#------------------------------------------------------------------------------ #$Date: 2019-11-04 18:10:36 +0200 (Mon, 04 Nov 2019) $ #$Revision: 223213 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/55/24/1552482.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1552482 loop_ _publ_author_name 'Zhang, Peng' 'Yuan, Xiao-Long' 'Du, Yong-Mei' 'Zhang, Huai-Bao' 'Shen, Guo-Ming' 'Zhang, Zhong-Feng' 'Liang, Yu-Jun' 'Zhao, Dong-Lin' 'Xu, Kuo' _publ_section_title ; Angularly Prenylated Indole Alkaloids with Antimicrobial and Insecticidal Activities from an Endophytic Fungus Fusarium sambucinum TE-6L. ; _journal_issue 43 _journal_name_full 'Journal of agricultural and food chemistry' _journal_page_first 11994 _journal_page_last 12001 _journal_paper_doi 10.1021/acs.jafc.9b05827 _journal_volume 67 _journal_year 2019 _chemical_absolute_configuration rm _chemical_formula_sum 'C26 H29 N3 O4' _chemical_formula_weight 447.52 _space_group_crystal_system orthorhombic _space_group_IT_number 19 _space_group_name_Hall 'P 2ac 2ab' _space_group_name_H-M_alt 'P 21 21 21' _symmetry_space_group_name_Hall 'P 2ac 2ab' _symmetry_space_group_name_H-M 'P 21 21 21' _atom_sites_solution_hydrogens mixed _audit_creation_method SHELXL-2018/3 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 7.1440(2) _cell_length_b 17.6831(5) _cell_length_c 18.5462(5) _cell_measurement_reflns_used 9782 _cell_measurement_temperature 293(2) _cell_measurement_theta_max 71.4500 _cell_measurement_theta_min 4.7820 _cell_volume 2342.91(11) _computing_cell_refinement 'CrysAlisPro 1.171.39.35c (Rigaku OD, 2017)' _computing_data_collection 'CrysAlisPro 1.171.39.35c (Rigaku OD, 2017)' _computing_data_reduction 'CrysAlisPro 1.171.39.35c (Rigaku OD, 2017)' _computing_structure_refinement 'SHELXL-2018/3 (Sheldrick, 2018)' _computing_structure_solution 'SHELXL-2018/3 (Sheldrick, 2018)' _diffrn_ambient_temperature 293(2) _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 1.000 _diffrn_measurement_device_type 'Xcalibur, Eos, Gemini' _diffrn_radiation_type CuK\a _diffrn_radiation_wavelength 1.54184 _diffrn_reflns_av_R_equivalents 0.0249 _diffrn_reflns_av_unetI/netI 0.0233 _diffrn_reflns_Laue_measured_fraction_full 1.000 _diffrn_reflns_Laue_measured_fraction_max 1.000 _diffrn_reflns_limit_h_max 5 _diffrn_reflns_limit_h_min -8 _diffrn_reflns_limit_k_max 21 _diffrn_reflns_limit_k_min -21 _diffrn_reflns_limit_l_max 22 _diffrn_reflns_limit_l_min -22 _diffrn_reflns_number 15907 _diffrn_reflns_point_group_measured_fraction_full 1.000 _diffrn_reflns_point_group_measured_fraction_max 1.000 _diffrn_reflns_theta_full 67.230 _diffrn_reflns_theta_max 67.230 _diffrn_reflns_theta_min 4.769 _diffrn_source 'fine-focus sealed X-ray tube' _exptl_absorpt_coefficient_mu 0.699 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.89024 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details sadabs _exptl_crystal_colour white _exptl_crystal_density_diffrn 1.269 _exptl_crystal_description block _exptl_crystal_F_000 952 _exptl_crystal_size_max 0.120 _exptl_crystal_size_mid 0.120 _exptl_crystal_size_min 0.110 _refine_diff_density_max 0.411 _refine_diff_density_min -0.183 _refine_diff_density_rms 0.044 _refine_ls_abs_structure_details ; Flack x determined using 1519 quotients [(I+)-(I-)]/[(I+)+(I-)] (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). ; _refine_ls_abs_structure_Flack -0.16(7) _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.052 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 342 _refine_ls_number_reflns 4195 _refine_ls_number_restraints 1368 _refine_ls_restrained_S_all 0.966 _refine_ls_R_factor_all 0.0472 _refine_ls_R_factor_gt 0.0432 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0801P)^2^+0.1765P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1162 _refine_ls_wR_factor_ref 0.1190 _reflns_Friedel_coverage 0.738 _reflns_Friedel_fraction_full 1.000 _reflns_Friedel_fraction_max 1.000 _reflns_number_gt 3855 _reflns_number_total 4195 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file jf9b05827_si_002.cif _cod_data_source_block exp_10138 _cod_depositor_comments 'Adding full bibliography for 1552482.cif.' _cod_original_cell_volume 2342.91(12) _cod_database_code 1552482 _shelx_shelxl_version_number 2018/3 _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 0.921 _shelx_estimated_absorpt_t_max 0.927 _shelx_res_file ; TITL CF solution in P212121 exp_10138.res created by SHELXL-2018/3 at 17:28:41 on 31-Mar-2019 CELL 1.54184 7.144018 17.683117 18.546193 90 90 90 ZERR 4 0.000224 0.000537 0.000505 0 0 0 LATT -1 SYMM 0.5-X,-Y,0.5+Z SYMM 0.5+X,0.5-Y,-Z SYMM -X,0.5+Y,0.5-Z SFAC C H N O UNIT 104 116 12 16 OMIT -3.00 134.50 L.S. 20 ACTA BOND FMAP 2 PLAN 5 size 0.11 0.12 0.12 simu 0.02 0.04 3.8 WGHT 0.080100 0.176500 FVAR 5.94391 0.44481 0.47560 N1 3 0.858829 0.876341 0.153145 11.00000 0.04147 0.02753 = 0.03938 -0.00471 0.00398 -0.00077 N2 3 0.663106 0.768207 0.085908 11.00000 0.03158 0.04173 = 0.03049 -0.00263 -0.00483 -0.00278 AFIX 43 H2 2 0.563796 0.753954 0.063499 11.00000 -1.20000 AFIX 0 N3 3 0.548648 0.548538 0.293567 11.00000 0.05753 0.02523 = 0.03748 -0.00307 0.00420 -0.00739 AFIX 43 H3A 2 0.543672 0.499951 0.292869 11.00000 -1.20000 AFIX 0 O1 4 0.350234 0.606063 0.539433 11.00000 0.13900 0.05270 = 0.05223 0.00437 0.04413 0.00662 O2 4 0.594492 0.889373 0.220335 11.00000 0.05284 0.03513 = 0.04003 -0.00063 0.01083 0.01134 O3 4 0.838938 0.790920 -0.014293 11.00000 0.04433 0.05867 = 0.03191 -0.00377 0.00507 0.00415 O4 4 0.624409 0.569463 0.175576 11.00000 0.08039 0.04516 = 0.03762 -0.00960 0.00953 -0.01750 C2 1 0.408037 0.624952 0.471807 11.00000 0.07114 0.04214 = 0.04338 -0.00147 0.01884 0.00306 C3 1 0.416262 0.701322 0.453784 11.00000 0.10921 0.04268 = 0.05201 -0.00658 0.03021 0.00715 AFIX 43 H3 2 0.377856 0.737601 0.486938 11.00000 -1.20000 AFIX 0 C4 1 0.481309 0.723457 0.386785 11.00000 0.08787 0.03121 = 0.05191 -0.00104 0.01859 0.00602 AFIX 43 H4 2 0.491488 0.774548 0.375554 11.00000 -1.20000 AFIX 0 C5 1 0.531018 0.669380 0.336697 11.00000 0.04767 0.03217 = 0.03862 0.00190 0.00482 0.00276 C6 1 0.615231 0.675019 0.262523 11.00000 0.03987 0.02804 = 0.03416 -0.00053 0.00176 -0.00060 C7 1 0.831632 0.697863 0.262574 11.00000 0.03683 0.02814 = 0.03724 0.00292 -0.00733 0.00011 C8 1 0.852942 0.719297 0.182977 11.00000 0.03068 0.02574 = 0.03517 -0.00148 -0.00257 0.00164 AFIX 13 H8 2 0.839935 0.672154 0.155651 11.00000 -1.20000 AFIX 0 C9 1 1.028532 0.758492 0.153619 11.00000 0.02951 0.03674 = 0.04438 -0.00262 -0.00264 0.00074 AFIX 23 H9A 2 1.103275 0.723119 0.125888 11.00000 -1.20000 H9B 2 1.104206 0.777721 0.192985 11.00000 -1.20000 AFIX 0 C10 1 0.961627 0.824005 0.105291 11.00000 0.03356 0.03200 = 0.03820 -0.00296 0.00454 -0.00189 C11 1 1.113888 0.873574 0.072529 11.00000 0.04195 0.04432 = 0.05618 -0.00046 0.00916 -0.00941 PART 1 AFIX 3 H11A 2 1.230407 0.845934 0.067386 31.00000 -1.20000 H11B 2 1.076339 0.892945 0.025784 31.00000 -1.20000 PART 2 H11C 2 1.126455 0.863061 0.021426 -31.00000 -1.20000 H11D 2 1.233261 0.864054 0.095739 -31.00000 -1.20000 PART 1 AFIX 0 C12 1 1.133019 0.935324 0.126780 31.00000 0.04725 0.04515 = 0.06521 0.00172 -0.00081 -0.01541 AFIX 3 H12A 2 1.215697 0.919404 0.165391 31.00000 -1.20000 H12B 2 1.185281 0.980306 0.104626 31.00000 -1.20000 PART 2 AFIX 0 C12' 1 1.054489 0.955282 0.084455 -31.00000 0.04977 0.04007 = 0.06996 0.00725 0.00604 -0.01328 AFIX 3 H12C 2 0.976897 0.973427 0.045175 -31.00000 -1.20000 H12D 2 1.162668 0.988062 0.089170 -31.00000 -1.20000 PART 0 AFIX 0 C13 1 0.942037 0.951579 0.156483 11.00000 0.04987 0.03305 = 0.05678 -0.00668 -0.00238 -0.00823 PART 1 AFIX 3 H13A 2 0.949311 0.970174 0.205608 31.00000 -1.20000 H13B 2 0.873747 0.987577 0.127064 31.00000 -1.20000 PART 2 H13C 2 1.023425 0.956895 0.198040 -31.00000 -1.20000 H13D 2 0.846287 0.990435 0.158080 -31.00000 -1.20000 PART 0 AFIX 0 C14 1 0.703958 0.851326 0.184607 11.00000 0.03656 0.03190 = 0.02710 0.00133 -0.00150 0.00437 C15 1 0.677660 0.767060 0.165325 11.00000 0.02909 0.03147 = 0.02797 0.00133 -0.00164 0.00256 C16 1 0.520227 0.728784 0.206992 11.00000 0.03247 0.03583 = 0.03974 0.00365 0.00013 -0.00178 AFIX 23 H16A 2 0.440625 0.700258 0.174504 11.00000 -1.20000 H16B 2 0.444277 0.766204 0.231622 11.00000 -1.20000 AFIX 0 C17 1 0.816215 0.793126 0.051185 11.00000 0.03455 0.03099 = 0.03375 -0.00238 0.00422 0.00474 C18 1 0.597926 0.592069 0.236310 11.00000 0.04460 0.03297 = 0.03632 -0.00370 0.00164 -0.00505 C19 1 0.506839 0.593249 0.354116 11.00000 0.04188 0.03089 = 0.03598 -0.00074 0.00113 -0.00098 C20 1 0.452467 0.568331 0.421947 11.00000 0.04480 0.03544 = 0.03787 0.00223 0.00324 -0.00104 C21 1 0.441841 0.489876 0.445202 11.00000 0.05334 0.03596 = 0.04152 0.00051 0.00279 -0.00574 AFIX 43 H21 2 0.464672 0.451054 0.412536 11.00000 -1.20000 AFIX 0 C22 1 0.400220 0.474174 0.511966 11.00000 0.11828 0.04203 = 0.04402 0.00854 0.01178 -0.00434 AFIX 43 H22 2 0.432106 0.427332 0.531174 11.00000 -1.20000 PART 1 AFIX 0 C1 1 0.294391 0.535197 0.561084 21.00000 0.11078 0.04837 = 0.04410 -0.00448 0.02211 -0.01177 C23 1 0.088551 0.548373 0.549128 21.00000 0.11022 0.07717 = 0.08966 -0.00461 0.04503 -0.00291 AFIX 137 H23D 2 0.044313 0.585812 0.582514 21.00000 -1.50000 H23E 2 0.021592 0.501949 0.556538 21.00000 -1.50000 H23F 2 0.068473 0.565759 0.500705 21.00000 -1.50000 AFIX 0 C24 1 0.343742 0.514671 0.635979 21.00000 0.12252 0.06762 = 0.05114 0.00447 0.03343 -0.00061 AFIX 137 H24D 2 0.476010 0.520864 0.642954 21.00000 -1.50000 H24E 2 0.309954 0.462939 0.644758 21.00000 -1.50000 H24F 2 0.277310 0.546882 0.668863 21.00000 -1.50000 PART 2 AFIX 0 C1' 1 0.405063 0.535597 0.567469 -21.00000 0.08480 0.05140 = 0.03837 0.00862 0.00567 0.01321 C23' 1 0.592283 0.554506 0.597584 -21.00000 0.11456 0.06792 = 0.06777 -0.00919 -0.02622 0.01225 AFIX 137 H23A 2 0.667203 0.578090 0.560967 -21.00000 -1.50000 H23B 2 0.652725 0.509067 0.613719 -21.00000 -1.50000 H23C 2 0.577749 0.588564 0.637504 -21.00000 -1.50000 AFIX 0 C24' 1 0.256220 0.516508 0.628299 -21.00000 0.11777 0.07709 = 0.06582 0.01907 0.04571 0.00957 AFIX 137 H24A 2 0.236104 0.560386 0.657779 -21.00000 -1.50000 H24B 2 0.302228 0.475853 0.657671 -21.00000 -1.50000 H24C 2 0.140269 0.501735 0.606252 -21.00000 -1.50000 PART 0 AFIX 0 C25 1 0.961596 0.633096 0.283349 11.00000 0.05166 0.04340 = 0.05818 0.01396 -0.01172 0.00681 AFIX 137 H25A 2 0.942601 0.591392 0.251026 11.00000 -1.50000 H25B 2 0.934813 0.617340 0.331797 11.00000 -1.50000 H25C 2 1.089249 0.649754 0.280310 11.00000 -1.50000 AFIX 0 C26 1 0.869169 0.764057 0.314351 11.00000 0.06012 0.04305 = 0.03625 0.00080 -0.01069 -0.00940 AFIX 137 H26A 2 0.865368 0.746153 0.363196 11.00000 -1.50000 H26B 2 0.775219 0.802242 0.307706 11.00000 -1.50000 H26C 2 0.990356 0.785106 0.304479 11.00000 -1.50000 AFIX 0 HKLF 4 REM CF solution in P212121 REM wR2 = 0.1190, GooF = S = 1.052, Restrained GooF = 0.966 for all data REM R1 = 0.0432 for 3855 Fo > 4sig(Fo) and 0.0472 for all 4195 data REM 342 parameters refined using 1368 restraints END WGHT 0.0803 0.1759 REM Highest difference peak 0.411, deepest hole -0.183, 1-sigma level 0.044 Q1 1 0.7579 0.6048 0.6872 11.00000 0.05 0.41 Q2 1 0.4607 0.5872 0.5561 11.00000 0.05 0.19 Q3 1 0.3273 0.4180 0.5258 11.00000 0.05 0.16 Q4 1 0.3845 0.7848 0.2463 11.00000 0.05 0.16 Q5 1 0.5976 0.7212 0.0651 11.00000 0.05 0.15 ; _shelx_res_checksum 74788 _shelx_hkl_file ; 0 0 -2 102431. 469.445 16 0 0 2 100234. 478.571 10 0 0 2 104126. 452.956 11 0 0 -2 101219. 446.201 18 0 0 -3 101.925 34.9252 6 0 0 -3 103.427 36.0218 18 0 0 3 174.205 39.0573 11 0 0 -3 171.877 41.7668 16 0 0 -4 3119.41 107.944 6 0 0 -4 3144.62 123.556 16 0 0 -4 2997.94 113.069 18 0 0 4 2860.76 121.059 10 0 0 -5 96.0603 50.8244 6 0 0 -5 8.69224 39.8336 18 0 0 5 9.84556 55.9411 10 0 0 -5 43.2832 53.2152 16 0 0 -6 63010.4 640.110 16 0 0 -6 63065.0 581.854 18 0 0 -6 63195.5 815.339 5 0 0 -7-80.9652 120.689 5 0 0 -7 83.6743 43.8869 6 0 0 -8 116717. 1334.62 5 0 0 -9 33.7115 125.978 5 0 0 -10 30011.7 790.483 5 0 0 -11 293.452 125.507 14 0 0 -11 18.9928 121.604 5 0 0 -12 12292.1 572.085 5 0 0 -12 12625.0 517.954 14 0 0 13 74.4393 154.807 2 0 0 -13 81.3378 116.111 4 0 0 13-65.3353 139.977 17 0 0 -14-57.4096 112.713 4 0 0 -14 99.9678 138.209 5 0 0 14 205.869 165.258 17 0 0 14-34.0594 132.849 2 0 0 -15-28.0424 129.928 28 0 0 15 39.0277 128.011 19 0 0 16 3895.02 410.575 19 0 0 -16 3507.05 393.754 28 0 0 17 82.1549 145.071 19 0 0 -17-86.4524 209.849 28 0 0 -18 2015.22 319.254 28 0 0 18 2585.61 337.411 19 0 0 19-135.549 171.598 19 0 0 -19-57.9344 193.821 28 0 0 -20-128.869 180.420 28 0 0 20-7.06023 138.601 19 0 0 -21-8.76701 136.703 28 0 0 21 7.03442 105.639 19 0 0 22-46.2248 78.9882 19 0 0 -22 38.5530 110.946 28 0 1 0 150.468 62.8936 1 0 -1 2 279510. 796.841 12 0 -1 -2 284020. 688.077 12 0 -1 2 282142. 827.860 15 0 1 -2 280277. 633.520 8 0 1 2 281596. 753.256 9 0 -1 -3 110850. 642.132 18 0 1 -3 110592. 547.612 18 0 -1 3 110749. 566.947 15 0 1 -3 114542. 484.783 8 0 1 3 111070. 563.770 9 0 -1 -3 114529. 406.167 12 0 -1 4 42811.9 467.197 11 0 1 -4 43492.1 359.556 8 0 -1 4 44077.6 386.320 15 0 1 -4 45305.4 399.902 18 0 -1 4 44774.4 518.911 10 0 1 4 45011.0 412.091 9 0 -1 -4 44156.7 452.195 18 0 -1 5 9804.16 271.922 10 0 1 5 9560.90 217.734 9 0 -1 -5 9320.96 228.415 18 0 1 -5 9559.53 245.621 16 0 1 -5 9216.69 210.081 18 0 -1 5 9275.99 241.456 11 0 -1 -6 15494.1 315.447 18 0 -1 -6 14743.7 327.378 6 0 -1 6 13792.3 332.010 11 0 1 6 16418.7 313.546 9 0 1 -6 16080.0 294.213 18 0 1 -6 15843.5 341.254 16 0 -1 -6 15142.2 413.097 5 0 -1 6 15555.5 372.062 10 0 1 -6 15122.2 402.536 5 0 1 -7 2838.92 163.378 16 0 1 -7 2842.75 135.906 18 0 1 -7 2762.65 223.508 5 0 -1 -7 2760.81 218.498 5 0 -1 7 2715.27 179.765 10 0 1 7 2680.09 144.547 9 0 1 -8 58012.9 738.642 16 0 1 -8 55303.3 916.143 5 0 1 8 59587.0 699.011 9 0 -1 8 55159.9 808.562 10 0 -1 -8 56741.8 928.101 5 0 1 -9 7795.64 390.739 5 0 -1 -9 7480.11 340.375 14 0 -1 -9 7690.78 388.501 5 0 1 -10 57.8749 135.895 5 0 -1 -10 79.8367 135.042 5 0 -1 -10 34.8852 101.897 14 0 -1 -11 70357.0 1271.34 5 0 -1 -11 69302.6 1151.50 14 0 1 -11 72369.7 1289.75 5 0 -1 -12 36768.9 1000.72 4 0 1 12 38870.7 1060.30 2 0 -1 -12 38147.7 904.302 14 0 -1 -12 37971.9 988.493 5 0 1 -12 38566.5 1012.02 5 0 1 12 37383.9 1013.91 17 0 1 -12 37963.2 887.130 14 0 -1 -13 18991.6 745.782 5 0 1 -13 19385.0 764.432 4 0 -1 -13 18108.1 747.853 4 0 1 13 21095.0 825.274 2 0 1 13 20482.7 797.619 17 0 1 -13 19664.8 768.413 5 0 -1 -13 19469.1 682.100 14 0 1 14 2654.70 323.193 17 0 1 -14 2975.68 326.379 4 0 -1 -14 2481.13 296.037 5 0 -1 14 2733.12 319.387 17 0 1 14 3079.51 346.428 2 0 -1 -14 2533.34 311.771 4 0 1 -14 3062.42 325.799 5 0 -1 14 3344.94 354.511 2 0 -1 -15 546.845 163.208 23 0 -1 -15 563.058 196.989 28 0 1 15 396.942 169.382 19 0 1 -15 469.141 202.119 28 0 -1 16 2906.01 357.574 19 0 -1 -16 3016.63 382.511 28 0 1 16 2985.97 364.182 19 0 -1 -16 3217.05 346.817 23 0 1 -16 2688.94 351.939 28 0 -1 17 130.608 160.104 19 0 -1 -17-90.0333 192.938 28 0 1 -17 105.164 165.181 28 0 1 17 13.3857 154.613 19 0 1 18 11713.8 667.985 19 0 -1 18 10673.3 654.535 19 0 -1 -18 11006.5 667.775 28 0 1 -18 10472.3 652.545 28 0 1 19 2135.37 293.980 19 0 -1 19 2442.34 325.920 19 0 -1 -19 2170.14 331.760 28 0 1 -19 1887.50 307.527 28 0 1 -20 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288.506 23 0 9 -15 689.511 211.313 26 0 -9 -16 1544.15 332.359 23 0 -9 -16 1269.62 257.285 28 0 -9 16 1254.37 230.690 33 0 9 -16 1053.26 247.215 28 0 9 -16 1070.50 247.435 26 0 -9 -17 4346.78 443.174 23 0 9 -17 2542.21 321.693 28 0 -9 18 2108.49 304.211 19 0 9 -18 1703.39 252.634 28 0 9 -19-10.5017 111.131 28 0 -9 19 60.7266 141.379 19 0 9 -20 1295.25 174.331 28 0 -9 20 1137.83 188.203 19 0 9 20 1251.39 193.914 20 0 -10 0 1214.81 230.578 15 0 -10 0 1035.78 202.822 13 0 -10 1 119993. 1722.36 15 0 -10 1 120052. 1735.54 13 0 -10 -1 121687. 1723.70 15 0 -10 -1 119198. 1715.92 13 0 -10 -2 28634.5 834.829 13 0 -10 2 27208.4 845.647 13 0 -10 -2 28210.2 838.037 15 0 -10 2 28572.0 851.955 15 0 -10 3 6940.17 437.892 15 0 -10 -3 6992.52 434.015 15 0 -10 3 7231.34 456.197 13 0 10 4 76594.4 1347.76 7 0 -10 4 77291.0 1427.73 15 0 -10 -4 78584.9 1407.46 15 0 -10 4 78972.1 1462.64 13 0 -10 5 419.917 181.313 13 0 -10 -5 446.169 167.040 15 0 -10 5 281.743 144.839 15 0 10 5 275.993 157.800 7 0 -10 6 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25071.3 940.245 22 -4 -2 13 21348.5 934.172 33 -4 2 -14 1483.02 262.954 27 -4 -2 14 1197.81 257.651 19 -4 -2 14 1646.70 321.303 24 -4 2 -14 1127.17 265.733 23 -4 -2 15 14994.4 769.977 19 -4 -2 15 15067.0 788.119 24 -4 2 -15 13643.9 709.632 23 -4 -2 16 1607.10 286.640 19 -4 -2 16 1691.44 298.208 24 -4 2 -16 2060.66 303.090 23 -4 -2 17 3383.80 368.434 19 -4 -2 17 3260.79 360.540 24 -4 2 -17 3292.45 337.721 23 -4 -2 18 3007.51 321.799 19 -4 -2 18 3164.57 322.818 24 -4 2 -18 3072.62 304.482 23 -4 -2 19 2096.80 249.808 19 -4 -2 19 1723.54 218.759 24 -4 2 -19 1917.26 221.413 23 -4 -2 20 675.697 143.243 19 -4 -3 -20-182.619 132.422 23 -4 3 19 290.180 146.893 19 -4 -3 -19 286.274 137.136 23 -4 3 18 188.594 165.747 19 -4 3 18 98.2332 124.862 24 -4 -3 -18 321.215 166.383 23 -4 3 17 833.785 229.835 19 -4 3 17 939.106 228.322 24 -4 -3 -17 926.123 226.370 23 -4 3 16 2611.12 357.052 19 -4 3 16 2471.31 337.316 24 -4 -3 -16 2689.94 334.830 23 -4 -3 -16 2521.13 319.597 22 -4 3 15 2253.66 355.039 19 -4 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1332.59 288.856 30 -5 9 -2 6282.40 521.424 20 -5 -9 2 6891.75 572.929 30 -5 9 -3 2730.90 359.138 20 -5 -9 3 3269.97 414.205 30 -5 9 -3 3093.50 370.999 22 -5 9 -4 2339.24 337.780 20 -5 -9 4 2317.31 366.688 30 -5 9 -4 2062.05 302.496 22 -5 9 -5 18071.5 860.126 20 -5 9 -5 19003.0 836.278 22 -5 -9 5 18064.0 927.524 30 -5 9 -6 708.225 225.691 20 -5 -9 6 879.478 281.431 30 -5 -9 6 1047.40 240.282 25 -5 9 -7 1063.23 271.450 20 -5 -9 7 1371.99 322.489 30 -5 -9 7 934.395 222.876 25 -5 9 -8 1391.12 291.006 20 -5 -9 8 1416.48 313.711 30 -5 -9 8 1395.38 264.677 25 -5 -9 9 1459.61 307.178 30 -5 9 -9 1267.05 260.105 27 -5 9 -10 886.813 231.351 27 -5 -9 10 628.321 233.770 30 -5 -9 10 677.597 193.285 33 -5 -9 11 137.989 168.295 30 -5 9 -11 322.954 164.258 27 -5 -9 11 401.947 166.710 33 -5 -9 12 3162.77 348.450 30 -5 9 -12 3006.13 326.221 27 -5 -9 12 3404.50 331.175 33 -5 9 -13 4126.00 350.848 27 -5 -9 13 4068.27 381.840 24 -5 9 -13 4317.27 355.249 23 -5 -9 13 4476.97 364.377 33 -5 9 -14 197.776 132.837 27 -5 -9 14 429.139 175.163 24 -5 9 -14 80.7394 115.752 23 -5 9 -15 1913.74 220.651 27 -5 -9 15 1953.83 244.663 24 -5 9 -15 1657.12 189.009 23 -5 -9 16 2197.71 216.639 24 -5 10 15 2527.73 232.687 19 -5 10 15 2929.89 259.466 32 -5 10 14 901.030 177.344 20 -5 10 14 837.353 181.396 19 -5 10 14 698.393 173.874 32 -5 10 13 719.648 182.382 20 -5 10 13 428.992 163.096 19 -5 10 13 487.642 177.178 32 -5 10 12 669.957 195.869 20 -5 10 12 502.150 184.399 19 -5 10 12 728.718 216.522 32 -5 10 11 229.032 164.515 20 -5 10 11 19.0221 156.653 19 -5 10 10 1711.75 282.588 20 -5 10 10 1650.75 285.599 19 -5 10 9 677.116 219.938 20 -5 -10 -9 818.942 249.669 29 -5 10 9 693.429 237.414 19 -5 -10 -9 756.158 208.333 22 -5 10 8 2020.37 307.974 20 -5 -10 -8 3036.93 416.142 29 -5 10 8 2203.95 343.469 19 -5 -10 -8 2765.26 325.374 22 -5 10 7 10595.5 652.149 20 -5 -10 -7 11956.4 782.423 29 -5 10 7 10446.7 682.345 19 -5 -10 -7 11788.5 554.383 21 -5 10 7 10771.6 651.746 32 -5 10 6 3686.43 405.344 20 -5 -10 -6 3859.97 489.290 29 -5 10 6 3977.32 447.222 19 -5 10 6 4236.21 430.580 32 -5 10 5 5805.95 507.303 20 -5 10 5 6668.15 562.891 19 -5 10 5 6536.38 518.567 32 -5 10 4 4929.33 474.321 20 -5 10 4 4819.82 486.332 19 -5 10 4 4445.74 428.600 32 -5 10 3 3959.07 422.546 20 -5 10 3 3171.32 403.013 19 -5 10 3 4143.94 406.440 32 -5 10 2 3864.18 425.422 20 -5 10 2 4237.57 454.124 19 -5 10 2 3545.31 376.164 32 -5 10 1 12265.6 717.469 20 -5 -10 -1 13407.2 749.615 30 -5 10 0 565.440 220.421 20 -5 -10 0 293.401 181.546 30 -5 10 -1 12491.1 734.264 20 -5 -10 1 13156.6 768.403 30 -5 10 -2 3078.61 382.269 20 -5 -10 2 3877.65 440.046 30 -5 10 -3 3787.33 419.238 20 -5 -10 3 4105.36 469.893 30 -5 10 -3 3460.76 384.057 22 -5 10 -4 4455.91 457.807 20 -5 -10 4 4536.61 488.720 30 -5 10 -5 6621.47 545.856 20 -5 -10 5 6369.69 566.084 30 -5 10 -6 4535.83 457.886 20 -5 -10 6 5258.45 518.660 30 -5 -10 6 4658.84 423.405 25 -5 -10 7 10737.5 713.664 30 -5 -10 7 11235.9 650.847 25 -5 10 -7 11837.8 691.214 20 -5 -10 8 2793.01 397.196 30 -5 -10 8 2258.81 320.447 25 -5 10 -8 2542.77 352.209 20 -5 -10 9 538.548 246.749 30 -5 10 -9 642.736 208.001 27 -5 -10 10 1463.96 285.894 30 -5 10 -10 1473.45 262.177 27 -5 -10 11 296.885 179.099 30 -5 10 -11 186.093 158.022 27 -5 -10 11 107.408 131.689 33 -5 -10 12 397.376 167.765 30 -5 10 -12 648.523 187.644 27 -5 -10 12 625.224 177.104 33 -5 10 -13 678.402 167.746 27 -5 -10 13 581.778 187.822 24 -5 10 -13 370.780 145.649 23 -5 -10 13 861.783 173.970 33 -5 10 -14 821.120 167.151 27 -5 -10 14 874.396 193.959 24 -5 10 -14 757.043 153.877 23 -5 -10 15 3084.57 263.019 24 -5 11 14 1096.48 172.675 20 -5 11 14 1063.97 172.982 19 -5 11 14 1083.31 183.726 32 -5 11 13 94.3531 122.797 20 -5 11 13 90.3051 144.875 32 -5 11 12 809.202 195.818 20 -5 11 12 570.690 169.666 19 -5 11 12 816.931 202.167 32 -5 11 11 679.452 206.875 20 -5 11 11 700.980 211.210 19 -5 11 11 876.356 222.561 32 -5 11 10 1496.34 261.018 20 -5 11 10 1878.39 286.528 19 -5 11 10 1787.32 280.308 32 -5 11 9 2121.90 315.610 20 -5 -11 -9 2381.21 331.106 29 -5 11 9 1639.58 284.158 19 -5 11 9 1991.99 322.055 32 -5 11 8 3405.75 382.404 20 -5 -11 -8 2967.53 388.659 29 -5 11 8 2605.03 357.263 19 -5 11 8 2891.80 362.222 32 -5 11 7 1065.86 268.115 20 -5 -11 -7 1070.75 288.521 29 -5 11 7 933.467 251.233 19 -5 11 7 591.823 225.308 32 -5 11 6 2568.58 359.300 20 -5 -11 -6 3355.67 444.918 29 -5 11 6 2772.34 375.615 19 -5 11 6 3243.33 384.467 32 -5 11 5 3319.52 395.197 20 -5 11 5 2837.52 382.252 19 -5 11 5 3347.48 385.108 32 -5 11 4 197.790 194.940 20 -5 11 4-3.52550 195.167 19 -5 11 4 344.802 180.272 32 -5 11 3 104.817 172.053 20 -5 11 3 3.49790 143.126 32 -5 11 2 1063.96 273.211 20 -5 11 2 885.340 212.887 32 -5 11 1 143.096 192.196 20 -5 -11 -1 258.294 179.763 30 -5 11 0 10124.1 667.502 20 -5 -11 0 11524.7 707.453 30 -5 11 -1 267.820 188.341 20 -5 -11 1 87.3712 174.259 30 -5 11 -2 878.640 252.663 20 -5 -11 2 1140.26 285.827 30 -5 11 -3 141.521 181.044 20 -5 -11 3 196.881 197.123 30 -5 11 -4 153.717 187.602 20 -5 -11 4 114.513 193.315 30 -5 11 -5 3617.79 406.894 20 -5 -11 5 3327.64 424.058 30 -5 -11 6 3538.61 439.478 30 -5 -11 6 3566.85 372.325 25 -5 11 -6 3429.55 396.630 20 -5 11 -7 607.451 215.035 20 -5 -11 7 797.598 276.061 30 -5 -11 7 778.585 223.539 25 -5 -11 8 2734.71 385.110 30 -5 11 -8 3156.01 360.910 27 -5 -11 8 3466.68 363.542 25 -5 -11 9 1628.18 307.261 30 -5 11 -9 1957.81 298.794 27 -5 -11 10 2009.06 312.483 30 -5 11 -10 1977.96 281.952 27 -5 -11 11 1002.93 228.541 30 -5 11 -11 620.859 188.780 27 -5 -11 11 682.301 159.885 33 -5 -11 12 536.396 174.572 30 -5 11 -12 577.893 176.828 27 -5 -11 12 711.636 161.625 33 -5 11 -13 35.5114 109.542 27 -5 -11 13 4.13346 124.361 24 -5 11 -13-142.095 109.239 23 -5 11 -14 1206.35 170.287 27 -5 -11 14 1267.11 193.963 24 -5 11 -14 873.043 133.282 23 -5 12 13 1670.76 210.191 20 -5 12 13 1447.06 203.590 32 -5 12 12 369.381 151.900 20 -5 12 12 391.610 143.826 19 -5 12 12 303.820 144.252 32 -5 12 11 513.297 168.661 19 -5 12 11 367.508 164.355 32 -5 12 10 770.377 214.088 20 -5 12 10 708.779 197.506 19 -5 12 10 703.984 206.219 32 -5 12 9 24.8776 166.812 20 -5 -12 -9 106.609 151.614 29 -5 12 9 141.008 157.095 19 -5 12 9 154.949 158.391 32 -5 12 8 4386.02 415.347 20 -5 -12 -8 4939.84 465.529 29 -5 12 8 3876.47 394.632 19 -5 12 8 4365.05 411.235 32 -5 12 7 2048.18 307.801 20 -5 -12 -7 2257.05 357.652 29 -5 12 7 1861.03 304.012 19 -5 12 7 2203.26 315.488 32 -5 12 6 5632.34 491.224 20 -5 -12 -6 5644.50 545.274 29 -5 12 6 4973.12 461.931 19 -5 12 6 5386.64 460.556 32 -5 12 5 6518.27 525.230 20 -5 12 5 6284.11 490.618 32 -5 12 4 1953.88 329.976 20 -5 12 4 1655.98 280.981 32 -5 12 3 1242.51 273.878 20 -5 12 3 1540.32 270.629 32 -5 12 2 363.800 196.162 20 -5 12 2 519.395 181.563 32 -5 12 1 3048.56 395.495 20 -5 -12 -1 2786.26 348.027 30 -5 12 1 2977.14 346.585 32 -5 -12 0 3082.00 374.030 30 -5 12 0 2505.76 356.800 20 -5 12 -1 2702.70 369.274 20 -5 -12 1 2342.62 343.313 30 -5 -12 2 372.397 219.882 31 -5 12 -2 486.916 201.391 20 -5 -12 2 620.428 234.004 30 -5 -12 3 1217.41 260.073 31 -5 12 -3 1583.84 306.044 20 -5 -12 3 1597.06 319.166 30 -5 -12 4 869.116 221.207 31 -5 12 -4 1898.63 311.641 20 -5 -12 4 1773.16 337.363 30 -5 12 -5 6577.02 523.345 20 -5 -12 5 6395.48 556.478 30 -5 -12 6 5648.59 515.763 30 -5 -12 6 5279.11 419.819 25 -5 12 -6 5563.90 477.546 20 -5 12 -7 2107.26 322.533 20 -5 -12 7 2222.87 362.564 30 -5 -12 7 2080.52 278.627 25 -5 -12 8 4628.30 459.039 30 -5 12 -8 4312.57 393.616 27 -5 -12 8 4577.26 401.090 25 -5 12 -9 38.9844 154.144 27 -5 -12 9 161.437 175.634 30 -5 -12 10 603.645 204.474 30 -5 12 -10 603.659 183.152 27 -5 -12 11 519.160 175.138 30 -5 12 -11 460.168 159.051 27 -5 -12 12 457.686 152.829 30 -5 12 -12 334.243 135.472 27 -5 12 -12 337.914 119.883 23 -5 -12 12 334.893 115.122 33 -5 12 -13 1711.18 196.772 27 -5 -12 13 1624.21 216.844 24 -5 12 -13 1617.92 170.335 23 -5 13 12 1881.25 220.887 20 -5 13 12 1842.08 217.858 32 -5 13 11 786.467 178.061 20 -5 13 11 863.841 191.499 32 -5 13 10-81.0045 149.989 20 -5 13 10 204.898 152.052 32 -5 13 9 364.325 176.401 20 -5 13 9 257.933 160.288 32 -5 13 8 581.202 211.579 20 -5 -13 -8 880.775 225.494 29 -5 13 8 621.685 192.410 32 -5 13 7-27.3815 177.935 20 -5 -13 -7-245.498 187.329 29 -5 13 7 183.081 160.651 32 -5 13 6 16.6094 183.570 20 -5 -13 -6 68.6923 198.737 29 -5 13 5 534.296 206.679 20 -5 13 5 668.547 203.631 32 -5 13 4 1817.50 308.071 20 -5 13 4 1505.56 267.219 32 -5 13 3 4018.35 419.437 20 -5 13 3 3910.08 391.457 32 -5 -13 -2 5664.45 481.231 31 -5 13 2 5017.90 472.197 20 -5 -13 -1 2503.47 348.834 31 -5 13 1 2017.96 326.107 20 -5 -13 0 365.589 243.802 31 -5 13 0-28.7872 187.881 20 -5 -13 0 48.1958 153.738 30 -5 -13 1 2167.35 332.671 31 -5 13 -1 2229.20 334.106 20 -5 -13 1 2140.53 327.039 30 -5 13 -2 5485.32 479.928 20 -5 -13 2 5715.81 498.677 30 -5 -13 2 5536.17 464.314 31 -5 13 -3 4546.14 432.416 20 -5 -13 3 3245.94 349.466 31 -5 -13 3 4238.88 451.253 30 -5 13 -4 1865.05 301.892 20 -5 -13 4 1798.16 321.770 30 -5 13 -5 799.950 228.338 20 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384.029 20 -5 -14 -2 1844.99 318.233 31 -5 14 2 1118.38 268.078 20 -5 -14 -1 2055.17 325.294 31 -5 14 1 1489.03 281.367 20 -5 -14 0 2337.84 312.372 30 -5 14 0 2003.34 311.389 20 -5 -14 0 2620.51 346.184 31 -5 -14 1 1359.03 287.207 31 -5 14 -1 1718.31 286.730 20 -5 -14 1 1664.50 285.974 30 -5 -14 2 434.541 229.345 31 -5 14 -2 1009.96 245.273 20 -5 -14 2 1073.47 253.367 30 -5 14 -3 4184.78 401.896 20 -5 -14 3 3044.70 335.561 31 -5 -14 3 4055.97 415.507 30 -5 14 -4 1969.56 290.915 20 -5 -14 4 1811.84 306.956 30 -5 14 -5 248.501 167.146 20 -5 -14 5 65.6113 185.463 30 -5 14 -6 225.308 163.420 20 -5 -14 6 77.1622 174.880 30 -5 -14 7 2498.89 333.579 30 -5 14 -7 2547.36 281.810 27 -5 -14 7 2477.29 260.021 25 -5 -14 8 904.802 226.012 30 -5 14 -8 688.328 172.646 27 -5 -14 9 1419.49 240.447 30 -5 14 -9 1566.01 216.099 27 -5 -14 10 21.3474 118.631 30 -5 14 -10 18.2333 98.4667 27 -5 -14 11 868.688 163.914 30 -5 14 -11 854.260 143.531 27 -5 15 10 159.343 97.7497 20 -5 15 9 2809.54 260.937 20 -5 -15 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14819.1 775.688 22 -6 4 -1 1834.45 342.023 30 -6 -4 1 1724.54 310.064 30 -6 -4 1 1690.58 337.951 29 -6 4 -1 1731.17 297.972 22 -6 4 -2 2565.36 384.660 30 -6 -4 2 3004.02 404.195 30 -6 -4 2 2756.13 395.600 29 -6 4 -2 2534.85 347.421 22 -6 4 -3 6553.92 563.120 30 -6 -4 3 6001.91 559.584 30 -6 4 -3 5358.64 481.313 22 -6 4 -4 1627.00 274.658 20 -6 4 -4 2102.57 336.073 30 -6 -4 4 1559.28 318.627 30 -6 4 -4 1953.64 310.841 22 -6 4 -5 2748.91 372.898 30 -6 -4 5 2232.86 374.286 30 -6 4 -5 2513.57 348.146 22 -6 4 -5 2537.65 322.427 20 -6 -4 6 3513.85 449.197 30 -6 4 -6 3467.28 408.004 22 -6 -4 7 300.313 215.844 30 -6 4 -7 54.0904 177.411 22 -6 -4 8 3346.55 428.948 30 -6 -4 8 4210.65 412.106 24 -6 4 -8 4136.82 426.015 22 -6 -4 9 512.497 227.538 30 -6 -4 9 670.257 216.153 24 -6 4 -9 671.161 215.428 22 -6 -4 10 4018.55 436.142 30 -6 -4 10 4445.60 425.584 24 -6 4 -10 4236.27 399.858 22 -6 -4 11 2245.08 315.440 30 -6 -4 11 2539.99 327.448 24 -6 4 -11 2628.96 304.772 23 -6 4 -11 2533.79 297.468 22 -6 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3204.55 409.807 30 -6 -5 1 3425.98 451.786 29 -6 5 -1 3004.70 383.792 22 -6 5 -2 1899.16 302.138 20 -6 5 -2 1412.72 305.276 30 -6 -5 2 1476.50 299.788 30 -6 -5 2 1744.58 331.649 29 -6 5 -2 1459.57 280.780 22 -6 5 -3 754.953 197.031 20 -6 5 -3 760.073 253.028 30 -6 -5 3 1320.00 304.801 30 -6 5 -3 901.780 241.000 22 -6 5 -4 5215.44 500.195 30 -6 -5 4 4825.63 499.878 30 -6 5 -4 4862.88 455.314 22 -6 5 -4 4554.46 432.223 20 -6 5 -5 665.239 208.844 20 -6 -5 5 542.921 242.401 30 -6 5 -5 766.071 231.867 22 -6 -5 6 2370.19 379.789 30 -6 5 -6 2601.52 343.963 22 -6 5 -6 2825.63 362.116 20 -6 -5 7 2842.95 393.845 30 -6 5 -7 3288.99 337.015 27 -6 5 -7 2935.26 370.533 22 -6 -5 8 1736.22 332.953 30 -6 5 -8 1940.21 268.214 27 -6 -5 8 1871.63 283.792 24 -6 5 -8 1791.42 295.558 22 -6 -5 9 870.614 264.653 30 -6 5 -9 1017.44 203.706 27 -6 -5 9 962.020 220.607 24 -6 5 -9 959.159 230.014 22 -6 -5 10 1588.61 291.890 30 -6 5 -10 1770.96 245.391 27 -6 -5 10 1746.16 278.299 24 -6 5 -10 1702.14 262.508 22 -6 -5 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337.141 234.337 30 -6 -9 4 532.772 207.624 29 -6 9 -4 357.107 183.018 22 -6 -9 5 7350.28 581.063 30 -6 9 -5 7146.56 510.566 22 -6 9 -5 6513.58 516.739 20 -6 -9 6 7474.12 597.746 30 -6 9 -6 7027.34 482.143 22 -6 9 -6 7277.05 547.281 20 -6 -9 7 352.235 247.021 30 -6 9 -7 109.043 157.606 27 -6 -9 8 849.808 249.515 30 -6 9 -8 758.635 207.255 27 -6 -9 9 2255.91 321.149 30 -6 9 -9 1830.67 251.429 27 -6 -9 9 2209.14 272.646 24 -6 -9 10 1235.71 242.745 30 -6 9 -10 1156.67 202.613 27 -6 -9 10 918.916 194.070 24 -6 -9 11-35.5214 127.204 30 -6 9 -11 81.6535 108.593 27 -6 -9 11 169.712 125.740 24 -6 -9 12 1867.37 225.712 30 -6 9 -12 1905.86 212.192 27 -6 -9 12 2407.64 257.096 24 -6 9 -12 2150.36 238.337 23 -6 9 -13 1745.65 184.117 27 -6 -9 13 1727.20 204.491 24 -6 9 -13 1699.75 189.311 23 -6 10 12 484.201 145.968 19 -6 10 12 505.068 140.384 32 -6 10 11 1745.24 213.509 20 -6 10 11 1273.23 217.824 19 -6 10 11 1490.14 216.286 32 -6 10 10 556.762 156.892 20 -6 -10 -10 410.767 158.211 29 -6 10 10 650.063 197.741 19 -6 10 10 880.385 189.903 32 -6 10 9 337.952 150.410 20 -6 -10 -9 527.433 189.771 29 -6 10 9 524.931 193.132 19 -6 10 9 393.202 162.808 32 -6 10 8 573.809 184.978 20 -6 -10 -8 1053.35 247.259 29 -6 10 8 647.328 227.418 19 -6 10 8 813.697 189.903 32 -6 10 7 1513.80 251.445 20 -6 -10 -7 1684.29 319.437 29 -6 10 7 1704.79 301.616 19 -6 10 7 1335.90 229.566 32 -6 10 6 3443.08 358.635 20 -6 -10 -6 3778.56 449.683 29 -6 10 6 3302.31 393.373 19 -6 10 6 3702.37 351.281 32 -6 10 5 2036.95 300.167 20 -6 -10 -5 2030.18 370.667 29 -6 10 4 2303.37 326.438 20 -6 -10 -4 2536.17 416.532 29 -6 10 3 2871.82 355.492 20 -6 -10 -3 2610.72 413.483 29 -6 10 2 1381.17 262.046 20 -6 -10 -2 1741.89 361.457 29 -6 10 1 200.158 173.038 20 -6 -10 -1 65.7412 152.139 30 -6 -10 -1 236.104 232.760 29 -6 10 0 367.716 205.395 20 -6 -10 0 479.490 209.366 30 -6 -10 0 410.748 246.195 29 -6 10 -1 259.559 196.175 20 -6 -10 1 244.134 206.400 30 -6 10 -1 150.127 152.133 22 -6 10 -2 1336.13 279.155 20 -6 -10 2 1534.30 295.176 30 -6 10 -2 1591.44 279.956 22 -6 10 -3 2765.82 356.918 20 -6 -10 3 2850.42 394.215 30 -6 10 -3 2159.69 306.258 22 -6 10 -4 2622.24 346.552 20 -6 -10 4 2479.70 365.379 30 -6 -10 4 2560.74 365.619 29 -6 10 -4 2866.30 329.102 22 -6 10 -5 2041.59 311.260 20 -6 -10 5 2168.77 360.839 30 -6 10 -5 2592.24 299.268 22 -6 -10 6 3341.65 407.197 30 -6 10 -6 4020.51 402.182 20 -6 -10 7 1846.48 322.866 30 -6 10 -7 1455.08 249.543 27 -6 -10 8 770.606 237.083 30 -6 10 -8 1031.88 209.949 27 -6 -10 9 619.558 208.801 30 -6 10 -9 339.299 158.528 27 -6 -10 9 608.577 165.464 24 -6 -10 10 506.190 182.221 30 -6 10 -10 523.594 157.536 27 -6 -10 10 731.854 168.362 24 -6 -10 11 1711.35 234.452 30 -6 10 -11 1469.01 196.790 27 -6 -10 11 1638.91 212.032 24 -6 10 -12 305.723 112.192 27 -6 -10 12 401.871 126.608 24 -6 10 -12 564.606 137.595 23 -6 11 11 334.002 113.087 20 -6 11 11 395.525 131.198 32 -6 11 10 500.489 140.797 20 -6 11 10 682.940 156.018 32 -6 11 9 955.149 188.459 20 -6 -11 -9 1154.07 215.519 29 -6 11 8 413.972 176.835 20 -6 -11 -8 285.611 185.794 29 -6 -11 -7 1392.73 283.582 29 -6 11 7 1487.02 229.735 32 -6 11 6 1454.57 257.591 20 -6 -11 -6 1461.67 304.821 29 -6 11 5 4810.96 426.035 20 -6 -11 -5 4670.93 483.781 29 -6 11 4 3633.09 378.958 20 -6 -11 -4 3685.18 453.885 29 -6 11 3 2438.13 327.246 20 -6 -11 -3 2231.91 383.975 29 -6 11 2 460.494 206.395 20 -6 -11 -2 920.343 304.405 29 -6 11 1 234.153 184.646 20 -6 -11 -1 125.586 239.296 29 -6 11 0 78.8929 178.422 20 -6 -11 0 4.00324 143.758 30 -6 -11 0-43.4640 215.993 29 -6 11 0-12.9413 146.271 22 -6 11 -1 160.555 181.314 20 -6 -11 1 347.430 201.057 30 -6 11 -1 234.380 159.696 22 -6 11 -2 608.259 217.589 20 -6 -11 2 594.177 210.587 30 -6 11 -2 628.322 188.447 22 -6 11 -3 2538.16 333.573 20 -6 -11 3 2110.95 327.355 30 -6 11 -3 2281.79 289.425 22 -6 11 -4 3651.77 390.469 20 -6 -11 4 3707.10 413.673 30 -6 -11 4 3747.93 409.559 29 -6 -11 5 4834.24 463.177 30 -6 11 -5 5042.15 436.952 20 -6 11 -6 1683.94 282.155 20 -6 -11 6 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3599.73 417.715 30 -7 0 2 3437.81 442.729 30 -7 0 -2 3364.16 462.466 29 -7 0 -2 3646.08 389.459 22 -7 0 2 3849.45 392.037 22 -7 0 -3 1515.01 289.910 30 -7 0 3 1293.61 298.733 30 -7 0 -3 1844.58 372.709 29 -7 0 -3 1105.56 253.115 22 -7 0 3 1325.85 248.701 22 -7 0 4 5839.15 543.022 30 -7 0 -4 6672.62 603.588 29 -7 0 -4 6286.90 507.712 22 -7 0 5 159.797 204.214 30 -7 0 -5 571.939 326.033 29 -7 0 -5 88.8447 180.996 22 -7 0 6 435.477 249.756 30 -7 0 -6 391.190 210.465 22 -7 0 7 1528.07 298.983 30 -7 0 -7 1197.74 274.017 22 -7 0 8 1314.26 277.008 30 -7 0 -8 1102.81 247.135 22 -7 0 9 135.759 152.418 30 -7 0 -9 205.776 175.253 22 -7 0 10 6612.73 460.476 30 -7 0 10 7583.28 451.994 24 -7 0 -10 7138.69 457.128 22 -7 0 11 27.1080 109.971 24 -7 0 -11 238.680 145.318 22 -7 0 12 547.447 144.908 24 -7 0 -12 586.760 157.112 22 -7 0 13 110.405 99.5554 24 -7 0 -13 105.386 99.6569 22 -7 1 13 23.3885 86.6573 24 -7 -1 -13 61.0111 93.5342 22 -7 1 12 1581.86 209.006 24 -7 -1 -12 1728.51 219.336 22 -7 1 11 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312.125 30 -7 3 -7 1511.82 264.369 22 -7 -3 8 187.370 180.620 30 -7 3 -8 113.132 120.602 23 -7 3 -8 419.700 185.307 22 -7 -3 9 2071.10 306.100 30 -7 3 -9 1940.21 230.578 23 -7 3 -9 2057.07 274.389 22 -7 -3 10 1596.27 255.579 30 -7 3 -10 1387.44 198.347 23 -7 3 -10 1580.03 224.479 22 -7 -3 11 1770.37 231.034 30 -7 -3 11 1953.24 226.971 24 -7 3 -11 1786.99 205.879 23 -7 3 -11 2174.28 239.451 22 -7 -3 12 749.792 145.722 24 -7 3 -12 770.881 139.152 23 -7 3 -12 770.890 149.156 22 -7 -4 -13 56.2725 87.0887 22 -7 4 12 270.125 126.491 19 -7 -4 -12 207.963 118.070 22 -7 4 11 1279.58 195.397 19 -7 -4 -11 1216.24 203.713 22 -7 4 10 1026.01 196.837 19 -7 -4 -10 1211.74 208.370 22 -7 4 9 177.505 138.571 30 -7 4 9-62.9910 139.159 19 -7 -4 -9 125.545 139.808 22 -7 4 8 34.0104 147.140 30 -7 4 8 69.0373 120.461 19 -7 -4 -8 21.2508 137.604 22 -7 4 8 370.640 148.061 22 -7 4 7 713.067 218.474 30 -7 -4 -7 450.649 259.357 29 -7 4 7 458.071 162.247 19 -7 -4 -7 598.674 194.335 22 -7 4 7 471.846 180.362 22 -7 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2243.98 347.146 22 -7 4 -3 1733.45 298.033 30 -7 -4 3 1406.94 317.170 30 -7 4 -3 1492.07 297.205 22 -7 -4 4 1546.93 330.084 30 -7 4 -4 1433.58 300.261 22 -7 -4 5 960.745 272.598 30 -7 4 -5 858.883 247.833 22 -7 -4 6 3260.91 418.301 30 -7 4 -6 2876.10 351.897 22 -7 -4 7 582.731 240.528 30 -7 4 -7 415.097 193.439 22 -7 -4 8 172.165 178.408 30 -7 4 -8 66.7016 117.720 23 -7 4 -8 238.460 166.774 22 -7 -4 9 28.7175 145.392 30 -7 4 -9 256.449 131.771 23 -7 4 -9 133.763 143.361 22 -7 -4 10 1109.86 227.277 30 -7 4 -10 1229.34 187.935 23 -7 4 -10 1213.57 205.195 22 -7 -4 11 1302.29 203.928 30 -7 -4 11 1046.01 168.384 24 -7 4 -11 1224.91 176.795 23 -7 4 -11 1001.29 174.209 22 -7 -4 12 73.9912 90.5162 24 -7 4 -12 1.28520 90.1474 23 -7 4 -12 259.823 97.7090 22 -7 5 12 709.763 147.787 19 -7 -5 -12 444.136 130.635 22 -7 5 11 1414.61 202.492 19 -7 -5 -11 1535.46 209.859 22 -7 5 10 1279.99 217.216 19 -7 -5 -10 1430.21 215.202 22 -7 5 9 463.220 168.869 19 -7 -5 -9 246.757 139.955 22 -7 5 9 133.187 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339.282 30 -7 -6 2 1942.44 315.089 29 -7 6 -2 1581.41 291.176 22 -7 -6 3 367.917 227.616 30 -7 6 -3 237.082 182.577 22 -7 -6 4 1579.19 308.186 30 -7 6 -4 1601.76 288.775 22 -7 -6 5 177.872 211.974 30 -7 6 -5 348.355 180.162 22 -7 -6 6-125.690 192.655 30 -7 6 -6 41.7512 146.081 22 -7 -6 7 268.369 192.243 30 -7 6 -7 326.356 152.107 22 -7 -6 8 2070.34 300.468 30 -7 6 -8 1677.42 241.692 22 -7 -6 9 308.765 162.535 30 -7 6 -9 212.526 123.778 23 -7 6 -9 367.126 137.665 22 -7 -6 10 2987.77 300.200 30 -7 6 -10 2605.21 249.037 23 -7 6 -10 2666.44 237.262 22 -7 -6 11 123.110 102.526 30 -7 6 -11 289.660 116.956 23 -7 7 11 336.095 123.356 19 -7 7 10 375.675 139.583 19 -7 -7 -10 326.624 117.914 22 -7 7 10 347.107 115.308 22 -7 -7 -9 3203.29 353.411 29 -7 7 9 2426.28 272.149 19 -7 -7 -9 2543.31 247.729 22 -7 7 9 2657.21 261.991 22 -7 -7 -8 147.928 182.938 29 -7 7 8 657.527 182.259 19 -7 -7 -8 465.603 138.505 22 -7 7 8 459.896 159.810 22 -7 -7 -7 91.2372 194.390 29 -7 7 7 7.36280 132.442 19 -7 -7 -7 173.000 116.905 22 -7 -7 -6 346.731 214.503 29 -7 7 6 369.146 176.696 22 -7 -7 -5 1002.14 286.580 29 -7 7 5 855.897 239.449 22 -7 -7 -4 1127.77 301.955 29 -7 7 4 1161.16 259.562 22 -7 -7 -3 2159.26 365.812 29 -7 7 3 2521.05 340.172 22 -7 -7 -2 2459.71 385.391 29 -7 7 2 2218.35 333.709 22 -7 -7 -1 2286.96 308.519 30 -7 -7 -1 2127.19 352.219 29 -7 7 1 2323.86 337.654 22 -7 -7 0 2589.42 342.416 30 -7 -7 0 2452.84 365.925 29 -7 7 0 2200.43 318.201 22 -7 7 -1 2181.26 280.504 20 -7 -7 1 2455.81 341.397 30 -7 -7 1 2409.09 358.611 29 -7 7 -1 2179.20 318.193 22 -7 -7 2 2245.65 332.419 30 -7 -7 2 2789.46 362.764 29 -7 7 -2 2396.35 333.239 22 -7 7 -2 2846.55 314.185 20 -7 -7 3 2338.61 345.121 30 -7 7 -3 2435.42 328.115 22 -7 7 -3 2542.77 303.988 20 -7 -7 4 1064.43 265.549 30 -7 7 -4 1147.17 239.345 22 -7 -7 5 1039.30 263.533 30 -7 7 -5 1167.54 237.095 22 -7 -7 6 529.294 220.884 30 -7 7 -6 336.173 152.264 22 -7 -7 7 178.392 191.393 30 -7 7 -7 181.826 144.713 22 -7 -7 8 600.515 204.307 30 -7 7 -8 423.164 136.246 22 -7 -7 9 2446.75 293.070 30 -7 7 -9 2495.05 245.461 23 -7 7 -9 2670.21 245.674 22 -7 -7 10 499.249 152.860 30 -7 7 -10 400.221 125.704 23 -7 7 -11 324.517 112.424 23 -7 8 10 1415.60 173.609 22 -7 -8 -9 360.934 119.345 22 -7 8 9 363.972 130.275 22 -7 -8 -8 1374.63 257.654 29 -7 8 8 1274.14 207.568 22 -7 -8 -7 2458.83 339.954 29 -7 8 7 1908.90 258.313 22 -7 -8 -6 826.047 252.855 29 -7 8 6 866.692 208.569 22 -7 -8 -5 619.368 253.853 29 -7 8 5 510.771 194.889 22 -7 -8 -4 234.402 206.148 29 -7 8 4 315.499 176.552 22 -7 -8 -3 1534.92 300.549 29 -7 8 3 1764.04 285.778 22 -7 8 2 76.4849 122.324 20 -7 -8 -2-95.8156 205.298 29 -7 8 2 67.4588 176.098 22 -7 8 1 1648.03 251.507 20 -7 -8 -1 1480.46 245.439 30 -7 -8 -1 1817.80 317.140 29 -7 8 1 1551.98 274.547 22 -7 8 0 196.996 131.418 20 -7 -8 0-15.7862 140.945 30 -7 -8 0 143.264 195.482 29 -7 8 0-74.5448 175.679 22 -7 8 -1 1580.09 249.226 20 -7 -8 1 1666.07 276.310 30 -7 -8 1 1560.36 295.609 29 -7 8 -1 1364.81 266.882 22 -7 8 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864.933 144.969 27 -7 -9 9 974.047 182.999 30 -7 9 -9 709.576 142.538 23 -7 -10 -8 147.998 122.591 29 -7 10 8 271.791 127.122 22 -7 -10 -7 2147.47 269.396 29 -7 10 7 1939.69 225.762 22 -7 10 6 347.379 112.614 20 -7 -10 -6 208.894 159.485 29 -7 10 6 179.294 137.078 22 -7 10 5 719.122 156.932 20 -7 -10 -5 424.128 197.103 29 -7 10 5 581.691 173.620 22 -7 10 4 209.730 115.297 20 -7 -10 -4 525.729 218.032 29 -7 10 4 371.972 165.509 22 -7 10 3 2634.00 269.446 20 -7 -10 -3 2479.80 329.912 29 -7 10 3 2482.58 287.694 22 -7 10 2 119.467 131.091 20 -7 -10 -2 207.303 191.679 29 -7 10 2 73.3463 153.062 22 -7 10 1 759.633 186.276 20 -7 -10 -1 660.391 223.500 29 -7 10 1 466.913 169.458 22 -7 10 0 144.608 124.567 20 -7 -10 0 103.215 118.185 30 -7 -10 0 113.529 160.751 29 -7 10 0 125.046 144.827 22 -7 10 -1 688.848 173.644 20 -7 -10 1 710.689 182.501 30 -7 -10 1 745.677 216.230 29 -7 10 -1 786.958 189.934 22 -7 10 -2 183.702 139.101 20 -7 -10 2 164.783 139.294 30 -7 -10 2 87.7990 149.419 29 -7 10 -2 248.644 143.451 22 -7 -10 3 2715.57 314.829 30 -7 -10 3 2225.83 281.268 29 -7 10 -3 2768.81 281.896 22 -7 10 -3 2856.02 293.575 20 -7 -10 4 332.389 184.286 30 -7 10 -4 203.993 116.325 27 -7 10 -4 270.943 125.849 22 -7 -10 5 676.041 199.859 30 -7 10 -5 462.280 130.519 27 -7 10 -5 535.711 135.172 22 -7 -10 6 107.272 143.765 30 -7 10 -6 220.132 97.9679 27 -7 -10 7 2146.08 258.210 30 -7 10 -7 2001.33 197.615 27 -7 -10 8 321.230 139.036 30 -7 -11 -7 63.1005 114.473 29 -7 11 7 294.435 118.990 22 -7 -11 -6 894.878 187.994 29 -7 11 6 614.979 153.227 22 -7 11 5 2618.09 232.445 20 -7 -11 -5 2830.55 306.012 29 -7 11 5 2408.94 254.190 22 -7 11 4 2385.37 237.352 20 -7 -11 -4 2350.78 300.792 29 -7 11 4 2148.16 248.576 22 -7 11 3 409.461 139.682 20 -7 -11 -3 289.487 173.120 29 -7 11 3 291.882 137.037 22 -7 11 2 1690.87 228.437 20 -7 -11 -2 1825.26 279.863 29 -7 11 2 1719.23 236.293 22 -7 11 1 248.385 125.668 20 -7 -11 -1 405.978 193.055 29 -7 11 1 149.833 122.008 22 -7 11 0 663.720 168.432 20 -7 -11 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-12 0 133.919 134.962 29 -7 12 0 94.8633 101.482 22 -7 12 -1 861.008 163.740 20 -7 -12 1 918.127 153.317 30 -7 -12 1 1026.44 194.889 29 -7 12 -1 890.788 145.659 22 -7 12 -2 743.900 159.328 20 -7 -12 2 722.172 152.880 30 -7 -12 2 925.975 188.657 29 -7 -12 3 651.939 149.860 30 -7 12 -3 639.751 132.996 27 -7 -12 4 158.256 114.824 30 -7 12 -4 238.074 102.273 27 -7 -12 5 1784.99 208.748 30 -8 0 0 371.884 173.288 30 -8 0 0 659.330 170.393 22 -8 0 -1 556.572 180.747 30 -8 0 1 710.416 217.806 30 -8 0 -1 616.045 174.438 22 -8 0 1 434.339 140.164 22 -8 0 -2 1662.60 248.119 30 -8 0 2 1673.76 277.876 30 -8 0 -2 1806.35 249.380 22 -8 0 3-88.9677 175.677 30 -8 0 -3-6.94366 127.831 22 -8 0 4 119.564 166.908 30 -8 0 -4 132.953 134.212 22 -8 0 5 1286.73 260.057 30 -8 0 -5 1740.27 238.022 22 -8 0 6 117.949 151.560 30 -8 0 -6 166.618 135.555 22 -8 0 7 531.059 164.253 30 -8 0 -7 735.258 172.232 22 -8 0 8 886.219 173.655 30 -8 0 -8 926.189 168.560 22 -8 0 -9 15.2853 84.0800 22 -8 -1 -9 816.010 144.725 22 -8 1 8 787.194 168.424 30 -8 -1 -8 1017.81 167.099 22 -8 1 7 723.861 181.328 30 -8 -1 -7 569.497 153.400 22 -8 1 6 1109.19 226.965 30 -8 -1 -6 1300.78 206.774 22 -8 1 5 837.524 222.662 30 -8 -1 -5 1080.34 198.526 22 -8 1 4 2230.11 309.081 30 -8 -1 -4 2321.46 265.577 22 -8 1 3-46.4097 176.295 30 -8 -1 -3 54.6403 120.879 22 -8 1 3 52.7854 109.782 22 -8 -1 -2 524.988 169.797 30 -8 1 2 684.580 225.874 30 -8 -1 -2 848.924 176.809 22 -8 1 2 755.903 165.094 22 -8 1 1 656.575 211.029 30 -8 -1 -1 731.032 192.560 30 -8 -1 -1 699.426 167.778 22 -8 1 1 1145.84 205.347 22 -8 1 0 2222.53 298.083 30 -8 -1 0 2117.82 290.530 30 -8 -1 0 1815.12 229.689 22 -8 1 0 2198.24 267.273 22 -8 1 -1 677.515 187.973 30 -8 -1 1 707.064 205.594 30 -8 1 -1 577.774 175.454 22 -8 1 -2 837.655 199.292 30 -8 -1 2 767.337 220.533 30 -8 1 -2 809.458 197.712 22 -8 -1 3 40.7365 173.456 30 -8 1 -3-121.194 144.926 22 -8 -1 4 2390.06 318.776 30 -8 1 -4 2366.01 279.431 22 -8 -1 5 860.748 225.240 30 -8 1 -5 960.471 197.818 22 -8 -1 6 1564.23 257.019 30 -8 1 -6 1618.53 224.222 22 -8 -1 7 673.005 177.899 30 -8 1 -7 554.577 156.600 22 -8 -1 8 877.481 171.932 30 -8 1 -8 1130.42 180.078 22 -8 1 -9 771.685 140.425 22 -8 -2 -9 302.709 108.614 22 -8 2 8 2275.95 233.278 30 -8 -2 -8 2770.35 237.558 22 -8 2 7 561.880 167.024 30 -8 -2 -7 834.925 161.643 22 -8 2 6 207.038 158.066 30 -8 -2 -6 175.492 123.286 22 -8 2 5 357.411 185.504 30 -8 -2 -5 111.079 120.618 22 -8 2 4 238.284 181.985 30 -8 -2 -4 186.395 121.556 22 -8 2 4 241.086 118.993 22 -8 2 3 1703.17 277.898 30 -8 -2 -3 2200.53 249.812 22 -8 2 3 2241.64 247.155 22 -8 2 2 503.733 208.794 30 -8 -2 -2 614.669 165.332 30 -8 -2 -2 796.916 166.002 22 -8 2 2 613.462 162.518 22 -8 2 1 440.803 196.287 30 -8 -2 -1 385.712 162.878 30 -8 -2 -1 479.776 144.933 22 -8 2 1 628.410 178.639 22 -8 2 0 20.4396 152.330 30 -8 -2 0-64.8995 136.553 30 -8 2 0-79.5147 145.654 22 -8 2 -1 428.017 169.099 30 -8 -2 1 460.881 181.642 30 -8 2 -1 564.045 170.273 22 -8 -2 2 581.510 204.959 30 -8 2 -2 629.537 181.452 22 -8 -2 3 1751.27 278.932 30 -8 2 -3 2255.10 277.610 22 -8 -2 4 333.832 191.105 30 -8 2 -4 290.691 160.607 22 -8 -2 5 56.9222 158.257 30 -8 2 -5 62.1353 125.816 22 -8 -2 6 88.3988 144.277 30 -8 2 -6 30.2559 125.772 22 -8 -2 7 766.176 185.511 30 -8 2 -7 602.010 157.786 22 -8 -2 8 2471.42 254.496 30 -8 2 -8 2561.90 239.827 22 -8 2 -9 187.777 95.8349 22 -8 -3 -8 298.378 113.860 22 -8 -3 -7 672.668 146.211 22 -8 3 6 418.169 163.913 30 -8 -3 -6 630.185 143.537 22 -8 3 5 113.459 140.773 30 -8 -3 -5 365.042 127.660 22 -8 3 5 357.852 114.635 22 -8 3 4 749.779 217.869 30 -8 -3 -4 529.161 140.774 22 -8 3 4 717.025 165.870 22 -8 3 3 1363.06 252.376 30 -8 -3 -3 1800.97 218.245 22 -8 3 3 2209.66 252.248 22 -8 3 2 868.920 231.246 30 -8 3 2 1149.26 205.600 22 -8 3 1 1142.99 244.233 30 -8 -3 -1 1152.41 213.977 30 -8 3 1 1396.48 224.354 22 -8 3 0 2805.94 329.559 30 -8 -3 0 3160.06 326.785 30 -8 3 0 3383.86 325.672 22 -8 -3 1 935.777 206.401 30 -8 3 -1 1116.18 213.596 22 -8 -3 2 946.085 221.072 30 -8 3 -2 1000.33 210.075 22 -8 -3 3 2085.38 298.504 30 -8 3 -3 1641.07 244.349 22 -8 -3 4 515.277 191.698 30 -8 3 -4 667.608 187.120 22 -8 -3 5 255.020 161.931 30 -8 3 -5 285.631 141.711 22 -8 -3 6 419.741 172.775 30 -8 3 -6 508.785 159.686 22 -8 -3 7 707.591 176.389 30 -8 3 -7 502.465 146.293 22 -8 -3 8 444.330 141.973 30 -8 3 -8 189.412 108.123 22 -8 -4 -7 131.875 98.9556 22 -8 -4 -6 214.828 96.7843 22 -8 4 6 301.121 110.213 22 -8 -4 -5 726.232 141.527 22 -8 4 5 454.655 138.811 22 -8 -4 -4 350.110 118.597 22 -8 4 4 506.886 147.870 22 -8 -4 -3 3950.36 393.819 29 -8 4 3 4045.36 322.818 22 -8 -4 -2 1414.17 268.907 29 -8 4 2 626.736 174.788 22 -8 -4 -1 2849.57 290.608 30 -8 -4 -1 3225.13 342.082 29 -8 4 1 2946.67 301.409 22 -8 -4 0 2137.90 269.440 30 -8 -4 0 2416.50 297.555 29 -8 4 0 2007.74 265.074 22 -8 -4 1 2809.64 314.222 30 -8 4 -1 2767.11 299.481 22 -8 -4 2 689.713 194.716 30 -8 4 -2 520.781 172.579 22 -8 -4 3 3850.38 362.237 30 -8 4 -3 4121.23 351.965 22 -8 -4 4 398.546 171.118 30 -8 4 -4 515.970 173.201 22 -8 -4 5 530.517 188.620 30 -8 4 -5 489.166 157.468 22 -8 -4 6 19.5327 130.211 30 -8 4 -6 117.696 113.481 22 -8 -4 7-4.07855 118.077 30 -8 4 -7-41.1182 104.237 22 -8 -4 8 1598.79 202.866 30 -8 4 -8 1950.77 194.599 22 -8 5 6 290.073 109.217 22 -8 5 5 591.211 142.740 22 -8 -5 -4 1146.66 246.457 29 -8 5 4 409.535 147.653 22 -8 -5 -3 644.816 218.212 29 -8 5 3 55.5786 125.025 22 -8 -5 -2 4385.84 395.376 29 -8 5 2 4943.08 360.655 22 -8 -5 -1 1148.44 200.631 30 -8 -5 -1 1223.98 240.448 29 -8 5 1 1324.59 226.948 22 -8 -5 0 5179.03 375.532 30 -8 -5 0 4973.24 388.412 29 -8 5 0 5512.00 389.555 22 -8 -5 1 1394.78 230.036 30 -8 5 -1 1443.66 228.828 22 -8 -5 2 4568.54 372.128 30 -8 5 -2 4533.68 358.160 22 -8 -5 3 192.326 149.664 30 -8 5 -3 33.6900 129.415 22 -8 -5 4 186.581 154.214 30 -8 5 -4 371.309 145.132 22 -8 -5 5 299.228 147.999 30 -8 5 -5 304.433 126.679 22 -8 -5 6 449.853 159.207 30 -8 5 -6 359.528 129.894 22 -8 -5 7 925.255 175.814 30 -8 5 -7 745.277 141.739 22 -8 -6 -5 1154.00 230.329 29 -8 6 5 642.013 141.831 22 -8 -6 -4 1401.64 250.299 29 -8 6 4 1183.65 185.783 22 -8 -6 -3 2339.49 288.483 29 -8 6 3 1724.71 222.068 22 -8 -6 -2 2215.63 283.829 29 -8 6 2 1898.54 239.717 22 -8 -6 -1 3067.22 310.179 29 -8 6 1 3358.69 299.037 22 -8 -6 0 528.338 151.191 30 -8 -6 0 811.673 190.348 29 -8 6 0 780.563 190.364 22 -8 -6 1 2709.70 279.083 30 -8 6 -1 2880.07 283.464 22 -8 -6 2 1819.62 244.524 30 -8 6 -2 2038.06 243.572 22 -8 -6 3 2118.90 251.593 30 -8 6 -3 1973.72 232.861 22 -8 -6 4 930.242 196.247 30 -8 6 -4 907.565 174.666 22 -8 -6 5 793.741 175.075 30 -8 6 -5 721.857 153.795 22 -8 -6 6 917.622 176.928 30 -8 6 -6 764.810 145.001 22 -8 -7 -5 490.583 169.593 29 -8 7 5 108.131 93.6917 22 -8 -7 -4 845.977 201.371 29 -8 7 4 535.515 139.892 22 -8 -7 -3 919.101 205.997 29 -8 7 3 492.467 136.004 22 -8 -7 -2 1779.96 243.710 29 -8 7 2 1374.99 200.251 22 -8 -7 -1 2025.31 250.489 29 -8 7 1 2120.13 240.619 22 -8 -7 0 613.604 142.410 30 -8 -7 0 467.068 145.768 29 -8 7 0 372.431 140.208 22 -8 -7 1 1849.86 220.937 30 -8 7 -1 2078.66 237.353 22 -8 -7 2 1422.32 201.408 30 -8 7 -2 1438.64 204.608 22 -8 -7 3 790.715 170.569 30 -8 7 -3 455.913 139.930 22 -8 -7 4 588.342 157.506 30 -8 7 -4 575.423 136.092 22 -8 -7 5 126.464 110.836 30 -8 7 -5 39.5859 87.4651 22 -8 -8 -3 882.327 186.072 29 -8 8 3 907.733 156.308 22 -8 -8 -2 1436.57 212.302 29 -8 8 2 1379.38 185.934 22 -8 -8 -1 271.137 134.968 29 -8 8 1 563.188 141.592 22 -8 8 0 584.156 143.729 22 -8 8 -1 599.254 145.143 22 -8 8 -2 1316.44 175.568 22 -8 8 -3 536.156 120.581 22 0 0 0 0.00 0.00 0 TITL exp_10138 in P2(1)2(1)2(1) REM P2(1)2(1)2(1) (#19 in standard setting) CELL 1.54184 7.144018 17.683117 18.546193 90.0000 90.0000 90.0000 ZERR 10.00 0.000224 0.000537 0.000505 0.0000 0.0000 0.0000 LATT -1 SYMM -x+1/2,-y, z+1/2 SYMM -x, y+1/2,-z+1/2 SYMM x+1/2,-y+1/2,-z SFAC C H N O UNIT 110.00 100.00 10.00 10.00 TREF HKLF 4 END ; _shelx_hkl_checksum 92607 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, -y, z+1/2' 'x+1/2, -y+1/2, -z' '-x, y+1/2, -z+1/2' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_disorder_assembly _atom_site_disorder_group N1 N 0.8588(3) 0.87634(12) 0.15314(12) 0.0361(5) Uani 1 1 d . U . . . N2 N 0.6631(3) 0.76821(13) 0.08591(11) 0.0346(5) Uani 1 1 d . U . . . H2 H 0.563796 0.753954 0.063499 0.042 Uiso 1 1 calc R U . . . N3 N 0.5486(4) 0.54854(13) 0.29357(12) 0.0401(5) Uani 1 1 d . U . . . H3A H 0.543672 0.499951 0.292869 0.048 Uiso 1 1 calc R U . . . O1 O 0.3502(5) 0.60606(14) 0.53943(13) 0.0813(9) Uani 1 1 d . U . . . O2 O 0.5945(3) 0.88937(11) 0.22034(10) 0.0427(5) Uani 1 1 d . U . . . O3 O 0.8389(3) 0.79092(12) -0.01429(10) 0.0450(5) Uani 1 1 d . U . . . O4 O 0.6244(4) 0.56946(12) 0.17558(11) 0.0544(6) Uani 1 1 d . U . . . C2 C 0.4080(5) 0.62495(18) 0.47181(17) 0.0522(8) Uani 1 1 d . U . . . C3 C 0.4163(7) 0.7013(2) 0.45378(19) 0.0680(11) Uani 1 1 d . U . . . H3 H 0.377856 0.737601 0.486938 0.082 Uiso 1 1 calc R U . . . C4 C 0.4813(6) 0.72346(18) 0.38679(18) 0.0570(9) Uani 1 1 d . U . . . H4 H 0.491488 0.774548 0.375554 0.068 Uiso 1 1 calc R U . . . C5 C 0.5310(4) 0.66938(15) 0.33670(15) 0.0395(6) Uani 1 1 d . U . . . C6 C 0.6152(4) 0.67502(15) 0.26252(14) 0.0340(6) Uani 1 1 d . U . . . C7 C 0.8316(4) 0.69786(15) 0.26257(14) 0.0341(6) Uani 1 1 d . U . . . C8 C 0.8529(3) 0.71930(14) 0.18298(13) 0.0305(5) Uani 1 1 d . U . . . H8 H 0.839935 0.672154 0.155651 0.037 Uiso 1 1 calc R U . . . C9 C 1.0285(4) 0.75849(15) 0.15362(16) 0.0369(6) Uani 1 1 d . U . . . H9A H 1.103275 0.723119 0.125888 0.044 Uiso 1 1 calc R U . . . H9B H 1.104206 0.777721 0.192985 0.044 Uiso 1 1 calc R U . . . C10 C 0.9616(4) 0.82401(15) 0.10529(14) 0.0346(6) Uani 1 1 d . U . . . C11 C 1.1139(4) 0.87357(18) 0.07253(17) 0.0475(7) Uani 1 1 d . U . . . H11A H 1.230407 0.845934 0.067386 0.057 Uiso 0.476(11) 1 d R U P A 1 H11B H 1.076339 0.892945 0.025784 0.057 Uiso 0.476(11) 1 d R U P A 1 H11C H 1.126455 0.863061 0.021426 0.057 Uiso 0.524(11) 1 d R U P A 2 H11D H 1.233261 0.864054 0.095739 0.057 Uiso 0.524(11) 1 d R U P A 2 C12 C 1.1330(11) 0.9353(4) 0.1268(5) 0.053(2) Uani 0.476(11) 1 d . U P A 1 H12A H 1.215697 0.919404 0.165391 0.063 Uiso 0.476(11) 1 d R U P A 1 H12B H 1.185281 0.980306 0.104626 0.063 Uiso 0.476(11) 1 d R U P A 1 C12' C 1.0545(11) 0.9553(4) 0.0845(4) 0.053(2) Uani 0.524(11) 1 d . U P A 2 H12C H 0.976897 0.973427 0.045175 0.064 Uiso 0.524(11) 1 d R U P A 2 H12D H 1.162668 0.988062 0.089170 0.064 Uiso 0.524(11) 1 d R U P A 2 C13 C 0.9420(5) 0.95158(16) 0.15648(18) 0.0466(7) Uani 1 1 d . U . . . H13A H 0.949311 0.970174 0.205608 0.056 Uiso 0.476(11) 1 d R U P A 1 H13B H 0.873747 0.987577 0.127064 0.056 Uiso 0.476(11) 1 d R U P A 1 H13C H 1.023425 0.956895 0.198040 0.056 Uiso 0.524(11) 1 d R U P A 2 H13D H 0.846287 0.990435 0.158080 0.056 Uiso 0.524(11) 1 d R U P A 2 C14 C 0.7040(4) 0.85133(14) 0.18461(12) 0.0319(6) Uani 1 1 d . U . . . C15 C 0.6777(3) 0.76706(14) 0.16532(13) 0.0295(5) Uani 1 1 d . U . . . C16 C 0.5202(4) 0.72878(16) 0.20699(15) 0.0360(6) Uani 1 1 d . U . . . H16A H 0.440625 0.700258 0.174504 0.043 Uiso 1 1 calc R U . . . H16B H 0.444277 0.766204 0.231622 0.043 Uiso 1 1 calc R U . . . C17 C 0.8162(4) 0.79313(14) 0.05119(13) 0.0331(6) Uani 1 1 d . U . . . C18 C 0.5979(4) 0.59207(15) 0.23631(14) 0.0380(6) Uani 1 1 d . U . . . C19 C 0.5068(4) 0.59325(15) 0.35412(14) 0.0363(6) Uani 1 1 d . U . . . C20 C 0.4525(4) 0.56833(16) 0.42195(15) 0.0394(6) Uani 1 1 d . U . . . C21 C 0.4418(5) 0.48988(17) 0.44520(15) 0.0436(7) Uani 1 1 d . U . . . H21 H 0.464672 0.451054 0.412536 0.052 Uiso 1 1 calc R U . . . C22 C 0.4002(7) 0.47417(19) 0.51197(18) 0.0681(11) Uani 1 1 d . U . . . H22 H 0.432106 0.427332 0.531174 0.082 Uiso 1 1 calc R U . B 1 C1 C 0.294(2) 0.5352(6) 0.5611(6) 0.068(3) Uani 0.445(8) 1 d . U P C 1 C23 C 0.0886(19) 0.5484(7) 0.5491(6) 0.092(4) Uani 0.445(8) 1 d . U P C 1 H23D H 0.044313 0.585812 0.582514 0.139 Uiso 0.445(8) 1 calc R U P C 1 H23E H 0.021592 0.501949 0.556538 0.139 Uiso 0.445(8) 1 calc R U P C 1 H23F H 0.068473 0.565759 0.500705 0.139 Uiso 0.445(8) 1 calc R U P C 1 C24 C 0.344(3) 0.5147(13) 0.6360(12) 0.080(5) Uani 0.445(8) 1 d . U P C 1 H24D H 0.476010 0.520864 0.642954 0.121 Uiso 0.445(8) 1 calc R U P C 1 H24E H 0.309954 0.462939 0.644758 0.121 Uiso 0.445(8) 1 calc R U P C 1 H24F H 0.277310 0.546882 0.668863 0.121 Uiso 0.445(8) 1 calc R U P C 1 C1' C 0.4051(15) 0.5356(5) 0.5675(4) 0.0582(19) Uani 0.555(8) 1 d . U P C 2 C23' C 0.5923(14) 0.5545(5) 0.5976(4) 0.083(3) Uani 0.555(8) 1 d . U P C 2 H23A H 0.667203 0.578090 0.560967 0.125 Uiso 0.555(8) 1 calc R U P C 2 H23B H 0.652725 0.509067 0.613719 0.125 Uiso 0.555(8) 1 calc R U P C 2 H23C H 0.577749 0.588564 0.637504 0.125 Uiso 0.555(8) 1 calc R U P C 2 C24' C 0.256(2) 0.5165(12) 0.6283(10) 0.087(4) Uani 0.555(8) 1 d . U P C 2 H24A H 0.236104 0.560386 0.657779 0.130 Uiso 0.555(8) 1 calc R U P C 2 H24B H 0.302228 0.475853 0.657671 0.130 Uiso 0.555(8) 1 calc R U P C 2 H24C H 0.140269 0.501735 0.606252 0.130 Uiso 0.555(8) 1 calc R U P C 2 C25 C 0.9616(5) 0.63310(19) 0.28335(18) 0.0511(8) Uani 1 1 d . U . . . H25A H 0.942601 0.591392 0.251026 0.077 Uiso 1 1 calc R U . . . H25B H 0.934813 0.617340 0.331797 0.077 Uiso 1 1 calc R U . . . H25C H 1.089249 0.649754 0.280310 0.077 Uiso 1 1 calc R U . . . C26 C 0.8692(5) 0.76406(17) 0.31435(15) 0.0465(7) Uani 1 1 d . U . . . H26A H 0.865368 0.746153 0.363196 0.070 Uiso 1 1 calc R U . . . H26B H 0.775219 0.802242 0.307706 0.070 Uiso 1 1 calc R U . . . H26C H 0.990356 0.785106 0.304479 0.070 Uiso 1 1 calc R U . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 N1 0.0415(12) 0.0275(11) 0.0394(11) -0.0047(9) 0.0040(10) -0.0008(10) N2 0.0316(11) 0.0417(12) 0.0305(10) -0.0026(9) -0.0048(9) -0.0028(10) N3 0.0575(14) 0.0252(11) 0.0375(12) -0.0031(9) 0.0042(10) -0.0074(10) O1 0.139(3) 0.0527(14) 0.0522(13) 0.0044(11) 0.0441(16) 0.0066(17) O2 0.0528(12) 0.0351(10) 0.0400(10) -0.0006(8) 0.0108(9) 0.0113(9) O3 0.0443(11) 0.0587(13) 0.0319(10) -0.0038(9) 0.0051(8) 0.0042(10) O4 0.0804(16) 0.0452(12) 0.0376(11) -0.0096(9) 0.0095(10) -0.0175(11) C2 0.071(2) 0.0421(16) 0.0434(15) -0.0015(13) 0.0188(15) 0.0031(16) C3 0.109(3) 0.0427(17) 0.0520(18) -0.0066(15) 0.030(2) 0.007(2) C4 0.088(2) 0.0312(14) 0.0519(17) -0.0010(13) 0.0186(17) 0.0060(16) C5 0.0477(15) 0.0322(13) 0.0386(14) 0.0019(11) 0.0048(12) 0.0028(12) C6 0.0399(14) 0.0280(13) 0.0342(13) -0.0005(10) 0.0018(11) -0.0006(11) C7 0.0368(13) 0.0281(12) 0.0372(13) 0.0029(10) -0.0073(11) 0.0001(11) C8 0.0307(12) 0.0257(12) 0.0352(12) -0.0015(10) -0.0026(10) 0.0016(10) C9 0.0295(12) 0.0367(14) 0.0444(14) -0.0026(12) -0.0026(11) 0.0007(11) C10 0.0336(13) 0.0320(13) 0.0382(13) -0.0030(11) 0.0045(11) -0.0019(11) C11 0.0419(15) 0.0443(17) 0.0562(17) -0.0005(13) 0.0092(13) -0.0094(14) C12 0.047(4) 0.045(4) 0.065(4) 0.002(3) -0.001(3) -0.015(3) C12' 0.050(4) 0.040(3) 0.070(4) 0.007(3) 0.006(3) -0.013(3) C13 0.0499(16) 0.0331(14) 0.0568(17) -0.0067(13) -0.0024(14) -0.0082(13) C14 0.0366(14) 0.0319(13) 0.0271(12) 0.0013(10) -0.0015(11) 0.0044(11) C15 0.0291(12) 0.0315(12) 0.0280(11) 0.0013(10) -0.0016(9) 0.0026(10) C16 0.0325(13) 0.0358(13) 0.0397(13) 0.0037(11) 0.0001(11) -0.0018(11) C17 0.0345(13) 0.0310(13) 0.0338(13) -0.0024(10) 0.0042(11) 0.0047(11) C18 0.0446(15) 0.0330(14) 0.0363(14) -0.0037(11) 0.0016(11) -0.0051(12) C19 0.0419(15) 0.0309(13) 0.0360(13) -0.0007(11) 0.0011(11) -0.0010(11) C20 0.0448(15) 0.0354(14) 0.0379(14) 0.0022(11) 0.0032(12) -0.0010(12) C21 0.0533(17) 0.0360(14) 0.0415(15) 0.0005(12) 0.0028(13) -0.0057(13) C22 0.118(3) 0.0420(17) 0.0440(17) 0.0085(14) 0.012(2) -0.004(2) C1 0.111(7) 0.048(5) 0.044(4) -0.004(3) 0.022(6) -0.012(6) C23 0.110(8) 0.077(6) 0.090(7) -0.005(5) 0.045(6) -0.003(6) C24 0.123(12) 0.068(7) 0.051(6) 0.004(5) 0.033(9) -0.001(10) C1' 0.085(5) 0.051(4) 0.038(3) 0.009(3) 0.006(4) 0.013(4) C23' 0.115(7) 0.068(5) 0.068(4) -0.009(4) -0.026(5) 0.012(5) C24' 0.118(10) 0.077(6) 0.066(7) 0.019(5) 0.046(8) 0.010(9) C25 0.0517(17) 0.0434(16) 0.0582(18) 0.0140(14) -0.0117(15) 0.0068(15) C26 0.0601(19) 0.0431(16) 0.0362(14) 0.0008(12) -0.0107(13) -0.0094(15) 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' 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 C14 N1 C13 128.7(2) C14 N1 C10 118.0(2) C13 N1 C10 113.2(2) C17 N2 C15 115.2(2) C18 N3 C19 111.2(2) C2 O1 C1 125.5(5) C2 O1 C1' 118.3(4) O1 C2 C3 118.1(3) O1 C2 C20 120.1(3) C3 C2 C20 121.7(3) C4 C3 C2 120.3(3) C5 C4 C3 119.7(3) C4 C5 C19 118.8(3) C4 C5 C6 132.3(3) C19 C5 C6 109.0(2) C5 C6 C18 101.1(2) C5 C6 C16 118.1(2) C18 C6 C16 109.6(2) C5 C6 C7 113.8(2) C18 C6 C7 108.5(2) C16 C6 C7 105.5(2) C25 C7 C8 111.7(2) C25 C7 C26 107.9(2) C8 C7 C26 113.3(2) C25 C7 C6 113.6(2) C8 C7 C6 99.1(2) C26 C7 C6 111.2(2) C7 C8 C9 122.4(2) C7 C8 C15 105.0(2) C9 C8 C15 109.9(2) C8 C9 C10 107.0(2) N1 C10 C11 103.5(2) N1 C10 C9 106.0(2) C11 C10 C9 116.3(2) N1 C10 C17 106.1(2) C11 C10 C17 115.1(2) C9 C10 C17 108.7(2) C12 C11 C10 102.6(4) C12' C11 C10 106.8(3) C11 C12 C13 107.8(5) C11 C12' C13 103.2(4) N1 C13 C12 100.4(3) N1 C13 C12' 102.2(3) O2 C14 N1 125.9(2) O2 C14 C15 125.3(2) N1 C14 C15 108.7(2) N2 C15 C16 117.4(2) N2 C15 C14 103.08(19) C16 C15 C14 113.7(2) N2 C15 C8 106.01(19) C16 C15 C8 104.4(2) C14 C15 C8 112.3(2) C15 C16 C6 106.6(2) O3 C17 N2 124.9(2) O3 C17 C10 124.5(2) N2 C17 C10 110.6(2) O4 C18 N3 125.5(3) O4 C18 C6 126.3(2) N3 C18 C6 108.2(2) C20 C19 C5 123.4(3) C20 C19 N3 127.2(2) C5 C19 N3 109.4(2) C19 C20 C2 115.8(3) C19 C20 C21 125.9(3) C2 C20 C21 118.3(3) C22 C21 C20 119.8(3) C21 C22 C1' 119.6(4) C21 C22 C1 120.3(5) O1 C1 C24 115.4(13) O1 C1 C23 95.7(10) C24 C1 C23 114.2(12) O1 C1 C22 108.1(7) C24 C1 C22 104.9(13) C23 C1 C22 118.8(10) O1 C1' C23' 101.0(7) O1 C1' C22 112.5(5) C23' C1' C22 116.2(7) O1 C1' C24' 105.4(9) C23' C1' C24' 112.5(9) C22 C1' C24' 108.6(10) loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance N1 C14 1.327(3) N1 C13 1.459(3) N1 C10 1.478(3) N2 C17 1.344(3) N2 C15 1.477(3) N3 C18 1.358(4) N3 C19 1.405(3) O1 C2 1.362(4) O1 C1 1.375(11) O1 C1' 1.406(8) O2 C14 1.226(3) O3 C17 1.226(3) O4 C18 1.210(3) C2 C3 1.392(5) C2 C20 1.399(4) C3 C4 1.383(5) C4 C5 1.380(4) C5 C19 1.395(4) C5 C6 1.505(4) C6 C18 1.550(3) C6 C16 1.557(4) C6 C7 1.598(4) C7 C25 1.524(4) C7 C8 1.532(3) C7 C26 1.538(4) C8 C9 1.533(4) C8 C15 1.546(3) C9 C10 1.541(4) C10 C11 1.523(4) C10 C17 1.544(4) C11 C12 1.491(8) C11 C12' 1.522(7) C12 C13 1.499(8) C12' C13 1.560(8) C14 C15 1.544(3) C15 C16 1.523(3) C19 C20 1.388(4) C20 C21 1.455(4) C21 C22 1.303(4) C22 C1' 1.497(9) C22 C1 1.602(12) C1 C24 1.48(3) C1 C23 1.51(2) C1' C23' 1.488(14) C1' C24' 1.587(19)