#------------------------------------------------------------------------------ #$Date: 2023-05-06 11:48:43 +0100 (Sat, 06 May 2023) $ #$Revision: 283595 $ #$URL: svn://www.crystallography.net/cod/cif/2/24/42/2244241.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_2244241 loop_ _publ_author_name 'Sielaff, Elizabeth N.' 'Staples, Richard J.' 'Biros, Shannon M.' _publ_section_title ; Crystal structure of tert-butyl 3,6-di-iodo-carbazole-9-carboxyl-ate. ; _journal_coeditor_code WM5676 _journal_issue 'Pt 4' _journal_name_full 'Acta crystallographica. Section E, Crystallographic communications' _journal_page_first 345 _journal_page_last 348 _journal_paper_doi 10.1107/S205698902300230X _journal_volume 79 _journal_year 2023 _chemical_formula_iupac 'C17 H15 I2 N O2' _chemical_formula_moiety 'C17 H15 I2 N O2' _chemical_formula_sum 'C17 H15 I2 N O2' _chemical_formula_weight 519.10 _chemical_name_systematic ; tert-Butyl 3,6-diiodocarbazole-9-carboxylate ; _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_method ; Olex2 1.5 (compiled 2023.02.24 svn.rf166f9f3 for OlexSys, GUI svn.r6725) ; _cell_angle_alpha 65.618(4) _cell_angle_beta 78.588(3) _cell_angle_gamma 74.826(4) _cell_formula_units_Z 2 _cell_length_a 6.9611(3) _cell_length_b 11.9737(5) _cell_length_c 12.0697(4) _cell_measurement_reflns_used 6514 _cell_measurement_temperature 100.00(14) _cell_measurement_theta_max 79.2630 _cell_measurement_theta_min 4.0450 _cell_volume 879.72(7) _computing_cell_refinement ; CrysAlisPro (Oxford Diffraction, 2006) ; _computing_data_collection ; CrysAlisPro (Oxford Diffraction, 2006) ; _computing_data_reduction ; CrysAlisPro (Oxford Diffraction, 2006) ; _computing_molecular_graphics ; CrystalMaker (Palmer, 2007) ; _computing_publication_material ; Olex2 (Dolomanov et al., 2009; Bourhis et al., 2015) ; _computing_structure_refinement ; SHELXL (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXT (Sheldrick, 2015a) ; _diffrn_ambient_temperature 100.00(14) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.970 _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'XtaLAB Synergy, Dualflex, HyPix' _diffrn_measurement_method '\w scans' _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Cu K\a' _diffrn_radiation_wavelength 1.54184 _diffrn_reflns_av_R_equivalents 0.0383 _diffrn_reflns_av_unetI/netI 0.0422 _diffrn_reflns_limit_h_max 8 _diffrn_reflns_limit_h_min -8 _diffrn_reflns_limit_k_max 15 _diffrn_reflns_limit_k_min -15 _diffrn_reflns_limit_l_max 12 _diffrn_reflns_limit_l_min -15 _diffrn_reflns_number 10800 _diffrn_reflns_theta_full 67.684 _diffrn_reflns_theta_max 79.966 _diffrn_reflns_theta_min 4.042 _diffrn_source 'micro-focus sealed X-ray tube' _exptl_absorpt_coefficient_mu 28.127 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.75563 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (CrysAlisPro; Oxford Diffraction, 2006) ; _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 1.960 _exptl_crystal_description irregular _exptl_crystal_F_000 492 _exptl_crystal_size_max 0.112 _exptl_crystal_size_mid 0.055 _exptl_crystal_size_min 0.024 _refine_diff_density_max 0.740 _refine_diff_density_min -1.168 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.080 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 202 _refine_ls_number_reflns 3717 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.080 _refine_ls_R_factor_all 0.0391 _refine_ls_R_factor_gt 0.0329 _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^)+(0.0414P)^2^+2.1415P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0869 _refine_ls_wR_factor_ref 0.0899 _reflns_number_gt 3209 _reflns_number_total 3717 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file wm5676sup1.cif _cod_data_source_block I _cod_depositor_comments 'Adding full bibliography for 2244241.cif.' _cod_original_cell_volume 879.71(7) _cod_database_code 2244241 _cod_database_fobs_code 2244241 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_min 0.145 _shelx_estimated_absorpt_t_max 0.552 _shelx_hkl_file ; 0 0 -1 3513.24 175.743 10 0 0 -2 4080.01 209.936 11 0 0 -2 4195.83 231.607 10 0 0 -2 4455.75 209.912 9 0 0 -3 819.556 78.4633 11 0 0 -3 1059.50 98.2400 7 0 0 -3 755.894 106.613 10 0 0 -4 3005.43 181.953 11 0 0 -4 2872.34 222.288 10 0 0 -4 3116.00 202.323 7 0 0 -4 3139.68 183.985 8 0 0 -5 1697.11 130.679 8 0 0 -5 1698.50 176.082 10 0 0 -5 1656.18 154.563 7 0 0 -6 28831.9 1304.78 15 0 0 -6 27769.3 1380.83 7 0 0 -6 30944.4 1352.28 8 0 0 -7 3799.87 282.445 7 0 0 -7 3793.64 247.240 8 0 0 -8 14402.8 690.829 35 0 0 -8 12938.7 766.218 7 0 0 -8 15661.4 688.432 30 0 0 -8 13116.9 676.943 40 0 0 -8 15576.4 698.846 37 0 0 -8 15443.8 686.670 42 0 0 -9 93.1733 60.2432 35 0 0 -9 119.461 60.7202 37 0 0 -9-12.7488 51.2851 30 0 0 -9 66.4404 57.0341 39 0 0 -9 60.3655 42.1390 23 0 0 -9 105.181 49.7859 42 0 0 -10 460.823 60.8151 23 0 0 -10 555.813 81.7179 39 0 0 -10 384.133 79.0874 37 0 0 -10 396.377 68.4977 42 0 0 -11-17.0321 29.0139 23 0 0 -11 53.0751 59.1087 39 0 0 -11 14.1935 58.2613 37 0 0 -11-5.82327 49.1165 42 0 0 -12 4187.10 223.473 39 0 0 -12 4419.51 226.823 37 0 0 -12 3904.86 223.849 48 0 0 -13 1530.91 99.5319 49 0 0 -13 1580.96 103.236 48 0 1 -13 725.024 56.6378 48 0 1 -12 709.648 75.8512 37 0 1 -12 623.932 73.0369 48 0 1 -12 610.107 67.0479 49 0 1 -11 185.021 48.0154 42 0 1 -11 269.300 64.8937 37 0 1 -11 298.235 67.1290 48 0 1 -10 2344.60 155.607 30 0 1 -10 1738.52 129.647 23 0 1 -10 1883.45 142.879 42 0 1 -10 2120.86 157.414 48 0 1 -10 1875.88 156.054 37 0 1 -9 4177.98 245.710 28 0 1 -9 4971.43 261.632 30 0 1 -9 4595.65 252.450 42 0 1 -9 4409.15 243.602 23 0 1 -9 4906.90 260.001 40 0 1 -9 4827.51 270.002 37 0 1 -9 4672.70 263.449 48 0 1 -8 12329.8 592.194 48 0 1 -8 11252.4 575.978 28 0 1 -8 12532.3 587.916 30 0 1 -8 10658.8 680.709 7 0 1 -8 12611.5 583.263 22 0 1 -8 12469.1 574.596 23 0 1 -8 12916.6 584.090 42 0 1 -8 12880.5 597.157 37 0 1 -8 11922.2 582.341 40 0 1 -8 11985.3 574.391 19 0 1 -7 3305.20 277.570 7 0 1 -6 5061.54 264.260 15 0 1 -6 5250.07 351.000 7 0 1 -5 995.028 73.8785 16 0 1 -5 891.586 76.4675 15 0 1 -5 927.257 131.459 7 0 1 -4 2418.47 147.027 8 0 1 -4 1904.19 185.178 10 0 1 -4 1954.09 177.341 7 0 1 -3 4206.47 197.364 8 0 1 -3 3879.30 239.231 10 0 1 -3 3981.69 234.760 7 0 -1 2 38413.9 1699.68 3 0 1 -2 38827.1 1698.21 2 0 1 -1 3364.59 164.275 2 0 -1 1 3148.29 164.848 3 0 1 0 3517.36 175.965 7 0 1 1 3604.92 175.902 2 0 -1 -1 3484.24 162.864 10 0 1 2 68.9082 28.4894 2 0 -1 -2-12.0595 31.3981 3 0 -1 -2 14.9289 39.9661 10 0 -1 -3 70.3357 24.2394 3 0 1 3 54.4056 23.2171 2 0 -1 -3 100.169 45.1928 9 0 -1 -3 52.4746 68.4138 10 0 -1 -3 103.889 64.8354 11 0 -1 -4 28747.2 1413.46 11 0 -1 -4 28687.4 1428.22 10 0 -1 -5 1332.77 152.309 10 0 -1 -5 1230.29 119.370 7 0 -1 -5 1331.50 113.383 9 0 -1 -6 29923.6 1335.83 16 0 -1 -6 30046.3 1397.78 7 0 -1 -7 739.301 70.8186 16 0 -1 -7 566.592 99.8445 7 0 -1 -7 886.316 109.638 8 0 -1 -8 221.571 77.4131 7 0 -1 -8 214.045 63.4680 8 0 -1 -8 270.463 52.7248 16 0 -1 -9 56.8885 49.2721 39 0 -1 -9 84.7444 51.5351 37 0 -1 -9-13.8071 47.8369 35 0 -1 -9 67.1773 48.4796 30 0 -1 -9 49.8460 47.6640 42 0 -1 -9 64.7608 57.4454 48 0 -1 -10 4323.27 254.036 35 0 -1 -10 4228.08 232.000 23 0 -1 -10 4528.66 248.187 42 0 -1 -10 4208.66 252.648 48 0 -1 -10 4266.18 232.922 50 0 -1 -10 4249.65 247.469 39 0 -1 -10 4482.67 253.201 37 0 -1 -11 862.205 99.4489 37 0 -1 -11 940.823 80.5489 23 0 -1 -11 933.855 108.538 48 0 -1 -11 980.820 97.7508 42 0 -1 -11 1198.50 106.655 39 0 -1 -12 9862.64 478.252 48 0 -1 -12 9385.31 466.520 42 0 -1 -12 10149.6 475.017 39 0 -1 -12 9279.23 471.571 37 0 -1 -13 420.676 51.4002 42 0 -1 -13 512.558 68.3418 48 0 -1 -13 497.491 59.2707 37 0 -1 -14 666.529 49.2982 49 0 2 -12 201.219 41.8361 48 0 2 -12 237.209 50.5523 37 0 2 -11 2747.25 165.638 49 0 2 -11 2882.93 171.580 48 0 2 -11 3008.91 181.007 37 0 2 -10 3438.66 219.967 42 0 2 -10 4103.42 237.633 30 0 2 -10 3934.76 236.910 48 0 2 -10 4060.62 244.631 37 0 2 -10 4249.40 240.814 39 0 2 -9 10016.1 479.671 37 0 2 -9 9830.65 469.155 40 0 2 -9 9831.78 474.450 39 0 2 -9 10465.8 475.273 30 0 2 -9 9296.08 462.049 28 0 2 -9 8743.96 451.069 33 0 2 -9 9166.79 452.250 23 0 2 -9 9904.69 473.097 48 0 2 -9 9292.07 459.172 42 0 2 -9 8618.46 455.007 45 0 2 -8 1519.87 117.759 45 0 2 -8 1664.74 118.512 42 0 2 -8 1707.21 123.294 28 0 2 -8 1364.04 109.503 33 0 2 -8 1560.15 124.156 30 0 2 -8 1310.03 190.525 7 0 2 -8 1740.28 127.259 22 0 2 -8 1772.43 115.851 23 0 2 -8 1839.86 131.238 48 0 2 -8 1271.01 124.956 40 0 2 -7 302.947 59.5060 35 0 2 -7 313.147 58.8621 30 0 2 -7 335.270 59.9754 28 0 2 -7 351.993 59.1116 22 0 2 -7 108.813 82.2813 40 0 2 -7 284.931 104.668 7 0 2 -7 334.901 59.5083 46 0 2 -6-58.3455 85.8538 7 0 2 -5 2547.85 151.262 15 0 2 -5 2433.31 222.929 7 0 2 -4 18520.1 926.624 7 0 -2 3 29698.3 1363.90 3 0 2 -3 31390.9 1365.27 2 0 2 -3 31102.2 1434.41 7 0 -2 2 31127.1 1416.11 3 0 2 -2 31132.5 1411.72 2 0 2 -2 33260.3 1450.02 10 0 2 -1 9202.50 445.778 2 0 -2 1 8624.56 446.551 3 0 2 -1 9787.36 453.377 10 0 2 -1 9508.58 465.866 7 0 2 0 124.193 51.5110 7 0 2 1 303.195 64.0821 2 0 -2 -1 292.496 58.4936 11 0 2 2 5482.51 273.979 2 0 -2 -2 5116.79 245.977 10 0 -2 -3 11344.6 520.588 3 0 2 3 11255.6 517.739 2 0 -2 -3 10205.6 516.891 10 0 -2 -4 41947.0 1967.71 11 0 -2 -4 44397.8 1920.98 3 0 2 4 44263.6 1919.34 2 0 -2 -4 40522.3 1950.24 10 0 -2 -5 7092.08 351.642 9 0 -2 -5 6272.89 364.043 10 0 -2 -5 5961.09 294.890 3 0 -2 -5 6399.87 371.604 11 0 -2 -6 2059.14 160.197 9 0 -2 -6 1663.12 142.306 7 0 -2 -7 565.281 59.7134 16 0 -2 -7 411.380 82.1561 7 0 -2 -8 3659.67 200.319 16 0 -2 -8 3282.42 257.039 8 0 -2 -9 258.729 75.4972 8 0 -2 -9 278.611 60.0777 35 0 -2 -9 320.714 61.9558 37 0 -2 -9 263.141 68.3653 48 0 -2 -9 264.798 57.8763 39 0 -2 -9 290.765 61.7884 16 0 -2 -10 14247.6 698.569 35 0 -2 -10 14629.6 695.985 42 0 -2 -10 14315.0 702.216 48 0 -2 -10 15198.5 697.377 39 0 -2 -10 14594.2 696.486 37 0 -2 -11 305.055 72.5661 35 0 -2 -11 321.958 66.4734 37 0 -2 -11 271.400 52.3373 23 0 -2 -11 257.022 54.9455 50 0 -2 -11 355.243 77.3628 48 0 -2 -11 296.366 66.5998 42 0 -2 -11 332.041 72.0224 39 0 -2 -12 3486.93 216.314 48 0 -2 -12 3721.53 211.374 42 0 -2 -12 3622.33 209.741 37 0 -2 -13 52.6535 40.8117 42 0 -2 -13 57.8515 37.2638 37 0 -2 -13 92.2839 52.3793 48 0 -2 -14 467.420 50.3791 48 0 3 -11 7493.34 365.434 39 0 3 -10 370.358 68.0001 30 0 3 -10 516.561 70.9735 48 0 3 -10 467.606 58.3446 49 0 3 -10 336.111 68.7756 39 0 3 -9 4473.55 247.991 39 0 3 -9 4479.92 254.423 37 0 3 -9 4010.38 241.553 40 0 3 -9 4501.19 243.738 28 0 3 -9 4947.64 250.207 30 0 3 -9 3774.75 225.433 33 0 3 -9 4128.60 225.010 23 0 3 -9 4571.11 240.533 49 0 3 -9 4324.20 241.807 48 0 3 -9 4095.54 228.231 42 0 3 -9 4279.72 235.916 45 0 3 -8 757.983 103.591 40 0 3 -8 895.484 103.658 37 0 3 -8 919.125 87.9081 33 0 3 -8 915.999 96.4105 30 0 3 -8 1119.76 100.158 28 0 3 -8 1031.88 177.989 7 0 3 -8 942.794 85.5838 23 0 3 -8 930.142 98.6223 22 0 3 -8 1022.03 88.3238 42 0 3 -8 1095.94 97.9407 45 0 3 -8 1060.98 98.7864 48 0 3 -7 478.430 73.0415 37 0 3 -7 358.200 62.8402 30 0 3 -7 294.998 54.9204 33 0 3 -7 165.524 60.1830 28 0 3 -7 406.117 56.0404 23 0 3 -7 305.106 66.5455 22 0 3 -7 334.333 62.6555 45 0 3 -7 338.509 55.3723 42 0 3 -7 299.016 113.034 7 0 3 -7 474.000 66.3522 48 0 3 -7 349.443 62.0308 46 0 3 -6 1430.31 194.525 7 0 3 -5 15040.5 704.412 15 0 3 -5 15565.5 828.896 7 0 3 -4 8367.06 402.153 15 0 3 -4 8399.00 506.900 7 0 3 -3 14423.7 680.491 2 0 -3 3 14333.8 681.213 3 0 3 -2 3833.62 223.477 2 0 -3 2 3679.73 224.153 3 0 -3 1 814.841 98.4695 3 0 3 -1 756.732 90.5403 2 0 3 -1 854.723 113.677 7 0 3 0 5375.09 300.609 2 0 -3 0 4994.92 300.740 3 0 3 0 5843.74 306.470 7 0 3 1 22304.6 1038.69 2 0 3 2 31155.8 1423.83 2 0 3 3 13035.9 648.150 2 0 -3 -3 13792.3 652.665 3 0 3 4 17542.6 820.993 2 0 -3 -4 17346.6 822.109 3 0 -3 -5 1674.45 179.754 11 0 3 5 1947.24 136.590 2 0 -3 -5 2136.61 141.379 3 0 -3 -6 138.961 36.0063 3 0 -3 -6 184.954 72.4200 9 0 -3 -7 2083.59 183.864 9 0 -3 -8 19332.3 970.658 9 0 -3 -8 19417.4 887.786 16 0 -3 -9 7445.96 373.485 48 0 -3 -9 7087.30 373.849 21 0 -3 -9 7014.88 365.156 37 0 -3 -9 7608.52 366.953 39 0 -3 -9 7290.92 365.826 16 0 -3 -9 6756.18 365.343 35 0 -3 -9 7318.80 455.258 8 0 -3 -10 6557.61 336.646 35 0 -3 -10 6151.16 329.957 16 0 -3 -10 6157.79 329.693 39 0 -3 -10 5935.65 325.509 37 0 -3 -10 6528.16 338.055 48 0 -3 -11 95.1752 57.8812 35 0 -3 -11 94.4379 51.5806 37 0 -3 -11 155.215 63.4660 48 0 -3 -11 93.3835 60.4239 42 0 -3 -11 72.8681 55.4517 39 0 -3 -12 198.379 44.8303 23 0 -3 -12 192.628 60.9171 35 0 -3 -12 169.389 52.7434 37 0 -3 -12 234.469 63.3676 42 0 -3 -12 336.741 71.4388 48 0 -3 -12 154.876 49.4699 50 0 -3 -13 226.773 47.1646 37 0 -3 -13 376.516 61.0139 42 0 -3 -13 303.919 62.9800 48 0 -3 -14 1626.43 102.240 42 0 -3 -14 1708.94 108.073 48 0 -3 -14 1954.15 112.893 49 0 4 -11 2679.84 143.512 39 0 4 -10 129.020 51.9953 39 0 4 -10 188.452 50.9859 30 0 4 -9 122.244 55.1763 30 0 4 -9 300.328 70.3128 28 0 4 -9 131.876 60.0369 37 0 4 -9 127.694 59.4930 39 0 4 -9 147.223 45.5951 48 0 4 -8-14.3735 53.1374 37 0 4 -8-47.5978 52.6309 30 0 4 -8-6.72384 60.4690 28 0 4 -8 24.4171 37.7994 23 0 4 -8-6.82603 55.7273 22 0 4 -8-6.52216 50.1664 45 0 4 -8-55.9557 44.6441 48 0 4 -8 26.3312 37.8566 49 0 4 -7 15793.5 711.439 37 0 4 -7 15093.8 699.759 33 0 4 -7 15300.7 707.456 30 0 4 -7 14484.7 706.752 28 0 4 -7 13577.6 850.865 7 0 4 -7 15730.1 709.950 45 0 4 -7 15674.8 710.763 22 0 4 -7 13875.0 690.304 23 0 4 -7 14709.7 698.154 46 0 4 -7 14364.8 694.756 48 0 4 -7 14664.3 688.169 20 0 4 -6 1307.00 108.880 37 0 4 -6 1215.23 101.392 33 0 4 -6 971.300 103.197 28 0 4 -6 1040.88 180.939 7 0 4 -6 1297.72 94.2625 20 0 4 -6 1076.57 107.063 22 0 4 -6 1310.88 98.6479 23 0 4 -6 1257.53 96.2262 44 0 4 -6 1228.07 108.196 45 0 4 -6 1214.54 97.8219 46 0 4 -6 1231.18 97.0732 48 0 4 -6 1325.49 108.710 47 0 4 -5 20632.0 1095.84 7 0 4 -4 715.397 74.3314 15 0 4 -4 912.303 155.676 7 0 4 -3 369.718 52.8202 15 0 -4 3 376.412 69.8875 3 0 4 -3 424.344 71.8801 2 0 4 -2 1118.72 156.659 7 0 -4 2 1249.12 124.204 3 0 4 -2 1110.09 116.261 2 0 4 -1 19292.1 934.345 7 0 -4 1 18960.3 912.465 3 0 4 -1 18562.9 906.972 2 0 4 0 7003.88 378.146 7 0 4 0 6113.86 366.525 2 0 -4 0 6485.71 370.974 3 0 -4 -1 27651.9 1294.10 3 0 4 2 11918.0 611.632 2 0 4 3 13447.3 692.280 2 0 -4 -3 14240.8 695.243 3 0 4 4 79.4499 74.4898 2 0 -4 -4 61.4110 73.1014 3 0 -4 -5 6617.17 380.316 3 0 4 5 7364.46 384.718 2 0 -4 -6 7440.35 409.758 3 0 4 6 8242.30 414.937 2 0 -4 -7 13750.0 726.508 9 0 -4 -8 10753.0 604.188 9 0 -4 -9 4505.90 239.602 16 0 -4 -9 4362.33 238.352 39 0 -4 -9 4088.24 315.780 9 0 -4 -9 4228.22 241.082 35 0 -4 -9 4248.39 241.348 48 0 -4 -10 3048.06 265.196 8 0 -4 -10 2785.75 182.724 48 0 -4 -10 3022.52 179.843 16 0 -4 -10 2599.00 178.698 35 0 -4 -11 13.4579 49.4120 16 0 -4 -11 7.00058 55.5250 48 0 -4 -11 14.1175 52.9025 35 0 -4 -12 4709.82 255.349 42 0 -4 -12 4461.23 250.744 48 0 -4 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14 7 2506.71 136.342 27 -1 -14 -8 3560.72 176.048 34 1 14 8 3335.01 172.337 38 1 14 8 3637.47 179.933 27 -1 -14 -9 2296.04 120.989 34 1 14 9 2255.22 120.313 27 -1 -14 -10 613.018 45.0611 34 -1 -15 -5 227.776 22.9360 6 -1 -15 -6 2750.13 132.800 6 -1 -15 -7 623.651 38.7227 6 1 15 7 585.666 40.3932 27 2 -13 -8 1097.76 61.1090 24 2 -13 -7 175.559 25.8219 24 -2 13 7 204.888 26.1240 27 2 -13 -6 348.072 32.7513 24 -2 13 6 316.577 32.2404 27 2 -13 -5 725.374 46.8328 24 -2 13 5 750.987 49.0005 44 -2 13 5 646.303 49.0511 47 -2 13 4 5318.34 245.817 44 -2 13 4 5104.29 244.927 47 -2 13 3 1494.37 84.5776 44 -2 13 3 1498.75 83.7487 47 -2 13 2 3094.04 143.699 44 -2 13 2 2757.56 140.759 47 -2 12 10 609.854 42.5098 27 -2 12 9 994.433 66.9235 27 2 -12 -8 9.43768 31.5159 24 -2 12 7 1150.93 80.7487 27 2 -12 -7 1010.63 78.7553 24 -2 12 6 3202.93 169.536 27 -2 12 6 2913.01 166.980 13 2 -12 -6 3238.42 170.080 24 -2 12 5 4886.72 244.233 27 -2 12 5 4723.76 243.725 13 2 -12 -5 5044.98 246.392 24 -2 12 4 4110.40 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411.221 22 -2 9 -3 8188.86 404.566 44 -2 9 -4 281.902 60.2540 22 -2 9 -4 362.100 57.0519 28 -2 9 -4 339.460 61.1827 47 -2 9 -4 283.661 50.2342 44 -2 9 -5 5880.09 296.959 28 -2 9 -5 6187.61 301.519 22 -2 9 -5 6292.24 301.319 47 -2 9 -6 487.283 52.2326 40 -2 9 -6 889.955 59.1297 22 2 -8 -13 230.366 33.0151 50 2 -8 -12 806.032 63.1289 16 2 -8 -12 781.595 57.0295 35 2 -8 -11 6852.45 339.896 16 2 -8 -11 6874.13 334.315 35 2 -8 -10 1717.66 119.392 35 2 -8 -10 1791.85 116.729 24 2 -8 -10 1718.21 130.738 21 2 -8 -9 5411.65 291.253 24 2 -8 -9 5794.54 305.504 21 2 -8 -8 2062.91 152.022 43 2 -8 -8 1680.99 137.219 21 2 -8 -8 2175.70 141.095 24 2 -8 -7 25.0237 78.0908 3 2 -8 -7 84.8548 84.8028 9 2 -8 -7 41.2022 49.7408 21 2 -8 -7 7.63786 56.8768 43 2 -8 -6 55.4066 96.1354 3 2 -8 -6 305.604 122.778 9 2 -8 -6 165.308 52.3514 21 2 -8 -6 154.848 63.8547 43 2 -8 -5 12641.5 765.839 3 2 -8 -5 10428.3 717.487 9 -2 8 5 12630.2 586.988 17 2 -8 -5 12254.0 593.981 43 2 -8 -4 392.919 134.940 3 2 -8 -4 507.494 72.6132 43 2 -8 -4 468.359 126.070 9 -2 8 4 459.287 73.9305 17 -2 8 3 12720.4 615.458 25 2 -8 -3 14401.5 816.719 3 -2 8 3 13287.6 622.949 17 2 -8 -3 12925.6 611.426 43 -2 8 2 1426.83 122.194 17 2 -8 -2 1625.44 232.504 3 -2 8 1 217.765 66.8691 17 2 -8 -1 151.536 117.679 3 -2 8 1 228.377 64.3498 25 -2 8 1 228.641 50.9813 27 2 -8 0 29.1709 104.086 3 -2 8 0 17.0434 40.5540 13 -2 8 0 26.0527 52.8832 25 -2 8 0 28.9129 39.3540 27 -2 8 -1 8750.68 407.265 13 -2 8 -1 7696.22 407.291 28 2 -8 1 8051.51 560.535 3 -2 8 -1 8448.74 420.046 17 -2 8 -1 8035.78 409.152 45 -2 8 -2 168.275 66.3279 22 -2 8 -2 243.885 62.9031 28 -2 8 -2 199.496 57.9445 45 -2 8 -2 215.316 59.4005 17 -2 8 -2 162.931 43.9571 13 -2 8 -3 14764.5 710.980 28 -2 8 -3 14715.5 708.047 17 -2 8 -3 15352.8 718.604 22 -2 8 -3 15629.6 718.394 47 -2 8 -3 14880.1 712.531 45 -2 8 -4 91.9334 59.9499 22 -2 8 -4 199.721 55.0562 44 -2 8 -4 88.6847 57.0723 45 -2 8 -4 174.725 62.1923 47 -2 8 -4 196.874 67.0230 28 -2 8 -5 1872.48 122.953 44 -2 8 -5 2005.29 140.709 45 -2 8 -5 2203.07 139.880 28 -2 8 -5 2378.96 146.091 22 -2 8 -5 2024.46 138.777 47 -2 8 -6 8.91031 45.6754 22 -2 8 -6 39.0725 44.6704 28 -2 8 -6 107.852 44.0248 47 -2 8 -7 1382.62 90.4418 40 -2 8 -7 1759.14 99.7851 28 2 -7 -13 1127.98 70.3559 50 2 -7 -13 1246.99 74.0548 42 2 -7 -12 3172.10 168.474 35 2 -7 -12 2992.70 170.036 16 2 -7 -11 2241.41 145.607 35 2 -7 -11 2254.75 146.937 16 2 -7 -11 2576.82 161.972 21 2 -7 -10 3820.74 224.412 21 2 -7 -10 3566.17 196.956 24 2 -7 -9 45.3382 54.9010 43 2 -7 -9 142.997 66.8101 21 2 -7 -9 132.951 49.3353 24 2 -7 -8 2824.89 173.728 24 2 -7 -8 2769.08 187.259 21 2 -7 -8 2588.47 282.637 9 2 -7 -7 2232.44 266.243 9 2 -7 -7 2739.24 186.403 43 2 -7 -7 3196.88 191.011 21 2 -7 -7 2512.36 261.718 3 2 -7 -6 4768.22 408.426 9 2 -7 -6 5730.43 303.676 43 2 -7 -6 4839.38 409.869 3 2 -7 -6 5682.25 300.130 21 2 -7 -5 9668.67 632.866 9 2 -7 -5 11097.3 670.377 3 2 -7 -5 9911.96 502.125 21 -2 7 5 10847.7 497.802 17 2 -7 -5 10300.2 508.923 43 2 -7 -4 2996.29 300.896 3 -2 7 4 2442.55 157.886 17 2 -7 -4 2661.79 163.938 43 2 -7 -3 6243.40 438.455 9 -2 7 3 6841.22 342.657 17 2 -7 -3 6468.29 335.404 43 2 -7 -2-27.8529 102.259 3 2 -7 -2-18.4988 61.9992 9 -2 7 2 19.5153 50.6632 17 -2 7 1 2152.95 146.845 17 -2 7 1 2146.10 142.135 25 2 -7 0 3203.65 320.412 3 -2 7 0 3057.76 191.978 17 -2 7 0 2936.36 172.989 27 -2 7 0 3354.67 189.728 25 -2 7 -1 11532.6 581.776 28 -2 7 -1 12127.9 583.380 25 -2 7 -1 11989.7 587.810 17 -2 7 -1 12593.1 582.250 45 2 -7 1 11841.7 734.574 3 -2 7 -1 12639.8 577.865 13 -2 7 -2 1221.92 115.065 28 -2 7 -2 1555.99 122.429 17 -2 7 -2 1615.08 121.568 45 2 -7 2 1696.65 212.570 3 -2 7 -2 1516.65 109.666 13 -2 7 -3 7930.04 400.947 28 -2 7 -3 7675.76 404.056 22 -2 7 -3 7782.94 399.185 45 -2 7 -3 7630.76 392.500 17 -2 7 -4-7.47277 62.3935 22 -2 7 -4 42.4251 57.1071 47 -2 7 -4 93.3427 59.9533 45 -2 7 -4 50.2327 59.9190 28 -2 7 -5 278.982 71.8250 22 -2 7 -5 331.759 70.1864 45 -2 7 -5 246.364 53.0260 44 -2 7 -5 369.156 75.2514 28 -2 7 -5 316.460 69.6813 47 -2 7 -6 190.485 63.9439 45 -2 7 -6 205.001 61.2297 28 -2 7 -6 196.654 56.9361 47 -2 7 -7 6098.34 312.792 45 -2 7 -7 6257.81 312.768 28 -2 7 -8 115.033 38.3758 22 2 -6 -13 760.670 58.4230 50 2 -6 -13 749.087 60.7748 42 2 -6 -13 690.900 58.1405 35 2 -6 -12 5373.13 276.636 16 2 -6 -12 5447.97 276.429 35 2 -6 -11 192.827 50.8618 16 2 -6 -11 203.522 66.8904 21 2 -6 -11 244.532 58.2098 35 2 -6 -10-16.1106 61.9612 21 2 -6 -9 160.541 67.5499 21 2 -6 -9 14.9029 58.9038 43 2 -6 -9 132.969 43.3505 24 2 -6 -8 4615.03 265.289 43 2 -6 -8 4354.38 266.119 21 2 -6 -8 4688.79 248.186 24 2 -6 -7 8888.10 594.995 9 2 -6 -7 8802.02 564.151 3 2 -6 -7 9841.27 478.860 21 2 -6 -6 17639.1 978.442 11 2 -6 -6 16843.4 788.381 43 2 -6 -6 15921.0 907.205 3 2 -6 -6 15991.3 915.525 9 2 -6 -6 16884.9 789.286 21 2 -6 -5 2152.78 245.009 9 2 -6 -5 2727.53 170.183 43 -2 6 4 2696.80 155.340 17 2 -6 -4 2107.08 256.213 11 2 -6 -4 2399.19 240.895 9 -2 6 3 1970.19 130.570 17 2 -6 -3 1927.42 226.672 11 2 -6 -3 1828.76 201.983 9 -2 6 2 5141.05 263.801 17 2 -6 -2 5679.50 377.811 11 -2 6 1 15650.0 713.394 17 2 -6 -1 16438.8 815.336 11 -2 6 0 12814.2 609.156 17 -2 6 -1 18284.1 838.530 13 -2 6 -2 3244.04 199.601 28 -2 6 -2 3156.46 189.821 25 -2 6 -2 3362.20 197.601 33 -2 6 -2 3485.76 188.657 13 -2 6 -2 3329.56 197.105 17 2 -6 2 3161.08 301.935 3 -2 6 -3 272.197 69.7788 33 -2 6 -3 240.168 62.3356 28 -2 6 -3 398.695 73.5891 45 -2 6 -3 269.256 52.1396 13 -2 6 -3 262.345 60.0469 17 -2 6 -4 1871.48 144.054 47 -2 6 -4 2028.29 154.917 22 -2 6 -4 1929.57 149.299 45 -2 6 -4 2047.79 148.803 33 -2 6 -4 2034.15 137.934 17 -2 6 -4 2062.99 151.548 28 -2 6 -5 3941.97 228.811 44 -2 6 -5 4640.57 253.767 45 -2 6 -5 4123.97 247.507 28 -2 6 -5 4433.35 248.740 33 -2 6 -5 4071.92 240.798 47 -2 6 -6 2816.18 175.577 28 -2 6 -6 2568.58 173.281 45 -2 6 -6 2385.90 144.515 44 -2 6 -6 2619.53 166.513 47 -2 6 -6 2137.65 144.739 30 -2 6 -7 11031.9 516.163 22 -2 6 -7 10719.0 517.547 45 -2 6 -7 10158.1 507.049 47 -2 6 -7 10439.3 515.280 28 -2 6 -8-125.529 61.2951 40 -2 6 -8 148.528 50.9690 22 -2 6 -9 1053.75 78.5821 28 2 -5 -13 146.764 36.3055 35 2 -5 -13 62.0328 31.7023 42 2 -5 -12 211.712 48.7904 16 2 -5 -12 129.006 48.9627 35 2 -5 -12 204.094 42.1869 48 2 -5 -11 64.2810 49.7609 16 2 -5 -11 19.5773 52.6799 35 2 -5 -11-9.47800 40.6062 48 2 -5 -10 5213.60 281.276 16 2 -5 -10 5125.28 282.329 35 2 -5 -10 4821.21 264.426 48 2 -5 -9 1833.50 137.783 43 2 -5 -9 1678.51 146.810 21 2 -5 -9 1852.44 236.145 8 2 -5 -8 16932.1 989.664 11 2 -5 -8 16413.8 767.410 24 2 -5 -8 16786.2 796.615 21 2 -5 -8 16788.3 787.687 43 2 -5 -7 2276.81 149.521 43 2 -5 -7 1853.09 192.921 3 2 -5 -7 2066.52 150.520 21 2 -5 -7 1553.19 251.042 11 2 -5 -7 2256.13 242.472 9 2 -5 -6 4199.26 232.403 43 2 -5 -6 3576.36 313.233 9 2 -5 -6 4198.17 321.840 3 2 -5 -6 4026.08 234.148 21 2 -5 -5 156.932 91.4919 9 2 -5 -5 24.6497 100.121 11 -2 5 4 4811.00 243.004 17 2 -5 -4 4946.22 373.476 11 2 -5 -4 4753.00 345.593 9 -2 5 3 1794.60 115.969 17 2 -5 -3 1753.26 203.016 11 2 -5 -3 2062.86 194.565 9 -2 5 2 20452.7 954.422 17 2 -5 -2 20503.1 1036.99 9 -2 5 1 11860.8 557.209 17 2 -5 -1 12629.5 651.788 11 2 -5 -1 11163.3 614.266 9 -2 5 0 6598.41 323.953 17 -2 5 0 6313.51 345.264 10 2 -5 0 5753.01 356.851 9 -2 5 -1 507.975 84.5861 10 -2 5 -2 710.784 73.9217 17 -2 5 -2 645.225 63.8446 13 2 -5 3 1158.83 161.196 3 -2 5 -3 1172.01 94.1422 17 -2 5 -3 1028.38 98.8953 28 -2 5 -3 929.880 89.9264 29 -2 5 -3 1100.10 86.5756 13 -2 5 -3 826.290 133.447 10 -2 5 -3 1060.56 93.4423 33 -2 5 -4 9032.91 442.598 33 -2 5 -4 8684.00 431.682 17 -2 5 -4 8763.60 446.690 28 -2 5 -5 11481.0 567.509 28 -2 5 -5 11003.4 561.015 33 -2 5 -5 12134.6 564.213 23 -2 5 -5 11662.9 559.650 47 -2 5 -5 11270.9 559.845 29 -2 5 -6 3068.48 200.205 28 -2 5 -6 2968.26 196.749 22 -2 5 -6 3106.94 199.149 45 -2 5 -6 2862.01 187.458 47 -2 5 -6 3039.31 177.846 30 -2 5 -7 2744.43 185.052 33 -2 5 -7 3125.33 192.298 22 -2 5 -7 3104.38 183.660 47 -2 5 -7 2859.35 169.604 30 -2 5 -8 37.1538 56.9808 28 -2 5 -8-5.78002 52.9540 22 -2 5 -8 171.941 57.6103 33 -2 5 -8-50.7534 58.8915 45 -2 5 -9 350.732 54.2664 22 -2 5 -9 263.750 54.8525 45 -2 5 -9 230.667 53.7720 28 -2 5 -10 1899.44 110.207 28 2 -4 -13 106.261 32.6898 48 2 -4 -13 111.505 38.9137 35 2 -4 -12 903.842 81.3301 42 2 -4 -12 887.661 86.7063 35 2 -4 -12 971.556 86.3199 16 2 -4 -12 899.101 79.1739 48 2 -4 -11 48.1736 54.9191 35 2 -4 -11 17.1592 50.0034 48 2 -4 -11 21.5039 59.1840 21 2 -4 -10 11711.3 732.082 8 2 -4 -10 11969.0 604.073 21 2 -4 -10 12709.8 600.561 35 2 -4 -9 1603.45 207.172 8 2 -4 -9 852.417 92.5032 43 2 -4 -8 4663.09 424.066 11 2 -4 -8 5513.15 290.731 43 2 -4 -7 280.573 126.704 11 2 -4 -7 308.966 65.3515 21 2 -4 -7 240.883 54.1939 43 2 -4 -6 1317.55 167.856 9 2 -4 -6 1393.25 204.717 11 2 -4 -5-17.3236 71.8990 9 2 -4 -4 14565.9 769.557 11 2 -4 -4 13304.8 730.383 9 2 -4 -3 3961.94 295.808 11 2 -4 -3 3736.34 270.441 9 -2 4 2 27578.5 1248.28 17 2 -4 -2 30686.5 1356.97 11 2 -4 -2 27503.5 1322.09 9 -2 4 1 48.3157 38.3840 17 2 -4 -1 63.2166 60.5159 9 2 -4 -1 26.5708 69.0125 11 -2 4 1 49.9787 34.7179 10 -2 4 0 287.218 48.8903 17 2 -4 0 239.954 61.7617 9 -2 4 0 217.474 60.4430 10 2 -4 0 303.670 76.4873 11 2 -4 1 310.763 71.6250 11 -2 4 -1 198.419 62.8829 10 -2 4 -2 7516.16 373.318 17 -2 4 -2 7937.70 369.861 13 -2 4 -2 7489.33 442.304 10 -2 4 -3 5657.51 284.652 17 -2 4 -3 5643.28 279.603 13 -2 4 -3 5046.17 361.389 10 -2 4 -4 14413.1 657.867 17 -2 4 -4 14851.5 785.676 10 -2 4 -4 13778.5 645.492 14 -2 4 -5 8051.20 410.051 28 -2 4 -5 9096.30 541.606 10 -2 4 -5 7813.09 404.371 22 -2 4 -5 7967.84 400.314 23 -2 4 -5 7604.10 395.108 47 -2 4 -5 8226.28 396.735 49 -2 4 -5 7592.90 397.566 29 -2 4 -5 8014.64 402.122 33 -2 4 -6 2494.09 166.508 23 -2 4 -6 2602.86 172.480 22 -2 4 -6 2524.08 166.221 29 -2 4 -6 2466.74 154.305 30 -2 4 -6 2492.81 162.376 49 -2 4 -6 2525.37 163.273 47 -2 4 -7 1754.71 135.555 28 -2 4 -7 1613.17 128.685 33 -2 4 -7 1634.28 127.992 23 -2 4 -7 1715.11 132.945 22 -2 4 -7 1593.28 121.811 47 -2 4 -7 1337.37 108.329 30 -2 4 -7 1358.82 119.879 29 -2 4 -8 2772.65 168.632 39 -2 4 -8 3425.27 199.452 28 -2 4 -8 2735.70 169.484 30 -2 4 -8 3184.41 197.155 45 -2 4 -8 3102.14 191.461 33 -2 4 -8 3027.58 188.627 23 -2 4 -8 3400.62 194.090 22 -2 4 -9 1779.74 125.859 33 -2 4 -9 2023.31 128.069 22 -2 4 -9 1975.39 131.484 28 -2 4 -9 1953.29 134.914 45 -2 4 -10 5632.07 281.951 28 -2 4 -10 5671.14 284.081 45 2 -3 -13 718.976 61.0629 48 2 -3 -12 4792.69 243.897 48 2 -3 -12 4530.85 247.135 35 2 -3 -12 4523.88 230.779 37 2 -3 -12 4327.50 232.708 42 2 -3 -11 1040.09 99.3086 48 2 -3 -11 1215.13 110.424 35 2 -3 -11 1011.32 93.1613 37 2 -3 -10 6972.61 519.470 8 2 -3 -10 7854.20 416.422 35 2 -3 -10 8194.85 409.013 37 2 -3 -10 8419.74 421.789 21 2 -3 -9 199.568 61.0379 37 2 -3 -9 124.125 63.5234 21 2 -3 -9 115.558 60.8887 16 2 -3 -9 77.0404 86.2741 8 2 -3 -8 2036.26 143.473 19 2 -3 -8 2538.18 253.844 8 2 -3 -8 2224.19 254.877 11 2 -3 -8 1987.67 144.692 37 2 -3 -8 2139.01 157.622 21 2 -3 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156.549 10 -2 3 -6 963.441 99.4595 28 -2 3 -6 1034.41 100.687 37 -2 3 -6 853.135 89.6803 42 -2 3 -6 850.731 88.9659 29 -2 3 -7 118.348 58.5302 37 -2 3 -7 130.187 58.3124 33 -2 3 -7 55.9766 41.3798 30 -2 3 -7 82.1338 51.5331 29 -2 3 -7 117.550 65.3397 28 -2 3 -7 191.261 50.4033 39 -2 3 -7 73.9578 53.5603 23 -2 3 -7 124.644 58.9369 22 -2 3 -7 166.172 61.0148 42 -2 3 -7 137.330 50.7460 48 -2 3 -7 82.5254 49.1839 47 -2 3 -7 161.668 55.5280 49 -2 3 -8 7766.14 387.741 28 -2 3 -8 7919.24 383.468 49 -2 3 -8 6757.59 368.101 48 -2 3 -8 7978.54 382.354 22 -2 3 -8 7321.39 380.239 23 -2 3 -8 6856.63 365.782 39 -2 3 -8 7742.03 384.468 33 -2 3 -8 7180.56 365.005 30 -2 3 -8 7312.02 374.275 29 -2 3 -9 1911.01 127.391 30 -2 3 -9 2400.98 153.058 28 -2 3 -9 2046.19 143.953 49 -2 3 -9 2087.95 148.255 33 -2 3 -9 2203.12 143.153 22 -2 3 -9 2341.16 149.095 23 -2 3 -9 2104.57 135.013 39 -2 3 -9 1722.91 137.319 40 -2 3 -9 2358.59 155.715 45 -2 3 -10 3050.61 170.828 22 -2 3 -10 3154.23 176.338 23 -2 3 -10 3061.59 175.070 28 -2 3 -10 2703.71 173.987 33 -2 3 -10 3147.76 180.133 45 2 -2 -13 1847.94 102.443 48 2 -2 -13 1464.89 86.3898 37 2 -2 -12 3558.43 204.690 48 2 -2 -12 3583.76 197.444 37 2 -2 -12 3888.77 210.454 35 2 -2 -11 3887.30 231.560 35 2 -2 -11 3837.97 214.321 42 2 -2 -11 4219.05 232.793 48 2 -2 -11 3861.33 227.244 16 2 -2 -11 3832.87 223.326 37 2 -2 -10 323.269 69.8767 16 2 -2 -10 426.435 73.8659 21 2 -2 -10 486.859 77.3290 37 2 -2 -10 288.117 71.0452 35 2 -2 -10 295.825 56.9712 39 2 -2 -9 1123.37 175.924 8 2 -2 -9 990.308 85.7239 39 2 -2 -9 782.621 92.6861 16 2 -2 -9 894.995 98.6665 21 2 -2 -9 780.455 90.5470 19 2 -2 -9 949.420 99.5279 35 2 -2 -9 817.464 99.3489 37 2 -2 -8 3130.55 209.669 37 2 -2 -8 3471.02 198.669 46 2 -2 -8 3250.13 311.714 11 2 -2 -8 3634.95 311.246 8 2 -2 -8 3221.40 211.592 21 2 -2 -8 3406.83 203.852 19 2 -2 -8 3645.36 209.328 16 2 -2 -8 3822.10 197.918 39 2 -2 -7 2418.41 166.890 21 2 -2 -7 2597.99 157.866 19 2 -2 -7 3067.39 265.987 8 2 -2 -7 2468.64 257.006 11 2 -2 -6 20154.6 1047.95 11 2 -2 -5 3444.11 215.291 1 2 -2 -5 3151.28 265.176 11 2 -2 -4 15048.0 763.170 9 2 -2 -3 137.813 67.3309 9 2 -2 -3 305.306 91.1792 11 2 -2 -2 7829.98 408.516 9 -2 2 2 7033.93 405.691 12 2 -2 -2 8055.85 425.809 11 2 -2 -1 3099.86 201.586 9 -2 2 1 3606.84 222.847 12 2 -2 0 32569.2 1468.98 9 -2 2 -1 250.693 79.4767 12 -2 2 -2 28636.2 1334.11 10 -2 2 -3 1298.49 148.759 10 -2 2 -4 163.195 82.9896 10 2 -2 4 307.747 66.8005 1 -2 2 -4 230.022 37.5462 14 -2 2 -5 101.171 97.4943 10 -2 2 -5-26.1379 32.4932 14 -2 2 -6 20218.8 1081.40 10 -2 2 -7 19.9172 50.7683 42 -2 2 -7-5.79001 45.1258 29 -2 2 -7-27.1450 57.8626 28 -2 2 -7 84.3532 111.516 10 -2 2 -7 68.4317 50.2421 23 -2 2 -7 88.2940 54.8874 22 -2 2 -7 36.7306 40.1384 47 -2 2 -7 103.111 50.0982 48 -2 2 -7 26.8552 51.3391 49 -2 2 -7 48.0385 38.1265 39 -2 2 -8 18511.9 853.579 29 -2 2 -8 17325.5 841.672 30 -2 2 -8 18516.7 860.619 28 -2 2 -8 18521.5 862.988 42 -2 2 -8 18224.3 853.355 22 -2 2 -8 18983.5 859.986 23 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49.3920 30 2 8 -7 2210.92 95.2487 40 2 8 -6 9718.64 448.381 30 2 8 -6 8810.21 431.794 31 2 8 -6 9075.07 440.837 40 2 8 -5 363.510 68.0766 30 2 8 -5 293.448 59.3758 31 2 8 -5 261.627 53.3556 46 2 8 -5 330.789 62.5711 20 2 8 -5 196.666 73.8245 40 2 8 -4 26.0563 50.1066 20 2 8 -4 5.47203 43.6614 46 2 8 -3 708.200 171.132 7 2 8 -3 518.743 74.2798 15 2 8 -3 567.788 78.2511 22 2 8 -3 514.168 78.4920 20 2 8 -3 574.152 77.3833 47 2 8 -2 8010.76 402.461 15 2 8 -2 7692.36 568.237 7 2 8 -2 7982.47 405.471 22 2 8 -2 8458.43 415.157 44 2 8 -2 7798.57 404.425 47 2 8 -1 16.2071 43.8857 38 2 8 -1 40.5371 47.8328 47 2 8 -1 110.811 45.2613 15 2 8 -1-11.7285 47.3619 27 2 8 -1 50.6007 48.1919 22 2 8 -1 138.333 104.371 7 2 8 -1 46.6838 51.6449 44 2 8 -1 21.3982 74.0867 2 -2 -8 1-19.2660 62.4023 3 2 8 0 15538.9 815.822 2 2 8 0 13863.4 667.957 27 2 8 0 13426.1 671.703 44 2 8 0 15109.8 823.782 7 2 8 0 14577.4 665.413 38 -2 -8 0 15137.3 795.467 3 2 8 1 95.3522 99.7050 2 -2 -8 -1 472.671 119.693 3 2 8 1 351.182 104.971 7 -2 -8 -2 6545.90 456.419 3 2 8 2 6678.69 427.432 7 2 8 2 7401.08 496.959 2 -2 -8 -3 111.796 107.839 3 2 8 4 8019.44 546.500 2 2 8 5 783.546 151.180 2 -2 -8 -5 574.316 142.200 3 -2 -8 -6 12231.0 601.067 24 2 8 6 13577.6 755.122 2 -2 -8 -6 13653.2 734.351 3 -2 -8 -7 2285.44 151.509 24 2 8 7 2240.09 242.529 2 -2 -8 -7 1999.83 218.660 3 -2 -8 -8 7854.00 384.237 34 -2 -8 -8 7635.10 480.450 3 -2 -8 -8 7151.11 383.395 24 2 8 8 7712.64 493.645 2 -2 -8 -9 13.3374 52.8935 24 -2 -8 -10 44.2709 71.6925 9 -2 -8 -10 46.0146 54.2917 34 -2 -8 -10 34.2126 41.9048 26 -2 -8 -11 2637.47 175.236 50 -2 -8 -11 2750.11 170.550 34 -2 -8 -11 2817.89 172.633 42 -2 -8 -11 2406.14 147.801 26 -2 -8 -12 5709.08 311.325 50 -2 -8 -12 5802.23 304.220 42 -2 -8 -12 5827.12 301.068 34 -2 -8 -13 1959.47 129.262 42 -2 -8 -13 1905.84 136.179 50 -2 -8 -14 2151.94 126.157 42 -2 -8 -14 2074.20 119.924 18 -2 -8 -15 43.0714 19.7947 42 -2 -8 -15 35.1602 18.1749 23 2 9 -7 246.583 26.0358 39 2 9 -7 238.299 34.0549 30 2 9 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15760.2 722.713 27 -2 -9 -4 14980.9 716.941 24 -2 -9 -4 16490.0 890.075 3 -2 -9 -5 711.831 78.4283 24 2 9 5 746.621 168.359 2 -2 -9 -5 684.376 151.627 3 2 9 5 625.761 74.0776 27 2 9 6 10688.2 631.155 2 2 9 6 8981.83 450.221 27 -2 -9 -6 9301.58 456.845 24 -2 -9 -6 9043.22 587.056 3 2 9 7 310.029 58.0388 27 -2 -9 -7 264.875 61.5659 24 2 9 7 439.794 125.359 2 -2 -9 -7 333.763 113.784 3 2 9 8 78.2653 46.1876 27 -2 -9 -8 55.0252 55.6347 24 2 9 8 72.0008 83.1540 2 -2 -9 -8 177.110 85.7534 3 -2 -9 -9 94.1233 51.2158 34 -2 -9 -10 10056.9 499.422 50 -2 -9 -11 1088.11 93.7816 42 -2 -9 -11 1165.01 101.201 34 -2 -9 -11 833.442 73.5900 26 -2 -9 -11 1056.20 99.9056 50 -2 -9 -12 5890.43 317.101 42 -2 -9 -12 6354.14 328.834 50 -2 -9 -12 6712.25 324.299 34 -2 -9 -13 376.245 54.8816 42 -2 -9 -13 389.660 63.3915 50 -2 -9 -13 422.228 54.4023 34 -2 -9 -14 496.802 54.6823 50 -2 -9 -14 422.894 47.3154 18 -2 -9 -14 437.766 47.5317 42 2 10 -6 171.524 26.2651 30 2 10 -5 1480.69 91.9021 40 2 10 -5 1315.61 93.3763 30 2 10 -4 3796.72 198.881 30 2 10 -4 3881.31 195.862 20 2 10 -3 1204.14 94.6404 20 2 10 -3 760.267 89.0825 40 2 10 -2 6363.01 329.160 44 2 10 -2 6084.22 318.516 47 2 10 -1 1605.10 123.850 44 2 10 -1 1201.09 106.622 47 2 10 0 282.856 65.9955 27 2 10 0 305.727 63.0087 38 2 10 0 374.082 75.3385 44 2 10 0 331.603 60.6508 47 -2 -10 0 313.201 103.303 3 2 10 0 194.382 90.1968 2 2 10 1 881.545 92.5577 38 2 10 1 1139.01 102.980 44 -2 -10 -1 961.255 166.918 3 2 10 1 1212.76 184.447 2 2 10 2 11745.2 733.888 2 -2 -10 -2 11699.3 715.120 3 2 10 2 11814.2 566.239 44 2 10 2 11455.0 565.506 27 2 10 2 11779.1 561.714 38 2 10 3 722.325 86.6858 27 2 10 3 746.739 162.878 2 -2 -10 -3 1052.87 182.597 3 2 10 3 782.202 84.0709 44 2 10 4 11850.9 567.659 27 -2 -10 -4 11484.9 558.502 24 2 10 4 12229.7 756.470 2 -2 -10 -4 12819.3 743.271 3 -2 -10 -5 1968.32 138.366 24 2 10 5 2254.53 264.787 2 2 10 5 2071.22 142.654 27 -2 -10 -6 422.438 70.9027 24 2 10 6 614.923 147.018 2 -2 -10 -6 489.841 146.626 3 2 10 6 490.590 68.8350 27 -2 -10 -7 54.1718 50.1311 24 2 10 7 27.8708 83.5873 2 -2 -10 -7 104.610 84.7176 3 2 10 7 58.8095 49.1444 27 2 10 8 10073.6 478.596 27 2 10 8 9223.23 613.752 2 -2 -10 -8 10267.3 492.199 24 -2 -10 -8 8355.07 594.748 3 2 10 9 244.763 52.0939 27 -2 -10 -9 173.436 61.5742 24 -2 -10 -9 188.395 51.7181 50 -2 -10 -9 200.653 62.9696 34 -2 -10 -10 4468.74 249.142 50 -2 -10 -10 4555.52 253.514 34 -2 -10 -11 36.2298 39.0412 42 -2 -10 -11 58.7255 50.8554 50 -2 -10 -12 1357.19 95.8636 42 -2 -10 -12 1530.15 111.001 50 -2 -10 -12 1404.42 106.218 34 -2 -10 -13 70.8846 31.7329 42 -2 -10 -13 79.4760 40.0754 50 -2 -10 -13 39.4991 35.9405 34 -2 -10 -14 1405.59 83.1343 50 -2 -10 -14 1527.03 81.5578 18 2 11 -5 1649.74 84.6556 30 2 11 -4 1543.26 93.7335 40 2 11 -4 1881.38 103.127 30 2 11 -3 1495.32 102.165 30 2 11 -3 1618.64 100.150 20 2 11 -2 80.7750 60.4348 40 2 11 -1 142.965 46.8480 47 2 11 -1 249.601 64.7023 44 2 11 0 2214.68 146.785 44 2 11 0 1972.40 131.112 47 2 11 0 1939.94 131.171 38 2 11 1 1953.79 146.951 27 2 11 1 2243.86 147.893 44 2 11 1 2087.23 138.212 38 -2 -11 -2 6198.06 469.956 3 2 11 2 7073.20 351.054 38 2 11 2 6624.39 494.950 2 2 11 2 6889.39 354.672 44 2 11 3 2003.00 140.254 27 -2 -11 -3 1901.27 238.682 3 2 11 3 2302.42 262.612 2 2 11 3 1711.03 130.311 44 2 11 4 1454.24 119.808 27 2 11 4 1504.37 111.559 44 -2 -11 -4 1540.59 216.984 3 -2 -11 -5 71.9357 45.2229 24 2 11 5 92.5022 92.4548 2 2 11 5 6.40281 49.9105 27 -2 -11 -6 840.285 87.1975 24 2 11 6 540.149 144.129 2 -2 -11 -6 670.862 153.139 3 2 11 6 899.720 91.5414 27 -2 -11 -7 593.785 78.8096 24 2 11 7 397.083 132.151 2 -2 -11 -7 508.974 139.299 3 2 11 7 599.259 77.6411 27 -2 -11 -8 9016.13 444.121 24 -2 -11 -8 8785.69 440.239 34 2 11 8 8730.07 433.851 27 -2 -11 -9 250.074 64.3160 34 2 11 9 362.158 57.9647 27 -2 -11 -10 6671.05 335.073 34 -2 -11 -10 6318.27 322.660 50 -2 -11 -11 1034.41 93.2860 34 -2 -11 -11 962.188 82.3642 50 -2 -11 -12 89.8836 39.1965 50 -2 -11 -13 5.95654 30.3891 34 -2 -11 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44 2 13 3 1242.87 89.8834 44 2 13 3 1161.38 85.2503 38 2 13 4 653.114 75.4804 27 2 13 4 525.904 58.3889 44 2 13 4 675.016 67.5409 38 2 13 5 5235.49 275.198 38 2 13 5 5626.11 283.421 27 -2 -13 -6 4442.79 232.695 34 2 13 6 4897.51 248.870 27 -2 -13 -7 4267.43 220.212 34 2 13 7 4167.28 226.201 27 -2 -13 -8 137.652 42.4790 34 2 13 8 176.856 47.5700 27 -2 -13 -9 12.1017 37.9266 34 2 13 9 20.8241 34.6446 27 -2 -13 -10 967.936 73.8199 34 2 13 10 846.883 61.9523 27 -2 -13 -11 2330.71 129.847 34 -2 -13 -12 2226.03 117.025 34 2 14 1 44.8897 20.8342 20 -2 -14 -2 82.3231 20.6499 6 2 14 2 59.4056 28.1303 20 -2 -14 -3 3942.04 187.304 6 2 14 3 3509.12 191.580 17 2 14 4 212.355 45.1281 27 2 14 5 2845.50 155.027 38 2 14 5 3266.79 167.576 27 2 14 6 99.3825 34.5464 38 2 14 6 97.9188 41.2635 27 2 14 7 139.642 38.3455 38 -2 -14 -7 124.289 27.1453 34 2 14 7 162.790 40.6775 27 2 14 8 326.288 43.6661 38 -2 -14 -8 261.046 36.1752 34 2 14 8 378.578 44.2478 27 -2 -14 -9 2264.59 119.004 34 -2 -14 -9 2165.01 115.749 6 2 14 9 2219.21 117.026 27 -2 -14 -10 1274.55 75.5107 34 -2 -14 -11 2687.99 130.750 34 2 15 5 616.625 42.0642 20 -2 -15 -5 860.108 48.7094 6 -2 -15 -6 60.5856 22.2350 6 -2 -15 -8 19.6763 14.6166 6 -3 12 7 357.455 29.2005 27 3 -12 -7 336.148 32.7037 24 3 -12 -6 67.7512 23.4337 24 3 -12 -5 303.687 35.1456 24 3 -12 -4 2549.64 129.139 24 3 -12 -3 529.887 37.5153 24 -3 12 3 719.721 52.6247 47 -3 12 2 5086.18 241.521 44 -3 12 2 5116.79 241.868 47 -3 12 1 910.905 56.0080 47 3 -11 -9 146.363 24.5381 24 -3 11 8 851.416 65.0298 27 -3 11 8 825.598 61.0240 25 3 -11 -8 935.392 64.4238 24 -3 11 7 29.4142 34.7852 25 -3 11 7 19.0179 34.1809 27 -3 11 7 48.8392 29.1502 13 -3 11 6 2500.58 135.850 27 -3 11 6 2366.51 139.951 25 3 -11 -6 2317.42 137.518 24 -3 11 5 82.2755 44.7501 25 -3 11 5 114.597 36.9631 27 -3 11 5 122.471 37.0098 13 3 -11 -5 140.193 41.8543 24 -3 11 4 9445.84 445.689 13 -3 11 3 252.366 42.8200 13 -3 11 2 3229.10 173.304 13 3 -11 -2 3439.68 173.049 24 3 -11 -1 35.9396 24.0099 24 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6816.68 315.364 22 -3 10 -2 6348.01 316.234 47 -3 10 -2 6419.69 311.721 44 -3 10 -3 106.027 33.3246 22 -3 10 -3 87.8073 32.2732 47 -3 10 -4 324.243 28.5454 22 -3 9 11 724.247 53.0962 27 3 -9 -10 114.873 32.2267 16 -3 9 10 131.594 31.1973 25 3 -9 -10 88.3503 26.1944 35 3 -9 -9 66.9410 36.7262 24 -3 9 9 84.2316 41.6679 25 3 -9 -9 97.4999 39.2303 21 3 -9 -8 5079.70 257.506 43 -3 9 8 4642.05 246.087 25 3 -9 -8 4530.55 244.011 24 3 -9 -8 4465.64 239.800 21 3 -9 -7 1855.06 139.368 43 -3 9 7 2200.49 140.549 25 3 -9 -6 8153.22 420.232 43 -3 9 6 8601.02 421.038 25 3 -9 -5 566.756 76.5932 43 -3 9 5 480.344 78.7685 25 3 -9 -4 219.699 58.8184 43 -3 9 4 201.629 66.2820 25 -3 9 3-20.6693 50.9438 17 3 -9 -3 16.8628 43.5101 43 -3 9 3-35.9745 45.5747 27 -3 9 2 6308.49 320.195 27 -3 9 2 6446.13 336.765 25 -3 9 2 6552.74 342.177 17 -3 9 2 6470.96 332.729 13 -3 9 1 739.317 85.6749 25 -3 9 1 801.246 91.6323 17 -3 9 1 843.093 82.7019 13 -3 9 0 13279.7 624.917 13 -3 9 -1 64.6607 54.3849 22 -3 9 -2 3438.05 193.847 22 -3 9 -2 3103.31 178.570 28 -3 9 -2 3497.90 194.062 47 -3 9 -3 4.59882 47.4277 22 -3 9 -3-3.68388 35.3620 44 -3 9 -3-18.0596 37.2524 28 -3 9 -3-44.9542 44.5301 47 -3 9 -4 1348.15 94.8217 22 -3 9 -4 1413.36 89.2980 28 -3 9 -4 1427.67 93.0928 47 -3 9 -5 74.7351 30.4865 22 -3 9 -5 66.6727 25.3994 28 3 -8 -11 249.657 34.4111 35 3 -8 -11 140.633 32.8245 16 3 -8 -10 716.920 68.2602 35 3 -8 -10 744.904 74.9705 21 3 -8 -10 917.550 75.4802 16 3 -8 -9 5697.32 287.085 24 3 -8 -9 5818.33 299.700 21 3 -8 -8 4851.96 264.891 21 3 -8 -8 4763.63 256.478 24 3 -8 -8 4927.89 271.396 43 3 -8 -7 5279.93 288.698 21 3 -8 -7 5521.28 299.404 43 3 -8 -6 1316.23 109.887 21 3 -8 -6 1423.14 122.617 43 3 -8 -5 662.819 156.383 3 3 -8 -5 573.054 84.3816 43 3 -8 -4 2175.31 151.197 43 -3 8 4 2058.09 145.397 17 3 -8 -4 2067.20 271.210 3 3 -8 -3 5604.40 300.062 43 -3 8 3 5581.64 305.871 17 3 -8 -2 6575.56 332.256 43 -3 8 2 6093.60 322.769 27 -3 8 2 6540.17 339.033 25 -3 8 2 6575.12 345.348 17 3 -8 -2 6098.86 495.763 3 3 -8 -1 3148.04 337.661 3 -3 8 1 3753.32 224.742 17 -3 8 1 3649.41 197.675 27 -3 8 1 3434.21 212.624 25 -3 8 1 3627.80 211.738 13 3 -8 0 2402.12 280.665 3 -3 8 0 2447.71 166.615 25 -3 8 0 2747.78 168.453 13 -3 8 0 2749.43 177.666 17 -3 8 -1 269.499 57.2699 28 -3 8 -1 227.767 55.7222 13 -3 8 -2 145.871 49.0145 45 -3 8 -2 103.759 68.0527 22 -3 8 -2 200.513 57.7773 28 -3 8 -3 1026.02 101.628 22 -3 8 -3 1051.88 91.5030 45 -3 8 -3 1005.33 97.6163 47 -3 8 -3 1079.72 95.7557 28 -3 8 -4 7352.60 365.597 45 -3 8 -4 7365.46 372.494 22 -3 8 -4 7554.50 368.510 47 -3 8 -4 7369.52 366.198 28 -3 8 -5 518.436 60.2316 47 -3 8 -5 586.117 68.1541 22 -3 8 -5 551.541 62.9071 28 -3 8 -6 2996.08 157.468 28 -3 8 -7 355.418 29.0616 28 -3 8 -7 46.1626 19.8673 22 3 -7 -12 98.8139 25.9148 35 3 -7 -11 3172.84 169.384 35 3 -7 -11 2965.22 169.079 16 3 -7 -10 1091.97 90.3459 16 3 -7 -10 1001.39 96.4690 21 3 -7 -9 8543.41 422.643 43 3 -7 -9 8409.79 425.239 21 3 -7 -9 8200.42 400.418 24 3 -7 -8 1621.79 119.563 24 3 -7 -8 1754.12 137.319 21 3 -7 -7 651.091 90.8481 43 3 -7 -7 703.114 86.6392 21 3 -7 -6 1128.29 108.293 21 3 -7 -6 1247.42 192.167 3 3 -7 -6 1088.39 111.266 43 3 -7 -5 7498.27 377.142 21 3 -7 -5 6945.04 539.800 11 3 -7 -5 7482.98 383.196 43 3 -7 -5 7615.99 542.676 3 3 -7 -5 5953.89 483.555 9 3 -7 -4 1773.77 136.242 43 -3 7 4 2009.13 132.886 17 3 -7 -4 1444.74 197.974 9 3 -7 -4 1166.53 209.450 11 3 -7 -4 1739.56 240.393 3 3 -7 -3 8406.46 569.490 11 -3 7 3 8221.77 419.025 17 -3 7 2 12431.4 605.462 17 -3 7 1 3390.94 203.281 25 -3 7 1 3332.88 209.759 17 -3 7 0 1811.06 138.580 17 -3 7 0 1637.60 128.348 25 -3 7 0 1758.98 126.367 13 -3 7 -1 115.360 54.6067 25 -3 7 -1 97.5912 53.6744 28 3 -7 1 59.7487 96.8748 3 -3 7 -1 174.570 54.7464 13 -3 7 -2 7268.04 384.196 45 -3 7 -2 8025.87 396.349 28 3 -7 2 8053.65 543.563 3 -3 7 -2 7738.38 387.380 13 -3 7 -3 7753.03 408.075 28 -3 7 -3 8316.50 419.235 22 -3 7 -3 8262.00 406.657 45 -3 7 -3 7913.45 389.908 14 -3 7 -4 7494.79 376.644 22 -3 7 -4 7245.11 369.315 45 -3 7 -4 7053.75 368.785 28 -3 7 -4 6982.52 366.365 47 -3 7 -5 1704.40 133.280 45 -3 7 -5 1955.05 137.857 28 -3 7 -6 1809.00 120.630 47 -3 7 -6 1950.11 129.223 45 -3 7 -7 82.1594 38.3925 45 -3 7 -7 27.6349 37.7256 22 -3 7 -7 3.55777 36.5915 28 -3 7 -8 1345.57 78.0696 28 3 -6 -12 19.0012 30.1915 42 3 -6 -12-9.25653 30.8108 35 3 -6 -12-52.8999 26.3989 16 3 -6 -11 7413.95 363.412 21 3 -6 -11 7063.22 354.990 35 3 -6 -10 158.139 61.9295 21 3 -6 -9 3018.07 192.677 43 3 -6 -9 3172.34 203.657 21 3 -6 -8-29.5613 95.7164 8 3 -6 -8-58.0237 64.9557 21 3 -6 -8 10.3619 39.5977 24 3 -6 -8 7.50426 57.3535 43 3 -6 -7 1261.14 221.863 11 3 -6 -7 1539.11 133.112 43 3 -6 -7 1506.15 132.625 21 3 -6 -6 210.276 97.1264 3 3 -6 -6 285.325 67.6335 21 3 -6 -6 203.219 137.914 11 3 -6 -5 10678.0 524.213 43 3 -6 -5 10714.2 704.362 11 3 -6 -5 10746.7 521.695 21 3 -6 -5 9500.64 642.489 9 -3 6 4 2828.68 187.231 41 3 -6 -4 2721.26 295.079 11 -3 6 4 3130.34 175.404 17 3 -6 -4 2660.99 269.793 9 -3 6 3 9614.04 479.325 41 -3 6 3 10175.2 472.944 17 3 -6 -3 10496.7 639.433 11 -3 6 2-6.18857 47.6328 36 -3 6 2 54.2120 52.4806 41 -3 6 2 38.8521 52.2965 17 -3 6 1 469.476 75.1936 17 -3 6 1 592.766 82.4717 36 -3 6 0 2942.46 190.069 28 -3 6 0 3107.81 191.001 25 -3 6 0 3610.13 195.493 13 -3 6 0 3518.24 205.269 17 -3 6 0 3134.29 201.180 36 -3 6 -1 14969.6 723.289 36 -3 6 -1 15640.7 712.717 13 -3 6 -1 15088.0 709.201 25 -3 6 -1 14720.5 715.155 28 3 -6 2 3309.28 317.373 3 -3 6 -2 3043.36 194.421 28 -3 6 -2 2782.36 177.262 25 -3 6 -2 3159.32 184.568 13 -3 6 -2 3135.66 193.242 17 -3 6 -3 4420.09 253.105 28 -3 6 -3 4205.06 244.092 33 -3 6 -4 3327.45 188.152 14 -3 6 -4 3694.54 219.769 28 -3 6 -4 3346.26 210.255 45 -3 6 -4 3408.20 206.375 47 -3 6 -4 3552.11 213.428 33 -3 6 -5-12.2370 48.5389 47 -3 6 -5-20.8446 61.6215 45 -3 6 -5 72.9453 35.9595 44 -3 6 -5 7.22745 59.9995 28 -3 6 -6 132.806 61.4402 22 -3 6 -6 217.884 54.4355 47 -3 6 -6 158.358 62.7466 45 -3 6 -6 200.089 65.3666 28 -3 6 -7 3457.13 188.573 45 -3 6 -7 3209.64 183.946 22 -3 6 -7 2855.87 182.252 28 -3 6 -8 2988.63 169.899 45 -3 6 -8 3237.91 167.802 22 -3 6 -9 1361.32 78.3571 28 3 -5 -12 266.880 44.9054 35 3 -5 -11 4582.13 246.570 35 3 -5 -10 325.955 67.7717 35 3 -5 -9 726.874 99.6443 21 3 -5 -9 785.889 88.5317 43 3 -5 -8 381.347 150.491 11 3 -5 -8 174.737 121.470 8 3 -5 -8 285.889 77.0460 21 3 -5 -8 285.233 69.2360 43 3 -5 -7 13433.2 810.680 8 3 -5 -7 13660.8 658.943 21 3 -5 -7 13171.2 648.122 43 3 -5 -6 164.911 60.7856 43 3 -5 -6 354.528 139.725 11 -3 5 6 188.894 59.2232 41 3 -5 -6 152.357 81.2074 1 3 -5 -6 256.328 66.4342 21 -3 5 5 17424.8 828.140 41 3 -5 -5 19545.9 1027.47 11 -3 5 4 224.860 56.0225 41 3 -5 -4 195.607 90.5912 9 3 -5 -4 81.3108 102.581 11 -3 5 3 624.027 68.0448 17 -3 5 3 571.116 73.2874 41 3 -5 -3 677.516 127.014 9 3 -5 -3 593.748 146.028 11 -3 5 2 645.898 70.8334 17 3 -5 -2 514.473 107.920 9 3 -5 -2 653.280 141.760 11 -3 5 1 9713.77 482.606 17 3 -5 -1 10777.6 601.782 11 3 -5 0 444.142 102.154 11 -3 5 0 376.994 63.3255 17 -3 5 0 357.095 64.2872 36 -3 5 -1 20449.8 968.844 36 -3 5 -1 20702.0 958.836 29 -3 5 -1 20665.7 967.062 17 -3 5 -1 21926.2 962.097 13 -3 5 -2 1032.47 88.0257 33 -3 5 -2 642.756 88.6618 36 -3 5 -2 637.608 84.0396 28 -3 5 -2 809.020 79.7009 25 -3 5 -2 931.267 89.3719 29 -3 5 -2 925.071 93.0255 17 -3 5 -2 997.877 86.4568 13 -3 5 -3 3716.06 208.508 33 -3 5 -3 3091.72 209.827 36 -3 5 -3 3376.10 205.233 29 3 -5 3 3018.12 275.022 1 -3 5 -3 3640.09 217.849 28 -3 5 -3 3520.80 201.807 13 -3 5 -4 157.216 67.7486 28 -3 5 -4 135.806 45.4241 14 -3 5 -4 220.272 64.8582 33 -3 5 -4 203.413 62.0481 29 -3 5 -5 3424.32 216.050 28 -3 5 -5 3385.69 203.161 47 -3 5 -5 3330.57 215.253 22 -3 5 -5 3606.66 213.822 33 -3 5 -5 3240.44 209.073 29 -3 5 -6 1995.92 149.669 22 -3 5 -6 1925.44 134.836 47 -3 5 -6 1865.94 145.527 33 -3 5 -6 2049.70 151.865 28 -3 5 -7 7193.27 362.391 22 -3 5 -7 7467.00 364.458 33 -3 5 -7 6939.97 363.737 45 -3 5 -7 6621.84 345.752 47 -3 5 -8 1708.50 116.726 22 -3 5 -8 1565.85 119.779 45 -3 5 -9 2106.10 124.524 28 -3 5 -9 2044.06 118.364 22 3 -4 -12 795.194 68.3752 35 3 -4 -12 646.728 52.4346 48 3 -4 -11 328.258 63.2162 35 3 -4 -11 333.369 50.3165 48 3 -4 -11 409.526 62.3996 16 3 -4 -11 421.160 66.2722 21 3 -4 -10 112.116 54.0118 16 3 -4 -10 44.7783 60.7359 21 3 -4 -10 137.700 62.0663 35 3 -4 -9 3059.85 186.909 43 3 -4 -8 2784.10 324.556 11 3 -4 -8 3119.29 192.380 43 3 -4 -7 10022.1 484.576 43 3 -4 -7 9477.07 658.809 11 3 -4 -7 9437.25 492.087 21 3 -4 -7 9386.11 625.508 8 3 -4 -6 507.623 105.862 1 -3 4 6 639.423 74.6929 41 3 -4 -5 3858.04 348.149 11 3 -4 -5 3934.25 292.161 1 -3 4 5 3680.20 212.036 41 3 -4 -4 24.3918 89.5587 11 3 -4 -3 4553.02 350.493 11 3 -4 -3 4172.39 314.976 9 3 -4 -2 99.5553 84.6095 11 3 -4 -2 120.790 68.1393 9 -3 4 2 145.861 41.7773 17 3 -4 -1 22697.6 1152.95 11 -3 4 1 23075.0 1043.58 17 -3 4 0 247.173 67.2853 10 3 -4 0 275.726 87.1914 11 -3 4 0 238.756 53.3044 17 -3 4 -1 9611.58 537.143 10 3 -4 1 9719.32 544.217 11 -3 4 -1 10075.9 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10 -3 122.156 34.9706 30 4 10 -3 169.272 39.6015 46 4 10 -2 117.457 48.0750 20 4 10 -2 42.4142 36.4267 15 4 10 -2 44.3073 36.4829 30 4 10 -1 1909.86 131.655 20 4 10 -1 1847.49 122.890 15 -4 -10 0 164.794 43.1717 6 4 10 0 233.397 60.9144 20 -4 -10 -1 7216.70 358.422 6 4 10 1 7035.80 365.323 20 4 10 2 1916.82 140.856 38 -4 -10 -2 2003.48 138.189 6 4 10 2 1972.76 251.224 2 -4 -10 -2 1898.01 230.883 3 4 10 3 3520.74 206.330 38 4 10 3 3423.79 347.517 2 -4 -10 -3 3377.60 205.748 6 -4 -10 -3 3325.34 327.290 3 4 10 4 37.8736 54.6291 38 -4 -10 -4-13.4482 53.6519 6 -4 -10 -4 58.0260 103.520 3 4 10 4 19.3789 50.9322 27 4 10 5 1054.95 200.819 2 4 10 5 778.646 86.3431 27 4 10 6 479.110 145.699 2 -4 -10 -6 565.610 140.592 3 4 10 6 582.553 72.3145 27 -4 -10 -6 549.600 66.6128 34 -4 -10 -6 582.682 79.0561 6 4 10 7 5006.29 413.407 2 -4 -10 -7 4676.40 387.034 3 -4 -10 -7 4704.83 252.797 6 -4 -10 -7 4265.37 245.375 34 -4 -10 -8 4018.49 217.109 6 -4 -10 -8 3621.90 217.732 34 -4 -10 -9 3221.57 182.275 6 -4 -10 -9 3234.87 193.805 34 -4 -10 -10 394.830 66.5954 26 -4 -10 -10 400.229 66.1874 34 -4 -10 -11 258.066 53.8750 26 -4 -10 -11 323.595 61.8606 34 -4 -10 -12 1118.60 85.0960 18 -4 -10 -12 815.861 71.2072 26 -4 -10 -13 1341.64 85.2267 32 -4 -10 -13 1358.03 88.4792 23 -4 -10 -13 1422.03 91.5585 18 -4 -10 -14 1480.09 87.0110 23 -4 -10 -14 1936.76 92.6108 18 4 11 -3 994.674 68.2110 31 4 11 -2-3.81501 38.6657 31 4 11 -2 42.6317 26.7900 30 4 11 -2 44.0937 34.1265 20 4 11 -1 2593.12 149.235 30 4 11 -1 3022.02 163.209 20 -4 -11 0 387.456 46.3244 6 4 11 0 335.802 58.6199 20 -4 -11 -1 5320.01 272.073 6 4 11 1 5399.21 281.961 20 -4 -11 -2 287.021 55.7643 6 4 11 2 319.668 59.5064 20 -4 -11 -3 52.4076 54.0765 6 4 11 3 42.0136 52.4951 38 -4 -11 -4 267.193 63.0777 6 4 11 4 225.230 66.1636 38 4 11 4 215.343 57.2650 27 -4 -11 -5 3736.16 223.619 6 4 11 5 4107.20 226.268 38 4 11 5 3845.76 222.495 27 4 11 6 1294.51 104.190 27 4 11 7 4315.93 231.667 27 -4 -11 -7 4710.89 245.621 6 -4 -11 -7 4112.42 230.145 34 -4 -11 -8 1092.89 93.2518 6 -4 -11 -8 1065.82 91.7480 34 -4 -11 -9 457.493 59.0768 6 -4 -11 -9 353.422 60.5679 34 -4 -11 -10 380.355 61.5270 26 -4 -11 -10 274.752 56.2872 34 -4 -11 -11 2376.51 136.869 26 -4 -11 -11 2187.78 139.186 34 -4 -11 -12 1347.90 87.1362 18 -4 -11 -12 1175.73 80.1525 26 -4 -11 -13 2170.06 114.082 18 -4 -11 -13 1968.44 107.346 32 -4 -11 -13 2019.24 108.221 23 4 12 -2 124.414 23.2997 31 4 12 -1 4460.74 221.585 20 4 12 -1 4501.90 223.814 31 4 12 0 284.262 45.7516 20 4 12 0 256.188 34.7315 30 -4 -12 -1 51.8849 31.5174 6 4 12 1 20.7921 36.5597 20 -4 -12 -2 16.0846 36.8379 6 4 12 2 26.7735 37.4497 20 -4 -12 -3 2832.26 165.570 6 4 12 3 2760.32 161.897 20 4 12 4 4.38151 35.5686 20 4 12 4-10.6819 51.4669 38 -4 -12 -4 15.6167 46.1596 6 4 12 5 8408.68 401.905 38 -4 -12 -5 7725.16 397.940 6 4 12 6 205.554 59.5151 38 -4 -12 -7 759.729 80.1598 6 -4 -12 -8 303.498 54.6453 6 -4 -12 -8 234.348 44.2752 34 -4 -12 -9 1946.94 120.926 6 -4 -12 -9 2018.90 123.437 34 -4 -12 -10 77.3435 39.1751 34 -4 -12 -10-6.39151 32.3756 18 -4 -12 -10-11.8040 39.2725 26 -4 -12 -11 1690.05 101.246 18 -4 -12 -11 1747.28 103.667 26 4 12 12 432.951 37.0301 38 -4 -12 -12 518.543 43.9645 18 -4 -12 -13 642.796 40.5501 18 4 13 0-21.5578 21.4538 31 4 13 1 517.039 46.6918 20 4 13 2 191.166 37.5691 20 -4 -13 -2 241.123 34.9774 6 4 13 3 3360.90 183.868 20 -4 -13 -3 3939.54 189.936 6 4 13 4 315.808 42.1078 20 -4 -13 -4 346.934 52.1345 6 -4 -13 -5 2160.85 133.890 6 4 13 5 2218.37 135.663 38 -4 -13 -6-12.8036 43.0703 6 4 13 6 17.3022 43.4915 38 -4 -13 -7 28.7281 40.5348 6 4 13 7 59.1176 44.6427 38 -4 -13 -8-3.67255 36.8044 6 4 13 8 67.3705 42.7090 38 -4 -13 -9 3446.90 176.025 6 4 13 9 3385.07 181.367 38 4 13 10 75.7402 33.9053 38 -4 -13 -10 83.9673 33.9802 26 4 13 11 3601.09 177.058 38 -4 -13 -11 3662.30 176.655 26 -4 -14 -3 1693.71 88.0628 6 -4 -14 -4 725.122 54.3445 6 -4 -14 -5 32.2922 29.3050 6 -4 -14 -6 584.863 54.1601 6 4 14 7 1449.56 91.4673 38 4 14 8 373.580 45.1467 38 -4 -14 -8 380.222 41.3525 6 -4 -14 -9 1591.01 86.9169 6 4 14 9 1680.41 92.9072 38 4 14 10 159.915 26.3164 38 -4 -14 -10 239.506 26.8360 26 -5 9 7 1284.38 70.1740 25 5 -9 -6 24.1059 19.4557 24 5 -9 -5 579.414 49.2557 43 5 -9 -5 572.383 49.3155 24 -5 9 5 648.593 53.2136 25 5 -9 -4 613.468 51.2454 43 -5 9 4 730.721 58.1504 25 5 -9 -3 3819.15 197.946 43 -5 9 3 4728.59 207.827 25 -5 9 2 925.644 68.5136 22 -5 9 2 1113.89 71.6455 14 -5 9 1 3044.94 157.440 22 -5 9 0 256.788 37.4070 22 -5 9 -1 227.492 29.4427 22 -5 8 8 42.6887 21.9792 25 -5 8 8 35.4174 18.8429 27 5 -8 -8 54.2566 18.0148 35 5 -8 -7-9.32113 30.1807 43 -5 8 7 8.63272 30.7005 25 5 -8 -6 128.034 42.4600 43 5 -8 -6 84.7468 31.3203 24 -5 8 5 5261.49 265.528 25 -5 8 5 5000.66 261.583 13 5 -8 -5 5576.18 268.034 43 -5 8 4 49.4822 44.8380 25 -5 8 4 98.2432 38.9138 13 5 -8 -4 77.5278 43.1161 43 -5 8 3 8212.06 374.440 25 -5 8 3 7616.84 374.822 13 5 -8 -3 7339.06 371.745 43 -5 8 2 343.054 51.0447 25 -5 8 2 297.650 50.3514 13 5 -8 -2 310.411 48.5415 43 -5 8 1 243.060 44.6570 25 5 -8 -1 290.864 39.7402 43 -5 8 0 48.6194 33.2306 14 -5 8 -1 1922.40 114.107 14 -5 8 -1 2104.27 126.495 22 -5 8 -2 437.386 52.8761 22 -5 8 -3 4753.11 229.388 22 5 -7 -9 118.530 23.7031 35 -5 7 9 147.887 25.2206 25 5 -7 -8 15.8260 31.5915 43 5 -7 -8 6.03180 29.8745 21 5 -7 -7 2493.97 143.064 21 5 -7 -6 166.161 47.4378 21 5 -7 -6 154.846 51.8091 43 -5 7 6 92.9095 36.8144 13 5 -7 -5 6617.35 323.555 43 -5 7 5 5696.16 310.965 13 5 -7 -5 6527.11 314.083 21 5 -7 -4 96.7517 52.3954 43 -5 7 4 122.023 46.6752 13 5 -7 -4 140.927 42.8876 21 -5 7 3 1523.72 111.899 25 -5 7 3 1509.58 111.693 13 5 -7 -3 1397.88 112.543 43 -5 7 2 143.833 51.1722 25 -5 7 2 107.182 48.2988 13 5 -7 -2 71.6441 47.6747 43 -5 7 1 2404.58 145.208 25 -5 7 1 2391.94 151.115 13 5 -7 -1 2304.00 147.058 43 -5 7 0 58.0738 36.1246 25 5 -7 0 17.4839 38.9805 43 -5 7 -1 7623.35 372.247 28 -5 7 -1 8027.57 381.860 14 -5 7 -2 149.212 42.3572 28 -5 7 -2 221.058 43.2786 14 -5 7 -3 4358.68 222.622 28 -5 7 -3 4473.95 233.351 22 -5 7 -4 32.5775 28.8075 28 -5 7 -5 240.130 28.5665 28 -5 7 -5 232.072 34.7259 22 5 -6 -10 14.4137 13.7912 35 5 -6 -9 475.701 49.7120 35 5 -6 -9 483.151 51.5576 21 5 -6 -8 1767.80 115.122 21 5 -6 -8 1653.84 108.635 43 5 -6 -7 5289.52 271.521 21 5 -6 -7 4931.99 266.034 43 5 -6 -6 2350.40 150.001 21 -5 6 6 2081.33 131.560 13 5 -6 -5 4156.93 231.259 43 -5 6 5 3700.98 216.243 13 5 -6 -5 4125.83 228.651 21 5 -6 -4 695.266 89.2903 43 -5 6 4 739.426 78.4650 13 5 -6 -4 643.171 81.0905 21 -5 6 3 585.879 77.6472 13 -5 6 2 1549.46 120.063 13 -5 6 2 1443.27 118.423 36 -5 6 1 4376.29 241.075 25 -5 6 1 4433.02 248.237 13 -5 6 1 4480.68 254.674 36 -5 6 0 1182.46 105.459 28 -5 6 0 1469.30 105.357 25 -5 6 0 1578.91 119.558 13 -5 6 0 1503.00 128.415 36 -5 6 -1 4690.16 255.660 28 -5 6 -2 5.72403 51.2408 28 -5 6 -2-26.8941 43.1687 14 -5 6 -3 43.0684 50.1865 28 -5 6 -3 13.8099 36.5241 14 -5 6 -4 76.1484 52.5432 22 -5 6 -4 19.0207 46.7477 28 -5 6 -4 3.26270 32.3315 45 -5 6 -4 27.9866 30.7408 14 -5 6 -5 3036.99 167.353 45 -5 6 -5 3463.81 180.288 28 -5 6 -5 3519.24 180.959 22 -5 6 -6 75.1434 23.9610 45 -5 6 -6 91.7720 35.1923 28 -5 6 -6 133.387 34.1921 22 5 -5 -10 876.642 59.1860 35 5 -5 -9 1790.40 111.273 16 5 -5 -9 2080.53 122.896 21 5 -5 -9 1945.07 118.041 35 5 -5 -8 3606.36 203.438 21 5 -5 -8 3469.77 190.341 43 5 -5 -7 2491.97 176.501 21 5 -5 -7 3184.12 176.664 43 5 -5 -6 1057.18 108.924 21 5 -5 -6 1259.09 108.548 43 -5 5 5 206.991 68.0933 41 -5 5 5 258.876 54.4300 13 5 -5 -5 243.167 68.8805 21 -5 5 4 1750.39 129.120 13 -5 5 4 1948.85 145.474 41 -5 5 3 1589.83 124.945 36 -5 5 3 1799.00 131.139 13 -5 5 3 1717.50 139.749 41 -5 5 2 2483.17 166.196 36 -5 5 2 2392.85 162.843 13 -5 5 1 14226.1 675.697 13 -5 5 1 14306.2 680.850 41 -5 5 1 14417.5 680.799 36 5 -5 -1 12042.7 826.775 1 -5 5 0 948.966 99.2793 41 -5 5 0 927.683 106.008 36 -5 5 0 855.995 95.6917 13 -5 5 0 980.095 87.9894 25 -5 5 -1 2762.19 189.911 36 -5 5 -1 2910.32 182.420 13 -5 5 -1 2676.69 161.326 25 -5 5 -2 530.616 89.3199 36 -5 5 -2 323.253 64.3231 14 -5 5 -2 448.653 79.7200 28 -5 5 -3 4240.02 236.133 14 -5 5 -3 4312.07 248.985 28 -5 5 -4 2871.03 181.936 28 -5 5 -4 2825.08 168.484 45 -5 5 -4 2800.64 167.117 14 -5 5 -5 8255.25 388.225 28 -5 5 -5 7600.23 375.203 45 -5 5 -5 7006.14 365.095 14 -5 5 -5 8302.27 386.171 22 -5 5 -6 333.553 56.5107 22 -5 5 -6 363.967 60.0153 28 -5 5 -6 354.256 54.4996 45 -5 5 -7 2349.38 130.380 22 -5 5 -7 2594.17 139.539 28 -5 5 -7 2552.31 135.829 45 5 -4 -10 3214.57 164.105 21 5 -4 -9 841.461 68.9048 16 5 -4 -8 2404.17 143.472 16 5 -4 -8 2310.98 138.658 43 5 -4 -7 104.748 45.8076 37 5 -4 -7 186.154 54.1981 43 5 -4 -7 86.9894 63.2834 21 -5 4 6 50.4182 53.7433 41 5 -4 -6 31.4616 62.7779 21 5 -4 -6 39.8188 52.0357 43 -5 4 5 308.113 52.5957 13 -5 4 5 209.421 67.7652 41 -5 4 4 4061.64 233.416 41 5 -4 -4 3711.64 330.797 1 -5 4 4 3656.96 214.721 13 5 -4 -4 3985.61 379.246 11 5 -4 -3 4118.72 373.158 1 -5 4 3 4810.85 260.480 36 -5 4 3 4815.27 272.009 41 5 -4 -3 5248.95 433.136 11 -5 4 3 4741.54 261.058 13 5 -4 -2 5275.19 436.431 11 -5 4 2 5179.51 285.525 13 -5 4 2 5514.16 291.099 36 5 -4 -2 4931.21 417.680 1 5 -4 -1 446.588 132.717 11 -5 4 1 595.713 86.2888 36 -5 4 1 626.396 79.5893 13 -5 4 1 661.234 89.0436 41 -5 4 0 188.536 71.5802 36 5 -4 0 146.008 113.256 1 -5 4 0 135.711 63.4732 41 -5 4 0 198.971 60.4254 13 -5 4 -1 1414.60 107.412 25 5 -4 1 1433.61 213.568 1 -5 4 -1 1549.75 122.682 41 -5 4 -1 1492.59 124.727 13 -5 4 -1 1565.48 135.345 36 5 -4 2 3986.84 354.694 1 -5 4 -2 4130.85 237.479 41 -5 4 -2 4517.24 239.472 29 -5 4 -2 4254.69 256.447 36 -5 4 -3 4072.10 233.620 29 -5 4 -3 4153.69 236.244 14 -5 4 -4 1395.67 126.046 28 -5 4 -4 1347.30 113.592 29 -5 4 -4 1478.14 112.021 14 -5 4 -4 1184.51 100.575 33 -5 4 -4 1239.46 122.380 36 -5 4 -5 3945.98 237.357 28 -5 4 -5 4003.17 220.993 33 -5 4 -5 3924.91 219.904 14 -5 4 -5 4089.63 229.149 29 -5 4 -6 100.940 53.6710 22 -5 4 -6 53.9078 42.6926 33 -5 4 -6 12.4888 60.2239 28 -5 4 -7 26.5884 38.7692 22 -5 4 -7 59.7420 51.8901 28 -5 4 -7 4.59068 45.8284 45 -5 4 -8 663.411 62.4635 45 -5 4 -9 1793.59 93.0665 45 -5 4 -9 1727.03 91.1819 28 5 -3 -10 2857.30 151.667 21 5 -3 -10 3076.09 155.574 35 5 -3 -9 24.7099 29.8203 37 5 -3 -9 26.2015 41.0909 35 5 -3 -9 46.8705 41.7992 21 5 -3 -9 71.8145 32.9224 16 5 -3 -8 30.0498 43.8486 37 5 -3 -8 57.3858 55.5135 21 5 -3 -8 87.9940 41.3148 16 5 -3 -7 263.452 56.0391 43 5 -3 -6 6069.72 325.260 21 5 -3 -6 5770.37 306.817 43 -5 3 6 5509.55 302.760 41 5 -3 -5 335.821 136.830 11 5 -3 -5 226.573 107.497 8 -5 3 5 279.619 68.8526 41 -5 3 4 10999.1 517.974 41 5 -3 -4 10152.4 659.407 8 -5 3 4 10138.0 496.128 13 5 -3 -4 9976.69 687.848 11 5 -3 -4 10297.6 634.422 1 5 -3 -3 1501.52 199.981 1 -5 3 3 1324.25 106.957 36 -5 3 3 1493.01 120.929 41 -5 3 3 1120.68 100.433 13 5 -3 -3 1162.76 207.527 11 5 -3 -3 1240.30 185.950 8 5 -3 -2 2143.75 253.939 1 -5 3 2 1948.54 143.690 36 -5 3 2 2133.03 151.128 41 -5 3 2 2043.77 140.507 13 5 -3 -2 2292.56 271.556 11 -5 3 1 319.441 69.4120 41 5 -3 -1 307.355 121.625 11 -5 3 1 285.479 70.1172 36 -5 3 1 309.112 60.0309 13 -5 3 0 2081.99 156.898 36 -5 3 0 2085.76 152.625 41 5 -3 0 1944.44 246.760 1 -5 3 0 2350.65 152.652 13 5 -3 0 2318.16 257.911 11 -5 3 -1 1161.63 114.149 36 -5 3 -1 1015.18 99.6654 41 5 -3 1 1121.91 192.739 1 -5 3 -1 1218.50 106.508 13 -5 3 -2 11971.1 572.178 36 -5 3 -2 11430.1 554.227 41 5 -3 2 11318.4 705.500 1 -5 3 -2 11304.7 550.985 29 -5 3 -3 2920.28 181.859 14 -5 3 -3 2492.10 164.802 41 5 -3 3 2787.94 278.715 1 -5 3 -3 3042.69 179.752 29 -5 3 -4 3103.64 190.200 29 -5 3 -4 2799.73 176.085 33 -5 3 -4 3099.86 200.281 36 -5 3 -4 2914.70 185.873 14 -5 3 -5-23.7834 47.1693 33 -5 3 -5 54.6446 57.9244 29 -5 3 -5 49.1317 50.9866 14 -5 3 -5 88.4069 67.1764 36 -5 3 -5-8.13051 68.9447 28 -5 3 -6 339.349 61.6088 33 -5 3 -6 343.684 68.0647 29 -5 3 -6 238.750 62.8219 22 -5 3 -6 180.798 49.1606 14 -5 3 -6 279.244 80.7957 28 -5 3 -7 1024.85 96.5773 29 -5 3 -7 993.630 91.6546 33 -5 3 -7 1089.23 90.5732 22 -5 3 -8 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36 7 3 7 416.567 56.0591 4 -7 -3 -7 352.287 56.1634 36 -7 -3 -8-4.44936 42.7023 29 -7 -3 -9 334.920 48.5677 29 -7 -3 -9 204.855 36.9381 33 -7 -3 -10 10.3296 19.1370 33 -7 -3 -10-21.9612 28.6053 29 7 4 -5 747.299 52.0367 19 7 4 -5 843.409 64.9116 37 7 4 -4 1534.63 95.6285 19 7 4 -4 1395.77 101.463 15 7 4 -3 908.181 70.2443 46 7 4 -3 1112.81 80.6610 19 -7 -4 3 977.930 78.2531 41 -7 -4 2 855.470 70.8549 5 -7 -4 2 957.919 85.2289 41 -7 -4 1 569.771 66.3884 5 7 4 -1 498.764 68.1477 4 -7 -4 1 599.083 80.0453 41 7 4 0 156.963 56.5222 4 -7 -4 0 157.353 54.4521 5 -7 -4 0 217.451 67.6441 41 7 4 1 885.920 93.8054 4 -7 -4 -1 698.547 83.9978 5 -7 -4 -1 663.932 90.9566 41 -7 -4 -2 1279.40 110.386 5 -7 -4 -2 1259.84 114.843 41 7 4 3 3567.18 219.292 4 -7 -4 -3 3737.21 218.003 5 -7 -4 -3 3713.41 217.198 41 7 4 4 665.931 86.1927 4 -7 -4 -4 653.058 82.3383 5 -7 -4 -4 587.846 75.5043 41 7 4 5 998.714 98.9261 4 -7 -4 -5 1022.62 94.3581 5 -7 -4 -5 1006.49 88.2473 41 -7 -4 -6 19.7910 44.3220 5 7 4 6 64.0918 49.9430 4 -7 -4 -7 80.8477 41.7058 5 7 4 7 122.675 47.0508 4 -7 -4 -7 61.9588 41.7695 36 -7 -4 -8 172.761 38.1728 32 -7 -4 -9 3622.43 195.024 29 -7 -4 -10 72.0359 35.1648 29 -7 -4 -11 1319.26 75.8066 29 7 5 -5 57.6026 16.5475 19 7 5 -4 1499.97 84.1764 19 7 5 -4 1470.12 88.8864 37 7 5 -3 99.1170 34.6735 46 -7 -5 3 121.864 35.0602 41 7 5 -3 161.059 45.8830 15 7 5 -3 193.120 50.6050 37 7 5 -3 185.204 41.2001 19 -7 -5 2-13.2121 43.9551 41 -7 -5 1 170.821 58.2861 41 -7 -5 1 120.577 45.1510 5 7 5 -1 112.360 50.1613 4 -7 -5 0 1670.69 126.784 41 7 5 0 1531.83 118.325 4 -7 -5 0 1392.16 112.397 5 -7 -5 -1 1919.09 143.969 41 7 5 1 1928.64 141.093 4 -7 -5 -1 1850.67 134.659 5 7 5 2 2761.16 179.314 4 -7 -5 -2 2749.67 176.528 5 -7 -5 -3 1537.19 122.142 41 7 5 3 1303.58 117.448 4 -7 -5 -3 1335.80 116.295 5 -7 -5 -4 747.156 84.6655 41 7 5 4 773.328 94.5806 4 -7 -5 -5 47.8805 47.8716 41 7 5 5 39.5784 53.5732 4 -7 -5 -5 23.0583 52.8179 5 -7 -5 -6 177.196 42.2280 41 -7 -5 -6 189.848 55.4903 5 7 5 6 183.085 57.6711 4 7 5 7 2693.10 170.701 4 -7 -5 -7 3051.03 165.899 5 -7 -5 -8 1459.10 97.0173 32 -7 -5 -9 1229.08 84.3836 32 -7 -5 -10 473.637 53.6204 29 -7 -5 -11 33.5309 25.8357 29 -7 -5 -11 24.4518 17.8318 33 7 6 -4 361.325 32.0273 46 7 6 -4 494.492 39.4172 19 7 6 -3 15.7522 30.9857 19 7 6 -3 36.2976 30.1032 46 -7 -6 2 393.793 49.8759 41 -7 -6 1 344.512 59.1333 41 -7 -6 1 341.269 46.9974 5 -7 -6 0 2855.51 171.270 41 7 6 0 2494.34 163.427 4 -7 -6 0 2761.34 159.946 5 -7 -6 -1 347.443 71.0739 41 -7 -6 -1 347.598 66.1251 5 7 6 1 387.939 69.6155 4 7 6 2 1900.46 140.734 4 -7 -6 -2 1917.62 137.822 5 -7 -6 -3-6.65106 55.5051 41 -7 -6 -3 19.0129 56.4652 5 -7 -6 -4 230.697 60.5469 41 7 6 4 337.100 70.9531 4 -7 -6 -5 720.656 76.9450 41 -7 -6 -5 589.458 78.7477 5 7 6 5 554.128 83.5726 4 -7 -6 -6 2392.75 150.389 41 7 6 6 2601.96 167.398 4 -7 -6 -6 2654.50 159.453 5 7 6 7 1018.45 93.7989 4 -7 -6 -7 1083.09 86.7933 5 7 6 8 1160.84 86.6053 4 -7 -6 -8 944.555 77.2615 32 -7 -6 -9 371.243 48.2594 32 -7 -6 -10 21.0278 28.7859 32 -7 -6 -11 40.4501 26.6670 29 7 7 -3 159.774 30.1744 46 7 7 -3 112.164 28.3936 19 7 7 -2 2112.35 124.532 15 -7 -7 2 1877.22 106.787 41 -7 -7 1 19.1154 38.3059 41 -7 -7 0 2845.13 161.248 41 7 7 0 2486.02 153.234 4 -7 -7 0 2523.40 146.783 5 -7 -7 -1 40.7112 52.5519 41 7 7 1-11.1759 47.3875 4 -7 -7 -1 33.7832 44.4044 5 -7 -7 -2 25.3650 55.9627 41 7 7 2 18.7650 51.3522 4 -7 -7 -2-11.2236 50.4691 5 -7 -7 -3-36.2092 56.7509 5 7 7 4 2477.06 176.003 4 -7 -7 -4 2729.34 175.695 5 -7 -7 -5 196.904 54.1398 41 7 7 5 85.7049 57.3965 4 -7 -7 -6 3147.71 178.408 41 7 7 6 3038.14 189.740 4 -7 -7 -6 3103.52 182.444 5 7 7 7-11.0061 48.3335 4 -7 -7 -7 31.2872 42.8995 5 -7 -7 -8 153.734 37.7104 32 7 7 8 184.110 46.0039 4 -7 -7 -8 197.473 42.2412 5 -7 -7 -9 46.9521 32.3424 32 -7 -7 -10 880.395 63.0353 32 -7 -7 -11 318.253 30.9770 32 7 8 -2 2238.65 120.513 46 -7 -8 1 154.630 34.2771 41 7 8 -1 187.021 40.1377 15 -7 -8 0 123.671 31.5996 5 -7 -8 0 190.699 46.6013 41 -7 -8 -1 46.5002 41.0732 5 -7 -8 -1-24.4169 44.7262 41 7 8 2 2069.32 138.043 4 -7 -8 -2 1847.51 130.271 5 -7 -8 -2 2168.55 141.798 41 7 8 3 48.5465 53.8212 4 -7 -8 -3 5.41876 50.7336 5 7 8 4 4178.87 242.467 4 -7 -8 -4 4346.88 238.756 5 -7 -8 -4 4357.70 241.152 41 7 8 5 62.4080 56.6626 4 -7 -8 -5 16.4184 48.0895 41 7 8 6 880.936 91.3895 4 -7 -8 -6 885.034 84.9439 5 -7 -8 -6 938.268 82.3007 41 7 8 7 36.8842 50.2247 4 -7 -8 -7 78.3023 44.6175 5 -7 -8 -8 196.011 38.0553 32 -7 -8 -8 190.548 41.4516 5 -7 -8 -9 65.7211 32.0822 32 -7 -8 -10 1575.95 90.9057 32 -7 -8 -11 176.858 22.9357 32 7 9 -1 28.2038 25.1052 46 -7 -9 0 31.2783 28.9176 41 -7 -9 -1 328.401 41.8418 5 -7 -9 -1 307.250 48.7773 41 -7 -9 -2 1936.92 117.573 5 -7 -9 -2 1790.82 124.181 41 -7 -9 -3 273.449 56.2673 5 -7 -9 -3 272.941 59.2318 41 -7 -9 -4 797.579 80.3594 5 7 9 5 61.3756 49.2811 4 -7 -9 -5-4.93259 49.8193 5 -7 -9 -5 89.9891 50.4929 41 -7 -9 -6 41.6038 43.1792 5 -7 -9 -6 88.0281 41.4732 41 -7 -9 -7 56.2992 39.8059 5 -7 -9 -7 86.6155 35.1099 41 -7 -9 -8 1938.56 103.271 5 -7 -9 -8 1376.85 91.4701 32 -7 -9 -9-9.50533 25.4394 32 -7 -9 -10 1203.36 70.4159 32 -7 -10 -1 1194.24 74.5324 41 -7 -10 -2 1655.43 93.4600 5 -7 -10 -2 1519.21 98.8878 41 -7 -10 -3 458.728 53.8551 5 -7 -10 -3 530.274 60.7013 41 -7 -10 -4 145.660 45.5598 5 -7 -10 -5-16.1448 42.0617 5 -7 -10 -5 49.9883 42.9595 41 -7 -10 -6 541.975 59.4718 41 -7 -10 -7 412.409 50.4944 5 -7 -10 -7 268.537 40.3774 41 -7 -10 -8 2794.67 146.633 5 -7 -10 -9 335.350 30.9547 32 -7 -11 -2 38.0405 19.5222 41 -7 -11 -3 2.49977 26.5856 41 -7 -11 -3 15.3005 21.5839 5 -7 -11 -4 275.623 40.8619 41 -7 -11 -4 218.371 35.7501 5 -7 -11 -5 1496.45 94.1749 41 -7 -11 -5 1522.13 94.0231 5 -7 -11 -6 1367.81 86.6616 41 -7 -11 -7 826.468 57.8371 41 -7 -11 -7 941.881 64.9282 5 -7 -11 -8 116.797 25.6905 5 -7 -12 -4 131.603 19.2072 41 -7 -12 -5 860.569 51.8716 5 -7 -12 -6 256.283 27.3070 41 -7 -12 -6 384.890 31.2222 5 -7 -12 -7 286.659 26.8357 5 8 -2 -2 89.8482 23.3438 21 8 -2 -1 119.682 26.7894 43 8 -2 -1 80.4030 27.4340 21 -8 2 -1 462.794 45.6071 36 -8 1 2 991.137 69.5348 41 8 -1 -2 945.324 70.6142 21 8 -1 -1 473.516 44.3670 43 -8 1 1 374.738 40.3877 36 -8 1 0 2992.94 155.644 41 -8 1 0 2789.26 152.878 36 -8 1 -1 460.138 52.0180 36 -8 1 -1 357.117 44.3371 41 -8 1 -2 236.109 47.0880 36 -8 1 -3 54.8946 32.0135 28 -8 1 -3 57.8125 37.2244 36 -8 1 -4 338.252 39.8256 28 -8 1 -5 322.648 31.1040 28 8 0 -3 108.393 26.9246 21 -8 0 3 190.876 29.8672 41 8 0 -2 2262.81 134.532 21 -8 0 2 2561.34 135.833 41 -8 0 1 22.3455 31.9957 36 -8 0 1 32.2395 39.3493 41 8 0 0 340.676 47.0368 4 -8 0 0 300.239 48.8109 36 -8 0 0 298.720 48.8869 41 -8 0 -1 23.3095 41.3156 36 -8 0 -1 7.11191 36.4148 41 8 0 2 714.187 66.7655 4 -8 0 -2 827.617 64.0451 41 -8 0 -2 730.464 72.9802 36 -8 0 -3-3.75832 42.8025 36 8 0 3 148.660 38.3003 4 -8 0 -4 3308.19 175.141 36 -8 0 -5-37.6198 31.0789 28 -8 0 -5 22.3325 29.8337 36 -8 -1 3 291.148 33.7239 41 8 1 -3 258.174 28.7595 21 -8 -1 2 989.041 67.7339 41 -8 -1 2 600.731 47.8572 36 -8 -1 1 34.5292 35.3283 36 -8 -1 1 11.5148 37.8850 41 8 1 0 23.6583 33.7797 4 -8 -1 0-19.3447 41.1422 36 -8 -1 -1 25.4343 44.3252 36 -8 -1 -1-28.4235 43.6059 41 8 1 2 2089.79 134.589 4 -8 -1 -2 2214.85 130.733 41 -8 -1 -2 2395.68 139.790 36 8 1 3 267.333 48.4090 4 -8 -1 -4 1963.43 118.603 36 8 1 4 1739.19 111.980 4 -8 -1 -5-6.38667 35.4974 36 -8 -1 -6 20.0037 32.3493 28 -8 -1 -7-9.22848 16.8407 28 -8 -2 3 70.0075 22.8624 41 8 2 -2 94.3219 27.4990 21 -8 -2 2 134.224 38.1309 41 -8 -2 2 74.6553 25.9913 36 -8 -2 1 58.3219 39.6992 41 -8 -2 1 16.4418 37.2441 36 8 2 0 1219.29 89.2342 4 8 2 1 966.283 85.3923 4 -8 -2 -1 1312.90 93.1997 41 8 2 2 1585.80 112.426 4 -8 -2 -2 1600.54 110.881 41 -8 -2 -2 1775.20 117.629 36 -8 -2 -3 53.9979 37.3583 41 8 2 3 77.9726 41.5340 4 8 2 4 956.135 80.3193 4 -8 -2 -4 1052.74 84.7442 36 8 2 5 13.8603 32.1565 4 -8 -2 -5-32.4643 38.8628 36 -8 -2 -6 413.148 45.4314 36 -8 -2 -7 2.29065 26.1476 28 8 3 -3 29.5333 25.7658 37 -8 -3 2 156.998 36.2413 41 -8 -3 2 127.862 27.6939 36 -8 -3 1 1383.98 95.3700 41 8 3 0 1319.45 94.4557 4 -8 -3 0 1486.81 103.284 41 8 3 1 1279.82 96.8710 4 -8 -3 -2 592.060 67.0357 41 8 3 3 43.3020 44.4553 4 -8 -3 -3-19.9564 38.4620 41 -8 -3 -4 473.161 63.0860 36 8 3 4 401.522 57.0645 4 -8 -3 -4 349.243 46.9991 41 8 3 5 765.141 71.5208 4 -8 -3 -5 872.008 74.6217 36 -8 -3 -6 820.433 66.0691 36 -8 -3 -7 390.478 42.9787 28 -8 -3 -7 302.821 29.8960 29 8 4 -2 392.124 44.5663 37 -8 -4 2 366.804 39.1485 41 -8 -4 1 2205.08 127.326 41 -8 -4 0 288.801 51.9558 41 8 4 0 235.917 42.7925 4 8 4 1 217.512 47.9619 4 -8 -4 -2-27.2961 45.0590 41 -8 -4 -2 30.8317 42.4430 5 -8 -4 -3 156.922 49.3656 41 -8 -4 -3 333.789 56.2455 5 8 4 3 200.482 51.3397 4 -8 -4 -4 1044.58 78.3150 41 8 4 4 953.200 84.4341 4 -8 -4 -5 1461.88 99.7412 36 8 4 5 1375.44 99.9922 4 -8 -4 -6 978.159 73.3949 36 8 4 6 950.742 74.9430 4 -8 -4 -7 429.903 39.3215 29 -8 -4 -8 24.3356 17.6903 29 -8 -5 1 829.422 63.2503 41 -8 -5 0 81.7613 41.0878 41 -8 -5 -1 30.0269 44.3347 41 -8 -5 -1 126.860 41.3633 5 8 5 1 48.4526 39.1794 4 -8 -5 -2-41.8465 43.4668 5 8 5 2-4.57285 38.5832 4 -8 -5 -3 1839.59 119.425 41 -8 -5 -3 1737.98 118.708 5 -8 -5 -4 356.372 52.0251 41 8 5 4 417.466 60.1790 4 8 5 5 1246.98 99.3220 4 -8 -5 -5 1594.92 100.753 5 -8 -5 -6 172.662 39.6075 36 8 5 6 221.869 45.9987 4 -8 -5 -6 219.149 40.6003 5 -8 -5 -7 2.09331 25.9996 29 -8 -5 -8 64.3383 22.5328 29 -8 -6 1-17.3795 21.8011 41 -8 -6 0 94.9429 35.5013 41 -8 -6 -1 2016.31 119.932 41 8 6 1 1753.10 111.998 4 -8 -6 -1 1894.27 110.565 5 8 6 2 29.2648 39.0242 4 -8 -6 -2 71.1099 39.9876 5 -8 -6 -3 1868.72 121.987 41 -8 -6 -3 1885.73 120.872 5 -8 -6 -4 3.85926 37.9320 41 8 6 4-32.4625 40.3321 4 -8 -6 -4 20.5136 42.8994 5 -8 -6 -5 202.329 40.1213 41 8 6 5 163.621 44.5685 4 -8 -6 -5 200.523 46.5722 5 8 6 6 7.75148 35.8100 4 -8 -6 -6-9.57043 33.0123 5 -8 -6 -7 739.737 53.2070 29 -8 -6 -8 53.9362 22.0176 29 -8 -7 0 238.139 33.1145 41 -8 -7 -1 1311.50 88.3012 41 -8 -7 -1 1359.48 79.1933 5 -8 -7 -2 251.524 47.0559 41 8 7 2 196.984 43.2949 4 -8 -7 -2 259.785 42.4791 5 8 7 3 2362.59 145.380 4 -8 -7 -3 2743.89 146.148 5 -8 -7 -4 388.059 52.9025 41 8 7 4 348.263 51.5824 4 -8 -7 -4 307.895 52.7668 5 -8 -7 -5 403.157 48.2272 41 8 7 5 405.543 54.4408 4 8 7 6 3.69699 32.9398 4 -8 -7 -6 12.3142 31.5233 5 -8 -7 -7 1896.02 104.249 5 -8 -7 -8-1.55106 17.5520 29 -8 -8 -1 593.793 45.6170 41 -8 -8 -2 415.445 39.7182 5 -8 -8 -2 398.112 44.9700 41 -8 -8 -3 755.030 61.5593 5 -8 -8 -4 948.134 72.6852 5 -8 -8 -4 964.490 72.5763 41 8 8 5 568.869 57.0375 4 -8 -8 -5 610.244 53.5265 41 -8 -8 -6 187.375 36.9169 5 -8 -8 -7 897.991 59.5851 5 -8 -9 -2 31.5866 18.0782 41 -8 -9 -3 245.632 29.1114 5 -8 -9 -3 296.077 33.9822 41 -8 -9 -4 609.727 47.8531 5 -8 -9 -4 438.874 45.0252 41 -8 -9 -5 878.645 60.5208 5 -8 -9 -5 771.281 56.0747 41 -8 -9 -6 512.796 44.3498 5 -8 -9 -7 239.567 26.2803 5 -8 -10 -5 314.962 27.0938 5 0 0 0 0.00 0.00 0 TITL GVSU1022B in P-1 REM P-1 (#2 in standard setting) CELL 1.54184 6.961081 11.973654 12.069668 65.6184 78.5882 74.8264 ZERR 3.00 0.000294 0.000493 0.000443 0.0038 0.0034 0.0036 LATT 1 SFAC C H N O UNIT 30.00 60.00 6.00 9.00 REM CrysAlisPro recorded range (K): Min=99.9; max=100.1; aver:100.0 TEMP -173 TREF HKLF 4 END ; _shelx_hkl_checksum 38110 _shelx_res_file ; TITL gvsu1022b_a.res in P-1 gvsu1022b.res created by SHELXL-2019/2 at 15:25:27 on 04-Mar-2023 REM Old TITL GVSU1022B in P-1 REM SHELXT solution in P-1: R1 0.088, Rweak 0.005, Alpha 0.046 REM 0.000 for 0 systematic absences, Orientation as input REM Formula found by SHELXT: C3 N1 O2 I2 CELL 1.54184 6.961081 11.973654 12.069668 65.6184 78.5882 74.8264 ZERR 2 0.000294 0.000493 0.000443 0.0038 0.0034 0.0036 LATT 1 SFAC C H I N O UNIT 34 30 4 2 4 L.S. 14 PLAN 7 SIZE 0.112 0.055 0.024 TEMP -173.15(14) CONF MPLA N1 C2 C3 C4 C5 C6 C7 C8 C9 C10 C11 C12 C13 RTAB angl C5 I1 I2 RTAB angl C11 I2 I1 RTAB angl C11 I2 I2 MORE -1 BOND $H fmap 2 acta OMIT 1 -7 9 OMIT 0 -7 9 REM REM REM WGHT 0.041400 2.141500 FVAR 1.31526 I1 3 0.355227 0.846541 0.680704 11.00000 0.03315 0.01775 = 0.02357 -0.01080 -0.00265 0.00301 I2 3 1.020779 0.064820 0.832595 11.00000 0.03258 0.01525 = 0.01960 -0.00313 -0.00287 0.00277 O1 5 0.908088 0.471327 0.203829 11.00000 0.04359 0.02034 = 0.02286 -0.01092 -0.00226 0.00622 O2 5 0.698978 0.659188 0.174023 11.00000 0.03160 0.01774 = 0.01504 -0.00525 -0.00474 0.00218 N1 4 0.772122 0.531376 0.364446 11.00000 0.01918 0.01425 = 0.01825 -0.00712 -0.00038 -0.00098 C1 1 0.802126 0.548406 0.240460 11.00000 0.02121 0.01748 = 0.02234 -0.00552 -0.00446 0.00027 C2 1 0.670435 0.618187 0.418341 11.00000 0.01737 0.01666 = 0.01947 -0.00657 -0.00103 -0.00532 C3 1 0.678416 0.557946 0.546212 11.00000 0.01665 0.01614 = 0.01830 -0.00681 -0.00084 0.00002 C4 1 0.590948 0.621179 0.623645 11.00000 0.02054 0.01561 = 0.02386 -0.00932 -0.00287 -0.00049 AFIX 43 H4 2 0.596672 0.580826 0.709538 11.00000 -1.20000 AFIX 0 C5 1 0.495368 0.744835 0.571229 11.00000 0.01714 0.01605 = 0.02250 -0.01052 0.00148 0.00119 C6 1 0.487717 0.806279 0.443861 11.00000 0.01966 0.01615 = 0.02337 -0.00665 -0.00115 -0.00175 AFIX 43 H6 2 0.423151 0.891758 0.410340 11.00000 -1.20000 AFIX 0 C7 1 0.574484 0.742158 0.366877 11.00000 0.01853 0.01642 = 0.02265 -0.00741 -0.00429 -0.00111 AFIX 43 H7 2 0.567988 0.782539 0.281049 11.00000 -1.20000 AFIX 0 C8 1 0.845857 0.416742 0.458189 11.00000 0.01569 0.01368 = 0.01919 -0.00542 -0.00126 -0.00138 C9 1 0.788121 0.431067 0.570570 11.00000 0.01499 0.01554 = 0.02052 -0.00763 0.00148 -0.00134 C10 1 0.839205 0.330274 0.680392 11.00000 0.01848 0.01446 = 0.01994 -0.00476 -0.00103 -0.00007 AFIX 43 H10 2 0.802819 0.338279 0.757291 11.00000 -1.20000 AFIX 0 C11 1 0.944941 0.219107 0.670704 11.00000 0.02085 0.01190 = 0.02279 -0.00251 -0.00871 0.00236 C12 1 0.999425 0.204571 0.559712 11.00000 0.02207 0.01557 = 0.02323 -0.00871 -0.00165 0.00003 AFIX 43 H12 2 1.070569 0.125606 0.558551 11.00000 -1.20000 AFIX 0 C13 1 0.952067 0.303023 0.450507 11.00000 0.01893 0.01680 = 0.02472 -0.00936 -0.00079 -0.00108 AFIX 43 H13 2 0.989829 0.293776 0.374211 11.00000 -1.20000 AFIX 0 C14 1 0.706339 0.698622 0.038945 11.00000 0.03462 0.02055 = 0.01710 -0.00815 -0.00279 -0.00236 C15 1 0.577319 0.828718 0.002703 11.00000 0.03992 0.02308 = 0.02875 -0.00684 -0.00969 0.00592 AFIX 137 H15A 2 0.442886 0.824282 0.045892 11.00000 -1.50000 H15B 2 0.568722 0.864481 -0.085716 11.00000 -1.50000 H15C 2 0.636703 0.881733 0.024436 11.00000 -1.50000 AFIX 0 C16 1 0.920350 0.701515 -0.019981 11.00000 0.04028 0.02653 = 0.02914 -0.01218 0.00529 -0.00261 AFIX 137 H16A 2 0.980140 0.748546 0.009296 11.00000 -1.50000 H16B 2 0.920443 0.742127 -0.109047 11.00000 -1.50000 H16C 2 0.998346 0.615734 0.001846 11.00000 -1.50000 AFIX 0 C17 1 0.613149 0.611043 0.014404 11.00000 0.05224 0.02806 = 0.02717 -0.00906 -0.01148 -0.00882 AFIX 137 H17A 2 0.688431 0.525099 0.050166 11.00000 -1.50000 H17B 2 0.616737 0.635693 -0.074038 11.00000 -1.50000 H17C 2 0.474017 0.615706 0.051213 11.00000 -1.50000 AFIX 0 HKLF 4 REM gvsu1022b_a.res in P-1 REM wR2 = 0.0899, GooF = S = 1.080, Restrained GooF = 1.080 for all data REM R1 = 0.0329 for 3209 Fo > 4sig(Fo) and 0.0391 for all 3717 data REM 202 parameters refined using 0 restraints END WGHT 0.0414 2.1415 REM Highest difference peak 0.740, deepest hole -1.168, 1-sigma level 0.150 Q1 1 0.9912 0.1366 0.8769 11.00000 0.05 0.74 Q2 1 0.9620 0.1757 0.7732 11.00000 0.05 0.73 Q3 1 0.3681 0.7399 0.7318 11.00000 0.05 0.73 Q4 1 0.3597 0.7599 0.6549 11.00000 0.05 0.72 Q5 1 1.0475 -0.0022 0.7783 11.00000 0.05 0.72 Q6 1 0.3278 0.9609 0.6300 11.00000 0.05 0.71 Q7 1 1.0446 -0.0485 0.8627 11.00000 0.05 0.65 ; _shelx_res_checksum 62558 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 I I1 0.35523(5) 0.84654(3) 0.68070(3) 0.02553(10) Uani d 1 . . I I2 1.02078(5) 0.06482(2) 0.83259(2) 0.02519(10) Uani d 1 . . O O1 0.9081(6) 0.4713(3) 0.2038(3) 0.0308(8) Uani d 1 . . O O2 0.6990(5) 0.6592(3) 0.1740(3) 0.0229(7) Uani d 1 . . N N1 0.7721(6) 0.5314(3) 0.3644(3) 0.0176(7) Uani d 1 . . C C1 0.8021(7) 0.5484(4) 0.2405(4) 0.0216(9) Uani d 1 . . C C2 0.6704(7) 0.6182(4) 0.4183(4) 0.0177(8) Uani d 1 . . C C3 0.6784(7) 0.5579(4) 0.5462(4) 0.0178(8) Uani d 1 . . C C4 0.5909(7) 0.6212(4) 0.6236(4) 0.0199(9) Uani d 1 . . H H4 0.596672 0.580826 0.709538 0.024 Uiso calc 1 . . C C5 0.4954(7) 0.7448(4) 0.5712(4) 0.0189(8) Uani d 1 . . C C6 0.4877(7) 0.8063(4) 0.4439(4) 0.0206(9) Uani d 1 . . H H6 0.423151 0.891758 0.410340 0.025 Uiso calc 1 . . C C7 0.5745(7) 0.7422(4) 0.3669(4) 0.0194(8) Uani d 1 . . H H7 0.567988 0.782539 0.281049 0.023 Uiso calc 1 . . C C8 0.8459(6) 0.4167(4) 0.4582(4) 0.0169(8) Uani d 1 . . C C9 0.7881(6) 0.4311(4) 0.5706(4) 0.0176(8) Uani d 1 . . C C10 0.8392(7) 0.3303(4) 0.6804(4) 0.0190(8) Uani d 1 . . H H10 0.802819 0.338279 0.757291 0.023 Uiso calc 1 . . C C11 0.9449(7) 0.2191(4) 0.6707(4) 0.0201(9) Uani d 1 . . C C12 0.9994(7) 0.2046(4) 0.5597(4) 0.0207(9) Uani d 1 . . H H12 1.070569 0.125606 0.558551 0.025 Uiso calc 1 . . C C13 0.9521(7) 0.3030(4) 0.4505(4) 0.0204(9) Uani d 1 . . H H13 0.989829 0.293776 0.374211 0.024 Uiso calc 1 . . C C14 0.7063(8) 0.6986(4) 0.0389(4) 0.0244(10) Uani d 1 . . C C15 0.5773(9) 0.8287(5) 0.0027(5) 0.0332(12) Uani d 1 . . H H15A 0.442886 0.824282 0.045892 0.050 Uiso calc 1 . . H H15B 0.568722 0.864481 -0.085716 0.050 Uiso calc 1 . . H H15C 0.636703 0.881733 0.024436 0.050 Uiso calc 1 . . C C16 0.9203(9) 0.7015(5) -0.0200(5) 0.0336(12) Uani d 1 . . H H16A 0.980140 0.748546 0.009296 0.050 Uiso calc 1 . . H H16B 0.920443 0.742127 -0.109047 0.050 Uiso calc 1 . . H H16C 0.998346 0.615734 0.001846 0.050 Uiso calc 1 . . C C17 0.6131(10) 0.6110(5) 0.0144(5) 0.0351(12) Uani d 1 . . H H17A 0.688431 0.525099 0.050166 0.053 Uiso calc 1 . . H H17B 0.616737 0.635693 -0.074038 0.053 Uiso calc 1 . . H H17C 0.474017 0.615706 0.051213 0.053 Uiso calc 1 . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 I1 0.03315(18) 0.01775(15) 0.02357(16) 0.00301(11) -0.00265(12) -0.01080(12) I2 0.03258(18) 0.01525(15) 0.01960(16) 0.00277(11) -0.00287(11) -0.00313(11) O1 0.044(2) 0.0203(16) 0.0229(16) 0.0062(15) -0.0023(15) -0.0109(14) O2 0.0316(18) 0.0177(15) 0.0150(14) 0.0022(13) -0.0047(12) -0.0053(12) N1 0.0192(18) 0.0143(16) 0.0183(17) -0.0010(14) -0.0004(14) -0.0071(14) C1 0.021(2) 0.017(2) 0.022(2) 0.0003(17) -0.0045(17) -0.0055(18) C2 0.017(2) 0.017(2) 0.019(2) -0.0053(16) -0.0010(16) -0.0066(16) C3 0.017(2) 0.016(2) 0.018(2) 0.0000(16) -0.0008(16) -0.0068(16) C4 0.021(2) 0.016(2) 0.024(2) -0.0005(16) -0.0029(17) -0.0093(17) C5 0.017(2) 0.016(2) 0.022(2) 0.0012(16) 0.0015(16) -0.0105(17) C6 0.020(2) 0.016(2) 0.023(2) -0.0018(16) -0.0012(17) -0.0066(17) C7 0.019(2) 0.016(2) 0.023(2) -0.0011(16) -0.0043(16) -0.0074(17) C8 0.0157(19) 0.0137(19) 0.019(2) -0.0014(15) -0.0013(15) -0.0054(16) C9 0.0150(19) 0.016(2) 0.021(2) -0.0013(15) 0.0015(15) -0.0076(16) C10 0.018(2) 0.0145(19) 0.020(2) -0.0001(16) -0.0010(16) -0.0048(17) C11 0.021(2) 0.0119(19) 0.023(2) 0.0024(16) -0.0087(17) -0.0025(16) C12 0.022(2) 0.0156(19) 0.023(2) 0.0000(16) -0.0016(17) -0.0087(17) C13 0.019(2) 0.017(2) 0.025(2) -0.0011(16) -0.0008(17) -0.0094(17) C14 0.035(3) 0.021(2) 0.017(2) -0.0024(19) -0.0028(18) -0.0082(18) C15 0.040(3) 0.023(2) 0.029(3) 0.006(2) -0.010(2) -0.007(2) C16 0.040(3) 0.027(3) 0.029(3) -0.003(2) 0.005(2) -0.012(2) C17 0.052(4) 0.028(3) 0.027(3) -0.009(2) -0.011(2) -0.009(2) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' I I -0.3257 6.8362 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag C1 O2 C14 . . 120.3(4) ? C1 N1 C2 . . 128.7(4) ? C1 N1 C8 . . 122.7(4) ? C2 N1 C8 . . 108.5(3) ? O1 C1 O2 . . 127.0(4) ? O1 C1 N1 . . 122.8(4) ? O2 C1 N1 . . 110.3(4) ? N1 C2 C3 . . 108.2(4) ? C7 C2 N1 . . 131.2(4) ? C7 C2 C3 . . 120.7(4) ? C2 C3 C9 . . 107.3(4) ? C4 C3 C2 . . 121.1(4) ? C4 C3 C9 . . 131.6(4) ? C3 C4 H4 . . 121.2 ? C5 C4 C3 . . 117.7(4) ? C5 C4 H4 . . 121.2 ? C4 C5 I1 . . 120.4(3) ? C4 C5 C6 . . 121.8(4) ? C6 C5 I1 . . 117.8(3) ? C5 C6 H6 . . 119.9 ? C7 C6 C5 . . 120.3(4) ? C7 C6 H6 . . 119.9 ? C2 C7 C6 . . 118.5(4) ? C2 C7 H7 . . 120.8 ? C6 C7 H7 . . 120.8 ? C9 C8 N1 . . 108.2(4) ? C13 C8 N1 . . 129.7(4) ? C13 C8 C9 . . 122.1(4) ? C8 C9 C3 . . 107.9(4) ? C8 C9 C10 . . 120.4(4) ? C10 C9 C3 . . 131.8(4) ? C9 C10 H10 . . 121.7 ? C11 C10 C9 . . 116.6(4) ? C11 C10 H10 . . 121.7 ? C10 C11 I2 . . 118.1(3) ? C10 C11 C12 . . 122.9(4) ? C12 C11 I2 . . 119.0(3) ? C11 C12 H12 . . 119.4 ? C13 C12 C11 . . 121.3(4) ? C13 C12 H12 . . 119.4 ? C8 C13 H13 . . 121.6 ? C12 C13 C8 . . 116.7(4) ? C12 C13 H13 . . 121.6 ? O2 C14 C15 . . 101.9(4) ? O2 C14 C16 . . 110.3(4) ? O2 C14 C17 . . 108.4(4) ? C15 C14 C16 . . 111.4(4) ? C15 C14 C17 . . 111.3(5) ? C17 C14 C16 . . 113.0(5) ? C14 C15 H15A . . 109.5 ? C14 C15 H15B . . 109.5 ? C14 C15 H15C . . 109.5 ? H15A C15 H15B . . 109.5 ? H15A C15 H15C . . 109.5 ? H15B C15 H15C . . 109.5 ? C14 C16 H16A . . 109.5 ? C14 C16 H16B . . 109.5 ? C14 C16 H16C . . 109.5 ? H16A C16 H16B . . 109.5 ? H16A C16 H16C . . 109.5 ? H16B C16 H16C . . 109.5 ? C14 C17 H17A . . 109.5 ? C14 C17 H17B . . 109.5 ? C14 C17 H17C . . 109.5 ? H17A C17 H17B . . 109.5 ? H17A C17 H17C . . 109.5 ? H17B C17 H17C . . 109.5 ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag I1 C5 . 2.092(4) ? I2 C11 . 2.104(4) ? O1 C1 . 1.201(6) ? O2 C1 . 1.330(5) ? O2 C14 . 1.493(5) ? N1 C1 . 1.404(6) ? N1 C2 . 1.413(6) ? N1 C8 . 1.416(6) ? C2 C3 . 1.414(6) ? C2 C7 . 1.385(6) ? C3 C4 . 1.391(6) ? C3 C9 . 1.446(6) ? C4 H4 . 0.9500 ? C4 C5 . 1.383(6) ? C5 C6 . 1.409(6) ? C6 H6 . 0.9500 ? C6 C7 . 1.393(6) ? C7 H7 . 0.9500 ? C8 C9 . 1.404(6) ? C8 C13 . 1.400(6) ? C9 C10 . 1.408(6) ? C10 H10 . 0.9500 ? C10 C11 . 1.382(6) ? C11 C12 . 1.388(7) ? C12 H12 . 0.9500 ? C12 C13 . 1.386(6) ? C13 H13 . 0.9500 ? C14 C15 . 1.512(7) ? C14 C16 . 1.521(8) ? C14 C17 . 1.516(7) ? C15 H15A . 0.9800 ? C15 H15B . 0.9800 ? C15 H15C . 0.9800 ? C16 H16A . 0.9800 ? C16 H16B . 0.9800 ? C16 H16C . 0.9800 ? C17 H17A . 0.9800 ? C17 H17B . 0.9800 ? C17 H17C . 0.9800 ? loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion _geom_torsion_publ_flag I1 C5 C6 C7 . . . . -178.5(3) ? I2 C11 C12 C13 . . . . 179.6(4) ? N1 C2 C3 C4 . . . . 179.7(4) ? N1 C2 C3 C9 . . . . 0.0(5) ? N1 C2 C7 C6 . . . . -179.2(4) ? N1 C8 C9 C3 . . . . -0.8(5) ? N1 C8 C9 C10 . . . . 179.1(4) ? N1 C8 C13 C12 . . . . -178.0(4) ? C1 O2 C14 C15 . . . . -177.9(4) ? C1 O2 C14 C16 . . . . -59.5(6) ? C1 O2 C14 C17 . . . . 64.7(6) ? C1 N1 C2 C3 . . . . 179.7(4) ? C1 N1 C2 C7 . . . . -0.6(8) ? C1 N1 C8 C9 . . . . -179.3(4) ? C1 N1 C8 C13 . . . . -1.6(7) ? C2 N1 C1 O1 . . . . 172.5(5) ? C2 N1 C1 O2 . . . . -7.2(7) ? C2 N1 C8 C9 . . . . 0.8(5) ? C2 N1 C8 C13 . . . . 178.6(5) ? C2 C3 C4 C5 . . . . 0.2(7) ? C2 C3 C9 C8 . . . . 0.5(5) ? C2 C3 C9 C10 . . . . -179.4(5) ? C3 C2 C7 C6 . . . . 0.6(7) ? C3 C4 C5 I1 . . . . 178.9(3) ? C3 C4 C5 C6 . . . . -0.7(7) ? C3 C9 C10 C11 . . . . 179.1(5) ? C4 C3 C9 C8 . . . . -179.1(5) ? C4 C3 C9 C10 . . . . 1.1(9) ? C4 C5 C6 C7 . . . . 1.2(7) ? C5 C6 C7 C2 . . . . -1.1(7) ? C7 C2 C3 C4 . . . . -0.1(7) ? C7 C2 C3 C9 . . . . -179.8(4) ? C8 N1 C1 O1 . . . . -7.3(7) ? C8 N1 C1 O2 . . . . 173.0(4) ? C8 N1 C2 C3 . . . . -0.5(5) ? C8 N1 C2 C7 . . . . 179.2(5) ? C8 C9 C10 C11 . . . . -0.7(7) ? C9 C3 C4 C5 . . . . 179.7(5) ? C9 C8 C13 C12 . . . . -0.5(7) ? C9 C10 C11 I2 . . . . -179.0(3) ? C9 C10 C11 C12 . . . . -0.3(7) ? C10 C11 C12 C13 . . . . 0.9(8) ? C11 C12 C13 C8 . . . . -0.5(7) ? C13 C8 C9 C3 . . . . -178.8(4) ? C13 C8 C9 C10 . . . . 1.1(7) ? C14 O2 C1 O1 . . . . 0.5(8) ? C14 O2 C1 N1 . . . . -179.8(4) ?