -7 15 18.71 5.15 0 7 -14 20.30 2.85 0 7 -14 19.79 2.95 0 -7 14 17.04 5.20 0 7 -13 367.93 9.39 0 7 -13 367.18 9.16 0 -7 13 408.38 9.61 0 7 -12 13.29 2.79 0 7 -12 10.14 3.08 0 7 -12 13.75 2.89 0 -7 12 11.56 4.73 0 7 -11 7.10 3.00 0 7 -11 7.68 2.75 0 7 -11 8.71 4.40 0 -7 11 8.02 4.67 0 7 -10 17.64 4.71 0 7 -10 13.43 1.93 0 -7 10 16.91 2.87 0 7 -9 152.93 4.87 0 7 -9 136.61 6.40 0 7 -8 5.88 3.85 0 7 -8 9.00 4.34 0 7 -7 4.17 2.21 0 7 -7 2.61 2.28 0 -7 7 4.83 3.24 0 7 -6 15.49 4.53 0 7 -6 10.06 4.66 0 -7 6 14.80 2.17 0 7 -5 87.65 6.11 0 7 -5 71.04 4.02 0 -7 5 87.76 5.61 0 7 -4 319.30 11.77 0 7 -4 327.98 10.53 0 -7 4 314.26 10.39 0 7 -3 42.39 6.53 0 7 -3 39.86 2.93 0 -7 3 38.56 5.46 0 7 -2 198.40 5.23 0 7 -2 209.68 10.68 0 -7 2 205.90 5.86 0 7 -1 534.50 10.58 0 7 -1 491.68 11.47 0 -7 1 527.48 15.45 0 7 0 425.25 10.40 0 -7 0 448.26 14.01 0 7 1 9.26 3.41 0 -7 -1 6.65 2.86 0 7 2 644.53 14.62 0 -7 -2 645.47 13.68 0 7 3 3.86 3.51 0 -7 -3 7.53 3.10 0 7 4 26.62 4.33 0 -7 -4 25.75 3.85 0 7 5 23.49 4.24 0 -7 -5 20.81 4.03 0 7 6 52.16 5.14 0 -7 -6 61.06 8.89 0 7 7 30.42 4.76 0 -7 -7 42.19 8.64 0 7 8 40.54 8.79 0 -7 -8 41.76 5.21 0 7 9 6.03 7.12 0 -7 -9 6.02 4.14 0 7 10 148.42 12.82 0 -7 -10 159.94 13.27 0 7 11 1528.62 42.94 0 -7 -11 1539.02 35.60 0 7 12 1372.83 38.59 0 -7 -12 1388.79 31.72 0 7 13 444.12 17.13 0 -7 -13 453.36 12.51 0 7 14 23.37 6.90 0 -7 -14 20.99 4.35 0 7 15 215.48 12.43 0 -7 -15 243.43 8.51 0 7 16 7.45 5.67 0 -7 -16 4.82 3.62 0 7 17 101.18 9.10 0 -7 -17 116.47 6.09 0 7 18 24.44 6.84 0 -7 -18 45.77 7.67 0 7 19 12.39 5.80 0 -7 -19 8.73 6.86 0 7 20 1.13 2.69 0 -7 -20 -3.86 3.15 0 -8 16 6.54 3.02 0 8 -15 -0.98 2.08 0 8 -15 1.33 2.19 0 -8 15 -0.40 2.46 0 8 -14 11.96 2.95 0 8 -14 11.92 1.62 0 -8 14 -2.13 3.00 0 8 -13 2.76 2.65 0 8 -13 6.01 4.68 0 8 -13 1.45 2.76 0 8 -12 218.52 7.08 0 8 -12 256.88 10.47 0 8 -12 227.65 7.54 0 8 -11 1.07 1.82 0 8 -11 14.90 3.52 0 8 -11 26.11 2.80 0 8 -10 9.18 4.72 0 8 -10 7.02 3.53 0 8 -9 0.67 1.85 0 8 -9 4.21 4.03 0 8 -8 7.63 3.91 0 8 -8 4.73 2.42 0 8 -7 4.77 4.15 0 8 -7 -0.99 4.06 0 -8 7 6.25 3.46 0 8 -6 65.68 3.98 0 8 -6 64.19 3.74 0 -8 6 63.11 5.62 0 8 -5 6.84 4.74 0 8 -5 2.80 4.08 0 -8 5 -0.07 2.10 0 8 -4 119.62 5.53 0 8 -4 119.01 7.49 0 -8 4 114.84 7.35 0 8 -3 101.59 4.20 0 8 -3 106.51 8.98 0 -8 3 95.98 4.44 0 8 -2 46.01 7.81 0 8 -2 37.01 5.64 0 -8 2 42.80 6.33 0 8 -1 99.02 7.07 0 8 -1 101.32 5.74 0 -8 1 124.42 8.30 0 8 0 557.11 20.65 0 -8 0 553.42 12.74 0 8 1 107.94 10.58 0 -8 -1 90.27 5.10 0 8 2 40.31 9.09 0 -8 -2 38.87 7.51 0 8 3 1.53 6.85 0 -8 -3 1.60 3.15 0 8 4 56.76 5.71 0 -8 -4 54.40 5.00 0 8 5 4.34 4.24 0 -8 -5 8.45 3.80 0 8 6 6.58 4.15 0 -8 -6 3.98 7.18 0 8 7 22.10 5.05 0 -8 -7 26.77 4.82 0 8 8 6.88 4.40 0 -8 -8 5.74 7.74 0 8 9 -0.05 3.60 0 -8 -9 0.21 3.72 0 8 10 1.03 3.79 0 -8 -10 0.78 6.98 0 8 11 4.23 3.70 0 -8 -11 5.07 7.45 0 8 12 0.84 3.31 0 -8 -12 2.15 6.61 0 8 13 4.83 3.75 0 -8 -13 10.88 4.22 0 8 14 170.86 7.20 0 -8 -14 175.28 8.16 0 8 15 2.73 3.12 0 -8 -15 -0.66 3.67 0 8 16 59.72 8.45 0 -8 -16 54.08 5.54 0 8 17 16.29 7.31 0 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111.69 7.60 0 -9 -6 120.76 12.10 0 9 7 41.86 5.83 0 -9 -7 48.86 5.61 0 9 8 36.34 10.14 0 -9 -8 46.64 9.67 0 9 9 16.77 9.27 0 -9 -9 32.57 5.09 0 9 10 -4.21 7.17 0 -9 -10 -1.41 3.88 0 9 11 160.29 13.78 0 -9 -11 191.58 13.93 0 9 12 120.55 11.85 0 -9 -12 131.42 12.47 0 9 13 223.83 14.01 0 -9 -13 224.47 9.28 0 9 14 5.67 6.92 0 -9 -14 5.47 4.23 0 9 15 4.20 3.54 0 -9 -15 0.32 3.90 0 9 16 36.54 4.67 0 -9 -16 23.93 5.11 0 9 17 17.58 4.28 0 -9 -17 13.62 4.69 0 9 18 1.76 3.57 0 -9 -18 3.57 7.01 0 10 -13 1.12 2.88 0 10 -13 -2.15 4.88 0 10 -13 2.41 1.80 0 10 -12 3.82 4.43 0 10 -12 0.19 1.64 0 10 -12 -1.85 3.01 0 10 -11 56.16 5.31 0 10 -11 58.04 7.29 0 10 -10 61.60 5.64 0 10 -10 61.06 4.20 0 10 -9 6.27 4.19 0 10 -9 5.20 5.02 0 10 -8 23.08 3.08 0 10 -8 27.26 5.90 0 10 -7 51.55 6.55 0 10 -7 50.21 3.81 0 -10 7 51.21 3.48 0 10 -6 6.46 5.00 0 10 -6 5.26 5.14 0 -10 6 7.12 4.49 0 10 -5 15.91 6.17 0 10 -5 22.67 5.65 0 -10 5 24.76 5.41 0 10 -4 335.90 8.45 0 10 -4 311.29 9.22 0 -10 4 326.03 8.71 0 10 -3 4.49 5.05 0 10 -3 5.73 6.18 0 -10 3 9.62 5.11 0 10 -2 44.01 4.64 0 10 -2 39.70 3.70 0 -10 2 41.38 6.96 0 10 -1 38.35 6.45 0 10 -1 37.57 8.61 0 -10 1 44.62 7.33 0 10 0 56.13 5.55 0 10 0 58.26 7.55 0 -10 0 63.36 8.14 0 10 1 34.27 9.16 0 -10 -1 31.61 7.73 0 10 2 107.16 12.49 0 -10 -2 126.53 10.48 0 10 3 34.47 5.58 0 -10 -3 49.39 8.51 0 10 4 41.57 10.25 0 -10 -4 44.76 5.04 0 10 5 113.75 12.94 0 -10 -5 124.17 11.66 0 10 6 212.68 9.35 0 -10 -6 228.38 14.38 0 10 7 59.50 5.98 0 -10 -7 47.77 5.78 0 10 8 72.85 12.08 0 -10 -8 90.00 11.49 0 10 9 23.31 9.46 0 -10 -9 24.54 9.19 0 10 10 0.46 7.70 0 -10 -10 4.49 4.22 0 10 11 -0.65 7.81 0 -10 -11 7.60 7.63 0 10 12 21.99 4.99 0 -10 -12 24.96 9.23 0 10 13 46.56 5.65 0 -10 -13 40.86 10.20 0 10 14 9.10 4.40 0 -10 -14 8.51 4.62 0 10 15 45.49 9.75 0 -10 -15 48.83 6.08 0 10 16 3.03 7.27 0 -10 -16 3.57 4.41 0 10 17 57.02 10.24 0 -10 -17 53.98 6.37 0 11 -11 1.24 3.02 0 11 -11 9.62 4.04 0 11 -10 -0.24 2.05 0 11 -10 0.56 4.45 0 11 -9 5.05 5.27 0 11 -9 6.56 2.60 0 11 -8 6.41 5.04 0 11 -8 15.35 5.50 0 11 -7 1.49 4.68 0 11 -7 1.30 2.71 0 -11 7 3.14 4.30 0 11 -6 58.24 7.35 0 11 -6 58.23 7.55 0 -11 6 63.17 6.90 0 11 -5 29.68 7.48 0 11 -5 47.04 6.66 0 -11 5 44.83 6.45 0 11 -4 0.75 2.77 0 11 -4 2.06 3.17 0 -11 4 1.07 4.77 0 11 -3 16.67 7.36 0 11 -3 17.72 6.17 0 -11 3 18.81 3.58 0 11 -2 121.52 7.01 0 11 -2 139.32 9.53 0 -11 2 153.67 6.39 0 11 -1 317.63 16.38 0 11 -1 328.61 13.36 0 -11 1 309.19 9.60 0 11 0 4.99 4.15 0 11 0 3.89 3.15 0 -11 0 8.40 3.56 0 11 1 47.83 10.48 0 11 1 62.57 4.76 0 -11 -1 50.41 5.14 0 11 2 3.71 4.26 0 -11 -2 4.04 6.64 0 11 3 125.25 13.62 0 -11 -3 138.58 12.31 0 11 4 491.85 15.23 0 -11 -4 497.35 14.25 0 11 5 385.95 20.76 0 -11 -5 401.98 12.47 0 11 6 164.51 15.06 0 -11 -6 148.19 14.11 0 11 7 598.22 17.89 0 -11 -7 647.14 17.51 0 11 8 5.79 4.59 0 -11 -8 -2.96 7.86 0 11 9 75.21 12.09 0 -11 -9 66.51 11.78 0 11 10 10.18 8.89 0 -11 -10 11.04 4.82 0 11 11 1.55 4.34 0 -11 -11 0.44 7.56 0 11 12 103.27 7.36 0 -11 -12 119.58 13.10 0 11 13 -0.62 7.06 0 -11 -13 1.41 7.35 0 11 14 0.15 7.50 0 -11 -14 1.72 4.37 0 11 15 -2.41 8.04 0 -11 -15 7.09 4.76 0 11 16 43.52 10.80 0 -11 -16 50.36 6.67 0 12 -9 40.11 6.63 0 12 -9 44.36 7.29 0 12 -8 2.51 5.00 0 12 -8 1.11 5.22 0 12 -7 44.37 7.23 0 12 -7 40.07 4.20 0 -12 7 50.04 6.65 0 12 -6 30.04 7.13 0 12 -6 35.21 4.04 0 -12 6 31.71 3.79 0 12 -5 9.71 6.32 0 12 -5 10.61 5.84 0 -12 5 10.48 3.20 0 12 -4 9.82 5.91 0 12 -4 9.68 3.69 0 -12 4 8.80 5.90 0 12 -3 -2.69 5.35 0 12 -3 2.56 6.14 0 -12 3 -5.48 5.50 0 12 -2 219.00 14.28 0 12 -2 228.64 7.68 0 -12 2 243.27 12.97 0 12 -1 26.90 3.83 0 12 -1 16.43 4.75 0 -12 1 17.47 7.50 0 12 0 13.36 8.11 0 12 0 12.85 6.27 0 -12 0 8.06 3.95 0 12 1 5.02 4.57 0 12 1 6.26 6.27 0 -12 -1 10.48 3.94 0 12 2 29.28 9.86 0 12 2 4.51 4.40 0 -12 -2 43.42 4.91 0 12 3 4.63 4.77 0 -12 -3 9.51 7.60 0 12 4 310.07 19.43 0 -12 -4 328.40 18.43 0 12 5 25.76 6.02 0 -12 -5 31.06 5.53 0 12 6 83.97 7.65 0 -12 -6 97.33 12.24 0 12 7 44.25 11.63 0 -12 -7 48.03 6.25 0 12 8 51.91 6.54 0 -12 -8 36.60 11.07 0 12 9 6.37 9.02 0 -12 -9 7.20 8.51 0 12 10 38.10 11.35 0 -12 -10 44.72 6.25 0 12 11 11.79 5.31 0 -12 -11 1.30 9.11 0 12 12 6.92 5.03 0 -12 -12 10.73 9.12 0 12 13 3.86 9.04 0 -12 -13 10.07 9.13 0 12 14 22.76 10.43 0 -12 -14 25.72 6.13 0 13 -6 9.95 6.20 0 13 -6 5.18 6.34 0 -13 6 5.35 5.82 0 13 -5 8.32 6.52 0 13 -5 4.98 3.39 0 -13 5 9.07 5.87 0 13 -4 1.34 2.94 0 13 -4 0.53 3.32 0 -13 4 -2.74 5.21 0 13 -3 100.20 11.57 0 13 -3 124.26 10.13 0 -13 3 112.10 10.34 0 13 -2 5.39 6.72 0 13 -2 12.52 7.90 0 -13 2 15.20 7.08 0 13 -1 2.76 3.92 0 13 -1 3.32 5.68 0 -13 1 -4.89 6.12 0 13 0 2.66 5.67 0 13 0 -0.34 7.11 0 -13 0 -1.34 6.24 0 13 1 171.67 12.14 0 13 1 179.84 15.08 0 -13 -1 172.62 13.69 0 13 2 35.54 9.45 0 13 2 50.16 6.31 0 -13 -2 41.69 5.67 0 13 3 98.88 13.68 0 -13 -3 101.37 12.40 0 13 4 30.96 6.05 0 -13 -4 20.40 9.81 0 13 5 167.38 15.92 0 -13 -5 148.14 8.94 0 13 6 171.45 10.10 0 -13 -6 198.40 16.28 0 13 7 223.01 19.02 0 -13 -7 249.61 11.06 0 13 8 26.47 11.32 0 -13 -8 27.49 10.67 0 13 9 20.42 6.25 0 -13 -9 25.43 10.38 0 13 10 103.31 15.33 0 -13 -10 101.17 8.31 0 13 11 48.16 13.18 0 -13 -11 51.53 12.53 0 13 12 53.07 7.38 0 -13 -12 50.92 12.87 0 14 -2 24.75 8.17 0 14 -2 25.61 9.72 0 -14 2 34.19 4.94 0 14 -1 44.08 8.59 0 14 -1 36.26 10.45 0 -14 1 36.03 5.41 0 14 0 84.14 10.37 0 14 0 85.78 7.33 0 -14 0 87.70 11.22 0 14 1 4.44 6.99 0 14 1 10.38 8.86 0 -14 -1 -0.83 7.84 0 14 2 2.66 6.98 0 14 2 -7.41 9.01 0 -14 -2 6.90 4.45 0 14 3 33.25 9.65 0 14 3 27.35 6.54 0 -14 -3 29.09 5.87 0 14 4 -6.95 8.98 0 14 4 3.47 4.32 0 -14 -4 1.70 7.97 0 14 5 55.27 7.99 0 -14 -5 80.15 7.35 0 14 6 20.68 11.64 0 -14 -6 17.51 10.68 0 14 7 13.62 6.49 0 -14 -7 20.99 5.94 0 14 8 37.48 12.53 0 -14 -8 28.94 11.90 1 -13 -10 26.84 6.35 -1 13 10 20.11 12.13 1 -13 -9 89.56 8.38 -1 13 9 91.43 8.87 1 -13 -8 11.03 9.50 -1 13 8 5.98 5.86 1 -13 -7 12.88 5.43 -1 13 7 8.31 10.68 1 -13 -6 6.19 9.06 -1 13 6 7.78 5.61 1 -13 -5 47.48 6.31 -1 13 5 33.15 12.71 1 -13 -4 73.65 11.84 -1 13 4 61.22 7.74 1 -13 -3 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2.24 2.81 1 -5 0 3.99 4.32 -1 5 0 1.27 4.80 1 -5 1 563.36 11.30 -1 5 -1 543.26 15.92 1 -5 2 19.09 2.60 -1 5 -2 21.41 3.78 -1 5 -2 22.94 5.12 1 -5 3 36.06 4.90 -1 5 -3 38.20 2.29 -1 5 -3 39.46 3.04 1 -5 4 13.72 3.95 -1 5 -4 17.91 3.38 -1 5 -4 14.64 4.36 1 -5 5 21.69 2.25 -1 5 -5 20.69 4.41 -1 5 -5 18.95 1.93 -1 5 -6 3.33 2.93 -1 5 -6 3.50 3.59 -1 5 -7 76.03 3.30 -1 5 -7 90.47 4.84 1 -5 8 13.88 3.83 -1 5 -8 8.82 3.90 -1 5 -8 13.47 1.95 1 -5 9 507.45 13.00 -1 5 -9 519.18 9.67 -1 5 -9 528.44 13.14 1 -5 10 446.21 9.18 -1 5 -10 484.31 12.33 -1 5 -10 470.25 9.21 -1 5 -10 463.10 8.80 1 -5 11 2.61 3.18 -1 5 -11 1.19 1.85 -1 5 -11 1.90 2.83 -1 5 -11 0.13 2.81 1 -5 12 45.26 2.88 -1 5 -12 54.42 4.14 -1 5 -12 46.22 4.03 1 -5 13 3.44 3.61 -1 5 -13 6.05 2.89 -1 5 -13 6.71 1.66 1 -5 14 3.29 3.59 -1 5 -14 4.39 2.65 -1 5 -14 2.56 2.80 1 -5 15 87.05 5.94 -1 5 -15 79.73 4.36 -1 5 -15 75.54 4.55 1 -5 16 17.93 4.55 -1 5 -16 22.19 3.13 -1 5 -16 16.48 3.17 1 -5 17 114.94 6.86 -1 5 -17 103.65 4.71 -1 5 -17 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682.71 12.92 -4 -6 -2 720.00 14.31 4 6 3 144.23 7.42 4 6 3 134.29 3.74 -4 -6 -3 150.47 8.68 4 6 4 47.37 5.83 -4 -6 -4 43.92 3.87 4 6 5 -0.40 2.14 -4 -6 -5 2.57 4.65 4 6 6 11.60 5.23 -4 -6 -6 14.68 6.39 4 6 7 583.50 12.46 -4 -6 -7 623.86 20.50 4 6 8 25.81 6.41 -4 -6 -8 38.24 8.26 4 6 9 -2.56 2.77 -4 -6 -9 1.02 6.48 4 6 10 4.31 5.32 -4 -6 -10 -0.26 6.77 4 6 11 4.79 3.21 -4 -6 -11 2.56 4.09 4 6 12 557.87 18.74 -4 -6 -12 544.40 14.51 4 6 13 12.17 3.53 -4 -6 -13 12.87 7.60 4 6 14 2.27 5.03 -4 -6 -14 -2.62 6.28 4 6 15 48.96 4.66 -4 -6 -15 60.35 5.65 4 6 16 12.07 6.41 -4 -6 -16 11.52 7.88 4 6 17 16.71 6.82 -4 -6 -17 19.73 4.54 4 6 18 146.29 6.61 -4 -6 -18 164.49 12.40 4 6 19 4.48 6.32 -4 -6 -19 7.99 7.29 4 6 20 2.91 5.66 -4 -6 -20 -1.54 6.78 -4 -7 17 30.48 9.33 -4 -7 16 19.97 8.46 -4 -7 15 54.88 9.62 -4 -7 14 21.42 8.06 -4 -7 13 229.18 13.67 -4 -7 12 315.21 14.98 4 7 -11 149.57 6.72 -4 -7 11 139.04 10.66 4 7 -10 12.28 3.63 -4 -7 10 10.39 3.48 4 7 -9 94.76 5.12 -4 -7 9 90.43 9.09 4 7 -8 11.58 0.55 4 7 -8 25.83 3.35 -4 -7 8 20.00 6.24 4 7 -7 13.05 5.69 4 7 -7 6.96 1.51 -4 -7 7 10.56 1.14 -4 -7 7 12.34 5.72 4 7 -6 44.22 6.61 4 7 -6 43.97 2.03 -4 -7 6 42.85 2.18 -4 -7 6 50.23 3.83 4 7 -5 114.42 3.61 4 7 -5 120.86 8.00 -4 -7 5 124.20 8.26 -4 -7 5 121.52 5.23 4 7 -4 23.45 2.95 4 7 -4 15.93 2.55 -4 -7 4 14.41 5.43 -4 -7 4 15.92 3.03 4 7 -3 238.88 6.63 4 7 -3 243.00 9.81 -4 -7 3 259.38 10.91 -4 -7 3 241.36 7.51 4 7 -2 191.50 8.41 4 7 -2 173.76 6.23 -4 -7 2 183.76 4.79 4 7 -1 44.18 3.17 4 7 -1 49.11 4.38 -4 -7 1 39.56 5.59 4 7 0 96.03 5.73 4 7 0 102.45 6.48 -4 -7 0 86.56 4.25 4 7 1 141.67 7.08 4 7 1 147.60 7.05 -4 -7 -1 120.55 8.60 4 7 2 231.47 6.19 4 7 2 239.24 5.76 -4 -7 -2 251.69 7.21 4 7 3 842.75 19.28 4 7 3 843.12 21.28 -4 -7 -3 866.23 24.39 4 7 4 973.07 19.33 -4 -7 -4 1064.51 28.77 4 7 5 40.27 3.69 -4 -7 -5 36.13 8.22 4 7 6 4.48 4.94 -4 -7 -6 0.08 3.44 4 7 7 187.93 6.52 -4 -7 -7 185.05 7.91 4 7 8 9.16 5.83 -4 -7 -8 3.60 7.60 4 7 9 540.14 12.99 -4 -7 -9 576.63 22.50 4 7 10 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356.69 8.85 4 10 -7 27.06 3.90 4 10 -7 32.47 7.64 -4 -10 7 31.41 3.91 4 10 -6 47.56 3.51 4 10 -6 46.80 8.05 -4 -10 6 46.87 3.62 4 10 -5 0.74 2.60 4 10 -5 -3.08 5.32 -4 -10 5 2.64 1.54 4 10 -4 3.23 5.07 4 10 -4 1.05 2.83 -4 -10 4 0.20 1.63 4 10 -3 57.64 4.26 4 10 -3 46.95 5.01 -4 -10 3 51.08 3.07 4 10 -2 40.24 3.92 4 10 -2 28.48 5.24 -4 -10 2 34.22 5.56 4 10 -1 26.48 5.67 4 10 -1 31.46 6.76 -4 -10 1 28.98 3.55 4 10 0 1.99 2.62 4 10 0 1.08 5.12 -4 -10 0 4.03 5.46 4 10 1 231.72 11.29 4 10 1 236.23 11.40 -4 -10 -1 241.71 12.97 4 10 2 14.39 6.12 4 10 2 10.57 3.16 -4 -10 -2 8.97 7.24 4 10 3 0.75 2.84 4 10 3 -1.82 2.48 -4 -10 -3 1.41 3.49 4 10 4 6.83 6.22 4 10 4 5.72 3.11 -4 -10 -4 5.40 7.89 4 10 5 185.37 7.26 -4 -10 -5 189.58 14.81 4 10 6 26.74 7.60 -4 -10 -6 21.87 5.34 4 10 7 39.83 4.75 -4 -10 -7 38.05 10.59 4 10 8 121.11 11.00 -4 -10 -8 125.87 13.59 4 10 9 168.17 7.27 -4 -10 -9 155.71 8.81 4 10 10 39.56 9.15 -4 -10 -10 49.14 6.35 4 10 11 -1.52 3.42 -4 -10 -11 1.41 4.35 4 10 12 2.47 6.29 -4 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1.87 4.74 -5 -8 2 4.00 4.14 5 8 -1 103.11 5.67 5 8 -1 119.10 4.50 -5 -8 1 117.18 7.84 5 8 0 69.65 3.81 5 8 0 72.96 5.53 -5 -8 0 77.16 7.43 5 8 1 44.90 5.37 5 8 1 45.33 5.78 -5 -8 -1 47.20 7.30 5 8 2 200.02 8.89 5 8 2 193.11 8.40 -5 -8 -2 197.46 11.46 5 8 3 101.02 7.59 5 8 3 99.35 3.92 -5 -8 -3 102.23 5.77 5 8 4 3.24 4.91 5 8 4 4.53 3.83 -5 -8 -4 6.18 6.61 5 8 5 187.22 6.43 5 8 5 198.85 8.34 -5 -8 -5 190.44 7.88 5 8 6 343.00 13.80 -5 -8 -6 343.85 11.06 5 8 7 82.67 8.74 -5 -8 -7 76.40 11.67 5 8 8 275.77 8.46 -5 -8 -8 299.26 17.45 5 8 9 234.84 12.74 -5 -8 -9 230.38 16.34 5 8 10 7.81 3.69 -5 -8 -10 13.39 8.38 5 8 11 260.70 13.54 -5 -8 -11 260.85 16.43 5 8 12 105.48 6.19 -5 -8 -12 121.06 7.44 5 8 13 5.57 6.76 -5 -8 -13 9.83 4.70 5 8 14 33.15 4.71 -5 -8 -14 33.46 5.69 5 8 15 12.01 7.32 -5 -8 -15 12.55 8.95 5 8 16 72.47 5.89 -5 -8 -16 66.39 11.94 5 8 17 1.57 7.29 -5 -8 -17 10.19 4.97 5 8 18 14.28 4.45 -5 -8 -18 15.25 9.66 5 8 19 -2.64 7.11 -5 -8 -19 -4.64 8.58 -5 -9 15 61.36 11.18 -5 -9 14 8.72 4.50 -5 -9 13 38.97 5.59 5 9 -12 8.77 4.30 -5 -9 12 7.89 4.15 5 9 -11 0.98 3.54 -5 -9 11 0.22 6.13 5 9 -10 86.62 5.87 -5 -9 10 98.54 10.05 5 9 -9 54.86 8.82 -5 -9 9 59.97 5.06 5 9 -8 2.90 5.80 5 9 -8 2.64 1.11 -5 -9 8 2.63 1.19 -5 -9 8 4.75 5.78 5 9 -7 1.04 5.29 5 9 -7 0.45 1.08 -5 -9 7 3.68 2.96 -5 -9 7 1.12 1.85 5 9 -6 -0.11 2.01 5 9 -6 -2.77 2.77 -5 -9 6 0.27 1.63 -5 -9 6 -0.25 5.34 5 9 -5 -1.14 1.77 5 9 -5 1.85 2.70 -5 -9 5 2.22 2.97 -5 -9 5 -2.37 2.10 5 9 -4 40.96 3.21 5 9 -4 36.11 3.97 -5 -9 4 37.04 4.01 5 9 -3 26.62 3.40 5 9 -3 22.21 3.47 -5 -9 3 21.12 4.39 5 9 -2 101.18 5.67 5 9 -2 112.36 8.63 -5 -9 2 102.87 7.32 5 9 -1 410.29 11.81 5 9 -1 427.59 14.30 -5 -9 1 439.87 14.77 5 9 0 46.30 5.39 5 9 0 42.93 6.66 -5 -9 0 43.49 4.12 5 9 1 132.99 7.75 5 9 1 123.26 5.00 -5 -9 -1 132.33 6.09 5 9 2 16.48 3.08 5 9 2 25.99 2.99 -5 -9 -2 14.26 4.12 5 9 3 5.44 4.65 5 9 3 7.64 2.91 -5 -9 -3 2.01 7.08 5 9 4 18.95 6.00 5 9 4 10.83 4.95 -5 -9 -4 14.77 4.56 5 9 5 163.45 8.56 5 9 5 153.54 10.45 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-10 5 68.72 4.09 5 10 -4 8.03 1.58 5 10 -4 7.14 5.85 -5 -10 4 12.08 3.23 5 10 -3 6.07 3.10 5 10 -3 5.69 5.71 -5 -10 3 9.67 3.69 5 10 -2 3.78 3.20 5 10 -2 0.67 5.02 -5 -10 2 3.00 2.23 5 10 -1 72.92 4.60 5 10 -1 71.42 5.76 -5 -10 1 83.86 7.12 5 10 0 1.93 4.09 5 10 0 4.50 2.90 -5 -10 0 1.17 5.27 5 10 1 545.53 16.31 5 10 1 560.88 12.56 -5 -10 -1 580.25 19.71 5 10 2 85.32 4.38 5 10 2 79.21 4.50 -5 -10 -2 73.84 9.98 5 10 3 10.17 5.04 5 10 3 5.95 3.04 -5 -10 -3 8.99 7.26 5 10 4 0.79 5.01 5 10 4 -3.35 4.41 -5 -10 -4 -1.11 3.72 5 10 5 69.48 6.80 5 10 5 68.34 8.34 -5 -10 -5 66.29 10.72 5 10 6 4.36 3.19 5 10 6 1.17 2.62 -5 -10 -6 2.80 4.02 5 10 7 400.80 16.45 -5 -10 -7 403.80 19.98 5 10 8 -2.34 3.51 -5 -10 -8 -7.05 7.84 5 10 9 177.36 12.39 -5 -10 -9 167.59 15.22 5 10 10 93.92 10.34 -5 -10 -10 79.95 7.35 5 10 11 2.25 3.55 -5 -10 -11 -0.50 4.50 5 10 12 20.37 7.95 -5 -10 -12 20.89 5.80 5 10 13 7.98 7.41 -5 -10 -13 11.20 5.38 5 10 14 4.39 3.80 -5 -10 -14 -5.56 8.86 5 10 15 25.68 9.02 -5 -10 -15 36.16 11.34 5 10 16 20.67 4.99 -5 -10 -16 16.32 11.09 5 10 17 11.63 8.33 -5 -10 -17 9.14 10.69 5 11 -12 107.21 7.35 -5 -11 12 105.00 7.90 5 11 -11 4.90 4.36 -5 -11 11 12.03 4.84 5 11 -10 10.12 3.97 -5 -11 10 -3.79 4.43 5 11 -9 37.74 5.21 5 11 -8 53.27 5.05 5 11 -8 44.67 2.30 -5 -11 8 39.23 2.29 5 11 -7 1.81 1.94 5 11 -7 6.87 3.67 -5 -11 7 5.33 2.06 5 11 -6 4.32 2.31 5 11 -6 4.55 3.56 -5 -11 6 7.02 2.51 5 11 -5 5.23 2.55 5 11 -5 2.49 3.43 -5 -11 5 3.29 2.78 5 11 -4 2.01 1.67 5 11 -4 8.14 3.38 -5 -11 4 7.28 1.83 5 11 -3 115.56 5.99 5 11 -3 123.04 5.98 -5 -11 3 129.71 6.68 5 11 -2 60.29 4.51 5 11 -2 53.73 5.05 -5 -11 2 47.15 5.86 5 11 -1 0.53 2.79 5 11 -1 0.54 3.55 -5 -11 1 1.49 4.25 5 11 0 99.34 7.00 5 11 0 94.33 5.23 -5 -11 0 92.52 8.15 5 11 1 132.58 4.99 5 11 1 123.18 5.67 -5 -11 -1 125.17 9.46 5 11 2 32.96 3.72 5 11 2 35.61 3.88 -5 -11 -2 48.48 7.79 5 11 3 41.06 3.88 5 11 3 44.79 7.02 -5 -11 -3 40.38 8.75 5 11 4 221.22 11.91 5 11 4 225.37 6.93 -5 -11 -4 245.90 8.95 5 11 5 10.24 3.18 5 11 5 13.35 3.67 -5 -11 -5 12.89 8.00 5 11 6 2.16 6.06 5 11 6 2.50 2.96 -5 -11 -6 3.12 4.13 5 11 7 3.17 6.31 -5 -11 -7 1.70 7.87 5 11 8 4.38 3.70 -5 -11 -8 3.02 4.63 5 11 9 14.55 7.70 -5 -11 -9 11.34 5.42 5 11 10 2.25 3.72 -5 -11 -10 0.92 4.72 5 11 11 4.78 7.56 -5 -11 -11 13.47 9.69 5 11 12 77.33 6.33 -5 -11 -12 74.99 13.87 5 11 13 6.97 7.87 -5 -11 -13 9.38 9.96 5 11 14 38.83 5.44 -5 -11 -14 38.00 12.35 5 11 15 10.24 8.67 -5 -11 -15 16.57 6.27 5 11 16 52.44 6.10 -5 -11 -16 46.85 7.88 5 12 -10 53.06 10.39 5 12 -9 4.51 4.16 5 12 -8 2.13 3.70 5 12 -7 22.10 2.74 5 12 -7 29.47 4.67 -5 -12 7 19.09 2.71 5 12 -6 5.30 1.49 5 12 -6 9.21 3.79 -5 -12 6 6.32 2.77 5 12 -5 61.33 4.37 5 12 -5 75.88 5.63 -5 -12 5 72.66 4.82 5 12 -4 5.03 3.16 5 12 -4 6.05 3.62 -5 -12 4 6.47 3.54 5 12 -3 0.07 3.15 5 12 -3 0.24 3.30 -5 -12 3 3.89 3.57 5 12 -2 43.44 4.53 5 12 -2 35.72 2.93 -5 -12 2 46.70 5.68 5 12 -1 229.63 7.82 5 12 -1 213.73 6.16 -5 -12 1 221.75 6.86 5 12 0 20.18 5.64 5 12 0 30.56 4.18 -5 -12 0 29.01 3.71 5 12 1 165.20 9.32 5 12 1 167.97 6.73 -5 -12 -1 171.37 6.70 5 12 2 2.60 5.08 5 12 2 1.75 3.12 -5 -12 -2 2.59 3.31 5 12 3 128.33 5.96 5 12 3 126.55 9.84 -5 -12 -3 129.47 11.32 5 12 4 35.04 4.23 5 12 4 25.26 7.17 -5 -12 -4 24.07 8.91 5 12 5 11.12 6.18 5 12 5 3.99 6.75 -5 -12 -5 13.76 4.58 5 12 6 0.32 5.92 5 12 6 5.22 6.39 -5 -12 -6 3.97 7.88 5 12 7 -3.27 3.52 5 12 7 3.78 3.17 -5 -12 -7 1.85 7.68 5 12 8 4.95 7.56 -5 -12 -8 11.01 5.14 5 12 9 139.71 7.63 -5 -12 -9 177.55 15.76 5 12 10 26.54 8.99 -5 -12 -10 22.06 11.25 5 12 11 54.89 5.97 -5 -12 -11 43.61 12.87 5 12 12 71.48 11.64 -5 -12 -12 88.08 8.20 5 12 13 11.71 4.99 -5 -12 -13 17.91 6.19 5 12 14 -1.01 7.30 -5 -12 -14 -0.21 5.06 5 12 15 48.79 6.16 -5 -12 -15 43.48 8.15 5 13 -9 44.85 10.33 5 13 -8 36.89 9.59 5 13 -7 -0.63 2.22 5 13 -7 8.03 6.43 5 13 -6 1.00 2.60 5 13 -6 0.83 3.62 -5 -13 6 1.53 2.77 5 13 -5 36.31 4.01 5 13 -5 39.11 5.15 -5 -13 5 39.27 4.55 5 13 -4 17.90 2.26 5 13 -4 16.17 4.31 -5 -13 4 13.71 4.37 5 13 -3 0.99 3.55 5 13 -3 3.57 3.55 -5 -13 3 1.00 3.79 5 13 -2 14.08 4.03 5 13 -2 16.63 4.58 -5 -13 2 9.96 2.78 5 13 -1 26.42 4.45 5 13 -1 19.71 5.39 -5 -13 1 22.62 5.98 5 13 0 7.58 5.08 5 13 0 9.00 3.85 -5 -13 0 7.88 5.57 5 13 1 6.79 3.04 5 13 1 7.78 3.71 -5 -13 -1 6.67 6.06 5 13 2 4.26 3.03 5 13 2 4.23 6.35 -5 -13 -2 7.10 6.39 5 13 3 69.84 9.23 5 13 3 79.63 8.39 -5 -13 -3 67.81 5.90 5 13 4 9.99 6.89 5 13 4 12.42 6.82 -5 -13 -4 16.31 7.97 5 13 5 1.12 3.33 5 13 5 -0.82 5.85 -5 -13 -5 3.21 6.96 5 13 6 98.32 5.92 5 13 6 90.18 10.72 -5 -13 -6 111.06 12.58 5 13 7 27.69 8.85 5 13 7 33.29 4.86 -5 -13 -7 24.81 5.83 5 13 8 4.14 4.01 5 13 8 2.20 3.89 -5 -13 -8 2.82 8.66 5 13 9 1.73 6.98 -5 -13 -9 0.30 4.75 5 13 10 8.54 4.52 -5 -13 -10 4.44 5.48 5 13 11 17.76 9.21 -5 -13 -11 20.97 11.56 5 13 12 2.47 4.49 -5 -13 -12 5.96 10.10 5 13 13 3.46 8.05 -5 -13 -13 0.16 10.22 5 13 14 0.07 4.28 -5 -13 -14 -3.70 9.93 5 14 -6 8.10 3.18 5 14 -6 10.87 7.90 -5 -14 6 5.71 3.28 5 14 -5 47.73 3.03 5 14 -5 75.96 5.97 -5 -14 5 51.08 5.37 5 14 -4 12.78 4.07 5 14 -4 9.06 4.41 -5 -14 4 8.70 2.51 5 14 -3 46.55 5.58 5 14 -3 45.20 5.43 -5 -14 3 40.59 5.96 5 14 -2 29.30 4.61 5 14 -2 12.99 5.22 -5 -14 2 17.63 5.56 5 14 -1 16.70 8.34 5 14 -1 16.85 5.69 -5 -14 1 27.28 3.48 5 14 0 25.89 6.07 5 14 0 22.29 8.50 -5 -14 0 25.73 3.89 5 14 1 97.22 8.76 5 14 1 107.75 11.16 -5 -14 -1 100.47 5.74 5 14 2 3.34 3.09 5 14 2 1.73 6.80 -5 -14 -2 3.98 6.31 5 14 3 46.28 4.72 5 14 3 52.67 5.22 -5 -14 -3 33.06 9.30 5 14 4 19.90 4.41 5 14 4 17.38 7.10 -5 -14 -4 6.50 4.69 5 14 5 2.69 6.43 5 14 5 3.39 6.56 -5 -14 -5 -0.71 7.56 5 14 6 3.84 4.10 5 14 6 5.61 6.98 -5 -14 -6 6.97 8.44 5 14 7 82.50 10.76 5 14 7 100.84 11.47 -5 -14 -7 81.69 13.01 5 14 8 67.17 10.46 5 14 8 47.24 5.96 -5 -14 -8 39.74 6.81 5 14 9 34.89 5.45 5 14 9 1.62 5.07 -5 -14 -9 29.27 10.94 -5 -14 -10 6.30 10.13 5 14 11 6.98 5.15 -5 -14 -11 11.84 6.09 5 14 12 24.11 11.16 -5 -14 -12 47.16 7.55 5 15 -2 157.13 13.40 5 15 -2 139.10 9.03 -5 -15 2 150.62 9.82 5 15 -1 2.69 7.87 5 15 -1 6.43 5.18 -5 -15 1 5.95 5.64 5 15 0 3.80 6.85 5 15 0 0.26 4.75 -5 -15 0 -3.70 5.17 5 15 1 50.67 7.80 5 15 1 55.11 5.94 -5 -15 -1 49.03 8.61 5 15 2 11.93 3.77 5 15 2 14.31 4.80 -5 -15 -2 17.67 7.52 5 15 3 49.17 5.16 5 15 3 47.22 10.36 -5 -15 -3 60.30 5.63 5 15 4 8.67 7.00 5 15 4 5.38 7.91 -5 -15 -4 11.37 8.16 5 15 5 124.32 12.53 5 15 5 101.85 11.71 -5 -15 -5 113.16 13.50 5 15 6 0.19 4.07 5 15 6 4.47 4.19 -5 -15 -6 4.77 4.67 5 15 7 9.73 4.95 5 15 7 12.14 8.40 -5 -15 -7 12.12 9.92 5 15 8 0.51 8.32 5 15 8 8.62 7.71 -5 -15 -8 1.14 9.70 6 -9 -7 -0.07 7.25 -6 9 7 3.99 9.06 6 -9 -6 3.03 8.10 -6 9 6 7.58 5.40 6 -9 -5 17.97 5.29 -6 9 5 24.35 6.26 6 -9 -4 -1.69 7.56 -6 9 4 -1.89 9.21 6 -9 -3 57.23 6.44 -6 9 3 57.52 7.66 6 -9 -2 93.92 12.02 -6 9 2 62.68 14.30 6 -9 -1 81.50 7.16 -6 9 1 74.30 14.18 -6 9 0 27.89 2.81 -6 9 0 22.49 11.57 -6 9 -1 7.57 8.79 -6 9 -1 1.03 3.08 -6 9 -2 0.97 2.61 -6 9 -2 -6.38 8.12 6 -8 -10 56.36 9.25 -6 8 10 24.27 11.24 6 -8 -9 71.97 10.15 -6 8 9 73.83 12.48 6 -8 -8 1.64 3.64 -6 8 8 -2.40 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161.01 6.58 -6 -7 0 152.67 8.31 6 7 1 43.64 2.79 6 7 1 40.98 2.84 -6 -7 -1 42.64 3.56 6 7 2 0.67 2.93 6 7 2 -1.61 3.64 -6 -7 -2 -0.68 4.60 6 7 3 86.59 7.01 6 7 3 90.72 5.36 -6 -7 -3 90.50 8.75 6 7 4 130.66 3.70 6 7 4 142.91 8.39 -6 -7 -4 123.09 6.06 6 7 5 254.55 7.80 6 7 5 260.57 11.61 -6 -7 -5 274.30 8.71 6 7 6 304.67 8.46 6 7 6 308.54 13.33 -6 -7 -6 314.74 10.07 6 7 7 43.82 2.47 6 7 7 49.96 4.62 -6 -7 -7 61.38 5.56 6 7 8 1139.44 25.25 -6 -7 -8 1155.44 26.72 6 7 9 69.53 9.22 -6 -7 -9 77.89 6.31 6 7 10 148.55 10.91 -6 -7 -10 139.12 7.44 6 7 11 37.27 4.61 -6 -7 -11 40.57 9.51 6 7 12 29.84 7.61 -6 -7 -12 25.61 8.95 6 7 13 4.78 6.56 -6 -7 -13 5.01 4.30 6 7 14 43.16 4.92 -6 -7 -14 35.41 5.59 -6 -7 -15 7.30 7.99 6 7 16 89.41 6.22 -6 -7 -16 74.64 6.95 6 7 17 11.10 7.35 -6 -7 -17 4.56 8.62 6 7 18 2.64 4.04 -6 -7 -18 4.89 8.58 -6 -8 15 17.39 5.28 -6 -8 14 18.92 5.06 -6 -8 13 0.37 3.67 -6 -8 12 87.41 10.81 -6 -8 11 -3.39 6.64 6 8 -10 36.19 4.82 -6 -8 10 34.46 8.27 6 8 -9 8.11 3.66 -6 -8 9 7.29 3.62 6 8 -8 -2.24 5.34 -6 -8 8 -1.44 5.58 6 8 -7 15.56 6.07 -6 -8 7 11.39 1.42 -6 -8 7 12.70 3.50 6 8 -6 2.50 5.23 6 8 -6 4.24 1.12 -6 -8 6 4.66 1.60 -6 -8 6 5.67 5.41 6 8 -5 133.59 8.89 -6 -8 5 120.28 5.56 -6 -8 5 129.54 4.56 6 8 -4 197.23 4.92 6 8 -4 216.32 10.38 -6 -8 4 204.53 6.69 -6 -8 4 219.40 7.08 6 8 -3 1.10 4.15 6 8 -3 -0.20 1.14 -6 -8 3 -0.19 2.56 -6 -8 3 -0.43 3.21 6 8 -2 83.56 6.99 6 8 -2 74.99 4.32 -6 -8 2 76.24 3.79 6 8 -1 308.41 10.91 6 8 -1 291.34 8.58 -6 -8 1 304.45 11.39 6 8 0 45.85 4.70 6 8 0 40.58 3.34 -6 -8 0 39.62 6.61 6 8 1 33.46 2.91 6 8 1 38.87 3.01 -6 -8 -1 35.74 3.92 6 8 2 84.01 3.93 6 8 2 79.75 6.06 -6 -8 -2 80.98 9.11 6 8 3 0.57 2.40 6 8 3 1.70 3.57 -6 -8 -3 2.24 3.25 6 8 4 54.37 3.93 6 8 4 56.26 5.19 -6 -8 -4 59.10 8.91 6 8 5 8.39 3.06 6 8 5 5.83 2.13 -6 -8 -5 4.73 3.92 6 8 6 165.04 6.49 6 8 6 167.79 7.12 -6 -8 -6 169.09 7.84 6 8 7 48.04 7.98 6 8 7 44.45 4.78 -6 -8 -7 45.51 5.55 6 8 8 998.79 28.79 -6 -8 -8 997.13 23.68 6 8 9 137.45 6.62 -6 -8 -9 139.19 7.49 6 8 10 917.18 27.25 -6 -8 -10 885.20 21.55 6 8 11 14.51 7.44 -6 -8 -11 16.97 4.74 6 8 12 18.57 4.37 -6 -8 -12 23.35 9.00 6 8 13 115.85 11.19 -6 -8 -13 124.16 13.04 6 8 14 1.37 3.47 -6 -8 -14 -1.09 7.70 6 8 15 1.63 6.76 -6 -8 -15 3.95 4.63 6 8 16 10.08 7.68 -6 -8 -16 9.47 9.60 6 8 17 18.63 8.49 -6 -8 -17 17.50 10.31 6 8 18 12.49 8.57 -6 -8 -18 18.40 5.74 -6 -9 14 2.95 7.63 -6 -9 13 4.82 7.70 -6 -9 12 33.93 9.09 6 9 -11 2.96 4.17 -6 -9 11 10.60 4.11 6 9 -10 63.13 5.55 -6 -9 10 52.95 5.53 6 9 -9 0.73 5.87 -6 -9 9 -4.66 6.14 6 9 -8 1.61 5.48 -6 -9 8 0.29 3.10 6 9 -7 26.91 7.06 6 9 -7 24.07 1.65 -6 -9 7 20.76 1.55 -6 -9 7 7.74 7.16 6 9 -6 7.61 5.90 6 9 -6 6.70 1.39 -6 -9 6 4.97 3.35 -6 -9 6 6.54 1.79 6 9 -5 1.01 4.86 6 9 -5 0.75 1.53 -6 -9 5 0.80 5.20 -6 -9 5 -0.17 2.08 6 9 -4 3.66 4.99 6 9 -4 3.15 1.95 -6 -9 4 1.19 3.01 -6 -9 4 -1.15 2.67 6 9 -3 124.60 4.76 6 9 -3 127.67 8.87 -6 -9 3 133.15 6.52 6 9 -2 482.47 11.44 6 9 -2 524.75 16.05 -6 -9 2 515.64 14.67 6 9 -1 3.36 3.18 6 9 -1 1.17 4.87 -6 -9 1 5.61 4.70 6 9 0 5.61 3.69 6 9 0 3.71 4.75 -6 -9 0 11.03 5.40 6 9 1 2.51 3.78 6 9 1 3.52 4.37 -6 -9 -1 0.81 5.55 6 9 2 321.57 11.40 6 9 2 334.50 7.88 -6 -9 -2 325.17 9.65 6 9 3 2.72 4.81 6 9 3 7.24 2.48 -6 -9 -3 7.03 6.87 6 9 4 246.80 11.17 6 9 4 247.00 6.20 -6 -9 -4 261.10 14.44 6 9 5 41.78 6.95 6 9 5 34.40 5.27 -6 -9 -5 35.76 9.18 6 9 6 162.08 6.39 6 9 6 168.51 7.89 -6 -9 -6 166.39 7.88 6 9 7 133.21 6.34 6 9 7 149.64 7.38 -6 -9 -7 157.83 7.79 6 9 8 642.13 21.47 -6 -9 -8 668.41 17.37 6 9 9 1.69 6.28 -6 -9 -9 4.01 4.34 6 9 10 117.18 6.41 -6 -9 -10 123.36 7.77 6 9 11 24.84 8.32 -6 -9 -11 41.44 5.81 6 9 12 22.49 4.50 -6 -9 -12 20.33 5.53 6 9 13 0.45 6.44 -6 -9 -13 1.67 4.37 6 9 14 3.49 7.32 -6 -9 -14 8.61 8.93 6 9 15 10.83 4.56 -6 -9 -15 4.85 9.54 6 9 16 14.56 7.98 -6 -9 -16 7.14 10.03 6 9 17 62.88 6.33 -6 -9 -17 57.42 7.55 -6 -10 13 4.13 4.45 -6 -10 12 6.35 4.48 6 10 -11 -2.10 6.94 -6 -10 11 5.31 6.87 6 10 -10 58.93 9.50 -6 -10 10 38.12 9.42 6 10 -9 4.14 5.98 -6 -10 9 -0.20 3.47 6 10 -8 13.76 6.71 6 10 -8 8.27 1.11 -6 -10 8 6.00 6.95 6 10 -7 8.67 3.53 6 10 -7 5.45 1.22 -6 -10 7 7.55 3.81 -6 -10 7 4.60 1.41 6 10 -6 34.04 4.33 6 10 -6 32.59 2.08 -6 -10 6 26.79 3.60 6 10 -5 162.75 4.57 6 10 -5 174.45 6.75 -6 -10 5 153.12 5.40 6 10 -4 8.50 2.42 6 10 -4 10.90 3.34 -6 -10 4 7.42 3.15 6 10 -3 168.51 5.71 6 10 -3 183.80 6.59 -6 -10 3 175.22 4.72 6 10 -2 32.58 3.74 6 10 -2 30.46 3.79 -6 -10 2 32.71 5.12 6 10 -1 6.53 3.54 6 10 -1 11.16 3.15 -6 -10 1 8.46 2.71 6 10 0 -2.23 3.28 6 10 0 1.07 2.44 -6 -10 0 1.46 2.47 6 10 1 179.07 9.50 6 10 1 176.12 5.26 -6 -10 -1 171.05 6.50 6 10 2 104.76 4.46 6 10 2 108.44 7.94 -6 -10 -2 107.22 5.66 6 10 3 75.83 7.26 6 10 3 89.75 7.20 -6 -10 -3 87.09 9.56 6 10 4 -1.56 4.74 6 10 4 -0.74 4.23 -6 -10 -4 -1.64 3.44 6 10 5 312.48 13.16 6 10 5 313.38 11.44 -6 -10 -5 311.97 16.44 6 10 6 264.86 13.22 6 10 6 288.58 10.79 -6 -10 -6 279.64 10.16 6 10 7 149.18 6.59 6 10 7 153.21 8.14 -6 -10 -7 144.79 8.15 6 10 8 91.57 9.91 6 10 8 96.91 4.43 -6 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56.94 4.22 6 11 1 8.10 2.47 6 11 1 9.15 5.59 -6 -11 -1 9.04 3.29 6 11 2 3.68 2.57 6 11 2 3.11 5.25 -6 -11 -2 7.27 5.96 6 11 3 77.78 7.37 6 11 3 70.89 7.77 -6 -11 -3 84.06 9.62 6 11 4 27.94 6.53 6 11 4 25.37 6.18 -6 -11 -4 35.04 4.88 6 11 5 45.65 7.25 6 11 5 28.10 6.31 -6 -11 -5 27.84 9.37 6 11 6 121.68 5.98 6 11 6 97.61 4.90 -6 -11 -6 120.77 7.41 6 11 7 218.75 8.20 6 11 7 203.02 6.49 -6 -11 -7 237.63 15.96 6 11 8 117.37 11.54 6 11 8 142.23 5.77 -6 -11 -8 142.93 14.46 6 11 9 33.56 7.21 6 11 9 -0.78 3.06 -6 -11 -9 31.10 9.17 6 11 10 77.95 5.98 -6 -11 -10 73.87 7.44 6 11 11 -0.28 6.81 -6 -11 -11 3.46 4.71 6 11 12 42.09 5.59 -6 -11 -12 49.94 6.80 6 11 13 -1.82 7.50 -6 -11 -13 -5.60 5.23 6 11 14 31.41 5.50 -6 -11 -14 19.64 11.95 6 11 15 2.50 7.93 -6 -11 -15 6.91 10.24 6 11 16 30.79 5.79 -6 -11 -16 15.92 13.01 6 12 -10 -3.82 7.49 6 12 -9 0.41 6.46 6 12 -8 1.04 3.78 6 12 -7 8.54 4.12 6 12 -6 17.90 2.45 6 12 -6 21.53 4.42 -6 -12 6 20.93 2.92 6 12 -5 -0.54 2.20 6 12 -5 -2.59 3.39 -6 -12 5 -0.73 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170.93 10.67 7 7 4 14.73 3.23 -7 -7 -4 13.17 6.81 7 7 5 39.58 3.74 7 7 5 43.72 7.01 -7 -7 -5 39.73 8.40 7 7 6 642.39 20.50 7 7 6 664.67 14.06 -7 -7 -6 645.77 22.58 7 7 7 1601.30 33.12 7 7 7 1587.44 41.73 -7 -7 -7 1613.17 44.46 7 7 8 372.90 8.51 -7 -7 -8 358.26 16.71 7 7 9 2.85 2.24 7 7 9 2.26 5.97 -7 -7 -9 4.84 6.61 7 7 10 9.12 2.47 7 7 10 13.31 3.76 -7 -7 -10 8.08 4.24 7 7 11 0.63 2.36 7 7 11 7.38 3.51 -7 -7 -11 3.67 3.95 7 7 12 0.28 1.32 7 7 12 18.23 6.35 -7 -7 -12 18.75 7.06 7 7 13 5.52 7.03 -7 -7 -13 3.58 7.79 7 7 14 -0.67 3.84 -7 -7 -14 6.62 4.32 7 7 15 95.46 11.46 -7 -7 -15 96.53 12.86 7 7 16 -6.38 6.69 -7 -7 -16 3.81 4.31 7 7 17 71.47 6.67 -7 -7 -17 84.00 12.93 -7 -8 14 39.54 5.79 -7 -8 13 2.20 4.05 -7 -8 12 34.10 5.28 -7 -8 11 73.01 10.28 -7 -8 10 63.24 9.62 -7 -8 9 38.50 8.18 7 8 -8 20.43 7.02 -7 -8 8 18.39 3.98 7 8 -7 11.61 3.33 -7 -8 7 7.19 0.80 -7 -8 7 6.88 6.03 -7 -8 7 6.73 1.05 7 8 -6 41.36 3.94 -7 -8 6 36.70 2.46 -7 -8 6 43.09 4.13 7 8 -5 213.96 6.64 -7 -8 5 202.94 6.76 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5.86 -10 -8 5 172.00 5.41 -10 -8 5 199.51 10.35 -10 -8 5 180.44 6.30 -10 -8 4 80.18 4.28 -10 -8 4 89.66 5.05 -10 -8 4 92.31 7.53 -10 -8 3 3.33 3.38 -10 -8 3 5.32 2.69 -10 -8 2 13.76 4.17 -10 -8 1 241.24 9.64 -10 -8 0 23.73 5.39 10 8 1 1.95 1.69 -10 -8 -1 -0.37 4.52 10 8 2 37.17 3.87 -10 -8 -2 49.68 6.90 10 8 3 -0.97 2.26 -10 -8 -3 1.75 2.70 10 8 4 18.98 2.79 -10 -8 -4 15.60 3.87 10 8 5 -0.39 1.82 -10 -8 -5 1.87 3.05 10 8 6 9.67 2.11 -10 -8 -6 15.71 4.13 10 8 7 3.60 3.91 -10 -8 -7 16.06 4.23 10 8 8 -0.84 4.43 -10 -8 -8 30.98 4.71 10 8 9 -4.74 3.98 -10 -8 -9 8.34 7.50 10 8 10 -4.81 4.44 -10 -8 -10 2.06 8.18 10 8 11 1.53 6.08 -10 -8 -11 171.44 11.82 -10 -9 8 2.20 3.64 -10 -9 7 103.00 10.28 -10 -9 6 24.19 4.17 -10 -9 5 83.03 9.32 -10 -9 4 53.73 4.66 -10 -9 4 65.82 4.67 -10 -9 3 317.00 10.33 10 9 -2 1.71 3.83 -10 -9 2 -1.31 3.26 10 9 -1 36.30 5.41 -10 -9 1 40.23 5.43 10 9 0 1.66 3.44 -10 -9 0 0.15 2.32 10 9 1 164.24 7.27 -10 -9 -1 184.54 9.66 10 9 2 29.69 3.69 10 9 2 2.08 2.87 -10 -9 -2 20.62 5.99 10 9 3 0.73 1.49 10 9 3 -0.48 2.36 -10 -9 -3 -0.90 2.78 10 9 4 2.55 2.72 10 9 4 2.97 2.77 -10 -9 -4 0.63 5.76 10 9 5 -0.46 1.29 10 9 5 4.08 4.64 -10 -9 -5 2.15 5.42 10 9 6 23.39 3.06 10 9 6 21.21 7.06 -10 -9 -6 18.92 8.12 10 9 7 22.20 2.81 10 9 7 19.22 7.40 -10 -9 -7 24.59 8.72 10 9 8 1.47 6.07 -10 -9 -8 -0.70 6.94 10 9 9 96.37 11.19 -10 -9 -9 98.09 12.63 10 9 10 31.12 9.54 -10 -9 -10 30.32 6.17 10 9 11 284.65 17.71 -10 -9 -11 297.22 12.22 -10 -10 7 4.88 7.16 -10 -10 6 21.32 4.66 10 10 -4 38.41 7.44 10 10 -3 198.52 7.02 -10 -10 3 193.24 7.99 10 10 -2 14.09 5.65 -10 -10 2 15.80 4.61 10 10 -1 37.44 3.53 -10 -10 1 44.48 3.43 10 10 0 -1.21 3.92 10 10 0 2.11 1.99 -10 -10 0 -2.60 4.52 10 10 1 178.79 8.45 10 10 1 190.80 5.65 -10 -10 -1 186.88 10.54 10 10 2 8.01 4.11 10 10 2 13.84 4.58 -10 -10 -2 8.06 5.82 10 10 3 18.73 4.17 10 10 3 17.30 3.05 -10 -10 -3 20.01 3.79 10 10 4 4.75 1.93 10 10 4 3.31 5.00 -10 -10 -4 8.09 6.16 10 10 5 24.11 6.47 10 10 5 25.13 3.91 -10 -10 -5 18.47 7.98 10 10 6 -2.81 5.44 10 10 6 2.36 2.85 -10 -10 -6 3.51 6.60 10 10 7 30.19 7.85 10 10 7 31.42 3.70 -10 -10 -7 30.65 9.26 10 10 8 4.12 6.78 10 10 8 4.82 2.73 -10 -10 -8 1.87 8.01 10 10 9 4.01 7.42 -10 -10 -9 7.14 8.51 10 10 10 70.13 11.35 -10 -10 -10 71.04 12.93 10 11 -5 4.68 6.38 10 11 -4 132.77 10.81 10 11 -3 138.47 10.03 -10 -11 3 133.06 7.06 10 11 -2 0.04 4.79 -10 -11 2 1.52 3.83 10 11 -1 144.19 5.92 10 11 -1 142.58 4.35 -10 -11 1 148.12 8.56 10 11 0 -2.63 4.16 10 11 0 0.18 3.10 -10 -11 0 2.67 4.25 10 11 1 54.59 6.26 10 11 1 52.17 5.39 -10 -11 -1 38.97 4.26 10 11 2 5.08 2.53 10 11 2 6.82 4.50 -10 -11 -2 3.15 5.87 10 11 3 50.06 3.86 10 11 3 52.81 5.82 -10 -11 -3 59.58 4.96 10 11 4 3.41 5.33 10 11 4 8.16 4.06 -10 -11 -4 7.03 6.77 10 11 5 -0.54 5.00 10 11 5 1.53 3.36 -10 -11 -5 0.79 6.63 10 11 6 4.24 5.30 10 11 6 -1.65 3.15 -10 -11 -6 1.36 3.78 10 11 7 22.13 7.67 10 11 7 23.97 2.50 -10 -11 -7 26.26 5.54 10 11 8 62.48 4.92 10 11 8 68.88 9.77 -10 -11 -8 65.13 7.04 10 12 -2 1.15 5.45 10 12 -2 2.71 2.83 -10 -12 2 -1.04 3.95 10 12 -1 100.69 5.57 10 12 -1 94.02 3.52 -10 -12 1 104.85 7.76 10 12 0 -0.94 5.24 10 12 0 5.74 3.62 -10 -12 0 3.99 5.06 10 12 1 2.55 4.84 10 12 1 3.40 3.93 -10 -12 -1 2.89 3.01 10 12 2 13.50 5.21 10 12 2 18.43 5.56 -10 -12 -2 15.90 6.93 10 12 3 22.22 3.47 10 12 3 17.08 5.64 -10 -12 -3 28.21 4.41 10 12 4 0.58 5.49 10 12 4 10.21 2.63 -10 -12 -4 -0.43 7.14 10 12 5 21.69 7.15 10 12 5 33.75 5.36 -10 -12 -5 31.47 5.14 10 12 6 46.56 5.80 10 12 6 43.60 8.22 -10 -12 -6 60.31 6.10 -11 -1 4 16.58 3.79 -11 -1 4 36.13 3.40 -11 -1 3 49.51 4.34 -11 -1 3 43.86 4.18 -11 -1 2 32.23 4.27 -11 -1 2 33.52 4.15 -11 -1 1 12.50 6.84 -11 -1 1 13.81 6.67 -11 -1 0 5.02 6.35 -11 -1 0 3.69 6.29 -11 -1 -1 68.76 5.72 -11 -1 -1 65.48 9.62 -11 -1 -2 102.06 10.84 -11 -1 -2 81.40 6.40 -11 -1 -3 43.81 5.46 -11 -1 -3 33.61 9.61 -11 -2 6 18.46 4.62 -11 -2 6 18.29 3.88 -11 -2 6 7.22 4.21 -11 -2 5 101.53 4.54 -11 -2 5 92.69 5.33 -11 -2 5 101.91 6.55 -11 -2 4 94.67 4.80 -11 -2 4 82.33 4.60 -11 -2 4 98.33 6.77 -11 -2 3 3.48 2.81 -11 -2 3 2.36 4.44 -11 -2 2 6.23 3.15 -11 -2 2 6.66 5.21 -11 -2 1 154.92 6.41 -11 -2 1 159.28 10.51 -11 -2 0 189.34 11.56 -11 -2 0 182.56 11.69 -11 -2 -1 89.05 10.02 -11 -2 -1 104.89 6.15 -11 -2 -2 93.35 6.11 -11 -2 -2 95.73 10.68 -11 -2 -3 5.24 6.87 -11 -2 -3 3.73 7.22 -11 -2 -4 132.14 12.24 -11 -2 -4 139.69 12.56 -11 -2 -5 56.75 6.06 -11 -2 -5 59.76 6.24 -11 -3 6 0.93 3.41 -11 -3 6 -2.38 3.20 -11 -3 6 -3.08 3.17 -11 -3 5 1.48 2.96 -11 -3 5 -3.00 2.06 -11 -3 5 -0.63 3.34 -11 -3 4 -6.76 3.75 -11 -3 4 -0.90 1.54 -11 -3 4 0.92 2.01 -11 -3 3 20.55 5.64 -11 -3 3 25.15 3.37 -11 -3 3 36.06 3.03 -11 -3 2 44.65 6.79 -11 -3 2 58.85 3.79 -11 -3 1 39.19 3.99 -11 -3 1 36.72 3.86 -11 -3 0 0.00 2.84 -11 -3 0 -2.58 2.92 -11 -3 -1 3.99 5.94 -11 -3 -1 7.55 6.11 -11 -3 -2 8.79 3.72 -11 -3 -2 9.51 6.68 -11 -3 -3 92.40 10.23 -11 -3 -3 106.73 10.61 -11 -3 -4 32.56 4.87 -11 -3 -4 31.83 5.01 -11 -3 -5 6.73 8.00 -11 -3 -5 21.93 8.33 -11 -3 -6 18.78 8.62 -11 -3 -6 11.55 8.50 -11 -4 7 0.59 2.02 -11 -4 6 3.33 3.03 -11 -4 6 3.14 3.15 -11 -4 6 5.72 3.62 -11 -4 5 12.95 3.56 -11 -4 5 8.05 2.16 -11 -4 5 9.82 3.62 -11 -4 4 -0.43 1.77 -11 -4 4 -1.20 3.23 -11 -4 4 0.47 2.71 -11 -4 3 0.89 3.42 -11 -4 3 5.29 3.52 -11 -4 3 -2.02 2.45 -11 -4 2 20.34 5.06 -11 -4 2 18.91 5.16 -11 -4 2 24.26 3.08 -11 -4 1 3.77 4.63 -11 -4 1 5.36 4.62 -11 -4 0 -2.92 4.47 -11 -4 0 1.49 2.52 -11 -4 -1 -3.03 5.16 -11 -4 -1 -2.10 2.91 -11 -4 -2 153.46 6.67 -11 -4 -2 152.37 10.53 -11 -4 -3 10.60 3.70 -11 -4 -3 4.96 3.72 -11 -4 -4 73.28 9.98 -11 -4 -4 79.42 9.70 -11 -4 -5 72.39 10.76 -11 -4 -5 91.46 10.36 -11 -4 -6 64.86 10.73 -11 -4 -6 70.58 6.14 -11 -4 -7 89.22 6.87 -11 -4 -7 86.21 11.54 -11 -5 7 37.22 5.64 -11 -5 6 29.71 3.57 -11 -5 6 28.44 2.22 -11 -5 6 30.06 2.97 -11 -5 5 3.86 3.05 -11 -5 5 1.81 2.97 -11 -5 4 1.90 1.88 -11 -5 4 8.25 3.23 -11 -5 4 4.50 3.17 -11 -5 3 4.93 3.61 -11 -5 3 4.83 3.49 -11 -5 3 1.58 2.91 -11 -5 2 1.73 3.58 -11 -5 2 1.81 3.49 -11 -5 2 -2.85 2.40 -11 -5 1 15.82 4.91 -11 -5 1 18.11 4.73 -11 -5 1 13.12 1.72 -11 -5 0 39.82 6.21 -11 -5 0 36.27 5.88 -11 -5 -1 -0.37 4.85 -11 -5 -1 2.45 2.72 -11 -5 -2 8.36 5.89 -11 -5 -2 6.77 5.66 -11 -5 -3 9.50 6.37 -11 -5 -3 10.43 6.30 -11 -5 -4 1.05 6.38 -11 -5 -4 7.41 6.07 -11 -5 -5 97.28 6.52 -11 -5 -5 103.60 6.15 -11 -5 -6 18.65 4.82 -11 -5 -7 14.28 8.74 -11 -5 -8 115.91 13.11 -11 -6 7 -1.55 4.43 -11 -6 6 5.32 2.48 -11 -6 5 2.33 2.61 -11 -6 5 0.48 1.59 -11 -6 5 1.39 3.53 -11 -6 4 2.47 3.02 -11 -6 4 -1.31 2.84 -11 -6 4 4.38 3.28 -11 -6 3 17.00 2.47 -11 -6 3 25.70 2.25 -11 -6 3 24.93 3.90 -11 -6 2 2.51 3.74 -11 -6 2 4.79 1.90 -11 -6 2 -0.24 3.05 -11 -6 1 1.13 3.98 -11 -6 1 -2.00 2.04 -11 -6 0 1.91 4.37 -11 -6 0 0.92 3.93 -11 -6 -1 2.82 2.75 -11 -6 -1 0.16 4.47 -11 -6 -2 12.45 3.26 -11 -6 -2 5.15 3.11 -11 -6 -3 12.70 3.69 -11 -6 -4 3.72 3.49 -11 -6 -5 9.94 7.33 -11 -6 -6 9.98 7.66 -11 -6 -7 35.66 9.71 -11 -6 -8 98.03 7.30 -11 -7 6 -0.33 2.38 -11 -7 5 21.44 3.00 -11 -7 4 2.21 2.83 -11 -7 4 3.33 1.78 -11 -7 4 3.29 3.80 -11 -7 3 -0.07 2.78 -11 -7 3 -1.42 3.20 -11 -7 3 -1.64 3.54 -11 -7 2 6.72 3.20 -11 -7 2 6.77 3.71 -11 -7 2 -0.94 1.97 -11 -7 1 7.14 4.58 -11 -7 1 10.86 3.85 -11 -7 0 16.54 5.52 -11 -7 0 22.70 2.74 -11 -7 -1 0.63 2.57 -11 -7 -2 5.73 3.12 -11 -7 -3 1.54 3.09 -11 -7 -4 56.42 5.07 -11 -7 -5 159.35 7.52 -11 -7 -6 24.39 4.99 -11 -7 -7 176.39 8.48 -11 -7 -8 5.65 8.32 -11 -8 5 74.37 4.41 -11 -8 4 6.77 2.81 -11 -8 4 3.63 3.28 -11 -8 4 11.07 4.96 -11 -8 3 6.21 3.01 -11 -8 3 5.98 3.60 -11 -8 2 14.38 3.56 -11 -8 2 10.37 4.28 -11 -8 1 3.86 4.15 -11 -8 0 10.15 5.11 -11 -8 -1 4.03 2.83 -11 -8 -2 41.26 7.08 -11 -8 -3 6.47 6.00 -11 -8 -4 -3.88 6.22 -11 -8 -5 2.92 6.64 -11 -8 -6 13.60 7.94 -11 -8 -7 1.44 7.07 -11 -8 -8 3.31 7.82 -11 -9 3 6.49 3.08 -11 -9 3 9.11 3.81 -11 -9 2 10.99 4.32 -11 -9 1 -0.53 3.83 -11 -9 0 0.56 4.27 -11 -9 -1 2.64 2.82 -11 -9 -2 3.13 5.35 -11 -9 -3 -0.16 5.15 -11 -9 -4 -0.79 5.70 -11 -9 -5 6.52 7.01 -11 -9 -6 44.75 5.52 -11 -9 -7 224.36 9.43 -11 -10 2 5.28 4.15 -11 -10 1 0.68 4.23 11 10 0 7.59 4.12 -11 -10 0 2.23 4.83 11 10 1 13.95 4.15 -11 -10 -1 10.62 3.32 11 10 2 -0.43 1.80 -11 -10 -2 -0.39 4.98 11 10 3 10.58 3.65 -11 -10 -3 14.08 6.65 11 10 4 3.31 3.04 -11 -10 -4 7.43 3.67 11 10 5 -0.29 3.03 -11 -10 -5 -1.16 3.52 ; _shelx_hkl_checksum 48937 _shelx_res_file ; shelxl.res created by SHELXL-2014/7 TITL 05111717 CELL 0.71075 9.10750 12.02030 16.67200 81.584 88.416 67.905 ZERR 2 0.00300 0.00490 0.00570 0.016 0.015 0.015 LATT 1 SFAC C H O N UNIT 76 92 12 4 SHEL 99999.000000 0.000000 L.S. 40 FMAP 2 PLAN -20 WPDB -2 HTAB BOND $H CONF LIST 4 TEMP -180.0 ACTA SIZE 0.240 0.070 0.550 WGHT 0.063900 FVAR 0.91986 0.64703 O1 3 1.425053 0.091851 0.274238 11.00000 0.01928 0.04069 = 0.03921 -0.01014 -0.00514 -0.00846 O2 3 1.541093 -0.044909 0.191447 11.00000 0.02963 0.03265 = 0.03989 -0.00902 -0.00848 -0.01322 O3 3 2.124838 -0.061591 0.403080 11.00000 0.01726 0.03571 = 0.02937 -0.01282 -0.00347 -0.00468 O4 3 -0.158648 0.358287 -0.052564 11.00000 0.02183 0.03378 = 0.03775 -0.01208 -0.00558 -0.00839 O5 3 -0.098869 0.203200 -0.122401 11.00000 0.02524 0.04842 = 0.05354 -0.02899 -0.00190 -0.00245 O6 3 -0.847899 0.481652 -0.183718 11.00000 0.02310 0.03166 = 0.03631 -0.00808 -0.00979 -0.00899 C1 1 1.702102 -0.008818 0.286935 11.00000 0.02231 0.02382 = 0.02590 -0.00075 -0.00350 -0.01016 C2 1 1.844214 -0.080401 0.256249 11.00000 0.02604 0.02212 = 0.02577 -0.00480 -0.00348 -0.01013 AFIX 43 H2 2 1.842294 -0.116026 0.209242 11.00000 -1.20000 AFIX 0 C3 1 1.989024 -0.100902 0.292940 11.00000 0.02196 0.02196 = 0.02748 -0.00538 -0.00044 -0.00707 AFIX 43 H3 2 2.085399 -0.149748 0.271273 11.00000 -1.20000 AFIX 0 C4 1 1.990560 -0.048790 0.361838 11.00000 0.02098 0.02592 = 0.02462 -0.00267 -0.00339 -0.00927 C5 1 1.849086 0.023073 0.393465 11.00000 0.02272 0.03434 = 0.02652 -0.00988 -0.00140 -0.00850 AFIX 43 H5 2 1.850850 0.058101 0.440769 11.00000 -1.20000 AFIX 0 C6 1 1.706291 0.043186 0.355784 11.00000 0.01987 0.03113 = 0.02755 -0.00599 0.00014 -0.00724 AFIX 43 H6 2 1.610023 0.092966 0.377036 11.00000 -1.20000 AFIX 0 C7 1 1.549904 0.010195 0.245665 11.00000 0.02400 0.02557 = 0.02918 -0.00034 -0.00345 -0.01223 C8 1 2.274791 -0.139552 0.377044 11.00000 0.01811 0.02583 = 0.02926 -0.00735 -0.00172 -0.00440 AFIX 23 H8A 2 2.296293 -0.106713 0.321944 11.00000 -1.20000 H8B 2 2.275063 -0.221738 0.375877 11.00000 -1.20000 AFIX 0 C9 1 2.398623 -0.144755 0.437226 11.00000 0.02106 0.03185 = 0.02835 -0.00775 -0.00244 -0.00599 AFIX 23 H9A 2 2.372078 -0.174402 0.492119 11.00000 -1.20000 H9B 2 2.395655 -0.061649 0.437583 11.00000 -1.20000 AFIX 0 C10 1 2.565636 -0.226437 0.418886 11.00000 0.01952 0.02655 = 0.02659 -0.00459 -0.00282 -0.00696 AFIX 23 H10A 2 2.592564 -0.197109 0.363995 11.00000 -1.20000 H10B 2 2.569282 -0.309808 0.418939 11.00000 -1.20000 AFIX 0 C11 1 2.688709 -0.229712 0.480329 11.00000 0.02288 0.03052 = 0.02836 -0.00221 -0.00589 -0.00938 AFIX 23 H11A 2 2.680978 -0.145754 0.482206 11.00000 -1.20000 H11B 2 2.664291 -0.262628 0.534783 11.00000 -1.20000 AFIX 0 C12 1 2.857041 -0.305970 0.460844 11.00000 0.02172 0.04334 = 0.03897 0.00051 -0.00505 -0.00868 AFIX 23 H12A 2 2.879183 -0.276130 0.405079 11.00000 -1.20000 H12B 2 2.866317 -0.390976 0.462203 11.00000 -1.20000 AFIX 0 C13 1 2.980610 -0.303534 0.518991 11.00000 0.02808 0.06357 = 0.05738 0.00779 -0.01877 -0.01689 AFIX 137 H13A 2 2.970685 -0.219474 0.518988 11.00000 -1.50000 H13B 2 3.086716 -0.351102 0.501758 11.00000 -1.50000 H13C 2 2.964268 -0.338451 0.573796 11.00000 -1.50000 AFIX 0 C14 1 -0.366434 0.343024 -0.124464 11.00000 0.02278 0.02457 = 0.02050 -0.00280 0.00010 -0.00970 C15 1 -0.473942 0.443622 -0.093673 11.00000 0.02617 0.02397 = 0.02076 -0.00512 -0.00099 -0.01122 AFIX 43 H15 2 -0.436672 0.482952 -0.058184 11.00000 -1.20000 AFIX 0 C16 1 -0.633371 0.486829 -0.113939 11.00000 0.02489 0.02259 = 0.02478 -0.00489 -0.00196 -0.00787 AFIX 43 H16 2 -0.705590 0.554114 -0.091435 11.00000 -1.20000 AFIX 0 C17 1 -0.688059 0.431442 -0.167512 11.00000 0.02376 0.02441 = 0.02642 -0.00114 -0.00473 -0.01022 C18 1 -0.583148 0.331902 -0.199795 11.00000 0.03079 0.02836 = 0.02685 -0.00829 -0.00441 -0.01341 AFIX 43 H18 2 -0.620146 0.294519 -0.236795 11.00000 -1.20000 AFIX 0 C19 1 -0.423165 0.287828 -0.177123 11.00000 0.02675 0.02626 = 0.02712 -0.00961 0.00072 -0.00850 AFIX 43 H19 2 -0.351415 0.218720 -0.198039 11.00000 -1.20000 AFIX 0 C20 1 -0.195455 0.294099 -0.100466 11.00000 0.02313 0.02958 = 0.02339 -0.00568 0.00177 -0.00945 C21 1 -0.913125 0.433954 -0.241438 11.00000 0.02830 0.03241 = 0.03610 -0.00586 -0.00933 -0.01375 AFIX 23 H21A 2 -0.892980 0.347258 -0.222919 11.00000 -1.20000 H21B 2 -0.864697 0.441237 -0.294864 11.00000 -1.20000 AFIX 0 C22 1 -1.089301 0.508074 -0.247600 11.00000 0.02745 0.03017 = 0.03220 -0.00242 -0.00589 -0.01281 AFIX 23 H22A 2 -1.106242 0.595131 -0.260714 11.00000 -1.20000 H22B 2 -1.135821 0.496104 -0.194208 11.00000 -1.20000 AFIX 0 C23 1 -1.175519 0.475203 -0.311345 11.00000 0.02416 0.03051 = 0.03407 -0.00543 -0.00535 -0.01088 AFIX 23 H23A 2 -1.156881 0.387772 -0.298982 11.00000 -1.20000 H23B 2 -1.130970 0.489070 -0.365011 11.00000 -1.20000 AFIX 0 C24 1 -1.353574 0.548653 -0.315593 11.00000 0.02521 0.02604 = 0.02818 -0.00332 -0.00314 -0.00983 AFIX 23 H24A 2 -1.399094 0.530755 -0.262952 11.00000 -1.20000 H24B 2 -1.371987 0.636184 -0.324423 11.00000 -1.20000 AFIX 0 C25 1 -1.438919 0.521893 -0.382569 11.00000 0.02808 0.03220 = 0.04069 -0.00970 -0.00823 -0.00896 AFIX 23 H25A 2 -1.413952 0.433418 -0.376009 11.00000 -1.20000 H25B 2 -1.398668 0.545382 -0.435508 11.00000 -1.20000 AFIX 0 C26 1 -1.618239 0.588156 -0.383425 11.00000 0.02766 0.04053 = 0.05408 -0.00432 -0.01279 -0.00822 AFIX 137 H26A 2 -1.644081 0.675883 -0.389908 11.00000 -1.50000 H26B 2 -1.659779 0.562400 -0.332230 11.00000 -1.50000 H26C 2 -1.666204 0.568808 -0.428688 11.00000 -1.50000 AFIX 0 PART 1 N1A 4 1.152231 0.116216 0.209270 21.00000 0.01429 0.02467 = 0.02908 0.00664 -0.00828 -0.01005 C27A 1 1.026838 0.186521 0.245111 21.00000 0.02159 0.02146 = 0.04218 0.00015 -0.00851 -0.01006 AFIX 43 H27A 2 1.046029 0.216654 0.291699 21.00000 -1.20000 AFIX 0 C28A 1 0.872315 0.219293 0.220686 21.00000 0.02403 0.02410 = 0.02942 -0.00556 -0.00430 -0.00653 AFIX 43 H28A 2 0.788536 0.269652 0.249812 21.00000 -1.20000 AFIX 0 C29A 1 0.840409 0.177578 0.152614 21.00000 0.02011 0.02133 = 0.02393 -0.00378 -0.00236 -0.00727 C30A 1 0.969902 0.104081 0.113221 21.00000 0.02781 0.03241 = 0.02633 -0.00481 -0.00363 -0.01093 AFIX 43 H30A 2 0.954787 0.073339 0.066079 21.00000 -1.20000 AFIX 0 C31A 1 1.121655 0.076718 0.144385 21.00000 0.02363 0.03674 = 0.03469 0.00042 0.00314 -0.00790 AFIX 43 H31A 2 1.208887 0.026326 0.117167 21.00000 -1.20000 AFIX 0 N2A 4 0.136749 0.285466 -0.009241 21.00000 0.01469 0.02463 = 0.02269 -0.00061 -0.00656 -0.00858 C32A 1 0.251482 0.201498 -0.041551 21.00000 0.02417 0.03278 = 0.02729 -0.00463 -0.00411 -0.01298 AFIX 43 H32A 2 0.224048 0.165102 -0.082639 21.00000 -1.20000 AFIX 0 C33A 1 0.409532 0.163518 -0.018905 21.00000 0.02327 0.02754 = 0.02525 -0.00702 -0.00142 -0.00851 AFIX 43 H33A 2 0.488201 0.104506 -0.045342 21.00000 -1.20000 AFIX 0 C34A 1 0.452532 0.212471 0.042995 21.00000 0.02006 0.02274 = 0.02204 -0.00356 0.00144 -0.00840 C35A 1 0.329235 0.298624 0.079369 21.00000 0.02451 0.02754 = 0.03074 -0.00928 -0.00419 -0.01066 AFIX 43 H35A 2 0.350993 0.333828 0.122768 21.00000 -1.20000 AFIX 0 C36A 1 0.175686 0.331102 0.050726 21.00000 0.02601 0.03316 = 0.04025 -0.01089 0.00412 -0.00948 AFIX 43 H36A 2 0.093083 0.389686 0.075538 21.00000 -1.20000 AFIX 0 C37A 1 0.674673 0.211317 0.126894 21.00000 0.01574 0.02496 = 0.03145 -0.00267 -0.00203 -0.00569 AFIX 43 H37A 2 0.597221 0.265592 0.156858 21.00000 -1.20000 AFIX 0 C38A 1 0.620073 0.175167 0.066890 21.00000 0.01996 0.02626 = 0.02721 -0.00325 -0.00019 -0.00774 AFIX 43 H38A 2 0.696010 0.120272 0.036660 21.00000 -1.20000 AFIX 0 PART 2 SAME N1A > C31A N1B 4 1.153894 0.118201 0.208938 -21.00000 0.04217 C27B 1 1.010180 0.186559 0.236566 -21.00000 0.03854 AFIX 43 H27B 2 1.004972 0.221755 0.284529 -21.00000 -1.20000 AFIX 0 C28B 1 0.872773 0.204354 0.194716 -21.00000 0.02299 AFIX 43 H28B 2 0.774375 0.256210 0.212809 -21.00000 -1.20000 AFIX 0 C29B 1 0.873062 0.149816 0.127833 -21.00000 0.01883 C30B 1 1.020157 0.077825 0.101699 -21.00000 0.03000 AFIX 43 H30B 2 1.026448 0.038273 0.055655 -21.00000 -1.20000 AFIX 0 C31B 1 1.154545 0.064282 0.142155 -21.00000 0.02713 AFIX 43 H31B 2 1.253647 0.015035 0.123158 -21.00000 -1.20000 AFIX 0 SAME N2A > C36A N2B 4 0.139821 0.283296 -0.006838 -21.00000 0.04058 C32B 1 0.278299 0.203555 -0.034402 -21.00000 0.02722 AFIX 43 H32B 2 0.273304 0.164913 -0.079477 -21.00000 -1.20000 AFIX 0 C33B 1 0.423053 0.178781 0.001789 -21.00000 0.02242 AFIX 43 H33B 2 0.516045 0.120308 -0.016312 -21.00000 -1.20000 AFIX 0 C34B 1 0.433026 0.239494 0.064928 -21.00000 0.01991 C35B 1 0.294729 0.322303 0.088890 -21.00000 0.02819 AFIX 43 H35B 2 0.298235 0.365498 0.131710 -21.00000 -1.20000 AFIX 0 C36B 1 0.154623 0.343598 0.053148 -21.00000 0.01871 AFIX 43 H36B 2 0.062103 0.403331 0.070587 -21.00000 -1.20000 AFIX 0 C37B 1 0.729664 0.162160 0.084401 -21.00000 0.02523 AFIX 43 H37B 2 0.742503 0.124330 0.037090 -21.00000 -1.20000 AFIX 0 C38B 1 0.582278 0.222225 0.105809 -21.00000 0.02475 AFIX 43 H38B 2 0.572431 0.258533 0.153626 -21.00000 -1.20000 AFIX 0 PART 0 H1 2 1.325090 0.099594 0.248066 11.00000 0.07909 H4 2 -0.032534 0.322610 -0.037075 11.00000 0.08270 HKLF 4 REM 05111717 REM R1 = 0.0425 for 5611 Fo > 4sig(Fo) and 0.0601 for all 7635 data REM 482 parameters refined using 24 restraints END WGHT 0.0637 0.0000 REM Instructions for potential hydrogen bonds EQIV $1 -x+2, -y, -z HTAB C3 O5_$1 EQIV $2 -x+4, -y, -z+1 HTAB C5 O3_$2 HTAB O1 N1A HTAB O4 N2A HTAB N2A O4 HTAB N2A O5 REM Highest difference peak 0.253, deepest hole -0.288, 1-sigma level 0.055 Q1 1 1.6321 0.0029 0.2661 11.00000 0.05 0.25 Q2 1 2.6359 -0.2336 0.4477 11.00000 0.05 0.23 Q3 1 1.9159 -0.0852 0.2749 11.00000 0.05 0.22 Q4 1 1.7834 0.0271 0.3783 11.00000 0.05 0.20 Q5 1 1.7610 -0.0041 0.2509 11.00000 0.05 0.19 Q6 1 -0.5621 0.4399 -0.0857 11.00000 0.05 0.19 Q7 1 -0.2857 0.3192 -0.1151 11.00000 0.05 0.18 Q8 1 2.3392 -0.1439 0.4044 11.00000 0.05 0.17 Q9 1 2.0624 -0.0598 0.3853 11.00000 0.05 0.17 Q10 1 2.9221 -0.2969 0.4856 11.00000 0.05 0.17 Q11 1 -0.5048 0.2995 -0.1770 11.00000 0.05 0.16 Q12 1 0.2164 0.2616 0.1620 11.00000 0.05 0.16 Q13 1 -0.8843 0.5569 -0.0891 11.00000 0.05 0.16 Q14 1 1.6149 -0.0652 0.1444 11.00000 0.05 0.16 Q15 1 2.4750 -0.1853 0.4205 11.00000 0.05 0.16 Q16 1 2.8921 -0.3453 0.4094 11.00000 0.05 0.15 Q17 1 2.0921 -0.1245 0.4480 11.00000 0.05 0.15 Q18 1 1.7634 -0.0636 0.2856 11.00000 0.05 0.15 Q19 1 -0.6963 0.6415 -0.0370 11.00000 0.05 0.14 Q20 1 -0.9988 0.4682 -0.2417 11.00000 0.05 0.14 ; _shelx_res_checksum 7413 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group O O1 1.42505(10) 0.09185(8) 0.27424(5) 0.0333(2) Uani d 1 . . O O2 1.54109(10) -0.04491(8) 0.19145(5) 0.0330(2) Uani d 1 . . O O3 2.12484(9) -0.06159(8) 0.40308(5) 0.02806(19) Uani d 1 . . O O4 -0.15865(10) 0.35829(8) -0.05256(5) 0.0309(2) Uani d 1 . . O O5 -0.09887(11) 0.20320(9) -0.12240(6) 0.0434(2) Uani d 1 . . O O6 -0.84790(9) 0.48165(8) -0.18372(5) 0.0302(2) Uani d 1 . . C C1 1.70210(13) -0.00882(10) 0.28693(7) 0.0238(2) Uani d 1 . . C C2 1.84421(13) -0.08040(10) 0.25625(7) 0.0241(2) Uani d 1 . . H H2 1.8423 -0.1160 0.2092 0.029 Uiso calc 1 . . C C3 1.98902(13) -0.10090(10) 0.29294(7) 0.0239(2) Uani d 1 . . H H3 2.0854 -0.1497 0.2713 0.029 Uiso calc 1 . . C C4 1.99056(13) -0.04879(10) 0.36184(7) 0.0237(2) Uani d 1 . . C C5 1.84909(13) 0.02307(11) 0.39347(7) 0.0279(3) Uani d 1 . . H H5 1.8508 0.0581 0.4408 0.033 Uiso calc 1 . . C C6 1.70629(13) 0.04319(11) 0.35578(7) 0.0267(2) Uani d 1 . . H H6 1.6100 0.0930 0.3770 0.032 Uiso calc 1 . . C C7 1.54990(14) 0.01020(11) 0.24567(7) 0.0257(2) Uani d 1 . . C C8 2.27479(13) -0.13955(11) 0.37704(7) 0.0251(2) Uani d 1 . . H H8A 2.2963 -0.1067 0.3219 0.030 Uiso calc 1 . . H H8B 2.2751 -0.2217 0.3759 0.030 Uiso calc 1 . . C C9 2.39862(13) -0.14475(11) 0.43723(7) 0.0278(3) Uani d 1 . . H H9A 2.3721 -0.1744 0.4921 0.033 Uiso calc 1 . . H H9B 2.3957 -0.0616 0.4376 0.033 Uiso calc 1 . . C C10 2.56564(12) -0.22644(11) 0.41889(7) 0.0246(2) Uani d 1 . . H H10A 2.5926 -0.1971 0.3640 0.029 Uiso calc 1 . . H H10B 2.5693 -0.3098 0.4189 0.029 Uiso calc 1 . . C C11 2.68871(13) -0.22971(11) 0.48033(7) 0.0275(3) Uani d 1 . . H H11A 2.6810 -0.1458 0.4822 0.033 Uiso calc 1 . . H H11B 2.6643 -0.2626 0.5348 0.033 Uiso calc 1 . . C C12 2.85704(14) -0.30597(13) 0.46084(8) 0.0363(3) Uani d 1 . . H H12A 2.8792 -0.2761 0.4051 0.044 Uiso calc 1 . . H H12B 2.8663 -0.3910 0.4622 0.044 Uiso calc 1 . . C C13 2.98061(17) -0.30353(16) 0.51899(10) 0.0512(4) Uani d 1 . . H H13A 2.9707 -0.2195 0.5190 0.077 Uiso calc 1 . . H H13B 3.0867 -0.3511 0.5018 0.077 Uiso calc 1 . . H H13C 2.9643 -0.3385 0.5738 0.077 Uiso calc 1 . . C C14 -0.36643(13) 0.34302(10) -0.12446(6) 0.0224(2) Uani d 1 . . C C15 -0.47394(13) 0.44362(10) -0.09367(6) 0.0229(2) Uani d 1 . . H H15 -0.4367 0.4830 -0.0582 0.027 Uiso calc 1 . . C C16 -0.63337(13) 0.48683(10) -0.11394(7) 0.0242(2) Uani d 1 . . H H16 -0.7056 0.5541 -0.0914 0.029 Uiso calc 1 . . C C17 -0.68806(13) 0.43144(10) -0.16751(7) 0.0247(2) Uani d 1 . . C C18 -0.58315(14) 0.33190(11) -0.19980(7) 0.0274(3) Uani d 1 . . H H18 -0.6201 0.2945 -0.2368 0.033 Uiso calc 1 . . C C19 -0.42317(14) 0.28783(11) -0.17712(7) 0.0265(2) Uani d 1 . . H H19 -0.3514 0.2187 -0.1980 0.032 Uiso calc 1 . . C C20 -0.19545(13) 0.29410(11) -0.10047(7) 0.0253(2) Uani d 1 . . C C21 -0.91312(14) 0.43395(12) -0.24144(7) 0.0313(3) Uani d 1 . . H H21A -0.8930 0.3473 -0.2229 0.038 Uiso calc 1 . . H H21B -0.8647 0.4412 -0.2949 0.038 Uiso calc 1 . . C C22 -1.08930(14) 0.50807(11) -0.24760(7) 0.0295(3) Uani d 1 . . H H22A -1.1062 0.5951 -0.2607 0.035 Uiso calc 1 . . H H22B -1.1358 0.4961 -0.1942 0.035 Uiso calc 1 . . C C23 -1.17552(14) 0.47520(11) -0.31134(7) 0.0292(3) Uani d 1 . . H H23A -1.1569 0.3878 -0.2990 0.035 Uiso calc 1 . . H H23B -1.1310 0.4891 -0.3650 0.035 Uiso calc 1 . . C C24 -1.35357(13) 0.54865(11) -0.31559(7) 0.0264(2) Uani d 1 . . H H24A -1.3991 0.5308 -0.2630 0.032 Uiso calc 1 . . H H24B -1.3720 0.6362 -0.3244 0.032 Uiso calc 1 . . C C25 -1.43892(15) 0.52189(12) -0.38257(8) 0.0337(3) Uani d 1 . . H H25A -1.4140 0.4334 -0.3760 0.040 Uiso calc 1 . . H H25B -1.3987 0.5454 -0.4355 0.040 Uiso calc 1 . . C C26 -1.61824(15) 0.58816(13) -0.38342(9) 0.0421(3) Uani d 1 . . H H26A -1.6441 0.6759 -0.3899 0.063 Uiso calc 1 . . H H26B -1.6598 0.5624 -0.3322 0.063 Uiso calc 1 . . H H26C -1.6662 0.5688 -0.4287 0.063 Uiso calc 1 . . N N1A 1.1522(5) 0.1162(6) 0.2093(3) 0.0228(18) Uani d 0.647(4) A 1 C C27A 1.0268(6) 0.1865(5) 0.2451(4) 0.0282(11) Uani d 0.647(4) A 1 H H27A 1.0460 0.2167 0.2917 0.034 Uiso calc 0.647(4) A 1 C C28A 0.8723(3) 0.2193(2) 0.22069(19) 0.0263(6) Uani d 0.647(4) A 1 H H28A 0.7885 0.2697 0.2498 0.032 Uiso calc 0.647(4) A 1 C C29A 0.8404(2) 0.1776(2) 0.15261(17) 0.0218(5) Uani d 0.647(4) A 1 C C30A 0.9699(4) 0.1041(3) 0.11322(15) 0.0288(5) Uani d 0.647(4) A 1 H H30A 0.9548 0.0733 0.0661 0.035 Uiso calc 0.647(4) A 1 C C31A 1.1217(5) 0.0767(5) 0.1444(3) 0.0334(10) Uani d 0.647(4) A 1 H H31A 1.2089 0.0263 0.1172 0.040 Uiso calc 0.647(4) A 1 N N2A 0.1367(6) 0.2855(6) -0.0092(4) 0.0205(17) Uani d 0.647(4) A 1 C C32A 0.2515(5) 0.2015(4) -0.0416(2) 0.0273(9) Uani d 0.647(4) A 1 H H32A 0.2240 0.1651 -0.0826 0.033 Uiso calc 0.647(4) A 1 C C33A 0.4095(3) 0.1635(2) -0.01891(17) 0.0253(6) Uani d 0.647(4) A 1 H H33A 0.4882 0.1045 -0.0453 0.030 Uiso calc 0.647(4) A 1 C C34A 0.4525(3) 0.2125(2) 0.04299(18) 0.0215(5) Uani d 0.647(4) A 1 C C35A 0.3292(4) 0.2986(3) 0.07937(19) 0.0267(7) Uani d 0.647(4) A 1 H H35A 0.3510 0.3338 0.1228 0.032 Uiso calc 0.647(4) A 1 C C36A 0.1757(6) 0.3311(7) 0.0507(4) 0.0331(14) Uani d 0.647(4) A 1 H H36A 0.0931 0.3897 0.0755 0.040 Uiso calc 0.647(4) A 1 C C37A 0.6747(2) 0.21132(16) 0.12689(11) 0.0247(5) Uani d 0.647(4) A 1 H H37A 0.5972 0.2656 0.1569 0.030 Uiso calc 0.647(4) A 1 C C38A 0.6201(2) 0.17517(17) 0.06689(11) 0.0248(5) Uani d 0.647(4) A 1 H H38A 0.6960 0.1203 0.0367 0.030 Uiso calc 0.647(4) A 1 N N1B 1.1539(14) 0.1182(14) 0.2089(8) 0.042(5) Uiso d 0.353(4) A 2 C C27B 1.0102(12) 0.1866(12) 0.2366(7) 0.039(3) Uiso d 0.353(4) A 2 H H27B 1.0050 0.2218 0.2845 0.046 Uiso calc 0.353(4) A 2 C C28B 0.8728(6) 0.2044(5) 0.1947(3) 0.0230(12) Uiso d 0.353(4) A 2 H H28B 0.7744 0.2562 0.2128 0.028 Uiso calc 0.353(4) A 2 C C29B 0.8731(6) 0.1498(4) 0.1278(3) 0.0188(9) Uiso d 0.353(4) A 2 C C30B 1.0202(7) 0.0778(5) 0.1017(3) 0.0300(14) Uiso d 0.353(4) A 2 H H30B 1.0264 0.0383 0.0557 0.036 Uiso calc 0.353(4) A 2 C C31B 1.1545(9) 0.0643(9) 0.1422(5) 0.0271(19) Uiso d 0.353(4) A 2 H H31B 1.2536 0.0150 0.1232 0.033 Uiso calc 0.353(4) A 2 N N2B 0.1398(14) 0.2833(15) -0.0068(9) 0.041(5) Uiso d 0.353(4) A 2 C C32B 0.2783(10) 0.2036(8) -0.0344(5) 0.027(2) Uiso d 0.353(4) A 2 H H32B 0.2733 0.1649 -0.0795 0.033 Uiso calc 0.353(4) A 2 C C33B 0.4231(6) 0.1788(5) 0.0018(3) 0.0224(13) Uiso d 0.353(4) A 2 H H33B 0.5160 0.1203 -0.0163 0.027 Uiso calc 0.353(4) A 2 C C34B 0.4330(7) 0.2395(5) 0.0649(3) 0.0199(11) Uiso d 0.353(4) A 2 C C35B 0.2947(8) 0.3223(6) 0.0889(4) 0.0282(17) Uiso d 0.353(4) A 2 H H35B 0.2982 0.3655 0.1317 0.034 Uiso calc 0.353(4) A 2 C C36B 0.1546(12) 0.3436(11) 0.0531(6) 0.0187(18) Uiso d 0.353(4) A 2 H H36B 0.0621 0.4033 0.0706 0.022 Uiso calc 0.353(4) A 2 C C37B 0.7297(4) 0.1622(3) 0.0844(2) 0.0252(10) Uiso d 0.353(4) A 2 H H37B 0.7425 0.1243 0.0371 0.030 Uiso calc 0.353(4) A 2 C C38B 0.5823(5) 0.2222(3) 0.1058(2) 0.0248(9) Uiso d 0.353(4) A 2 H H38B 0.5724 0.2585 0.1536 0.030 Uiso calc 0.353(4) A 2 H H1 1.325(2) 0.0996(18) 0.2481(12) 0.079(6) Uiso d 1 . . H H4 -0.033(3) 0.3226(19) -0.0371(12) 0.083(6) Uiso d 1 . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 O1 0.0193(4) 0.0407(5) 0.0392(5) -0.0085(4) -0.0051(4) -0.0101(4) O2 0.0296(5) 0.0326(5) 0.0399(5) -0.0132(4) -0.0085(4) -0.0090(4) O3 0.0173(4) 0.0357(5) 0.0294(4) -0.0047(4) -0.0035(3) -0.0128(3) O4 0.0218(4) 0.0338(5) 0.0378(5) -0.0084(4) -0.0056(3) -0.0121(4) O5 0.0252(5) 0.0484(6) 0.0535(6) -0.0024(4) -0.0019(4) -0.0290(5) O6 0.0231(4) 0.0317(5) 0.0363(4) -0.0090(4) -0.0098(3) -0.0081(4) C1 0.0223(6) 0.0238(6) 0.0259(5) -0.0102(5) -0.0035(4) -0.0008(4) C2 0.0260(6) 0.0221(6) 0.0258(5) -0.0101(5) -0.0035(4) -0.0048(4) C3 0.0220(6) 0.0220(6) 0.0275(5) -0.0071(5) -0.0004(4) -0.0054(4) C4 0.0210(5) 0.0259(6) 0.0246(5) -0.0093(5) -0.0034(4) -0.0027(4) C5 0.0227(6) 0.0343(6) 0.0265(5) -0.0085(5) -0.0014(5) -0.0099(5) C6 0.0199(5) 0.0311(6) 0.0276(6) -0.0072(5) 0.0001(4) -0.0060(5) C7 0.0240(6) 0.0256(6) 0.0292(6) -0.0122(5) -0.0034(5) -0.0003(5) C8 0.0181(5) 0.0258(6) 0.0293(6) -0.0044(5) -0.0017(4) -0.0074(5) C9 0.0211(6) 0.0319(6) 0.0283(6) -0.0060(5) -0.0024(5) -0.0077(5) C10 0.0195(5) 0.0266(6) 0.0266(5) -0.0070(5) -0.0028(4) -0.0046(4) C11 0.0229(6) 0.0305(6) 0.0284(6) -0.0094(5) -0.0059(5) -0.0022(5) C12 0.0217(6) 0.0433(8) 0.0390(7) -0.0087(6) -0.0051(5) 0.0005(6) C13 0.0281(7) 0.0636(10) 0.0574(9) -0.0169(7) -0.0188(7) 0.0078(8) C14 0.0228(6) 0.0246(6) 0.0205(5) -0.0097(5) 0.0001(4) -0.0028(4) C15 0.0262(6) 0.0240(6) 0.0208(5) -0.0112(5) -0.0010(4) -0.0051(4) C16 0.0249(6) 0.0226(6) 0.0248(5) -0.0079(5) -0.0020(4) -0.0049(4) C17 0.0238(6) 0.0244(6) 0.0264(5) -0.0102(5) -0.0047(4) -0.0011(4) C18 0.0308(6) 0.0284(6) 0.0268(5) -0.0134(5) -0.0044(5) -0.0083(5) C19 0.0267(6) 0.0263(6) 0.0271(6) -0.0085(5) 0.0007(5) -0.0096(5) C20 0.0231(6) 0.0296(6) 0.0234(5) -0.0094(5) 0.0018(4) -0.0057(5) C21 0.0283(6) 0.0324(7) 0.0361(6) -0.0137(6) -0.0093(5) -0.0059(5) C22 0.0275(6) 0.0302(6) 0.0322(6) -0.0128(5) -0.0059(5) -0.0024(5) C23 0.0242(6) 0.0305(6) 0.0341(6) -0.0109(5) -0.0053(5) -0.0054(5) C24 0.0252(6) 0.0260(6) 0.0282(6) -0.0098(5) -0.0031(5) -0.0033(5) C25 0.0281(6) 0.0322(7) 0.0407(7) -0.0090(5) -0.0082(5) -0.0097(5) C26 0.0277(7) 0.0405(8) 0.0541(8) -0.0082(6) -0.0128(6) -0.0043(6) N1A 0.0143(16) 0.0247(19) 0.029(2) -0.0100(10) -0.0083(6) 0.0066(6) C27A 0.0216(16) 0.0215(15) 0.042(2) -0.0101(11) -0.0085(12) 0.0001(10) C28A 0.0240(12) 0.0241(11) 0.0294(12) -0.0065(8) -0.0043(9) -0.0056(10) C29A 0.0201(10) 0.0213(10) 0.0239(11) -0.0073(8) -0.0024(9) -0.0038(9) C30A 0.0278(15) 0.0324(13) 0.0263(11) -0.0109(13) -0.0036(11) -0.0048(10) C31A 0.0236(17) 0.0367(18) 0.0347(15) -0.0079(16) 0.0031(15) 0.0004(11) N2A 0.0147(16) 0.0246(19) 0.0227(18) -0.0086(9) -0.0066(6) -0.0006(6) C32A 0.0242(17) 0.0328(15) 0.0273(15) -0.0130(13) -0.0041(11) -0.0046(9) C33A 0.0233(13) 0.0275(12) 0.0253(12) -0.0085(9) -0.0014(9) -0.0070(10) C34A 0.0201(11) 0.0227(11) 0.0220(11) -0.0084(9) 0.0014(9) -0.0036(10) C35A 0.0245(16) 0.0275(15) 0.0307(13) -0.0107(14) -0.0042(11) -0.0093(11) C36A 0.026(2) 0.033(2) 0.0403(18) -0.0095(18) 0.0041(15) -0.0109(14) C37A 0.0157(9) 0.0250(9) 0.0315(10) -0.0057(7) -0.0020(7) -0.0027(7) C38A 0.0200(10) 0.0263(10) 0.0272(9) -0.0077(7) -0.0002(7) -0.0032(7) 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' O O 0.0106 0.0060 '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' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle C7 O1 H1 112.0(12) C4 O3 C8 118.44(9) C20 O4 H4 112.4(12) C17 O6 C21 118.60(10) C2 C1 C6 118.87(11) C2 C1 C7 119.36(11) C6 C1 C7 121.77(11) C3 C2 C1 121.32(11) C3 C2 H2 119.3 C1 C2 H2 119.3 C4 C3 C2 118.90(11) C4 C3 H3 120.5 C2 C3 H3 120.5 O3 C4 C3 124.47(11) O3 C4 C5 115.04(11) C3 C4 C5 120.49(11) C6 C5 C4 119.77(11) C6 C5 H5 120.1 C4 C5 H5 120.1 C5 C6 C1 120.64(11) C5 C6 H6 119.7 C1 C6 H6 119.7 O2 C7 O1 123.31(11) O2 C7 C1 123.23(12) O1 C7 C1 113.45(11) O3 C8 C9 106.79(10) O3 C8 H8A 110.4 C9 C8 H8A 110.4 O3 C8 H8B 110.4 C9 C8 H8B 110.4 H8A C8 H8B 108.6 C8 C9 C10 113.37(10) C8 C9 H9A 108.9 C10 C9 H9A 108.9 C8 C9 H9B 108.9 C10 C9 H9B 108.9 H9A C9 H9B 107.7 C9 C10 C11 112.37(10) C9 C10 H10A 109.1 C11 C10 H10A 109.1 C9 C10 H10B 109.1 C11 C10 H10B 109.1 H10A C10 H10B 107.9 C12 C11 C10 113.19(11) C12 C11 H11A 108.9 C10 C11 H11A 108.9 C12 C11 H11B 108.9 C10 C11 H11B 108.9 H11A C11 H11B 107.8 C11 C12 C13 113.36(13) C11 C12 H12A 108.9 C13 C12 H12A 108.9 C11 C12 H12B 108.9 C13 C12 H12B 108.9 H12A C12 H12B 107.7 C12 C13 H13A 109.5 C12 C13 H13B 109.5 H13A C13 H13B 109.5 C12 C13 H13C 109.5 H13A C13 H13C 109.5 H13B C13 H13C 109.5 C19 C14 C15 118.54(11) C19 C14 C20 120.46(11) C15 C14 C20 120.99(11) C16 C15 C14 121.05(11) C16 C15 H15 119.5 C14 C15 H15 119.5 C15 C16 C17 119.71(11) C15 C16 H16 120.1 C17 C16 H16 120.1 O6 C17 C18 124.65(11) O6 C17 C16 114.96(11) C18 C17 C16 120.38(11) C17 C18 C19 119.06(11) C17 C18 H18 120.5 C19 C18 H18 120.5 C14 C19 C18 121.24(11) C14 C19 H19 119.4 C18 C19 H19 119.4 O5 C20 O4 123.15(11) O5 C20 C14 123.36(11) O4 C20 C14 113.49(10) O6 C21 C22 106.50(11) O6 C21 H21A 110.4 C22 C21 H21A 110.4 O6 C21 H21B 110.4 C22 C21 H21B 110.4 H21A C21 H21B 108.6 C21 C22 C23 113.34(11) C21 C22 H22A 108.9 C23 C22 H22A 108.9 C21 C22 H22B 108.9 C23 C22 H22B 108.9 H22A C22 H22B 107.7 C22 C23 C24 112.77(11) C22 C23 H23A 109.0 C24 C23 H23A 109.0 C22 C23 H23B 109.0 C24 C23 H23B 109.0 H23A C23 H23B 107.8 C25 C24 C23 113.04(11) C25 C24 H24A 109.0 C23 C24 H24A 109.0 C25 C24 H24B 109.0 C23 C24 H24B 109.0 H24A C24 H24B 107.8 C24 C25 C26 113.35(12) C24 C25 H25A 108.9 C26 C25 H25A 108.9 C24 C25 H25B 108.9 C26 C25 H25B 108.9 H25A C25 H25B 107.7 C25 C26 H26A 109.5 C25 C26 H26B 109.5 H26A C26 H26B 109.5 C25 C26 H26C 109.5 H26A C26 H26C 109.5 H26B C26 H26C 109.5 C31A N1A C27A 115.7(4) N1A C27A C28A 125.5(5) N1A C27A H27A 117.2 C28A C27A H27A 117.2 C27A C28A C29A 118.6(3) C27A C28A H28A 120.7 C29A C28A H28A 120.7 C28A C29A C30A 117.20(19) C28A C29A C37A 118.8(2) C30A C29A C37A 124.0(2) C31A C30A C29A 118.6(3) C31A C30A H30A 120.7 C29A C30A H30A 120.7 N1A C31A C30A 124.2(4) N1A C31A H31A 117.9 C30A C31A H31A 117.9 C32A N2A C36A 117.6(5) C32A N2A H4 120.6(9) C36A N2A H4 121.7(9) N2A C32A C33A 123.5(4) N2A C32A H32A 118.2 C33A C32A H32A 118.2 C32A C33A C34A 119.4(3) C32A C33A H33A 120.3 C34A C33A H33A 120.3 C33A C34A C35A 116.8(2) C33A C34A C38A 120.3(2) C35A C34A C38A 122.9(3) C36A C35A C34A 118.6(3) C36A C35A H35A 120.7 C34A C35A H35A 120.7 N2A C36A C35A 123.9(5) N2A C36A H36A 118.0 C35A C36A H36A 118.0 C38A C37A C29A 127.8(2) C38A C37A H37A 116.1 C29A C37A H37A 116.1 C37A C38A C34A 125.7(2) C37A C38A H38A 117.1 C34A C38A H38A 117.1 C31B N1B C27B 117.7(10) N1B C27B C28B 119.9(10) N1B C27B H27B 120.0 C28B C27B H27B 120.0 C29B C28B C27B 122.4(6) C29B C28B H28B 118.8 C27B C28B H28B 118.8 C28B C29B C30B 117.0(4) C28B C29B C37B 123.8(5) C30B C29B C37B 119.2(5) C31B C30B C29B 119.9(5) C31B C30B H30B 120.1 C29B C30B H30B 120.1 C30B C31B N1B 123.1(8) C30B C31B H31B 118.5 N1B C31B H31B 118.5 C36B N2B C32B 116.8(10) C33B C32B N2B 121.6(8) C33B C32B H32B 119.2 N2B C32B H32B 119.2 C32B C33B C34B 119.8(6) C32B C33B H33B 120.1 C34B C33B H33B 120.1 C35B C34B C33B 117.5(5) C35B C34B C38B 118.5(5) C33B C34B C38B 123.9(5) C36B C35B C34B 121.4(7) C36B C35B H35B 119.3 C34B C35B H35B 119.3 C35B C36B N2B 122.6(10) C35B C36B H36B 118.7 N2B C36B H36B 118.7 C38B C37B C29B 125.2(4) C38B C37B H37B 117.4 C29B C37B H37B 117.4 C37B C38B C34B 128.2(4) C37B C38B H38B 115.9 C34B C38B H38B 115.9 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance O1 C7 1.3231(16) O1 H1 0.99(2) O2 C7 1.2172(15) O3 C4 1.3660(14) O3 C8 1.4336(14) O4 C20 1.3173(15) O4 H4 1.09(2) O5 C20 1.2155(15) O6 C17 1.3673(14) O6 C21 1.4342(15) C1 C2 1.3899(17) C1 C6 1.3929(17) C1 C7 1.4884(16) C2 C3 1.3893(16) C2 H2 0.9500 C3 C4 1.3893(17) C3 H3 0.9500 C4 C5 1.3939(17) C5 C6 1.3815(17) C5 H5 0.9500 C6 H6 0.9500 C8 C9 1.5079(16) C8 H8A 0.9900 C8 H8B 0.9900 C9 C10 1.5198(16) C9 H9A 0.9900 C9 H9B 0.9900 C10 C11 1.5250(16) C10 H10A 0.9900 C10 H10B 0.9900 C11 C12 1.5161(18) C11 H11A 0.9900 C11 H11B 0.9900 C12 C13 1.517(2) C12 H12A 0.9900 C12 H12B 0.9900 C13 H13A 0.9800 C13 H13B 0.9800 C13 H13C 0.9800 C14 C19 1.3897(16) C14 C15 1.3956(17) C14 C20 1.4857(16) C15 C16 1.3786(16) C15 H15 0.9500 C16 C17 1.3918(16) C16 H16 0.9500 C17 C18 1.3908(18) C18 C19 1.3920(17) C18 H18 0.9500 C19 H19 0.9500 C21 C22 1.5119(18) C21 H21A 0.9900 C21 H21B 0.9900 C22 C23 1.5181(17) C22 H22A 0.9900 C22 H22B 0.9900 C23 C24 1.5249(17) C23 H23A 0.9900 C23 H23B 0.9900 C24 C25 1.5152(17) C24 H24A 0.9900 C24 H24B 0.9900 C25 C26 1.5236(18) C25 H25A 0.9900 C25 H25B 0.9900 C26 H26A 0.9800 C26 H26B 0.9800 C26 H26C 0.9800 N1A C31A 1.319(5) N1A C27A 1.326(5) C27A C28A 1.367(5) C27A H27A 0.9500 C28A C29A 1.385(3) C28A H28A 0.9500 C29A C30A 1.395(4) C29A C37A 1.467(3) C30A C31A 1.391(4) C30A H30A 0.9500 C31A H31A 0.9500 N2A C32A 1.317(5) N2A C36A 1.324(6) C32A C33A 1.381(5) C32A H32A 0.9500 C33A C34A 1.392(4) C33A H33A 0.9500 C34A C35A 1.404(4) C34A C38A 1.468(3) C35A C36A 1.381(6) C35A H35A 0.9500 C36A H36A 0.9500 C37A C38A 1.324(3) C37A H37A 0.9500 C38A H38A 0.9500 N1B C31B 1.367(11) N1B C27B 1.367(12) C27B C28B 1.379(10) C27B H27B 0.9500 C28B C29B 1.373(6) C28B H28B 0.9500 C29B C30B 1.393(6) C29B C37B 1.458(6) C30B C31B 1.358(8) C30B H30B 0.9500 C31B H31B 0.9500 N2B C36B 1.355(12) N2B C32B 1.381(12) C32B C33B 1.374(8) C32B H32B 0.9500 C33B C34B 1.389(6) C33B H33B 0.9500 C34B C35B 1.372(6) C34B C38B 1.467(7) C35B C36B 1.342(10) C35B H35B 0.9500 C36B H36B 0.9500 C37B C38B 1.331(6) C37B H37B 0.9500 C38B H38B 0.9500 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 O1 H1 N1A . 0.99(2) 1.65(2) 2.635(5) 176.5(15) yes O1 H1 N1B . 0.99(2) 1.63(2) 2.616(14) 176.3(19) yes O4 H4 N2A . 1.08(3) 1.51(3) 2.584(6) 172.8(18) yes O4 H4 N2B . 1.08(3) 1.54(3) 2.618(15) 172.5(18) yes C12 H12A Cg1 1_655 0.99 2.99 3.720(2) 132 yes C24 H24A Cg2 1_455 0.99 2.93 3.838(2) 154 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 C6 C1 C2 C3 0.13(16) C7 C1 C2 C3 -179.81(9) C1 C2 C3 C4 0.25(16) C8 O3 C4 C3 -3.85(15) C8 O3 C4 C5 176.62(10) C2 C3 C4 O3 -179.65(9) C2 C3 C4 C5 -0.14(16) O3 C4 C5 C6 179.21(10) C3 C4 C5 C6 -0.35(17) C4 C5 C6 C1 0.74(17) C2 C1 C6 C5 -0.63(16) C7 C1 C6 C5 179.31(10) C2 C1 C7 O2 8.78(16) C6 C1 C7 O2 -171.16(10) C2 C1 C7 O1 -171.90(9) C6 C1 C7 O1 8.17(15) C4 O3 C8 C9 -175.16(9) O3 C8 C9 C10 178.95(9) C8 C9 C10 C11 179.73(9) C9 C10 C11 C12 -177.26(10) C10 C11 C12 C13 176.62(10) C19 C14 C15 C16 0.84(15) C20 C14 C15 C16 -177.99(9) C14 C15 C16 C17 -1.61(15) C21 O6 C17 C18 -3.71(15) C21 O6 C17 C16 176.94(9) C15 C16 C17 O6 -179.76(9) C15 C16 C17 C18 0.86(15) O6 C17 C18 C19 -178.68(10) C16 C17 C18 C19 0.64(16) C15 C14 C19 C18 0.70(15) C20 C14 C19 C18 179.53(10) C17 C18 C19 C14 -1.43(16) C19 C14 C20 O5 -2.65(16) C15 C14 C20 O5 176.15(11) C19 C14 C20 O4 177.81(9) C15 C14 C20 O4 -3.39(14) C17 O6 C21 C22 -179.01(9) O6 C21 C22 C23 175.75(9) C21 C22 C23 C24 178.72(9) C22 C23 C24 C25 176.43(9) C23 C24 C25 C26 175.91(10) C31A N1A C27A C28A 0.6(9) N1A C27A C28A C29A -0.5(7) C27A C28A C29A C30A 0.0(4) C27A C28A C29A C37A 179.2(3) C28A C29A C30A C31A 0.3(4) C37A C29A C30A C31A -178.9(3) C27A N1A C31A C30A -0.2(9) C29A C30A C31A N1A -0.2(7) C36A N2A C32A C33A -3.3(10) N2A C32A C33A C34A 2.1(7) C32A C33A C34A C35A 0.4(4) C32A C33A C34A C38A -178.8(3) C33A C34A C35A C36A -1.5(5) C38A C34A C35A C36A 177.7(4) C32A N2A C36A C35A 2.1(11) C34A C35A C36A N2A 0.3(10) C28A C29A C37A C38A -175.75(18) C30A C29A C37A C38A 3.4(3) C29A C37A C38A C34A -179.43(16) C33A C34A C38A C37A -176.93(18) C35A C34A C38A C37A 4.0(3) C31B N1B C27B C28B -3(2) N1B C27B C28B C29B 3.9(17) C27B C28B C29B C30B -2.1(10) C27B C28B C29B C37B 177.1(8) C28B C29B C30B C31B 0.1(9) C37B C29B C30B C31B -179.2(6) C29B C30B C31B N1B 0.3(14) C27B N1B C31B C30B 1(2) C36B N2B C32B C33B 5(2) N2B C32B C33B C34B -3.4(14) C32B C33B C34B C35B 0.5(8) C32B C33B C34B C38B -178.1(5) C33B C34B C35B C36B 0.4(10) C38B C34B C35B C36B 179.0(7) C34B C35B C36B N2B 1.7(17) C32B N2B C36B C35B -5(2) C28B C29B C37B C38B -3.2(6) C30B C29B C37B C38B 175.9(4) C29B C37B C38B C34B 179.3(3) C35B C34B C38B C37B -168.6(4) C33B C34B C38B C37B 10.0(7) _cod_database_fobs_code 2241940