#------------------------------------------------------------------------------ #$Date: 2025-01-30 01:52:54 +0200 (Thu, 30 Jan 2025) $ #$Revision: 297532 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/57/38/1573813.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_1573813 _journal_paper_doi 10.1039/D4DT03382E _chemical_formula_moiety '2(C37 H29 In N2 O6 S6)' _chemical_formula_sum 'C74 H58 In2 N4 O12 S12' _chemical_formula_weight 1809.60 _space_group_crystal_system orthorhombic _space_group_IT_number 29 _space_group_name_Hall 'P 2c -2ac' _space_group_name_H-M_alt 'P c a 21' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_date 2024-11-26 _audit_creation_method ; Olex2 1.5 (compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928) ; _audit_update_record ; 2024-11-26 deposited with the CCDC. 2025-01-29 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 28.2437(6) _cell_length_b 17.5038(3) _cell_length_c 14.8073(3) _cell_measurement_reflns_used 20825 _cell_measurement_temperature 99.98(18) _cell_measurement_theta_max 26.8590 _cell_measurement_theta_min 2.4370 _cell_volume 7320.3(2) _computing_cell_refinement 'CrysAlisPro 1.171.42.63a (Rigaku OD, 2022)' _computing_data_collection 'CrysAlisPro 1.171.42.63a (Rigaku OD, 2022)' _computing_data_reduction 'CrysAlisPro 1.171.42.63a (Rigaku OD, 2022)' _computing_molecular_graphics 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2019/2 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' _diffrn_ambient_environment N~2~ _diffrn_ambient_temperature 99.98(18) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_detector_type HyPix3000 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.963 _diffrn_measurement_details ; List of Runs (angles in degrees, time in seconds): # Type Start End Width t~exp~ \w \q \k \f Frames #-------------------------------------------------------------------------- 1 \w -29.00 3.00 0.50 4.56 -- -11.14 -17.00 0.00 64 2 \w 0.00 51.00 0.50 4.56 -- 11.77-110.00-128.00 102 3 \w -53.00 -5.00 0.50 4.56 -- 11.77 -17.00 0.00 96 4 \w 16.00 49.00 0.50 4.56 -- 11.77-128.00 151.00 66 5 \w -26.00 13.00 0.50 4.56 -- -11.14 -99.00 -90.00 78 6 \w -73.00 -29.00 0.50 4.56 -- -11.14 -38.00 150.00 88 7 \w -26.00 23.00 0.50 4.56 -- -11.14 -99.00 30.00 98 8 \w -57.00 -21.00 0.50 4.56 -- 11.77 -77.00 -90.00 72 9 \w 47.00 72.00 0.50 4.56 -- 11.77 38.00 30.00 50 10 \w 1.00 28.00 0.50 4.56 -- 11.77 38.00 30.00 54 11 \w -19.00 41.00 0.50 4.56 -- 11.77 -99.00 150.00 120 12 \w -1.00 24.00 0.50 4.56 -- 11.77 77.00 -60.00 50 13 \w -52.00 -23.00 0.50 4.56 -- 11.77 -19.00-150.00 58 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'XtaLAB Synergy, Dualflex, HyPix3000' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 0.0009794000 _diffrn_orient_matrix_UB_12 0.0247807000 _diffrn_orient_matrix_UB_13 0.0075903000 _diffrn_orient_matrix_UB_21 0.0086150000 _diffrn_orient_matrix_UB_22 0.0037710000 _diffrn_orient_matrix_UB_23 -0.0462572000 _diffrn_orient_matrix_UB_31 -0.0395930000 _diffrn_orient_matrix_UB_32 0.0014506000 _diffrn_orient_matrix_UB_33 -0.0098648000 _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0623 _diffrn_reflns_av_unetI/netI 0.0763 _diffrn_reflns_Laue_measured_fraction_full 0.999 _diffrn_reflns_Laue_measured_fraction_max 0.963 _diffrn_reflns_limit_h_max 35 _diffrn_reflns_limit_h_min -35 _diffrn_reflns_limit_k_max 22 _diffrn_reflns_limit_k_min -20 _diffrn_reflns_limit_l_max 18 _diffrn_reflns_limit_l_min -18 _diffrn_reflns_number 54672 _diffrn_reflns_point_group_measured_fraction_full 0.969 _diffrn_reflns_point_group_measured_fraction_max 0.912 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.064 _diffrn_reflns_theta_min 2.308 _diffrn_source 'micro-focus sealed X-ray tube' _diffrn_source_type 'PhotonJet (Mo) X-ray Source' _exptl_absorpt_coefficient_mu 1.038 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.60759 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.42.63a (Rigaku Oxford Diffraction, 2022) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_crystal_colour 'metallic reddish orange' _exptl_crystal_colour_lustre metallic _exptl_crystal_colour_modifier reddish _exptl_crystal_colour_primary orange _exptl_crystal_density_diffrn 1.642 _exptl_crystal_description block _exptl_crystal_F_000 3664 _exptl_crystal_size_max 0.024 _exptl_crystal_size_mid 0.024 _exptl_crystal_size_min 0.024 _refine_diff_density_max 1.900 _refine_diff_density_min -0.614 _refine_diff_density_rms 0.125 _refine_ls_abs_structure_details ; Flack x determined using 3449 quotients [(I+)-(I-)]/[(I+)+(I-)] (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). ; _refine_ls_abs_structure_Flack 0.317(15) _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.042 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 937 _refine_ls_number_reflns 14672 _refine_ls_number_restraints 1 _refine_ls_restrained_S_all 1.042 _refine_ls_R_factor_all 0.0978 _refine_ls_R_factor_gt 0.0570 _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^)+(0.0541P)^2^+14.1861P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1231 _refine_ls_wR_factor_ref 0.1436 _reflns_Friedel_coverage 0.821 _reflns_Friedel_fraction_full 0.935 _reflns_Friedel_fraction_max 0.857 _reflns_number_gt 9988 _reflns_number_total 14672 _reflns_threshold_expression 'I > 2\s(I)' _iucr_refine_instructions_details ; TITL in-3_autored_a.res in Pca2(1) in-3_autored.res created by SHELXL-2019/2 at 08:36:27 on 26-Nov-2024 REM Old TITL in-3_autored_a.res in Pca2(1) REM SHELXT solution in Pca2(1): R1 0.119, Rweak 0.004, Alpha 0.015 REM 0.562 for 419 systematic absences, Orientation as input REM Flack x = 0.336 ( 0.028 ) from 3738 Parsons' quotients REM Formula found by SHELXT: C71 In2 N7 O12 S12 CELL 0.71073 28.2437 17.5038 14.8073 90 90 90 ZERR 4 0.0006 0.0003 0.0003 0 0 0 LATT -1 SYMM -X,-Y,0.5+Z SYMM 0.5+X,-Y,+Z SYMM 0.5-X,+Y,0.5+Z SFAC C H In N O S UNIT 296 232 8 16 48 48 L.S. 4 PLAN 5 SIZE 0.024 0.024 0.024 TEMP -173.17(18) CONF list 4 MORE -1 BOND $H fmap 2 acta REM REM REM WGHT 0.054100 14.186100 FVAR 0.05950 IN01 3 0.377555 0.953774 0.494861 11.00000 0.02877 0.01810 = 0.02107 0.00213 0.00253 -0.00014 IN02 3 0.384556 0.454517 0.500259 11.00000 0.03356 0.01912 = 0.01869 -0.00092 -0.00222 -0.00135 S3 6 0.372933 0.816992 0.802664 11.00000 0.03056 0.02554 = 0.01620 -0.00430 -0.00012 0.00189 S1 6 0.234429 1.134236 0.572109 11.00000 0.03345 0.02611 = 0.02812 0.00036 -0.00216 0.00438 S2 6 0.266999 1.048872 0.736453 11.00000 0.04473 0.02606 = 0.03502 0.00326 -0.01118 0.00528 S5 6 0.518335 1.130340 0.417088 11.00000 0.03371 0.02376 = 0.03185 0.00238 0.00038 -0.00434 S11 6 0.526403 0.635399 0.430600 11.00000 0.03723 0.02312 = 0.02882 0.00121 -0.00599 -0.00371 S9 6 0.378056 0.318870 0.190047 11.00000 0.04533 0.02971 = 0.02104 -0.00274 -0.00484 0.00180 S6 6 0.492441 1.050631 0.245259 11.00000 0.04075 0.02875 = 0.03831 -0.00251 -0.00101 -0.00325 S12 6 0.487187 0.548450 0.274503 11.00000 0.04870 0.02078 = 0.03297 -0.00481 -0.00137 -0.00428 S10 6 0.342275 0.402587 0.028782 11.00000 0.06707 0.03562 = 0.02602 0.00147 -0.00265 0.01604 S4 6 0.340847 0.902311 0.965726 11.00000 0.07377 0.03671 = 0.02443 -0.00452 0.00545 0.01926 S8 6 0.266515 0.547611 0.266144 11.00000 0.05880 0.03172 = 0.04617 -0.00463 0.01516 0.00216 S7 6 0.237972 0.631533 0.433454 11.00000 0.04754 0.04038 = 0.03777 0.00087 0.00410 0.01007 O8 5 0.438379 0.557409 0.501946 11.00000 0.03291 0.01958 = 0.02849 -0.00027 -0.00938 0.00190 O2 5 0.299765 0.942151 0.509687 11.00000 0.02758 0.02114 = 0.03425 -0.00772 0.00366 -0.00251 O4 5 0.378106 0.869597 0.616503 11.00000 0.03727 0.02962 = 0.01962 0.00320 0.00301 0.00280 O5 5 0.430648 1.054212 0.477739 11.00000 0.02493 0.02113 = 0.03810 0.00298 -0.00090 -0.00351 O3 5 0.380838 0.993031 0.639895 11.00000 0.04748 0.01879 = 0.02815 0.00306 -0.00566 -0.00119 O1 5 0.323823 1.061524 0.497384 11.00000 0.03438 0.02157 = 0.02622 0.00105 0.00402 0.00101 O7 5 0.464231 0.439727 0.486437 11.00000 0.03429 0.02232 = 0.03661 -0.00358 -0.00575 0.00098 O6 5 0.456739 0.935324 0.480021 11.00000 0.03086 0.02508 = 0.03245 -0.00106 0.00347 -0.00118 O11 5 0.305987 0.441521 0.495359 11.00000 0.03681 0.01703 = 0.03420 -0.00270 -0.00033 0.00220 O12 5 0.329336 0.560810 0.503302 11.00000 0.04773 0.02715 = 0.03337 0.00274 0.00416 -0.00473 O10 5 0.380859 0.491256 0.356470 11.00000 0.03462 0.03765 = 0.01762 -0.00247 -0.00304 -0.00499 O9 5 0.382401 0.367950 0.377161 11.00000 0.03309 0.03414 = 0.02252 -0.00930 -0.00150 -0.00117 C29 1 0.381558 0.705060 0.407900 11.00000 0.03048 0.01833 = 0.02677 0.00544 0.00102 0.00612 AFIX 43 H29 2 0.382648 0.657481 0.438698 11.00000 -1.20000 AFIX 0 N1 4 0.372715 0.979555 0.343489 11.00000 0.02950 0.02004 = 0.02493 0.00157 0.00305 0.00019 N2 4 0.376052 0.839816 0.415705 11.00000 0.02353 0.01577 = 0.02277 0.00079 -0.00016 0.00173 N4 4 0.383884 0.340890 0.576759 11.00000 0.03005 0.02549 = 0.02351 -0.00722 -0.00590 0.00413 C28 1 0.378177 0.771851 0.454724 11.00000 0.02833 0.03036 = 0.02073 -0.00100 -0.00307 -0.00233 AFIX 43 H28 2 0.377298 0.769523 0.518800 11.00000 -1.20000 AFIX 0 C33 1 0.373434 0.922119 0.284526 11.00000 0.02283 0.01513 = 0.03641 0.00983 -0.00370 -0.00534 C67 1 0.381618 0.207307 0.679607 11.00000 0.03659 0.01482 = 0.02496 0.00160 -0.00109 -0.00182 AFIX 43 H67 2 0.381351 0.162086 0.715081 11.00000 -1.20000 AFIX 0 N3 4 0.382451 0.482986 0.649875 11.00000 0.04061 0.02307 = 0.02154 -0.00263 0.00032 -0.00717 C10 1 0.377355 0.924051 0.669372 11.00000 0.01128 0.03165 = 0.03741 -0.00469 -0.00327 0.00649 C32 1 0.377007 0.842724 0.324409 11.00000 0.01421 0.03038 = 0.02820 -0.00042 -0.00310 -0.00424 C44 1 0.239369 0.841923 0.189292 11.00000 0.02650 0.03417 = 0.05570 0.02913 0.01235 0.00666 AFIX 43 H44 2 0.236540 0.889990 0.159992 11.00000 -1.20000 AFIX 0 C37 1 0.368910 1.052430 0.312640 11.00000 0.02440 0.02176 = 0.03647 -0.00495 0.00003 0.00315 AFIX 43 H37 2 0.367477 1.093208 0.354890 11.00000 -1.20000 AFIX 0 C22 1 0.503851 1.206109 0.264007 11.00000 0.01945 0.02900 = 0.03978 0.01042 -0.00723 -0.00068 C21 1 0.502976 1.129699 0.302721 11.00000 0.03037 0.02368 = 0.03744 -0.00419 -0.00155 0.00016 C1 1 0.291258 1.013336 0.510350 11.00000 0.02966 0.02347 = 0.01344 -0.00241 -0.00137 0.00040 C72 1 0.368645 0.510141 0.831014 11.00000 0.03806 0.04273 = 0.01982 -0.01334 0.00296 -0.00764 AFIX 43 H72 2 0.363261 0.519866 0.893292 11.00000 -1.20000 AFIX 0 C27 1 0.488280 1.269044 0.314424 11.00000 0.03562 0.03023 = 0.02225 0.00304 0.00073 0.00102 AFIX 43 H27 2 0.475041 1.260910 0.372613 11.00000 -1.20000 AFIX 0 C14 1 0.408120 0.707190 0.946733 11.00000 0.03360 0.03284 = 0.03249 -0.00259 -0.00780 -0.00196 AFIX 43 H14 2 0.427358 0.719153 0.896040 11.00000 -1.20000 AFIX 0 C58 1 0.504303 0.629293 0.321031 11.00000 0.02110 0.03058 = 0.02513 -0.00133 0.00010 -0.00290 C71 1 0.371658 0.437487 0.800517 11.00000 0.02759 0.04726 = 0.01633 0.00738 0.00343 0.00616 AFIX 43 H71 2 0.368952 0.396238 0.841893 11.00000 -1.20000 AFIX 0 C41 1 0.246399 0.702428 0.274806 11.00000 0.04011 0.02185 = 0.05759 0.00992 0.01534 0.00807 C47 1 0.379344 0.425214 0.328468 11.00000 0.02575 0.01781 = 0.01308 -0.00713 0.00391 -0.00309 C46 1 0.259360 0.769834 0.322924 11.00000 0.02957 0.03750 = 0.04699 0.02178 0.00454 0.00593 AFIX 43 H46 2 0.270631 0.767483 0.383309 11.00000 -1.20000 AFIX 0 C11 1 0.370329 0.916626 0.769000 11.00000 0.03507 0.02297 = 0.01954 -0.00173 -0.00227 0.00630 AFIX 23 H11A 2 0.339201 0.938319 0.785947 11.00000 -1.20000 H11B 2 0.395206 0.945792 0.801094 11.00000 -1.20000 AFIX 0 C64 1 0.502103 0.772446 0.322027 11.00000 0.03656 0.02846 = 0.02393 -0.01131 -0.00211 -0.00144 AFIX 43 H64 2 0.504288 0.771980 0.386046 11.00000 -1.20000 AFIX 0 C31 1 0.381329 0.779353 0.271966 11.00000 0.02878 0.01487 = 0.02430 0.00734 0.00263 0.00082 AFIX 43 H31 2 0.382923 0.783425 0.208062 11.00000 -1.20000 AFIX 0 C56 1 0.471329 0.511677 0.487677 11.00000 0.03500 0.01870 = 0.01747 -0.00024 -0.01519 -0.00234 C38 1 0.297655 0.512831 0.493193 11.00000 0.02851 0.03084 = 0.02993 -0.00165 0.00513 -0.00332 C13 1 0.369540 0.753452 0.967035 11.00000 0.02515 0.02633 = 0.01959 -0.00520 -0.00858 -0.00797 C40 1 0.251944 0.627850 0.318611 11.00000 0.03816 0.03705 = 0.02687 -0.00129 -0.00020 0.00582 C36 1 0.367115 1.068354 0.223481 11.00000 0.03413 0.02520 = 0.02259 0.00246 -0.00213 0.00479 AFIX 43 H36 2 0.364176 1.119694 0.203441 11.00000 -1.20000 AFIX 0 C59 1 0.501837 0.704314 0.275077 11.00000 0.03604 0.02405 = 0.02796 0.00298 0.00202 0.00028 C2 1 0.241103 1.038480 0.529714 11.00000 0.02532 0.03544 = 0.01242 0.00652 0.00253 -0.00145 AFIX 23 H2A 2 0.227196 1.002755 0.574244 11.00000 -1.20000 H2B 2 0.222479 1.033870 0.473337 11.00000 -1.20000 AFIX 0 C48 1 0.371581 0.416015 0.224841 11.00000 0.04478 0.02378 = 0.03281 -0.00602 -0.00516 -0.00552 AFIX 23 H48A 2 0.394797 0.448078 0.192090 11.00000 -1.20000 H48B 2 0.339453 0.434166 0.208898 11.00000 -1.20000 AFIX 0 C19 1 0.463328 1.006576 0.470408 11.00000 0.02686 0.02513 = 0.02139 0.00570 0.00082 -0.00151 C42 1 0.232022 0.704785 0.189680 11.00000 0.05251 0.02732 = 0.04630 0.00399 0.02796 0.01075 AFIX 43 H42 2 0.224387 0.658247 0.160053 11.00000 -1.20000 AFIX 0 C69 1 0.381153 0.345276 0.668339 11.00000 0.02846 0.02460 = 0.01525 0.00080 -0.00624 -0.00455 C51 1 0.343925 0.233405 -0.045385 11.00000 0.03430 0.03435 = 0.02035 0.00197 0.00590 -0.00015 AFIX 43 H51 2 0.318460 0.265959 -0.062001 11.00000 -1.20000 AFIX 0 C73 1 0.373425 0.569938 0.771312 11.00000 0.04586 0.04492 = 0.03358 -0.00819 -0.00073 -0.00721 AFIX 43 H73 2 0.372416 0.621280 0.792024 11.00000 -1.20000 AFIX 0 C68 1 0.380229 0.277216 0.719773 11.00000 0.04285 0.03752 = 0.02560 0.01302 0.00072 -0.00182 AFIX 43 H68 2 0.378602 0.280357 0.783748 11.00000 -1.20000 AFIX 0 C12 1 0.360321 0.824735 0.915909 11.00000 0.02589 0.03310 = 0.01760 0.00077 -0.00619 -0.00441 C23 1 0.520658 1.217933 0.177362 11.00000 0.02562 0.03241 = 0.03283 -0.00184 -0.00341 0.00372 AFIX 43 H23 2 0.529230 1.175465 0.140912 11.00000 -1.20000 AFIX 0 C53 1 0.389373 0.120576 -0.069688 11.00000 0.05597 0.02643 = 0.03076 -0.00083 0.01135 -0.00482 AFIX 43 H53 2 0.394736 0.074379 -0.101770 11.00000 -1.20000 AFIX 0 C49 1 0.363922 0.325756 0.076589 11.00000 0.02548 0.04249 = 0.02230 0.00263 0.00896 -0.00723 C4 1 0.247635 1.202014 0.730459 11.00000 0.02126 0.02409 = 0.03460 0.00153 -0.00465 0.00168 C20 1 0.513894 1.032729 0.452482 11.00000 0.03792 0.02345 = 0.03733 0.00445 0.00232 0.00232 AFIX 23 H20A 2 0.527901 0.999697 0.405241 11.00000 -1.20000 H20B 2 0.532743 1.025856 0.508262 11.00000 -1.20000 AFIX 0 C45 1 0.254820 0.839274 0.277765 11.00000 0.04111 0.02616 = 0.06144 0.00992 0.00131 0.00479 AFIX 43 H45 2 0.262452 0.885429 0.308219 11.00000 -1.20000 AFIX 0 C43 1 0.227625 0.774313 0.141209 11.00000 0.04332 0.03887 = 0.03415 0.00133 0.01282 0.01475 AFIX 43 H43 2 0.217411 0.775589 0.080099 11.00000 -1.20000 AFIX 0 C54 1 0.420411 0.141576 -0.000575 11.00000 0.04235 0.02636 = 0.04025 -0.00082 0.00292 0.00681 AFIX 43 H54 2 0.447586 0.111546 0.012443 11.00000 -1.20000 AFIX 0 C50 1 0.373685 0.253713 0.025381 11.00000 0.02349 0.02767 = 0.02348 0.00234 0.00698 -0.00197 C8 1 0.253149 1.339935 0.731095 11.00000 0.04369 0.01647 = 0.06547 -0.00770 -0.01320 -0.00375 AFIX 43 H8 2 0.260185 1.386092 0.700128 11.00000 -1.20000 AFIX 0 C34 1 0.372702 0.934143 0.192894 11.00000 0.04075 0.02403 = 0.02672 0.00523 -0.00010 -0.00706 AFIX 43 H34 2 0.374271 0.892478 0.151889 11.00000 -1.20000 AFIX 0 C15 1 0.418872 0.644888 0.998295 11.00000 0.05025 0.02088 = 0.04243 -0.01052 -0.01802 -0.00313 AFIX 43 H15 2 0.446219 0.615400 0.984869 11.00000 -1.20000 AFIX 0 C17 1 0.351984 0.668352 1.091495 11.00000 0.06073 0.03097 = 0.01600 -0.00003 -0.00841 -0.02011 AFIX 43 H17 2 0.331820 0.654411 1.140130 11.00000 -1.20000 AFIX 0 C57 1 0.521528 0.539572 0.471093 11.00000 0.02829 0.03754 = 0.02996 0.00433 -0.01002 0.01128 AFIX 23 H57A 2 0.536745 0.505090 0.426753 11.00000 -1.20000 H57B 2 0.539489 0.535434 0.528298 11.00000 -1.20000 AFIX 0 C26 1 0.491792 1.343416 0.281045 11.00000 0.03677 0.01936 = 0.05200 -0.00302 -0.00111 0.00454 AFIX 43 H26 2 0.481255 1.385988 0.315389 11.00000 -1.20000 AFIX 0 C74 1 0.379793 0.553742 0.679608 11.00000 0.04767 0.03202 = 0.01557 -0.00523 0.00726 -0.00698 AFIX 43 H74 2 0.382257 0.594735 0.637824 11.00000 -1.20000 AFIX 0 C39 1 0.246595 0.537311 0.478188 11.00000 0.03687 0.02054 = 0.07330 0.01496 0.01008 0.00410 AFIX 23 H39A 2 0.229679 0.533879 0.536606 11.00000 -1.20000 H39B 2 0.231585 0.500319 0.436496 11.00000 -1.20000 AFIX 0 C9 1 0.258660 1.269065 0.687565 11.00000 0.02592 0.03634 = 0.03733 -0.00933 0.00000 0.00754 AFIX 43 H9 2 0.270234 1.267659 0.627348 11.00000 -1.20000 AFIX 0 C70 1 0.378864 0.422057 0.706786 11.00000 0.02514 0.03352 = 0.01608 0.00392 -0.00724 -0.00084 C6 1 0.226151 1.276207 0.861812 11.00000 0.04029 0.03382 = 0.04435 -0.01611 -0.00798 0.00139 AFIX 43 H6 2 0.214512 1.279004 0.921915 11.00000 -1.20000 AFIX 0 C52 1 0.351430 0.165209 -0.092057 11.00000 0.05115 0.04291 = 0.03253 -0.00793 -0.00810 -0.01315 AFIX 43 H52 2 0.330420 0.149985 -0.138816 11.00000 -1.20000 AFIX 0 C3 1 0.251262 1.126277 0.683984 11.00000 0.02735 0.03169 = 0.03045 0.00042 0.00446 0.00066 C55 1 0.410709 0.207480 0.048905 11.00000 0.04027 0.01724 = 0.02805 0.00328 0.00039 0.00015 AFIX 43 H55 2 0.429940 0.220360 0.099291 11.00000 -1.20000 AFIX 0 C30 1 0.383375 0.707949 0.314392 11.00000 0.03332 0.03082 = 0.03916 -0.01554 -0.00756 0.00643 AFIX 43 H30 2 0.385955 0.662417 0.279823 11.00000 -1.20000 AFIX 0 C63 1 0.499185 0.842144 0.276208 11.00000 0.04296 0.02449 = 0.03607 -0.00028 -0.00279 -0.00732 AFIX 43 H63 2 0.498396 0.888931 0.308689 11.00000 -1.20000 AFIX 0 C16 1 0.389782 0.624270 1.070850 11.00000 0.07463 0.02077 = 0.03862 0.00104 -0.02212 -0.01782 AFIX 43 H16 2 0.396526 0.579761 1.105237 11.00000 -1.20000 AFIX 0 C18 1 0.342495 0.734154 1.041700 11.00000 0.03952 0.04386 = 0.02510 -0.00342 0.00403 -0.01018 AFIX 43 H18 2 0.317031 0.766353 1.059259 11.00000 -1.20000 AFIX 0 C5 1 0.230960 1.204352 0.820878 11.00000 0.03501 0.04367 = 0.02211 0.00399 -0.00642 -0.00427 AFIX 43 H5 2 0.223319 1.158803 0.852574 11.00000 -1.20000 AFIX 0 C65 1 0.385192 0.271758 0.539003 11.00000 0.03396 0.03126 = 0.02523 -0.00518 -0.00311 0.00279 AFIX 43 H65 2 0.387472 0.268624 0.475101 11.00000 -1.20000 AFIX 0 C35 1 0.369589 1.009304 0.161538 11.00000 0.03910 0.03897 = 0.02812 0.00993 -0.00672 -0.00395 AFIX 43 H35 2 0.369177 1.019695 0.098572 11.00000 -1.20000 AFIX 0 C60 1 0.499551 0.706246 0.180680 11.00000 0.04214 0.03790 = 0.02120 -0.00070 -0.00240 0.00244 AFIX 43 H60 2 0.500156 0.659782 0.147544 11.00000 -1.20000 AFIX 0 C66 1 0.383384 0.203154 0.588516 11.00000 0.04393 0.01591 = 0.04496 -0.00040 0.00569 -0.00183 AFIX 43 H66 2 0.383405 0.155124 0.558639 11.00000 -1.20000 AFIX 0 C25 1 0.511325 1.352730 0.195525 11.00000 0.03158 0.03837 = 0.04662 0.01121 -0.00775 -0.00216 AFIX 43 H25 2 0.515336 1.402885 0.172231 11.00000 -1.20000 AFIX 0 C24 1 0.525043 1.291125 0.143570 11.00000 0.03801 0.04987 = 0.03637 0.00664 -0.00224 0.01246 AFIX 43 H24 2 0.537473 1.299052 0.084696 11.00000 -1.20000 AFIX 0 C62 1 0.497501 0.841902 0.184716 11.00000 0.05372 0.02666 = 0.03339 0.00529 0.00441 0.00695 AFIX 43 H62 2 0.497028 0.889267 0.153405 11.00000 -1.20000 AFIX 0 C7 1 0.237571 1.341634 0.818361 11.00000 0.03004 0.03413 = 0.06675 -0.01774 -0.01079 -0.00113 AFIX 43 H7 2 0.234728 1.389178 0.848825 11.00000 -1.20000 AFIX 0 C61 1 0.496448 0.774466 0.135464 11.00000 0.06936 0.03830 = 0.03276 0.01087 -0.00789 0.00466 AFIX 43 H61 2 0.493627 0.775530 0.071545 11.00000 -1.20000 AFIX 0 HKLF 4 REM in-3_autored_a.res in Pca2(1) REM wR2 = 0.1436, GooF = S = 1.042, Restrained GooF = 1.042 for all data REM R1 = 0.0570 for 9988 Fo > 4sig(Fo) and 0.0978 for all 14672 data REM 937 parameters refined using 1 restraints END WGHT 0.0541 14.2004 REM Highest difference peak 1.900, deepest hole -0.614, 1-sigma level 0.125 Q1 1 0.2364 0.5533 0.2210 11.00000 0.05 1.90 Q2 1 0.2480 0.6412 0.0590 11.00000 0.05 1.74 Q3 1 0.2321 1.0521 0.7655 11.00000 0.05 1.40 Q4 1 0.2532 1.1422 0.9373 11.00000 0.05 1.25 Q5 1 0.3598 0.5453 0.4982 11.00000 0.05 1.00 REM The information below was added by Olex2. REM REM R1 = 0.0570 for 9988 Fo > 4sig(Fo) and 0.0978 for all 56154 data REM 937 parameters refined using n/a restraints REM Highest difference peak 1.90, deepest hole -0.61 REM Mean Shift 0, Max Shift 0.001. REM +++ Tabular Listing of Refinement Information +++ REM R1_all = 0.0978 REM R1_gt = 0.0570 REM wR_ref = 0.1436 REM GOOF = 1.042 REM Shift_max = 0.001 REM Shift_mean = 0 REM Reflections_all = 56154 REM Reflections_gt = 9988 REM Parameters = 937 REM Hole = -0.61 REM Peak = 1.90 REM Flack = 0.317(15) ; _cod_data_source_file d4dt03382e2.cif _cod_data_source_block in-3_autored _cod_database_code 1573813 _shelx_shelxl_version_number 2019/2 _chemical_oxdiff_formula 'C H O N Sn' _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_max 0.976 _shelx_estimated_absorpt_t_min 0.976 _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H) groups, All C(H,H) groups 2.a Secondary CH2 refined with riding coordinates: C11(H11A,H11B), C2(H2A,H2B), C48(H48A,H48B), C20(H20A,H20B), C57(H57A,H57B), C39(H39A,H39B) 2.b Aromatic/amide H refined with riding coordinates: C29(H29), C28(H28), C67(H67), C44(H44), C37(H37), C72(H72), C27(H27), C14(H14), C71(H71), C46(H46), C64(H64), C31(H31), C36(H36), C42(H42), C51(H51), C73(H73), C68(H68), C23(H23), C53(H53), C45(H45), C43(H43), C54(H54), C8(H8), C34(H34), C15(H15), C17(H17), C26(H26), C74(H74), C9(H9), C6(H6), C52(H52), C55(H55), C30(H30), C63(H63), C16(H16), C18(H18), C5(H5), C65(H65), C35(H35), C60(H60), C66(H66), C25(H25), C24(H24), C62(H62), C7(H7), C61(H61) ; _olex2_submission_special_instructions 'No special instructions were received' _oxdiff_exptl_absorpt_empirical_details ; Empirical correction (ABSPACK) includes: - Absorption correction using spherical harmonics - Frame scaling ; _oxdiff_exptl_absorpt_empirical_full_max 1.289 _oxdiff_exptl_absorpt_empirical_full_min 0.774 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, z+1/2' 'x+1/2, -y, z' '-x+1/2, y, 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 In01 In 0.37755(2) 0.95377(5) 0.49486(5) 0.0226(2) Uani 1 1 d . . . . . In02 In 0.38456(2) 0.45452(5) 0.50026(5) 0.0238(2) Uani 1 1 d . . . . . S3 S 0.37293(11) 0.81699(19) 0.8027(2) 0.0241(7) Uani 1 1 d . . . . . S1 S 0.23443(10) 1.13424(18) 0.5721(2) 0.0292(7) Uani 1 1 d . . . . . S2 S 0.26700(11) 1.04887(19) 0.7365(2) 0.0353(8) Uani 1 1 d . . . . . S5 S 0.51834(10) 1.13034(15) 0.4171(2) 0.0298(6) Uani 1 1 d . . . . . S11 S 0.52640(10) 0.63540(15) 0.4306(2) 0.0297(6) Uani 1 1 d . . . . . S9 S 0.37806(11) 0.3189(2) 0.1900(3) 0.0320(8) Uani 1 1 d . . . . . S6 S 0.49244(11) 1.05063(17) 0.2453(2) 0.0359(7) Uani 1 1 d . . . . . S12 S 0.48719(11) 0.54845(16) 0.2745(2) 0.0341(7) Uani 1 1 d . . . . . S10 S 0.34228(14) 0.4026(2) 0.0288(3) 0.0429(9) Uani 1 1 d . . . . . S4 S 0.34085(14) 0.9023(2) 0.9657(3) 0.0450(10) Uani 1 1 d . . . . . S8 S 0.26652(12) 0.5476(2) 0.2661(3) 0.0456(9) Uani 1 1 d . . . . . S7 S 0.23797(12) 0.6315(2) 0.4335(3) 0.0419(9) Uani 1 1 d . . . . . O8 O 0.4384(2) 0.5574(4) 0.5019(7) 0.0270(17) Uani 1 1 d . . . . . O2 O 0.2998(2) 0.9422(4) 0.5097(7) 0.028(2) Uani 1 1 d . . . . . O4 O 0.3781(3) 0.8696(6) 0.6165(6) 0.029(2) Uani 1 1 d . . . . . O5 O 0.4306(3) 1.0542(4) 0.4777(6) 0.028(2) Uani 1 1 d . . . . . O3 O 0.3808(3) 0.9930(5) 0.6399(7) 0.031(2) Uani 1 1 d . . . . . O1 O 0.3238(2) 1.0615(4) 0.4974(7) 0.0274(17) Uani 1 1 d . . . . . O7 O 0.4642(3) 0.4397(4) 0.4864(6) 0.031(2) Uani 1 1 d . . . . . O6 O 0.4567(3) 0.9353(4) 0.4800(6) 0.029(2) Uani 1 1 d . . . . . O11 O 0.3060(2) 0.4415(4) 0.4954(7) 0.0293(18) Uani 1 1 d . . . . . O12 O 0.3293(3) 0.5608(4) 0.5033(7) 0.036(2) Uani 1 1 d . . . . . O10 O 0.3809(3) 0.4913(6) 0.3565(7) 0.030(2) Uani 1 1 d . . . . . O9 O 0.3824(3) 0.3680(6) 0.3772(6) 0.030(2) Uani 1 1 d . . . . . C29 C 0.3816(4) 0.7051(7) 0.4079(10) 0.025(3) Uani 1 1 d . . . . . H29 H 0.382648 0.657481 0.438698 0.030 Uiso 1 1 calc R U . . . N1 N 0.3727(3) 0.9796(7) 0.3435(8) 0.025(3) Uani 1 1 d . . . . . N2 N 0.3761(3) 0.8398(6) 0.4157(8) 0.021(2) Uani 1 1 d . . . . . N4 N 0.3839(3) 0.3409(6) 0.5768(8) 0.026(3) Uani 1 1 d . . . . . C28 C 0.3782(4) 0.7719(8) 0.4547(10) 0.026(3) Uani 1 1 d . . . . . H28 H 0.377298 0.769523 0.518800 0.032 Uiso 1 1 calc R U . . . C33 C 0.3734(4) 0.9221(7) 0.2845(10) 0.025(3) Uani 1 1 d . . . . . C67 C 0.3816(4) 0.2073(7) 0.6796(10) 0.025(3) Uani 1 1 d . . . . . H67 H 0.381351 0.162086 0.715081 0.031 Uiso 1 1 calc R U . . . N3 N 0.3825(3) 0.4830(7) 0.6499(8) 0.028(3) Uani 1 1 d . . . . . C10 C 0.3774(4) 0.9241(9) 0.6694(10) 0.027(3) Uani 1 1 d . . . . . C32 C 0.3770(4) 0.8427(8) 0.3244(9) 0.024(3) Uani 1 1 d . . . . . C44 C 0.2394(4) 0.8419(8) 0.1893(10) 0.039(4) Uani 1 1 d . . . . . H44 H 0.236540 0.889990 0.159992 0.047 Uiso 1 1 calc R U . . . C37 C 0.3689(4) 1.0524(7) 0.3126(9) 0.028(3) Uani 1 1 d . . . . . H37 H 0.367477 1.093208 0.354890 0.033 Uiso 1 1 calc R U . . . C22 C 0.5039(4) 1.2061(6) 0.2640(8) 0.029(3) Uani 1 1 d . . . . . C21 C 0.5030(4) 1.1297(7) 0.3027(8) 0.030(3) Uani 1 1 d . . . . . C1 C 0.2913(4) 1.0133(6) 0.5103(8) 0.022(2) Uani 1 1 d . . . . . C72 C 0.3686(4) 0.5101(8) 0.8310(10) 0.034(3) Uani 1 1 d . . . . . H72 H 0.363261 0.519866 0.893292 0.040 Uiso 1 1 calc R U . . . C27 C 0.4883(4) 1.2690(7) 0.3144(9) 0.029(3) Uani 1 1 d . . . . . H27 H 0.475041 1.260910 0.372613 0.035 Uiso 1 1 calc R U . . . C14 C 0.4081(4) 0.7072(7) 0.9467(9) 0.033(3) Uani 1 1 d . . . . . H14 H 0.427358 0.719153 0.896040 0.040 Uiso 1 1 calc R U . . . C58 C 0.5043(4) 0.6293(7) 0.3210(8) 0.026(3) Uani 1 1 d . . . . . C71 C 0.3717(4) 0.4375(9) 0.8005(9) 0.030(3) Uani 1 1 d . . . . . H71 H 0.368952 0.396238 0.841893 0.036 Uiso 1 1 calc R U . . . C41 C 0.2464(5) 0.7024(7) 0.2748(12) 0.040(4) Uani 1 1 d . . . . . C47 C 0.3793(4) 0.4252(8) 0.3285(9) 0.019(3) Uani 1 1 d . . . . . C46 C 0.2594(5) 0.7698(8) 0.3229(11) 0.038(4) Uani 1 1 d . . . . . H46 H 0.270631 0.767483 0.383309 0.046 Uiso 1 1 calc R U . . . C11 C 0.3703(4) 0.9166(7) 0.7690(9) 0.026(3) Uani 1 1 d . . . . . H11A H 0.339201 0.938319 0.785947 0.031 Uiso 1 1 calc R U . . . H11B H 0.395206 0.945792 0.801094 0.031 Uiso 1 1 calc R U . . . C64 C 0.5021(4) 0.7724(7) 0.3220(9) 0.030(3) Uani 1 1 d . . . . . H64 H 0.504288 0.771980 0.386046 0.036 Uiso 1 1 calc R U . . . C31 C 0.3813(3) 0.7794(7) 0.2720(9) 0.023(3) Uani 1 1 d . . . . . H31 H 0.382923 0.783425 0.208062 0.027 Uiso 1 1 calc R U . . . C56 C 0.4713(4) 0.5117(6) 0.4877(7) 0.024(2) Uani 1 1 d . . . . . C38 C 0.2977(4) 0.5128(7) 0.4932(9) 0.030(3) Uani 1 1 d . . . . . C13 C 0.3695(4) 0.7535(7) 0.9670(8) 0.024(3) Uani 1 1 d . . . . . C40 C 0.2519(5) 0.6278(7) 0.3186(9) 0.034(3) Uani 1 1 d . . . . . C36 C 0.3671(4) 1.0684(7) 0.2235(9) 0.027(3) Uani 1 1 d . . . . . H36 H 0.364176 1.119694 0.203441 0.033 Uiso 1 1 calc R U . . . C59 C 0.5018(4) 0.7043(6) 0.2751(8) 0.029(3) Uani 1 1 d . . . . . C2 C 0.2411(4) 1.0385(7) 0.5297(7) 0.024(3) Uani 1 1 d . . . . . H2A H 0.227196 1.002755 0.574244 0.029 Uiso 1 1 calc R U . . . H2B H 0.222479 1.033870 0.473337 0.029 Uiso 1 1 calc R U . . . C48 C 0.3716(5) 0.4160(7) 0.2248(10) 0.034(3) Uani 1 1 d . . . . . H48A H 0.394797 0.448078 0.192090 0.041 Uiso 1 1 calc R U . . . H48B H 0.339453 0.434166 0.208898 0.041 Uiso 1 1 calc R U . . . C19 C 0.4633(4) 1.0066(6) 0.4704(7) 0.024(3) Uani 1 1 d . . . . . C42 C 0.2320(5) 0.7048(7) 0.1897(11) 0.042(4) Uani 1 1 d . . . . . H42 H 0.224387 0.658247 0.160053 0.050 Uiso 1 1 calc R U . . . C69 C 0.3812(4) 0.3453(7) 0.6683(9) 0.023(3) Uani 1 1 d . . . . . C51 C 0.3439(4) 0.2334(7) -0.0454(8) 0.030(3) Uani 1 1 d . . . . . H51 H 0.318460 0.265959 -0.062001 0.036 Uiso 1 1 calc R U . . . C73 C 0.3734(5) 0.5699(9) 0.7713(10) 0.041(4) Uani 1 1 d . . . . . H73 H 0.372416 0.621280 0.792024 0.050 Uiso 1 1 calc R U . . . C68 C 0.3802(4) 0.2772(8) 0.7198(10) 0.035(4) Uani 1 1 d . . . . . H68 H 0.378602 0.280357 0.783748 0.042 Uiso 1 1 calc R U . . . C12 C 0.3603(4) 0.8247(7) 0.9159(8) 0.026(3) Uani 1 1 d . . . . . C23 C 0.5207(4) 1.2179(7) 0.1774(9) 0.030(3) Uani 1 1 d . . . . . H23 H 0.529230 1.175465 0.140912 0.036 Uiso 1 1 calc R U . . . C53 C 0.3894(5) 0.1206(8) -0.0697(10) 0.038(3) Uani 1 1 d . . . . . H53 H 0.394736 0.074379 -0.101770 0.045 Uiso 1 1 calc R U . . . C49 C 0.3639(4) 0.3258(7) 0.0766(9) 0.030(3) Uani 1 1 d . . . . . C4 C 0.2476(5) 1.2020(6) 0.7305(10) 0.027(3) Uani 1 1 d . . . . . C20 C 0.5139(4) 1.0327(6) 0.4525(8) 0.033(3) Uani 1 1 d . . . . . H20A H 0.527901 0.999697 0.405241 0.039 Uiso 1 1 calc R U . . . H20B H 0.532743 1.025856 0.508262 0.039 Uiso 1 1 calc R U . . . C45 C 0.2548(5) 0.8393(8) 0.2778(11) 0.043(4) Uani 1 1 d . . . . . H45 H 0.262452 0.885429 0.308219 0.051 Uiso 1 1 calc R U . . . C43 C 0.2276(5) 0.7743(8) 0.1412(10) 0.039(3) Uani 1 1 d . . . . . H43 H 0.217411 0.775589 0.080099 0.047 Uiso 1 1 calc R U . . . C54 C 0.4204(4) 0.1416(7) -0.0006(9) 0.036(3) Uani 1 1 d . . . . . H54 H 0.447586 0.111546 0.012443 0.044 Uiso 1 1 calc R U . . . C50 C 0.3737(4) 0.2537(8) 0.0254(8) 0.025(3) Uani 1 1 d . . . . . C8 C 0.2531(5) 1.3399(7) 0.7311(11) 0.042(4) Uani 1 1 d . . . . . H8 H 0.260185 1.386092 0.700128 0.050 Uiso 1 1 calc R U . . . C34 C 0.3727(5) 0.9341(8) 0.1929(10) 0.031(3) Uani 1 1 d . . . . . H34 H 0.374271 0.892478 0.151889 0.037 Uiso 1 1 calc R U . . . C15 C 0.4189(4) 0.6449(6) 0.9983(10) 0.038(3) Uani 1 1 d . . . . . H15 H 0.446219 0.615400 0.984869 0.045 Uiso 1 1 calc R U . . . C17 C 0.3520(5) 0.6684(7) 1.0915(9) 0.036(3) Uani 1 1 d . . . . . H17 H 0.331820 0.654411 1.140130 0.043 Uiso 1 1 calc R U . . . C57 C 0.5215(4) 0.5396(6) 0.4711(8) 0.032(3) Uani 1 1 d . . . . . H57A H 0.536745 0.505090 0.426753 0.038 Uiso 1 1 calc R U . . . H57B H 0.539489 0.535434 0.528298 0.038 Uiso 1 1 calc R U . . . C26 C 0.4918(4) 1.3434(6) 0.2810(9) 0.036(3) Uani 1 1 d . . . . . H26 H 0.481255 1.385988 0.315389 0.043 Uiso 1 1 calc R U . . . C74 C 0.3798(4) 0.5537(8) 0.6796(9) 0.032(3) Uani 1 1 d . . . . . H74 H 0.382257 0.594735 0.637824 0.038 Uiso 1 1 calc R U . . . C39 C 0.2466(4) 0.5373(6) 0.4782(10) 0.044(4) Uani 1 1 d . . . . . H39A H 0.229679 0.533879 0.536606 0.052 Uiso 1 1 calc R U . . . H39B H 0.231585 0.500319 0.436496 0.052 Uiso 1 1 calc R U . . . C9 C 0.2587(4) 1.2691(8) 0.6876(10) 0.033(3) Uani 1 1 d . . . . . H9 H 0.270234 1.267659 0.627348 0.040 Uiso 1 1 calc R U . . . C70 C 0.3789(4) 0.4221(8) 0.7068(9) 0.025(3) Uani 1 1 d . . . . . C6 C 0.2262(4) 1.2762(8) 0.8618(10) 0.039(3) Uani 1 1 d . . . . . H6 H 0.214512 1.279004 0.921915 0.047 Uiso 1 1 calc R U . . . C52 C 0.3514(5) 0.1652(8) -0.0921(10) 0.042(4) Uani 1 1 d . . . . . H52 H 0.330420 0.149985 -0.138816 0.051 Uiso 1 1 calc R U . . . C3 C 0.2513(4) 1.1263(7) 0.6840(9) 0.030(3) Uani 1 1 d . . . . . C55 C 0.4107(4) 0.2075(6) 0.0489(9) 0.029(3) Uani 1 1 d . . . . . H55 H 0.429940 0.220360 0.099291 0.034 Uiso 1 1 calc R U . . . C30 C 0.3834(4) 0.7079(8) 0.3144(11) 0.034(4) Uani 1 1 d . . . . . H30 H 0.385955 0.662417 0.279823 0.041 Uiso 1 1 calc R U . . . C63 C 0.4992(4) 0.8421(7) 0.2762(9) 0.035(3) Uani 1 1 d . . . . . H63 H 0.498396 0.888931 0.308689 0.041 Uiso 1 1 calc R U . . . C16 C 0.3898(5) 0.6243(8) 1.0709(11) 0.045(4) Uani 1 1 d . . . . . H16 H 0.396526 0.579761 1.105237 0.054 Uiso 1 1 calc R U . . . C18 C 0.3425(5) 0.7342(8) 1.0417(9) 0.036(3) Uani 1 1 d . . . . . H18 H 0.317031 0.766353 1.059259 0.043 Uiso 1 1 calc R U . . . C5 C 0.2310(4) 1.2044(7) 0.8209(9) 0.034(3) Uani 1 1 d . . . . . H5 H 0.223319 1.158803 0.852574 0.040 Uiso 1 1 calc R U . . . C65 C 0.3852(4) 0.2718(8) 0.5390(10) 0.030(3) Uani 1 1 d . . . . . H65 H 0.387472 0.268624 0.475101 0.036 Uiso 1 1 calc R U . . . C35 C 0.3696(4) 1.0093(8) 0.1615(10) 0.035(3) Uani 1 1 d . . . . . H35 H 0.369177 1.019695 0.098572 0.042 Uiso 1 1 calc R U . . . C60 C 0.4996(5) 0.7062(7) 0.1807(9) 0.034(3) Uani 1 1 d . . . . . H60 H 0.500156 0.659782 0.147544 0.040 Uiso 1 1 calc R U . . . C66 C 0.3834(4) 0.2032(7) 0.5885(12) 0.035(4) Uani 1 1 d . . . . . H66 H 0.383405 0.155124 0.558639 0.042 Uiso 1 1 calc R U . . . C25 C 0.5113(4) 1.3527(8) 0.1955(9) 0.039(3) Uani 1 1 d . . . . . H25 H 0.515336 1.402885 0.172231 0.047 Uiso 1 1 calc R U . . . C24 C 0.5250(4) 1.2911(7) 0.1436(9) 0.041(3) Uani 1 1 d . . . . . H24 H 0.537473 1.299052 0.084696 0.050 Uiso 1 1 calc R U . . . C62 C 0.4975(5) 0.8419(7) 0.1847(9) 0.038(3) Uani 1 1 d . . . . . H62 H 0.497028 0.889267 0.153405 0.046 Uiso 1 1 calc R U . . . C7 C 0.2376(5) 1.3416(8) 0.8184(11) 0.044(4) Uani 1 1 d . . . . . H7 H 0.234728 1.389178 0.848825 0.052 Uiso 1 1 calc R U . . . C61 C 0.4964(5) 0.7745(7) 0.1355(9) 0.047(3) Uani 1 1 d . . . . . H61 H 0.493627 0.775530 0.071545 0.056 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 In01 0.0288(4) 0.0181(4) 0.0211(4) 0.0021(5) 0.0025(5) -0.0001(3) In02 0.0336(4) 0.0191(4) 0.0187(4) -0.0009(4) -0.0022(5) -0.0014(3) S3 0.0306(16) 0.0255(17) 0.0162(17) -0.0043(14) -0.0001(12) 0.0019(13) S1 0.0334(16) 0.0261(17) 0.0281(17) 0.0004(14) -0.0022(14) 0.0044(13) S2 0.0447(18) 0.0261(18) 0.0350(19) 0.0033(16) -0.0112(16) 0.0053(14) S5 0.0337(16) 0.0238(14) 0.0318(17) 0.0024(13) 0.0004(13) -0.0043(12) S11 0.0372(16) 0.0231(14) 0.0288(16) 0.0012(12) -0.0060(13) -0.0037(12) S9 0.045(2) 0.0297(19) 0.0210(19) -0.0027(16) -0.0048(14) 0.0018(14) S6 0.0408(18) 0.0287(16) 0.0383(19) -0.0025(14) -0.0010(15) -0.0033(13) S12 0.0487(19) 0.0208(14) 0.0330(16) -0.0048(13) -0.0014(14) -0.0043(13) S10 0.067(2) 0.036(2) 0.026(2) 0.0015(16) -0.0026(16) 0.0160(17) S4 0.074(3) 0.037(2) 0.024(2) -0.0045(16) 0.0054(16) 0.0193(18) S8 0.059(2) 0.032(2) 0.046(2) -0.0046(18) 0.0152(18) 0.0022(16) S7 0.048(2) 0.040(2) 0.038(2) 0.0009(17) 0.0041(17) 0.0101(16) O8 0.033(4) 0.020(4) 0.028(4) 0.000(4) -0.009(4) 0.002(3) O2 0.028(4) 0.021(4) 0.034(6) -0.008(4) 0.004(4) -0.003(3) O4 0.037(5) 0.030(6) 0.020(5) 0.003(5) 0.003(4) 0.003(4) O5 0.025(4) 0.021(4) 0.038(6) 0.003(4) -0.001(4) -0.004(3) O3 0.047(6) 0.019(6) 0.028(6) 0.003(5) -0.006(4) -0.001(4) O1 0.034(4) 0.022(4) 0.026(4) 0.001(4) 0.004(5) 0.001(3) O7 0.034(4) 0.022(4) 0.037(5) -0.004(4) -0.006(4) 0.001(3) O6 0.031(4) 0.025(4) 0.032(6) -0.001(3) 0.003(4) -0.001(3) O11 0.037(4) 0.017(4) 0.034(5) -0.003(4) 0.000(5) 0.002(3) O12 0.048(5) 0.027(5) 0.033(5) 0.003(5) 0.004(5) -0.005(4) O10 0.035(5) 0.038(6) 0.018(5) -0.002(5) -0.003(4) -0.005(4) O9 0.033(5) 0.034(6) 0.023(5) -0.009(5) -0.001(3) -0.001(4) C29 0.030(7) 0.018(8) 0.027(9) 0.005(6) 0.001(5) 0.006(5) N1 0.029(6) 0.020(6) 0.025(7) 0.002(5) 0.003(4) 0.000(4) N2 0.024(5) 0.016(6) 0.023(6) 0.001(5) 0.000(4) 0.002(4) N4 0.030(6) 0.025(6) 0.024(6) -0.007(5) -0.006(4) 0.004(4) C28 0.028(7) 0.030(8) 0.021(7) -0.001(6) -0.003(5) -0.002(5) C33 0.023(6) 0.015(7) 0.036(9) 0.010(6) -0.004(5) -0.005(5) C67 0.037(8) 0.015(7) 0.025(8) 0.002(6) -0.001(5) -0.002(4) N3 0.041(7) 0.023(6) 0.022(7) -0.003(5) 0.000(4) -0.007(5) C10 0.011(6) 0.032(9) 0.037(9) -0.005(7) -0.003(5) 0.006(5) C32 0.014(6) 0.030(8) 0.028(8) 0.000(6) -0.003(5) -0.004(5) C44 0.027(7) 0.034(8) 0.056(10) 0.029(7) 0.012(7) 0.007(6) C37 0.024(6) 0.022(7) 0.036(8) -0.005(6) 0.000(5) 0.003(5) C22 0.019(6) 0.029(7) 0.040(7) 0.010(6) -0.007(5) -0.001(5) C21 0.030(7) 0.024(6) 0.037(7) -0.004(5) -0.002(6) 0.000(5) C1 0.030(5) 0.023(6) 0.013(6) -0.002(5) -0.001(5) 0.000(5) C72 0.038(7) 0.043(9) 0.020(8) -0.013(7) 0.003(5) -0.008(7) C27 0.036(7) 0.030(7) 0.022(7) 0.003(6) 0.001(5) 0.001(6) C14 0.034(7) 0.033(8) 0.032(9) -0.003(6) -0.008(6) -0.002(5) C58 0.021(6) 0.031(7) 0.025(6) -0.001(5) 0.000(5) -0.003(5) C71 0.028(6) 0.047(9) 0.016(7) 0.007(7) 0.003(5) 0.006(6) C41 0.040(8) 0.022(8) 0.058(11) 0.010(7) 0.015(8) 0.008(6) C47 0.026(7) 0.018(7) 0.013(7) -0.007(6) 0.004(4) -0.003(5) C46 0.030(8) 0.038(8) 0.047(9) 0.022(7) 0.005(6) 0.006(6) C11 0.035(7) 0.023(7) 0.020(7) -0.002(6) -0.002(6) 0.006(5) C64 0.037(7) 0.028(7) 0.024(7) -0.011(6) -0.002(6) -0.001(6) C31 0.029(7) 0.015(7) 0.024(8) 0.007(6) 0.003(5) 0.001(4) C56 0.035(6) 0.019(5) 0.017(6) 0.000(5) -0.015(5) -0.002(5) C38 0.029(5) 0.031(7) 0.030(7) -0.002(7) 0.005(6) -0.003(5) C13 0.025(6) 0.026(7) 0.020(7) -0.005(5) -0.009(5) -0.008(5) C40 0.038(7) 0.037(8) 0.027(7) -0.001(7) 0.000(6) 0.006(6) C36 0.034(7) 0.025(7) 0.023(7) 0.002(6) -0.002(6) 0.005(5) C59 0.036(7) 0.024(6) 0.028(7) 0.003(5) 0.002(5) 0.000(5) C2 0.025(6) 0.035(7) 0.012(5) 0.007(5) 0.003(4) -0.001(5) C48 0.045(8) 0.024(7) 0.033(9) -0.006(6) -0.005(7) -0.006(6) C19 0.027(6) 0.025(6) 0.021(7) 0.006(5) 0.001(4) -0.002(5) C42 0.053(9) 0.027(8) 0.046(10) 0.004(7) 0.028(8) 0.011(6) C69 0.028(7) 0.025(8) 0.015(7) 0.001(6) -0.006(5) -0.005(5) C51 0.034(7) 0.034(8) 0.020(7) 0.002(6) 0.006(5) 0.000(6) C73 0.046(8) 0.045(9) 0.034(9) -0.008(7) -0.001(7) -0.007(6) C68 0.043(9) 0.038(9) 0.026(9) 0.013(7) 0.001(6) -0.002(6) C12 0.026(6) 0.033(7) 0.018(7) 0.001(6) -0.006(5) -0.004(5) C23 0.026(7) 0.032(7) 0.033(8) -0.002(6) -0.003(6) 0.004(5) C53 0.056(8) 0.026(8) 0.031(8) -0.001(7) 0.011(7) -0.005(7) C49 0.025(6) 0.042(8) 0.022(7) 0.003(6) 0.009(5) -0.007(6) C4 0.021(6) 0.024(7) 0.035(9) 0.002(6) -0.005(6) 0.002(5) C20 0.038(7) 0.023(6) 0.037(7) 0.004(5) 0.002(6) 0.002(5) C45 0.041(8) 0.026(8) 0.061(11) 0.010(7) 0.001(8) 0.005(6) C43 0.043(8) 0.039(8) 0.034(8) 0.001(7) 0.013(6) 0.015(7) C54 0.042(7) 0.026(7) 0.040(8) -0.001(7) 0.003(8) 0.007(5) C50 0.023(6) 0.028(7) 0.023(8) 0.002(6) 0.007(5) -0.002(5) C8 0.044(8) 0.016(7) 0.065(12) -0.008(7) -0.013(8) -0.004(6) C34 0.041(7) 0.024(7) 0.027(8) 0.005(6) 0.000(6) -0.007(6) C15 0.050(7) 0.021(6) 0.042(8) -0.011(7) -0.018(8) -0.003(5) C17 0.061(9) 0.031(8) 0.016(7) 0.000(6) -0.008(6) -0.020(7) C57 0.028(6) 0.038(7) 0.030(7) 0.004(5) -0.010(5) 0.011(5) C26 0.037(7) 0.019(6) 0.052(8) -0.003(6) -0.001(6) 0.005(5) C74 0.048(8) 0.032(8) 0.016(7) -0.005(6) 0.007(5) -0.007(6) C39 0.037(6) 0.021(6) 0.073(12) 0.015(7) 0.010(7) 0.004(6) C9 0.026(7) 0.036(8) 0.037(8) -0.009(7) 0.000(6) 0.008(6) C70 0.025(7) 0.034(8) 0.016(7) 0.004(6) -0.007(5) -0.001(5) C6 0.040(8) 0.034(8) 0.044(9) -0.016(7) -0.008(7) 0.001(7) C52 0.051(9) 0.043(9) 0.033(9) -0.008(7) -0.008(7) -0.013(7) C3 0.027(6) 0.032(7) 0.030(8) 0.000(6) 0.004(5) 0.001(6) C55 0.040(7) 0.017(7) 0.028(8) 0.003(5) 0.000(6) 0.000(5) C30 0.033(8) 0.031(9) 0.039(10) -0.016(7) -0.008(6) 0.006(5) C63 0.043(7) 0.024(6) 0.036(7) 0.000(6) -0.003(6) -0.007(5) C16 0.075(10) 0.021(7) 0.039(9) 0.001(7) -0.022(8) -0.018(7) C18 0.040(8) 0.044(9) 0.025(8) -0.003(7) 0.004(6) -0.010(7) C5 0.035(8) 0.044(9) 0.022(7) 0.004(6) -0.006(6) -0.004(6) C65 0.034(7) 0.031(8) 0.025(8) -0.005(7) -0.003(5) 0.003(6) C35 0.039(8) 0.039(9) 0.028(8) 0.010(7) -0.007(6) -0.004(7) C60 0.042(8) 0.038(8) 0.021(7) -0.001(6) -0.002(6) 0.002(6) C66 0.044(9) 0.016(8) 0.045(11) 0.000(6) 0.006(7) -0.002(5) C25 0.032(7) 0.038(8) 0.047(9) 0.011(6) -0.008(6) -0.002(6) C24 0.038(7) 0.050(8) 0.036(7) 0.007(6) -0.002(6) 0.012(6) C62 0.054(9) 0.027(7) 0.033(8) 0.005(6) 0.004(7) 0.007(6) C7 0.030(8) 0.034(8) 0.067(11) -0.018(8) -0.011(7) -0.001(6) C61 0.069(10) 0.038(8) 0.033(7) 0.011(6) -0.008(7) 0.005(7) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' In In -0.7276 1.3100 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _diffrn_refln_index_h _diffrn_refln_index_k _diffrn_refln_index_l _diffrn_refln_intensity_net _diffrn_refln_intensity_u 0 0 2 303.42 11.75 0 0 -2 305.02 11.77 0 0 -3 -0.26 0.24 0 0 -4 2506.49 94.48 0 0 -5 0.09 0.35 0 0 -6 871.95 33.88 0 0 -7 -0.13 0.66 0 0 -8 30.63 2.41 0 0 -9 0.33 0.72 0 0 10 244.51 11.56 0 0 -10 261.83 11.54 0 0 11 -1.27 1.55 0 0 -11 -0.2 1.01 0 0 -12 227.73 10.86 0 0 -14 77.32 6.19 0 0 -16 65.26 5.91 0 0 -17 -4.57 3.07 0 0 -18 3.85 1.99 -1 0 2 1.08 0.26 1 0 2 1.27 0.31 1 0 -2 1.52 0.31 1 0 -3 0.34 0.23 -1 0 3 -0.05 0.23 -1 0 -3 0.35 0.27 1 0 3 0.19 0.31 -1 0 -4 1.75 0.59 -1 0 4 3.7 0.9 1 0 -5 0.17 0.38 -1 0 -5 0.19 0.37 -1 0 -6 4.51 1 1 0 -6 4.08 0.97 -1 0 -7 0.13 0.64 1 0 7 -0.71 0.99 1 0 -7 0.72 0.59 -1 0 -8 0.15 0.67 1 0 8 -0.32 0.77 1 0 -8 0.14 0.69 -1 0 -9 0.85 0.73 1 0 9 -0.18 0.33 1 0 10 0.59 0.9 1 0 -10 -0.53 0.83 1 0 11 -1.48 1.48 -1 0 -11 0.41 0.95 1 0 -11 2.51 1.13 -1 0 -12 3.47 1.62 1 0 -12 0.21 1.12 -1 0 -13 -0.69 1.68 -1 0 -13 0.73 1.12 -1 0 -14 -1.86 2.36 1 0 -15 -2.01 2.1 -1 0 -15 -2.41 2.19 1 0 -16 -2.15 2.28 -1 0 -16 -0.43 1.63 1 0 -17 -4.11 3.01 -1 0 -17 -2.73 2.66 -1 0 -18 0.48 1.6 1 0 -18 -1.45 2.13 2 0 2 58.78 2.78 2 0 2 61.46 2.55 -2 0 -2 61.94 2.54 2 0 2 59.38 2.78 -2 0 -2 59.95 2.79 -2 0 2 57.34 2.53 -2 0 -3 112.18 4.46 -2 0 -3 113.33 4.88 2 0 3 107.58 4.83 -2 0 3 107.13 4.57 2 0 -3 107.41 4.59 -2 0 -4 52.45 2.85 2 0 4 59.74 2.98 -2 0 -4 56.53 2.52 -2 0 4 50.27 2.61 2 0 -4 53.87 2.69 2 0 5 427.04 16.79 -2 0 -5 435.8 16.23 2 0 -5 402.97 16.47 -2 0 5 395.31 16.36 -2 0 -5 419.39 16.72 2 0 6 132.09 6.22 -2 0 -6 133.11 5.64 -2 0 -6 127.47 6.16 2 0 -6 125.45 5.91 2 0 7 947.03 37.84 -2 0 -7 983.54 37.19 -2 0 -7 964.17 37.87 2 0 -7 972.93 37.62 -2 0 -8 16.96 1.43 -2 0 -8 16.84 1.81 2 0 -8 17.14 1.68 -2 0 -9 319.31 5.56 -2 0 -9 329.75 7.3 2 0 -9 322.02 6.66 -2 0 -10 8.26 1.72 -2 0 -10 9.51 1.55 2 0 10 9.43 1.54 2 0 -10 8.4 1.47 -2 0 -11 172.5 8.7 2 0 -11 170.49 8.45 2 0 11 170.59 8.69 -2 0 -11 176.76 9.36 2 0 -12 0.61 1.14 -2 0 -12 1.39 1.07 -2 0 -12 0.63 1.27 -2 0 -13 224.44 11.12 -2 0 -13 230.21 12.07 -2 0 -14 5.22 2.24 -2 0 -15 56.98 5.29 2 0 -16 -1.72 2.35 -2 0 -16 3.43 1.63 2 0 -17 89.63 7.41 -2 0 -17 84.99 7.06 2 0 -18 0.48 1.66 -2 0 -18 -0.48 1.83 -2 0 18 2.44 1.5 -3 0 1 0.04 0.17 -3 0 1 0.04 0.14 3 0 -1 0.04 0.13 3 0 1 0.08 0.14 3 0 1 -0.05 0.16 3 0 2 0.37 0.27 3 0 2 0.78 0.34 -3 0 -2 0.66 0.29 -3 0 -2 0.53 0.23 3 0 2 0.49 0.22 -3 0 2 0.52 0.31 -3 0 -3 -0.08 0.27 3 0 3 -0.08 0.32 3 0 3 0.08 0.14 -3 0 3 -0.04 0.19 -3 0 -3 -0.08 0.22 3 0 3 0.31 0.34 3 0 -4 0.14 0.22 -3 0 -4 0.19 0.31 -3 0 -4 0.25 0.22 3 0 4 0.28 0.38 -3 0 4 0.27 0.28 -3 0 -4 0.4 0.26 3 0 -5 0.37 0.36 -3 0 -5 1.06 0.37 -3 0 -5 0.42 0.39 -3 0 5 0.21 0.34 -3 0 -5 0.48 0.27 3 0 5 -0.11 0.59 3 0 -6 1.01 0.67 3 0 -6 1.4 0.49 -3 0 6 1.08 0.53 -3 0 -6 1.49 0.74 -3 0 -6 1.31 0.47 3 0 6 0.51 0.74 3 0 -7 0.33 0.76 3 0 -7 1.03 0.51 -3 0 -7 -0.14 0.67 -3 0 -7 0.31 0.38 3 0 7 -0.29 0.8 3 0 -8 -0.13 0.58 3 0 -8 0.17 0.37 -3 0 -8 0.65 0.65 -3 0 -8 0.45 0.46 -3 0 -9 0.36 0.71 3 0 9 0.18 0.24 3 0 -9 0.87 0.81 -3 0 -10 -1.03 1.31 -3 0 -10 -0.6 0.83 3 0 10 -1 1.29 3 0 -10 2.76 1.05 -3 0 -11 -0.86 1.24 -3 0 -11 -0.44 0.95 3 0 11 -0.65 1.25 3 0 -11 -0.36 1.05 -3 0 -12 -1.58 1.51 -3 0 -12 0.48 0.85 -3 0 -13 5.16 1.86 -3 0 -13 3.08 1.41 -3 0 -14 -1.49 2.09 -3 0 -14 -2.2 1.65 -3 0 -16 0.43 1.48 -3 0 -17 -3.18 2.75 3 0 -17 -3.66 2.84 3 0 -18 -0.96 1.84 -3 0 18 -1.24 1.7 4 0 0 456.58 17.45 -4 0 0 448.14 17.45 -4 0 1 33.15 1.67 4 0 -1 29.72 1.61 -4 0 -1 29.79 1.68 -4 0 1 29.56 1.67 4 0 1 31.6 1.54 4 0 1 30.93 1.7 -4 0 2 1161.03 44.35 -4 0 2 1173.6 44.46 -4 0 -2 1165.42 44.14 4 0 2 1181.92 44.15 4 0 2 1155.6 44.49 4 0 2 1176.48 44.52 4 0 3 29.1 1.87 4 0 3 28.87 1.89 -4 0 -3 28.34 1.85 4 0 3 30.71 1.42 4 0 3 28.89 1.56 -4 0 -3 27.24 1.52 -4 0 3 29.16 1.84 4 0 4 25.51 1.76 -4 0 -4 21.03 1.62 4 0 4 22.43 1.64 -4 0 -4 19.87 1.26 4 0 -4 18.96 1.07 -4 0 4 20.79 1.29 -4 0 -5 11.42 1.26 4 0 5 11.48 1.27 -4 0 -5 11.46 0.88 -4 0 -5 10.53 0.95 4 0 -5 11.27 0.84 -4 0 5 11.76 1 -4 0 -6 661.74 25.06 4 0 6 658.88 25.88 -4 0 6 642.28 25.27 -4 0 -6 667.66 25.17 -4 0 -6 623.62 25.8 4 0 -6 642.05 24.98 4 0 -7 5.06 0.71 -4 0 -7 3.88 0.98 -4 0 -7 4.32 0.71 -4 0 7 5.4 0.86 -4 0 -7 4.76 0.71 4 0 7 4.24 0.96 4 0 -8 118.97 5.81 -4 0 -8 119.19 6.26 4 0 -8 124.7 5.42 -4 0 -8 119.5 5.51 -4 0 -8 116.92 5.43 -4 0 -9 20.35 1.52 -4 0 -9 18.92 1.97 4 0 -9 21.18 1.84 -4 0 -10 262.42 12.55 4 0 10 259.84 11.99 -4 0 -10 259.74 11.98 -4 0 -11 13.23 2.1 4 0 11 9.48 1.71 -4 0 -11 13.33 1.95 -4 0 -12 22.76 2.96 -4 0 -12 19.1 2.49 -4 0 -13 7.39 1.67 -4 0 -13 5.85 1.92 -4 0 -14 38.09 3.61 -4 0 -14 29.79 3.73 -4 0 -15 2.4 1.61 -4 0 -16 8.57 2.43 -4 0 -17 4.56 2.42 4 0 -18 8.7 2.55 -4 0 -18 14.93 2.97 -4 0 18 8.33 2.21 5 0 0 0.24 0.27 -5 0 0 0.06 0.21 5 0 -1 0.06 0.21 -5 0 -1 0.27 0.24 -5 0 1 0.06 0.24 5 0 1 0.41 0.3 5 0 2 1.77 0.47 -5 0 -2 1.19 0.32 -5 0 2 1.2 0.43 5 0 -2 0.77 0.37 -5 0 2 1.26 0.39 5 0 2 1.17 0.38 5 0 2 1.3 0.46 5 0 3 0.3 0.36 5 0 3 0.65 0.41 -5 0 -3 0.85 0.39 -5 0 3 0.77 0.37 -5 0 -3 0.45 0.3 5 0 3 0.52 0.34 -5 0 3 0.27 0.35 5 0 4 -0.11 0.47 5 0 4 -0.24 0.44 -5 0 4 0.05 0.26 5 0 4 0.26 0.18 -5 0 -4 0.22 0.27 5 0 4 -0.06 0.27 -5 0 -4 0.06 0.26 -5 0 4 0.53 0.48 5 0 5 0.13 0.46 5 0 5 0.12 0.41 -5 0 -5 0.51 0.41 -5 0 5 0.26 0.35 -5 0 -5 -0.06 0.29 5 0 -5 0.07 0.23 -5 0 -6 -0.22 0.51 -5 0 6 0.7 0.52 -5 0 -6 1.03 0.64 5 0 6 0.42 0.62 5 0 -6 1.05 0.4 -5 0 7 0.09 0.36 -5 0 -7 -0.16 0.5 -5 0 -7 0.31 0.57 5 0 7 -0.94 0.61 5 0 -7 -0.06 0.32 -5 0 -8 0.27 0.54 -5 0 -8 1.05 0.72 -5 0 8 1.13 0.58 -5 0 -8 0.85 0.44 5 0 -8 0.43 0.36 5 0 9 -0.19 0.72 -5 0 -9 -0.19 0.86 -5 0 -9 -0.3 0.67 5 0 10 -0.21 1.1 -5 0 -10 0.21 1.04 5 0 11 -0.89 1.2 -5 0 -11 -0.46 1.03 -5 0 -12 -0.95 1.46 -5 0 -12 0.5 0.93 -5 0 -13 -1.04 1.59 -5 0 -13 0.27 1.06 -5 0 -14 -0.29 1.16 -5 0 -14 -0.37 1.42 -5 0 -15 0.61 1.36 -5 0 -15 -2.01 2.13 -5 0 -16 -3.01 2.03 -5 0 -17 -2.75 2.61 -5 0 -18 -0.48 1.67 -5 0 18 -0.42 1.35 6 0 0 0.51 0.31 -6 0 0 0.3 0.28 -6 0 0 0.34 0.17 -6 0 -1 197.6 8.41 6 0 -1 201.92 8.32 -6 0 1 201.6 8.05 6 0 1 197.97 8.42 6 0 -1 204.72 8.41 -6 0 1 205.83 8.4 -6 0 2 45.43 2.47 6 0 -2 44.78 2.43 -6 0 2 48.24 2.58 6 0 2 46.3 2.3 6 0 2 43.09 2.55 -6 0 3 141.26 6.43 -6 0 3 138.54 6.24 6 0 3 138.7 6.39 6 0 3 141.13 5.98 -6 0 -3 147.78 5.98 6 0 3 143.73 6.48 6 0 4 1.27 0.5 6 0 4 1.86 0.65 6 0 4 1.67 0.33 -6 0 -4 0.96 0.48 -6 0 4 2.17 0.61 -6 0 -4 1.42 0.38 6 0 4 1.56 0.43 -6 0 4 1.7 0.76 6 0 5 36.9 2.52 6 0 5 35.83 1.79 -6 0 -5 36 2.52 -6 0 -5 34.6 1.99 -6 0 5 37.55 2.51 -6 0 5 32.04 1.92 -6 0 -6 60.72 3.59 6 0 6 54.45 3.44 -6 0 -6 56.11 2.85 6 0 -6 51.42 2.5 -6 0 6 59.21 3.48 -6 0 6 54.06 2.84 6 0 7 160.77 7.47 -6 0 -7 173.26 7.67 -6 0 -7 152.11 7.38 -6 0 -7 147.6 6.56 6 0 -7 145.1 6.23 -6 0 7 146.36 6.6 -6 0 8 29.49 2.05 -6 0 -8 28.14 1.97 -6 0 -8 29.28 2.53 -6 0 -9 15.03 1.88 -6 0 -9 16.4 1.45 6 0 9 14.1 1.83 6 0 10 1.7 1.04 -6 0 -10 0.53 1.2 -6 0 -10 0.66 0.84 -6 0 -10 -0.9 1.46 -6 0 -11 74.17 5.49 6 0 11 83.64 5.27 -6 0 -11 84.38 5.32 -6 0 -12 15.02 2.39 -6 0 -12 14.17 2.14 -6 0 -13 117.67 6.91 -6 0 -13 105.41 7.26 -6 0 -14 13.59 2.23 -6 0 -14 12.04 2.5 -6 0 -15 48.55 4.45 -6 0 -15 57 5.26 -6 0 -16 22.91 3.49 -6 0 -17 38.07 4.6 -6 0 -18 9.68 2.66 -6 0 18 8.1 2.21 7 0 0 0.68 0.41 -7 0 0 0.43 0.35 -7 0 0 0.39 0.23 -7 0 -1 -0.09 0.38 -7 0 1 0.25 0.26 -7 0 1 0.69 0.41 7 0 -1 0.27 0.37 7 0 1 0.19 0.41 -7 0 2 0.85 0.5 -7 0 2 0.44 0.39 7 0 -2 0.83 0.5 7 0 2 0.19 0.38 7 0 2 -0.21 0.56 7 0 3 1.31 0.57 -7 0 3 2.35 0.71 7 0 3 1.56 0.61 -7 0 3 1.24 0.5 7 0 3 1.2 0.44 7 0 3 0.83 0.53 7 0 4 0.14 0.35 -7 0 -4 -0.13 0.38 7 0 4 0.37 0.43 -7 0 4 0.11 0.31 7 0 4 0.36 0.32 -7 0 -4 0.07 0.27 -7 0 4 -0.12 0.42 7 0 5 0.14 0.2 -7 0 -5 0.44 0.45 7 0 5 -0.16 0.41 -7 0 5 0.36 0.44 -7 0 5 -0.06 0.26 -7 0 5 0.41 0.44 -7 0 -5 0.22 0.32 7 0 5 0.31 0.42 7 0 5 -0.14 0.41 7 0 6 1.89 0.74 -7 0 -6 0.81 0.64 -7 0 -6 1.75 0.57 -7 0 6 0.3 0.61 -7 0 6 2.02 0.55 -7 0 -7 0.18 0.58 -7 0 7 0.09 0.44 -7 0 -7 0.09 0.46 -7 0 7 -0.5 0.67 -7 0 -8 0.19 0.55 -7 0 8 0.1 0.38 -7 0 -8 -0.28 0.71 -7 0 8 0.18 0.89 -7 0 -9 0.21 0.8 7 0 9 0.2 0.61 -7 0 -9 -0.21 0.66 -7 0 -9 -0.3 0.53 -7 0 9 0.2 0.71 -7 0 -9 -0.24 0.75 -7 0 -10 -0.54 0.9 7 0 10 -0.22 0.75 -7 0 -10 -0.23 0.72 -7 0 -11 -0.89 1.16 -7 0 -11 -0.25 0.91 -7 0 -12 -0.97 1.33 -7 0 -12 0.26 0.94 -7 0 -13 -1.75 1.92 -7 0 -13 0.28 1.14 -7 0 -14 -1.51 1.75 -7 0 -14 -0.91 1.63 -7 0 -15 1.28 1.35 -7 0 -16 -0.87 1.92 -7 0 -17 0.46 1.65 -7 0 17 1.64 1.47 -8 0 0 9352.62 355.19 8 0 0 9999 355.96 -8 0 0 9400.01 355.94 -8 0 -1 314.65 12.7 -8 0 1 295.5 12.09 8 0 1 341.04 12.84 8 0 -1 300.55 12.64 -8 0 1 301.25 12.57 8 0 -2 682.83 26.7 8 0 -2 692.94 26.89 -8 0 2 681.31 26.84 8 0 2 695.97 26.46 8 0 2 669.02 26.92 8 0 3 61.3 3.5 -8 0 3 63.81 3.49 -8 0 3 61.08 3.34 8 0 3 60.71 3.48 8 0 -3 61.68 3.32 8 0 3 60.54 3.08 8 0 3 61.76 3.54 8 0 4 140.45 6.77 -8 0 4 148.96 6.65 -8 0 -4 147.83 6.89 8 0 4 143.82 6.9 -8 0 -4 134.64 6.17 8 0 4 148.41 6.3 -8 0 4 149.09 6.82 8 0 5 25.07 2.08 8 0 5 22.79 1.35 -8 0 -5 21.31 1.97 -8 0 5 21.32 1.82 -8 0 5 23.84 2 -8 0 -5 21.68 1.54 8 0 5 19.62 1.55 8 0 5 22.78 2.07 8 0 6 80.13 4.65 -8 0 6 78.23 4.39 -8 0 6 78.57 3.84 8 0 6 78.15 4.01 -8 0 -6 83.36 3.99 -8 0 6 80.45 4.57 -8 0 -6 92.73 4.86 8 0 6 82.91 3.63 8 0 7 0.36 0.73 -8 0 -7 0.94 0.63 -8 0 -7 1.45 0.53 -8 0 7 0.25 0.4 -8 0 7 1.22 0.7 -8 0 -8 22.4 2.32 -8 0 8 22.13 1.72 -8 0 -8 19.56 1.64 -8 0 -8 24.45 2.32 -8 0 8 20.56 2.19 -8 0 -9 27.24 2.73 -8 0 -9 31.23 2.99 -8 0 -9 33.03 2.89 -8 0 9 35.79 2.94 -8 0 -10 81.99 5.14 8 0 10 77.52 5.02 -8 0 10 78.93 5 -8 0 -10 80.46 5.43 -8 0 -11 5.41 1.63 -8 0 -11 7.32 1.56 -8 0 -12 87.3 6.21 -8 0 -12 91.8 5.91 -8 0 -13 6.02 1.95 -8 0 -13 6.38 1.58 -8 0 -14 35.85 4.01 -8 0 -14 33.96 3.65 -8 0 -15 4.5 1.74 -8 0 -15 5.23 1.89 -8 0 -16 54.96 4.74 -8 0 -16 39.66 4.69 -8 0 -17 -2.77 1.81 -8 0 17 -0.42 1.33 9 0 0 0.33 0.5 -9 0 0 1 0.57 -9 0 0 0.5 0.27 -9 0 -1 0.23 0.39 -9 0 1 0.06 0.28 9 0 -1 0.23 0.41 -9 0 1 -0.32 0.51 9 0 1 0.37 0.47 -9 0 2 0.23 0.41 9 0 -2 -0.12 0.39 9 0 -2 0.1 0.44 -9 0 2 0.08 0.33 9 0 2 0.08 0.38 9 0 2 -0.13 0.42 -9 0 3 1.01 0.56 -9 0 3 0.35 0.46 9 0 -3 0.43 0.43 9 0 3 0.83 0.45 9 0 3 0.85 0.57 9 0 4 0.14 0.43 -9 0 4 0.28 0.36 9 0 4 -0.43 0.56 -9 0 4 -0.25 0.42 9 0 4 -0.09 0.41 9 0 4 -0.16 0.38 9 0 5 0.52 0.53 -9 0 -5 0.17 0.51 9 0 5 -0.16 0.54 -9 0 5 -0.14 0.44 9 0 5 0.18 0.41 -9 0 -5 -0.09 0.43 -9 0 5 0.76 0.54 -9 0 -6 1.09 0.65 9 0 6 1.02 0.39 9 0 6 1.16 0.67 -9 0 6 0.08 0.35 -9 0 6 -0.45 0.66 -9 0 6 0.83 0.67 9 0 6 0.68 0.55 -9 0 -6 0.63 0.5 9 0 6 1.36 0.72 9 0 7 -0.19 0.77 -9 0 -7 -0.2 0.6 -9 0 -7 0.19 0.52 -9 0 7 0.72 0.71 -9 0 7 0.34 0.39 -9 0 7 -0.16 0.67 -9 0 -8 0.22 0.66 -9 0 -8 0.2 0.48 -9 0 8 0.59 0.7 -9 0 -9 -0.65 1.21 -9 0 -9 -0.23 0.78 -9 0 9 0.84 0.86 -9 0 -9 1.32 0.93 -9 0 -9 -1.02 1.31 -9 0 -10 -0.72 0.91 -9 0 -10 0.28 0.89 -9 0 -11 1.3 1.01 -9 0 -11 -0.61 1.23 -9 0 -12 -0.28 1.03 -9 0 -13 -0.3 1.06 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17.43 -10 0 7 422.74 16.54 -10 0 7 413.55 17.62 -10 0 -7 407.6 16.69 10 0 7 430.91 17.78 -10 0 -8 54.33 4.04 -10 0 -8 45.71 4 10 0 8 68.78 4.41 -10 0 -8 70.1 4.5 -10 0 8 70.28 4.2 -10 0 -8 64.38 3.51 -10 0 8 77.37 4.49 -10 0 -9 162.04 8.32 -10 0 -9 166.68 8.49 -10 0 -9 155.94 8.54 -10 0 -9 163.53 8.38 -10 0 9 154.13 8.12 -10 0 9 156.31 7.94 -10 0 -10 28.81 3.16 -10 0 -10 28.05 2.87 -10 0 -11 17.04 2.61 -10 0 -11 17.82 2.33 -10 0 -12 24.45 3.12 -10 0 -12 28.19 3.06 -10 0 -13 48.72 4.68 -10 0 -13 49.41 4.25 -10 0 -14 24.12 2.98 -10 0 -14 23.22 3.35 -10 0 -15 1.36 1.44 -10 0 -15 1.65 1.38 -10 0 -16 21.07 3.13 -10 0 -16 22.41 3.54 -10 0 16 23.83 3.33 -10 0 -17 38.11 4.62 -10 0 17 45.17 4.73 11 0 0 0.13 0.39 -11 0 0 0.14 0.44 -11 0 0 0.3 0.24 -11 0 -1 -0.29 0.42 -11 0 1 -0.27 0.37 11 0 1 0.13 0.44 11 0 -1 -0.14 0.49 -11 0 1 0.13 0.53 11 0 1 0.93 0.57 11 0 -2 -0.14 0.66 -11 0 2 -0.41 0.58 -11 0 -2 0.15 0.46 11 0 -2 0.13 0.4 -11 0 2 0.27 0.35 11 0 2 -0.1 0.39 11 0 2 -0.16 0.53 -11 0 3 0.58 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30.93 3.56 -9 2 -13 31.31 3.62 -9 -2 -13 28.63 3.47 -9 -2 -13 26.23 3.2 -9 2 -13 39.06 3.51 -9 -2 14 5.25 1.88 -9 2 -14 9.19 1.96 -9 2 -14 6.12 2.05 -9 -2 -14 6.92 2.18 -9 -2 -14 9.81 2.13 -9 -2 15 7.56 2.1 -9 2 -15 7.42 1.87 -9 -2 -15 11.1 2.51 -9 2 -15 10.64 2.44 -9 -2 -15 9.68 2.07 -9 -2 -16 7.96 2.2 -9 -2 -16 10.94 2.6 -9 2 -16 8.27 2.39 -9 -2 16 3.37 1.71 -9 -2 -17 7.9 2.16 -9 -2 17 7.07 2.22 -9 2 -17 11.97 2.6 -9 -2 -17 5.56 2.11 -10 -2 0 3.63 0.65 10 2 0 3.43 0.62 -10 2 0 2.99 0.45 10 2 0 2.98 0.43 10 2 0 4.36 0.81 -10 -2 0 4.33 0.81 10 -2 0 4.02 0.79 10 -2 0 3.79 0.76 -10 2 0 4.05 0.77 10 2 1 62.82 3.57 10 -2 1 58.89 3.51 10 2 1 55.67 2.93 -10 -2 1 53.79 3.08 10 2 -1 54.02 3 -10 2 -1 57.67 3.46 10 2 1 63.67 3.49 -10 -2 1 56.15 3.26 10 -2 1 58.32 3.2 -10 2 1 59.83 3.28 10 -2 -1 67.07 3.4 10 -2 1 57.68 3.16 10 2 2 13.31 1.55 10 -2 2 13.43 1.56 10 2 2 13.46 1.17 10 -2 -2 15.58 1.57 -10 -2 2 16.17 1.45 10 2 -2 15.51 1.4 -10 -2 2 13.63 1.13 10 -2 2 16.29 1.22 -10 2 -2 18.87 1.71 10 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-11 2 6 47.36 1.88 -11 -2 6 47.37 2.97 -11 2 6 49.41 2.97 -11 2 -7 8.31 1.48 -11 -2 -7 5.76 1.34 11 -2 7 4.61 1.24 11 2 7 3.4 1.15 -11 -2 -7 5.76 1.31 -11 2 -7 6.44 1.31 11 2 7 7.1 1 11 -2 7 8.95 1.1 -11 -2 7 6.2 1.36 11 2 7 4.41 1.27 11 -2 7 -0.19 0.36 -11 -2 7 6.69 1.18 -11 2 7 6.7 1.33 -11 2 -7 6.71 1.11 -11 -2 -7 6.08 1.3 -11 -2 7 6.32 1.3 -11 2 7 7.83 1.45 -11 2 -8 4.23 1.37 -11 -2 -8 2.98 1.37 11 2 8 3.44 1.52 11 -2 8 7.97 1.73 -11 -2 8 6.61 1.46 -11 2 -8 6.91 1.37 -11 -2 -8 6.42 1.5 -11 -2 8 5.89 1.14 -11 2 8 8.22 1.56 11 -2 8 8.09 1.42 -11 -2 -8 10.03 1.64 -11 -2 8 6.32 1.35 -11 2 8 7.34 1.47 -11 2 -9 6.16 1.62 -11 -2 -9 7 1.71 -11 -2 9 5.91 1.47 -11 -2 -9 7.71 1.59 -11 2 -9 10.39 1.73 11 -2 9 9.17 1.59 -11 2 9 8.97 1.71 -11 -2 9 6.87 1.32 -11 -2 -9 6.05 1.52 -11 -2 9 7.37 1.55 -11 -2 -10 83.07 5.47 -11 2 10 79.63 5.28 -11 2 -10 92.17 5.58 -11 -2 -10 74.08 5.5 -11 2 -10 76.84 5.59 -11 -2 10 90.67 5.83 -11 -2 -11 1.69 1.36 -11 -2 -11 4.1 1.4 -11 2 -11 4.08 1.46 -11 -2 12 67.08 5.21 -11 2 -12 60.43 4.68 -11 -2 -12 55.77 4.97 -11 2 -12 56.77 5 -11 -2 -12 69.22 5.11 -11 -2 13 10.2 2.23 -11 -2 -13 9.29 1.97 -11 2 -13 14.55 2.27 -11 2 -13 7.63 2.25 -11 -2 -13 6.57 2.02 -11 -2 14 41.51 4.47 -11 2 -14 44.68 4.71 -11 -2 -14 51.59 5.01 -11 2 -14 43.43 4.13 -11 -2 15 0.41 1.37 -11 2 -15 3.04 1.49 -11 2 -15 0.41 2.02 -11 -2 -15 -0.42 2.07 -11 -2 -15 1.07 1.51 -11 -2 -16 47.22 4.58 -11 2 -16 52.58 4.69 -11 2 -16 42.17 4.94 -11 -2 16 44.13 4.79 -11 -2 -17 0.78 1.48 -11 -2 17 -0.45 1.67 -11 -2 -17 -1.86 2.47 -11 2 -17 -0.46 2.18 -12 -2 0 359.53 13.46 12 2 0 331.97 13.28 -12 2 0 324.02 12.73 12 2 0 305.18 12.72 -12 -2 0 347.82 14.05 12 -2 0 353.72 13.72 12 2 0 351.82 14.36 12 -2 0 352.47 13.84 12 2 1 48.03 3.33 12 -2 1 61.08 3.67 -12 -2 1 47.14 2.81 12 2 -1 43.43 2.64 12 2 1 47.92 2.65 -12 2 -1 46.85 3.25 -12 -2 1 40.23 2.92 12 2 1 46.25 3.22 12 -2 1 57.53 3.1 12 -2 -1 44.92 3 12 -2 1 58.63 3.18 -12 2 1 46.93 3 12 2 2 56.14 3.91 12 -2 2 68.1 4.17 12 2 2 60.31 3.27 -12 -2 2 72.39 3.8 -12 -2 2 67.3 3.19 12 -2 2 70.03 3.25 12 2 2 69.86 4.05 -12 -2 2 66.67 3.84 -12 2 -2 72.42 4.15 12 -2 2 73.23 3.79 12 -2 2 73.89 3.82 -12 2 2 60.77 3.76 12 -2 -2 61.17 3.81 -12 -2 3 17.84 1.91 -12 2 3 18.01 1.8 12 2 -3 19.6 1.73 -12 -2 3 19.28 1.78 -12 2 3 22.27 2.05 -12 -2 3 17.33 1.42 12 -2 3 19.24 1.48 -12 2 -3 14.97 1.77 12 -2 -3 21.29 1.97 12 -2 3 16.37 1.61 12 2 3 22.52 2.14 12 -2 3 18.27 1.99 -12 -2 4 55.91 2.69 -12 2 4 66.79 3.92 -12 -2 4 63.37 3.99 -12 -2 4 64.35 3.83 -12 2 4 62.11 3.96 12 2 -4 69.14 3.7 12 -2 4 61.65 2.76 12 2 4 69.68 4.1 12 -2 4 65.34 4.01 12 -2 4 67.56 3.71 -12 2 -4 62.77 3.6 12 2 4 59.62 3.33 -12 2 -4 67.2 3.9 12 -2 4 66.26 4.14 12 2 4 70.17 4.24 -12 2 -5 58.56 3.75 12 -2 5 58.33 3.81 12 2 5 53.54 3.72 -12 -2 -5 56.96 3.91 12 -2 5 54.27 2.75 -12 2 5 52.86 3.67 -12 -2 5 60.65 3.79 12 -2 5 60.3 4.01 12 2 5 49.5 3.77 -12 2 -5 50.83 3.29 12 2 5 59.8 3.16 12 -2 5 55.98 3.43 -12 2 5 56.66 3.7 -12 -2 5 61.1 3.88 -12 -2 -6 269.55 6.77 -12 2 -6 280.68 6.92 12 2 6 266.52 6.87 12 -2 6 286.24 7.14 -12 -2 -6 274.41 7.4 -12 2 -6 277.63 7.03 -12 -2 6 284.89 7.19 12 -2 6 269.56 4.5 -12 2 6 273.56 6.99 -12 -2 6 280.24 6.17 12 2 6 253.63 7.18 12 -2 6 294.24 7.64 -12 -2 -6 268.52 6.82 12 2 6 249.07 4.74 -12 2 -6 263.9 5.83 12 -2 6 278.41 6.09 -12 2 6 272.16 4.39 -12 -2 6 295.34 7.18 -12 2 6 271.6 6.82 -12 -2 -7 90 5.33 -12 2 -7 93.61 5.38 12 2 7 92.79 5.41 12 -2 7 93.88 5.43 -12 2 -7 91.25 5.38 -12 -2 -7 84.2 5.47 -12 -2 7 87.83 5.4 12 -2 7 88.24 4.46 -12 2 7 86.15 5.28 -12 -2 7 85.93 4.89 12 2 7 83.48 5.47 12 -2 7 94.63 5.67 12 -2 7 90.75 5.28 12 -2 7 87.53 4.83 -12 -2 -7 91.2 5.35 -12 2 7 81.84 5.16 -12 -2 7 89.05 5.3 -12 2 -8 84.5 5.18 -12 -2 -8 78.13 5.26 -12 -2 8 77.04 5.15 -12 2 8 79.57 5.05 -12 -2 8 66.29 4.42 12 2 8 78.91 5.11 12 -2 8 81.34 5.18 -12 -2 -8 81.51 5.13 12 -2 8 91.99 5.24 -12 2 8 77.69 4.97 -12 -2 8 80.1 5.04 -12 2 -8 81.61 5.16 -12 -2 -8 76.15 5.03 -12 2 9 9.49 1.74 -12 -2 9 9.71 1.52 12 -2 9 12.45 1.84 -12 -2 9 11.55 1.99 -12 -2 -9 10.94 1.79 -12 -2 -9 12.59 2 -12 2 -9 10.06 1.72 -12 -2 -10 46.87 3.93 -12 2 10 42.82 3.73 -12 -2 10 52.02 4.27 -12 2 -10 50.09 3.94 -12 -2 -10 47.35 4.09 -12 -2 11 18.74 2.63 -12 -2 -11 16.93 2.45 -12 -2 -11 16.71 2.63 -12 2 -11 18.85 2.71 -12 2 11 15.55 2.23 -12 -2 12 52.4 4.72 -12 2 -12 61.17 4.64 -12 -2 -12 46.57 4.53 -12 2 -12 56.93 4.82 -12 -2 -12 54.28 4.5 -12 2 12 48.16 4.15 -12 -2 13 8.16 2.12 -12 -2 -13 4.9 1.72 -12 2 -13 9.01 1.87 -12 -2 -13 4.43 1.78 -12 2 -13 5.14 1.87 -12 2 13 4.63 1.5 -12 -2 14 51.28 5.09 -12 2 -14 54.51 5.16 -12 -2 -14 52.04 5.11 -12 -2 -14 59.38 4.95 -12 2 -14 58.85 4.91 -12 -2 15 10.44 2.63 -12 2 -15 7.59 2.02 -12 -2 -15 15.51 2.91 -12 2 -15 17.93 3.14 -12 -2 -15 18.89 2.9 -12 -2 16 11.83 2.78 -12 2 -16 19.8 3.01 -12 -2 -16 20.87 3.43 -12 2 -16 12.36 2.86 -12 -2 -16 17.51 2.94 -12 -2 -17 2.37 1.55 -12 -2 17 1.37 1.4 -12 -2 -17 1.87 2.2 -12 2 -17 2.79 1.92 -13 -2 0 76.19 3.63 -13 2 0 66.27 2.99 13 2 0 74.37 3.5 -13 2 0 65.7 2.89 13 2 0 60.26 2.87 -13 -2 0 77.75 4.22 13 -2 0 83.07 4.01 13 -2 0 79.29 4.08 13 2 0 74.94 4.34 13 -2 1 123.37 6.41 13 2 1 121.2 6.38 -13 -2 1 122.39 5.68 13 2 -1 118.95 5.49 13 2 1 108.47 5.29 -13 2 -1 126.07 6.31 13 2 1 121.64 6.19 -13 -2 1 121.5 6.08 13 -2 1 128.4 5.9 13 -2 1 125.94 5.96 13 -2 -1 114.22 5.95 -13 2 1 116.57 5.9 13 -2 2 10.33 1.54 13 2 2 14.34 1.72 13 2 2 11.7 1.11 -13 -2 2 12.92 1.41 -13 -2 2 13.05 1.05 13 -2 2 11.7 1.03 -13 2 -2 14.62 1.71 13 2 2 13.99 1.69 -13 -2 2 12.93 1.53 13 -2 2 11.98 1.41 13 -2 -2 13.58 1.61 -13 2 2 13.8 1.6 13 -2 2 13.8 1.48 13 2 3 96.66 5.22 13 -2 3 76.71 4.87 13 2 3 83.4 3.98 13 2 -3 78.21 4.36 -13 -2 3 83.97 4.5 13 -2 -3 86.1 4.74 13 -2 3 86.77 4.05 -13 -2 3 75.59 3.91 -13 2 -3 78.28 4.75 13 -2 3 79.53 4.39 13 -2 -3 75.19 4.64 -13 -2 3 86.8 4.84 -13 2 3 78.64 4.57 13 -2 4 26.02 2.44 13 2 4 28.98 2.52 -13 2 4 32.12 2.51 -13 -2 4 24.15 2.37 -13 2 4 30.04 2.57 -13 -2 4 26.53 2.27 13 2 -4 27.44 2.18 -13 -2 4 24.03 1.86 13 -2 4 27.68 1.96 -13 -2 4 23.37 1.37 13 2 4 29.3 2.04 13 -2 4 24.54 2.09 -13 2 -4 21.04 2.17 13 2 4 28.32 2.68 13 -2 4 27.23 2.58 -13 2 -5 113.28 4.31 13 2 5 120.09 4.65 13 -2 5 109.77 4.45 -13 -2 -5 107.91 4.59 -13 2 5 110.18 4.44 -13 -2 5 101.09 4.11 13 -2 5 99.19 2.28 13 -2 5 122.12 4.98 13 2 5 115.94 4.83 13 2 -5 102.2 3.64 13 2 5 114.89 3.39 13 -2 5 106.96 3.81 -13 -2 5 110.4 4.5 -13 2 5 110.94 4.31 13 2 6 9.41 1.69 13 -2 6 8.26 1.62 -13 -2 -6 10.65 1.61 -13 2 -6 7.17 1.44 13 2 6 10.55 1.67 13 -2 6 8.55 1.56 -13 2 -6 7.71 1.45 -13 -2 -6 10.04 1.62 -13 -2 6 9.34 1.58 -13 2 6 9.78 1.55 13 -2 6 10.4 1.63 -13 -2 -6 10.68 1.61 13 -2 6 7.91 1.29 13 2 -6 7.18 1.46 -13 2 6 9.02 1.49 -13 -2 6 9 1.65 -13 -2 -7 118.71 6.44 -13 2 -7 113.65 6.37 13 -2 7 113.56 6.4 13 2 7 117.21 6.47 -13 2 -7 111.35 6.35 -13 -2 -7 118 6.71 -13 -2 7 118.44 6.55 -13 2 7 113.19 6.4 -13 -2 7 107.52 5.89 13 -2 7 107.76 6.56 13 2 7 104.39 6.51 13 -2 7 119.81 6.43 -13 -2 -7 119.01 6.42 13 -2 7 109.57 5.84 -13 -2 7 110.6 6.32 -13 2 7 110.84 6.3 -13 2 -8 3.13 1.21 -13 -2 -8 1.57 1.12 -13 2 -8 2.59 1.03 -13 -2 -8 3.97 1.23 -13 -2 8 3.43 0.99 -13 -2 8 5.39 1.41 13 -2 8 2.29 1.25 13 2 8 1.82 1.08 13 -2 8 3.74 1.22 -13 2 8 4.65 1.26 -13 -2 -8 4.24 1.31 -13 -2 8 3.41 1.25 -13 -2 9 70.9 5 -13 2 9 63.23 4.56 -13 -2 9 58.3 4.13 -13 2 -9 73.79 4.86 -13 -2 -9 66.3 4.86 -13 -2 -9 68.16 4.75 13 -2 9 72.53 4.75 -13 -2 10 8.55 1.83 -13 -2 -10 8.78 1.9 -13 2 -10 12.43 1.98 -13 -2 -10 11.37 2.01 -13 2 10 11.33 1.88 -13 -2 11 2.97 1.4 -13 -2 -11 2.64 1.3 -13 2 -11 1.4 1.07 -13 2 11 1.89 1.15 -13 2 12 1.98 1.17 -13 -2 12 0.35 1.13 -13 -2 -12 0.31 1.22 -13 2 -12 0.3 1.14 -13 2 -13 12.28 2.55 -13 -2 13 12.09 2.46 -13 2 -13 15.58 2.45 -13 -2 -13 11.96 2.37 -13 -2 -14 -0.4 1.43 -13 2 -14 1.98 1.55 -13 -2 -14 1.4 1.48 -13 2 -14 1.68 1.42 -13 -2 14 -0.4 1.48 -13 -2 -15 0.37 1.56 -13 -2 -15 0.85 1.56 -13 2 -15 3.36 1.82 -13 2 -15 1.41 1.49 -13 -2 15 -0.42 1.23 -13 -2 -16 5.79 2.06 -13 2 -16 8 2.48 -13 -2 -16 8.04 2.31 -13 -2 16 4.43 2.1 -13 2 -16 12.12 2.53 -13 -2 -17 3.61 1.97 14 2 0 39.53 2.36 -14 2 0 35.93 1.91 -14 -2 0 45.73 2.57 -14 -2 0 46.68 3.15 -14 2 0 44.9 3.23 14 -2 0 38.92 2.72 14 -2 0 39.21 2.85 14 -2 1 218.41 10.49 14 2 1 208.54 10.38 14 2 -1 220.37 9.41 14 2 1 212.17 9.24 -14 -2 1 221.57 9.6 -14 -2 1 235.67 10.22 -14 2 -1 235.26 10.44 14 2 1 235.22 10.29 14 -2 1 230.69 9.9 14 -2 -1 226.26 10.1 -14 2 1 232.49 10.05 14 -2 1 220.77 9.96 14 -2 -2 109.01 5.76 14 -2 2 114.13 5.62 -14 2 2 111.36 5.72 -14 -2 2 106.44 5.41 14 2 2 101.74 4.9 -14 2 -2 107.98 5.99 14 2 2 121.34 6.03 -14 -2 2 106.58 5.67 14 -2 2 109.04 5.48 14 2 2 105.31 6 14 -2 2 103.06 5.98 14 -2 3 58.26 4.02 14 2 3 51.94 3.88 14 2 3 52.63 2.93 14 2 -3 59.75 3.53 14 -2 -3 58.78 3.74 -14 -2 3 53.79 3.46 14 -2 3 59.48 3.04 -14 -2 3 52.21 2.91 -14 2 -3 53.1 3.75 14 -2 3 57.15 3.48 -14 2 3 59 3.73 -14 -2 3 59.63 3.88 -14 2 4 12.54 1.62 -14 -2 4 9.12 1.54 -14 -2 4 11.93 1.49 -14 -2 4 12.65 1.21 14 -2 4 14.86 1.31 14 -2 -4 11.49 1.57 14 2 -4 9.71 1.27 14 2 4 14.13 1.37 14 -2 4 12.59 1.51 14 -2 4 12.03 1.81 14 2 4 14.61 1.94 -14 -2 -5 175.67 8.75 -14 2 -5 175.43 8.76 14 2 5 200.18 9.16 14 -2 5 177.64 8.95 -14 -2 -5 188.84 9.23 -14 -2 5 186.9 8.86 -14 2 5 183.97 9.02 14 2 5 173.36 9.15 14 -2 5 188.29 9.32 14 2 -5 168.03 8.36 14 -2 5 191.95 9.1 14 2 5 188.09 8.21 14 -2 5 180.85 8.52 -14 -2 5 198.16 9.12 -14 2 5 182.42 8.87 -14 -2 -6 62.04 4.26 -14 2 -6 62.27 4.25 14 2 6 68.32 4.51 14 -2 6 69.67 4.56 -14 -2 -6 75.14 4.81 -14 -2 6 62.93 4.34 -14 2 6 61.93 4.32 14 -2 6 65.14 4.64 14 2 6 57.7 4.51 14 2 6 82.46 4.81 14 -2 6 72.22 4.55 14 -2 6 64.45 4.02 14 2 -6 62.53 4.53 -14 -2 6 67.02 4.46 -14 2 6 66.56 4.39 -14 -2 -7 252.15 11.73 -14 2 -7 246.01 11.67 14 2 7 239.58 11.67 14 -2 7 254.62 11.83 -14 -2 -7 254.12 12.12 -14 2 -7 240.66 11.77 -14 -2 7 258.45 11.91 -14 2 7 241.18 11.73 14 2 7 246.37 12.12 14 -2 7 273.14 12.34 14 -2 7 253.68 11.75 -14 -2 -7 259.85 11.82 14 -2 7 248.08 11.18 -14 -2 7 247.65 11.73 -14 2 7 249.1 11.69 -14 -2 8 31.23 2.8 -14 2 8 27.92 2.93 -14 -2 8 38.77 3.42 14 2 8 34.63 3.43 14 -2 8 39.56 3.59 14 -2 8 37.99 3.33 -14 -2 -8 31.48 3.07 -14 2 -8 41.46 3.43 -14 -2 -8 38.5 3.47 -14 2 9 14.93 2.17 -14 -2 9 15.76 2.32 -14 -2 -9 14.67 2.19 -14 -2 -9 16.18 2.4 -14 2 -9 19.49 2.39 -14 -2 -10 25.03 2.85 -14 2 10 18.83 2.49 -14 -2 10 23.67 2.91 -14 2 -10 24.81 2.86 -14 -2 -10 20.57 2.74 -14 -2 -11 98.4 6.43 -14 2 11 88.77 6.11 -14 -2 11 106.42 6.91 -14 2 -11 102.6 6.46 -14 -2 -11 107.34 6.82 -14 -2 -12 10.21 2.05 -14 2 -12 12.33 2.29 -14 2 12 7.22 1.7 -14 -2 12 11.15 2.21 -14 2 -13 0.98 1.2 -14 -2 -13 2.03 1.43 -14 -2 13 3.83 1.77 -14 2 -14 17.5 2.68 -14 -2 -14 10 2.43 -14 -2 14 14.21 2.75 -14 -2 -15 43.17 4.48 -14 2 -15 48.57 4.57 -14 -2 15 48.77 5.08 -14 2 -16 6.73 2.08 -14 -2 -16 4.7 1.86 -14 -2 16 7.16 2.2 -14 2 -17 1.55 1.56 -14 -2 -17 -0.41 1.6 -15 -2 0 94.04 4.36 -15 2 0 81.62 3.68 15 2 0 80.89 4.11 -15 2 0 93.07 5.17 -15 -2 0 88.94 5.03 15 -2 0 88.72 4.7 15 -2 0 88.8 4.86 15 -2 -1 2.38 0.96 15 -2 1 2.86 0.91 -15 2 1 2.05 0.91 -15 2 1 2.19 0.52 15 2 1 1.87 0.6 -15 -2 1 2.81 0.74 15 2 1 1.68 0.35 -15 -2 1 1.78 0.79 -15 2 -1 2.41 0.93 15 2 1 1.25 1.02 15 -2 1 2.9 0.89 15 2 1 1.74 1.1 15 -2 1 0.22 1.02 15 -2 2 15.21 1.7 -15 2 2 9.22 1.44 15 2 2 10.49 1.09 -15 -2 2 8.41 1.25 -15 2 -2 7.55 1.47 -15 -2 2 12.25 1.57 15 2 2 12.05 1.67 15 -2 2 12.66 1.51 15 -2 2 8.97 1.57 15 2 2 8.39 1.52 15 -2 3 40.12 2.79 -15 2 3 33.63 2.74 -15 -2 3 29.67 2.7 -15 -2 3 34.44 2.56 15 -2 -3 29.93 2.66 15 2 -3 34.2 2.6 -15 -2 3 32.21 2.02 15 -2 3 32.05 2.08 -15 -2 3 26.9 2.5 -15 2 -3 31.96 2.85 15 -2 3 39.79 2.77 15 -2 3 29.75 2.91 15 2 3 37.23 3.16 -15 2 4 52.38 3.57 -15 -2 4 47.34 3.51 15 2 -4 43.86 3.11 -15 -2 4 49.34 3.33 -15 -2 4 43.31 2.72 15 -2 4 49.28 2.89 15 -2 4 47.1 3.54 15 -2 -4 43.29 3.31 15 -2 4 45.06 3.16 15 2 4 47.97 2.98 15 2 4 45.54 3.67 15 -2 4 44.64 3.68 15 -2 5 0.21 1.1 15 2 5 1.06 1 -15 -2 5 2.77 1.09 -15 2 5 1.2 0.94 15 2 -5 -0.23 0.31 -15 2 5 1.75 0.95 -15 -2 5 0.97 0.7 15 -2 5 0.65 0.72 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19.16 1.91 -11 -3 -8 20.93 2.5 11 3 8 23.36 1.93 -11 3 -8 19.95 2.29 -11 3 8 20.63 2.41 11 -3 8 27.15 2.46 -11 -3 -8 17.74 2.29 -11 -3 8 20.59 2.31 -11 3 8 22.38 2.4 -11 3 -9 16.31 2.2 -11 -3 9 13.98 2.12 -11 3 -9 9.76 1.7 -11 -3 -9 14.54 2.18 11 -3 9 12.05 1.75 -11 3 9 19.66 2.38 -11 -3 -9 12.6 1.96 -11 -3 9 8.3 1.59 -11 3 -10 -0.24 1.03 -11 -3 10 0.3 1.09 -11 -3 -10 1.87 1.21 -11 3 -10 0.29 0.93 -11 -3 -10 1.17 0.89 11 -3 10 -1.09 1.32 -11 -3 11 12.84 2.29 -11 3 -11 14.71 2.37 -11 -3 -11 9.78 2.02 -11 -3 -11 10.05 2.01 -11 -3 12 2.83 1.53 -11 -3 -12 2.15 1.33 -11 3 -12 3.37 1.43 -11 -3 -12 3.74 1.41 -11 -3 13 5.66 1.79 -11 3 -13 8.42 1.91 -11 3 -13 4.34 1.72 -11 -3 -13 8.03 2.06 -11 -3 -13 2.94 1.69 -11 -3 14 7.19 2.2 -11 3 -14 7 1.97 -11 -3 -14 8.2 2.15 -11 3 -14 5.42 1.81 -11 -3 -14 11.4 2.34 -11 -3 15 4.21 1.95 -11 3 -15 2.68 1.61 -11 3 -15 2.89 1.57 -11 -3 -15 5.82 2 -11 -3 -15 2.91 1.65 -11 -3 -16 3.79 1.87 -11 3 -16 10.93 2.53 -11 -3 -16 6.61 2.21 -11 -3 16 7.5 2.24 -11 -3 -17 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28.71 2.49 -13 3 5 34.09 2.53 -13 -3 -6 20.67 2.23 -13 3 -6 18.93 2.15 13 -3 6 26.3 2.47 13 3 6 19.3 2.23 -13 -3 -6 22.04 2.44 -13 3 6 23.58 2.44 -13 -3 6 21.92 2.36 13 -3 6 23.53 2.18 13 3 6 19.78 2.42 -13 -3 6 20.82 2.05 13 -3 6 26.94 2.69 13 -3 6 22.76 2.34 -13 -3 -6 20.78 2.28 13 -3 6 21.53 2.18 -13 3 6 21.15 2.23 -13 -3 6 19.2 2.35 13 3 -6 17.44 2.29 -13 3 -7 45.95 3.57 -13 -3 -7 45.25 3.52 13 3 7 45.05 3.56 13 -3 7 42.62 3.5 -13 3 -7 48.58 3.6 -13 -3 -7 51.81 3.93 -13 -3 7 52.42 3.88 -13 3 7 46.07 3.64 13 -3 7 42.22 3.69 13 3 7 46.1 3.79 -13 -3 -7 46.44 3.6 13 -3 7 47.81 3.61 13 -3 7 38.62 3.16 -13 -3 7 46.63 3.63 -13 3 7 49.37 3.62 -13 3 -8 20.06 2.39 -13 -3 -8 19.08 2.36 13 3 8 16.9 2.29 -13 3 8 25.03 2.61 -13 -3 8 21.84 2.04 -13 -3 8 20.01 2.45 -13 -3 -8 19.29 2.45 -13 3 -8 27.6 2.64 13 -3 8 22.62 2.42 -13 -3 -8 18.72 2.35 -13 -3 8 20.68 2.42 13 -3 9 9.22 1.74 -13 3 9 8.5 1.69 -13 -3 9 6.7 1.61 -13 3 -9 6.41 1.32 -13 -3 -9 5.96 1.55 -13 -3 -9 7.81 1.67 -13 3 -9 6.51 1.52 -13 3 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1.85 14 3 2 13.97 1.37 -14 -3 2 14.96 1.62 14 3 -2 15.02 1.52 14 3 2 14.98 1.87 -14 3 -2 14.8 1.82 -14 -3 2 12.88 1.59 14 -3 2 14.58 1.66 14 -3 2 15.74 1.6 -14 3 2 14.8 1.66 14 -3 -2 11.45 1.56 14 -3 3 9.95 1.65 14 3 3 7.9 1.52 14 3 3 7.13 1.04 14 3 -3 12.5 1.44 -14 -3 3 9.95 1.42 -14 -3 3 10.51 1.13 -14 -3 3 7.2 0.84 14 -3 3 6.89 1.02 -14 -3 3 9.26 1.31 -14 3 -3 9.14 1.47 14 3 3 7.08 1.37 14 -3 3 6.96 1.26 14 -3 3 9.94 1.25 -14 3 3 7.26 1.26 14 -3 4 11.52 1.82 -14 3 4 11.88 1.63 -14 -3 4 11.28 1.76 -14 3 4 12.97 1.81 -14 -3 4 13.82 1.71 14 3 -4 13.9 1.54 -14 -3 4 10.85 1.3 14 -3 4 13.97 1.46 -14 3 -4 12.69 1.79 14 -3 4 14.89 1.74 -14 -3 -4 11.46 1.6 14 -3 4 13.17 1.89 14 3 4 14.6 1.97 -14 -3 -5 17.27 1.94 14 -3 5 17.12 2.17 14 3 5 13.05 1.93 -14 3 -5 16.74 1.91 14 3 5 16.37 1.98 14 -3 5 14.65 1.9 -14 -3 -5 14.8 2.11 -14 3 5 18.85 2.17 -14 -3 5 16.92 2 14 -3 5 16.8 1.76 -14 -3 5 15.65 1.66 14 3 -5 15.85 1.69 14 -3 5 16.54 2.01 14 3 5 16.37 1.57 -14 -3 -5 19.09 2.07 14 -3 5 15.87 1.89 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14.38 2.83 -21 -4 -13 19.81 3.08 -21 -4 13 15.55 2.99 -21 -4 -14 5.27 1.95 -21 -4 14 1.4 1.83 -22 4 0 4.51 1.76 22 4 0 0.33 1.05 22 -4 0 5.18 1.4 22 -4 0 5.5 1.62 -22 4 -1 0.3 1.01 -22 4 1 1.21 1.04 22 -4 1 3.69 1.19 22 4 1 2.63 1.21 22 4 -1 0.97 1.16 22 -4 -1 2.37 1.14 22 4 1 0.33 1.11 22 -4 1 2.08 1.36 -22 4 -2 6.67 1.68 -22 -4 2 10.17 1.84 22 -4 -2 3.49 1.53 22 4 2 9.26 1.97 22 4 -2 5.8 1.85 -22 -4 -2 7.56 1.4 22 -4 2 10.26 2.23 22 4 2 6.48 1.8 -22 4 -3 5.51 1.57 -22 -4 3 6.99 1.6 22 4 -3 9.04 2.06 -22 -4 -3 8.47 1.56 22 -4 3 7.59 2.02 22 4 3 5.61 1.82 -22 -4 4 15.34 2.13 -22 4 -4 14.58 2.31 -22 -4 -4 15.86 2.09 22 -4 4 14.64 2.74 22 4 4 18.55 2.93 22 4 -4 14.72 2.45 -22 -4 -5 18.89 2.36 22 -4 5 18.77 2.98 22 4 5 14.05 2.62 22 4 -5 18.65 2.84 22 -4 6 12 2.5 22 4 6 15.84 2.68 -22 -4 -6 13.35 2.08 22 4 -6 11.56 2.25 -22 -4 -6 13.64 2.4 22 4 7 13.62 2.59 22 -4 7 15.36 2.79 -22 -4 -7 17.44 2.43 22 4 -7 20.34 2.89 -22 -4 -7 17.26 2.69 22 4 8 6.61 2.29 22 -4 8 7.87 2.4 -22 -4 -8 10.95 2.07 22 4 -8 11.6 2.36 -22 4 -8 6.78 1.69 -22 -4 -8 8.01 1.98 -22 4 -9 8.28 1.94 -22 -4 -9 7.55 2 -22 -4 -9 12.89 2.25 22 -4 9 11.71 2.6 22 4 9 7.6 2.21 -22 -4 10 14.33 2.67 -22 4 10 7.51 2.06 -22 -4 -10 11.9 2.22 -22 -4 -10 8.17 2.12 22 4 10 7.05 2.23 -22 -4 -11 0.4 1.33 -22 4 11 1.46 1.43 -22 -4 11 -1.21 1.62 -22 -4 -11 -0.36 1.28 -22 -4 -12 0.83 1.33 -22 -4 12 1.7 1.71 -22 4 12 2.61 1.58 -22 -4 -12 2.26 1.39 -22 -4 -13 -1.29 1.48 -22 -4 -13 0.79 1.41 -22 -4 13 1.35 1.55 -22 -4 14 0.47 1.74 -23 4 0 125.5 7.54 23 4 0 131.26 7.79 23 -4 0 114.74 6.72 23 -4 0 112.07 7.57 23 4 0 111.95 7.55 -23 4 -1 5.06 1.67 -23 4 1 0.94 1.16 23 4 1 -1.37 1.3 23 4 -1 0.34 1.03 23 -4 -1 0.99 1.14 23 -4 1 -1.09 1.96 23 4 1 -1.76 2.2 -23 4 -2 18.67 2.73 -23 -4 2 17.61 2.41 23 -4 -2 14.08 2.25 23 4 2 16.54 2.72 23 4 -2 21.46 2.94 23 4 2 15.83 2.79 23 -4 2 15.67 2.8 -23 4 -3 3.83 1.36 -23 -4 3 4.46 1.44 23 4 -3 4.36 1.62 -23 -4 -3 7.45 1.5 23 -4 3 5.33 1.99 23 4 3 2.58 1.53 -23 4 -4 87.46 6.04 -23 -4 4 74.02 5.31 -23 -4 -4 95.54 5.52 23 -4 4 72.01 6.17 23 4 4 77.92 6.22 23 4 -4 80.63 6.01 -23 -4 -5 5.12 1.42 23 -4 5 3.1 1.75 23 4 5 3.4 1.78 23 4 -5 1.73 1.47 23 -4 6 10.23 2.47 23 4 6 13.5 2.77 -23 -4 -6 21.12 2.58 23 4 -6 14.1 2.45 -23 -4 -6 14.79 2.47 23 -4 7 10.44 2.6 23 4 7 9.87 2.61 -23 -4 -7 13.06 2.36 -23 -4 -7 14.95 2.32 23 4 -7 8.71 2.14 -23 -4 -8 90.51 5.91 23 4 8 67.22 5.94 23 -4 8 73.4 6.14 23 4 -8 78.99 6.06 -23 4 -8 70.97 5.62 -23 -4 -8 75.92 6.02 -23 -4 -9 1.16 1.24 -23 4 -9 1.37 1.3 -23 -4 -9 5.26 1.63 23 -4 9 -0.84 1.64 23 4 9 1.66 1.62 -23 -4 -10 14.2 2.5 -23 -4 -10 6.77 2.08 23 -4 10 10.38 2.52 23 4 10 8.56 2.36 -23 -4 -11 9.39 2.34 -23 -4 -11 6.92 1.95 -23 -4 -12 30.85 3.92 -23 4 12 28.14 3.57 -23 -4 -12 24.08 3.46 -23 -4 -13 1.2 1.61 -23 -4 -13 0.87 1.5 -24 4 0 9.87 2.03 24 4 0 6.71 1.86 24 4 0 2.55 1.79 24 -4 0 6.79 2.22 -24 4 -1 41.1 4.01 -24 4 1 42.23 4 24 -4 -1 28.5 3.27 24 4 -1 43.32 4.19 24 4 1 44.03 4.29 24 -4 1 45.18 4.67 24 4 1 44.98 4.49 -24 4 -2 35.22 3.64 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40.14 4.31 -25 -4 -10 8.77 2.37 -25 -4 -10 11.86 2.3 25 -4 10 7.87 2.32 25 4 10 7.31 2.41 -25 -4 -11 36.15 4.02 -25 -4 -11 28.5 3.87 -25 -4 -12 1.57 1.59 -25 -4 -12 2.62 1.66 -26 4 0 6.03 1.8 26 4 0 3.78 1.68 26 -4 0 1.65 1.43 26 4 0 4.77 1.95 -26 4 -1 0.71 1.13 -26 4 1 3.9 1.46 26 4 1 1.91 1.45 26 4 -1 0.75 1.15 26 -4 1 1.67 1.39 26 4 1 0.4 1.58 -26 4 -2 1.78 1.39 -26 4 2 0.71 1.31 -26 -4 2 -0.61 1.08 26 -4 -2 0.59 1.27 26 4 -2 0.37 1.24 26 4 2 0.77 1.46 26 -4 2 3.87 1.73 26 4 2 2.07 1.67 -26 4 3 0.72 1.15 -26 -4 3 0.3 1.24 -26 4 -3 2.15 1.37 26 -4 3 0.44 1.51 26 4 3 3.38 1.91 26 4 3 2.33 1.68 26 4 -3 1.88 1.7 26 -4 4 0.89 2.13 26 4 4 4.29 2.28 26 4 4 8.2 2.14 26 4 -4 6.43 2.13 -26 -4 -5 7.49 1.8 26 4 5 2.16 1.79 26 -4 5 1.33 1.98 26 4 -5 6.91 2.07 26 4 6 -2.63 2.49 26 -4 6 -1.8 2.08 -26 -4 -6 1.77 1.28 26 4 -6 2.73 1.91 -26 -4 -6 0.39 1.24 26 4 7 -1.34 2.25 -26 -4 -7 1.88 1.36 26 4 -7 2.8 1.77 -26 -4 -7 1.19 1.32 26 -4 8 2.78 2.06 26 4 8 5.9 2.41 -26 -4 -8 5.97 1.79 26 4 -8 5.33 2.12 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1.61 13 -6 0 132.27 6.13 13 6 0 138.91 6.72 13 6 0 132.82 6.3 -13 6 0 117.18 6.09 13 6 0 133.98 6.51 -13 -6 0 135.09 6.04 13 -6 0 118.58 6.42 -13 6 0 126.13 6.04 -13 -6 0 136.5 6.28 13 -6 1 165.23 5.33 13 6 1 176.41 5.42 13 -6 1 181.57 4.1 13 6 1 175.55 5.18 -13 -6 1 181.24 5.55 13 6 -1 195.32 5.54 13 6 -1 175.86 4.59 -13 6 -1 173.27 4.44 13 6 -1 178.72 4.78 -13 -6 -1 186.97 4.6 13 6 1 182.32 5.27 -13 -6 1 161.85 3.6 13 -6 -1 183.48 5.14 13 -6 1 179.36 5.23 -13 6 -1 178.64 4.02 -13 6 1 182.76 4.54 -13 -6 -1 178.56 4.75 -13 -6 1 172.97 4.31 13 -6 2 18.94 2.03 13 6 2 17.35 1.98 13 -6 2 17.33 1.44 13 6 2 16.76 1.87 -13 -6 2 19.68 2.11 -13 6 2 13.9 1.88 -13 6 -2 18.56 1.68 -13 -6 -2 18.65 1.82 13 6 -2 15.94 1.63 -13 -6 -2 16.93 1.73 -13 6 -2 20.75 2.09 13 6 2 15.15 1.88 13 -6 -2 14.82 1.76 13 -6 2 14.72 1.82 13 6 -2 18.28 2.16 -13 -6 2 19.76 1.63 -13 6 2 15.99 1.66 13 -6 3 294.03 12.72 13 6 3 256.1 12.46 13 6 3 262.7 12.22 -13 -6 -3 297.8 12.89 -13 -6 3 296.41 12.89 -13 6 3 259.93 12.69 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3.31 1.18 -13 6 -6 0.19 1.17 -13 -6 -6 1.7 1.08 -13 -6 6 3.44 1.05 -13 -6 -6 4.15 1.2 13 -6 6 2.23 0.94 13 6 6 5.1 1.24 -13 -6 -6 4.16 1.28 -13 -6 6 5.64 1.45 -13 -6 -6 4.27 1.1 -13 -6 6 3.21 1.24 13 -6 6 3.11 1.24 -13 -6 -6 2.86 1.1 -13 6 6 0.77 0.93 -13 6 -6 4.83 1.17 13 -6 -6 5.12 1.22 13 6 -6 6.43 1.53 -13 6 6 3.78 1.09 -13 -6 6 2.38 1.46 -13 6 -7 52.31 4.07 -13 -6 -7 59.88 4.19 13 -6 7 57.56 4.23 13 6 7 58.95 4.23 -13 -6 7 57.32 4.01 -13 -6 -7 55.01 3.99 -13 -6 -7 58.1 4.49 -13 6 -7 62.63 4.09 -13 -6 7 66.56 4.78 -13 6 7 55.3 4.4 -13 -6 7 58.92 4.27 13 -6 7 66.22 4.49 13 6 7 64.78 4.58 -13 -6 -7 62.39 4.39 -13 6 -7 66.93 4.26 13 -6 -7 50.52 3.58 13 6 -7 61.98 4.43 -13 6 7 57.77 4.13 -13 -6 7 56.25 4.22 -13 -6 -8 18.48 2.17 -13 -6 8 17.13 2.1 -13 -6 -8 22.08 2.72 -13 -6 8 19.93 2.65 -13 -6 8 22.77 2.62 13 -6 8 21.23 2.57 -13 6 8 18.11 2.48 -13 -6 -8 17.15 2.4 -13 6 -8 20.58 2.32 13 6 -8 16.37 2.41 -13 -6 9 155.23 9.04 13 -6 9 164.82 8.82 -13 -6 9 144.93 8.49 -13 -6 -9 160.02 8.68 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30.82 2.87 -11 -8 4 34.55 3.23 -11 8 4 32.01 2.96 11 8 -4 32.6 2.97 -11 8 -4 35.22 2.75 11 -8 4 33.1 2.7 11 8 4 29.53 2.66 -11 -8 -4 35.1 2.82 -11 8 -4 32.73 2.7 11 -8 -4 32.97 2.61 -11 8 -4 40.31 3.07 11 8 4 37.17 2.76 11 8 -4 36.79 3.07 -11 -8 -4 32.11 2.69 11 -8 5 4.05 1.12 11 8 5 2.35 0.94 -11 8 -5 1.14 0.82 11 -8 5 3.06 0.99 11 8 5 2.76 0.91 -11 -8 5 4.19 1.29 -11 -8 -5 0.67 0.96 -11 -8 -5 3.53 1.13 11 -8 -5 4.14 1.16 -11 -8 5 2.76 1.2 11 8 -5 4.79 1.26 -11 -8 5 3.27 1.17 11 -8 5 4.86 1.46 -11 -8 -5 4.1 1.1 -11 -8 -5 4.61 1.23 -11 8 5 3.74 1.27 -11 8 -5 4.47 1.06 11 -8 -5 4.26 1.03 11 8 5 3.51 1.07 -11 8 -5 2.99 1.11 11 8 -5 3.51 1.19 -11 8 -6 79.01 3.93 -11 -8 6 79.07 4.19 -11 -8 -6 75.59 4.18 11 -8 6 80.03 4 11 8 6 87.81 4.16 -11 -8 -6 82.13 4.61 -11 -8 6 86.02 5.02 11 8 -6 80 4.32 -11 -8 6 82.8 4.58 11 -8 6 77.22 4.55 -11 8 6 77.16 4.55 -11 -8 -6 81.88 4.37 -11 8 -6 85.65 4.4 11 8 6 83.21 4.16 11 8 -6 76.53 4.17 -11 -8 7 4.99 1.28 -11 -8 -7 6.48 1.37 -11 -8 -7 4.39 1.42 -11 -8 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2.64 5 -10 9 20.98 2.96 5 10 9 17.43 2.32 -5 10 -9 18.09 2.55 5 -10 9 18.04 2.5 -5 -10 9 15.87 2.59 -5 10 10 0.8 1.1 -5 -10 10 3.05 1.57 5 -10 10 2.65 1.61 5 10 10 1.27 1.13 5 -10 10 1.88 1.26 -5 -10 10 2.23 1.29 -5 10 -10 2.9 1.44 -5 -10 11 -0.81 2.04 5 -10 11 -0.8 2.02 5 -10 11 0.33 1.18 -5 -10 11 1.57 1.45 -5 10 -11 -0.3 1.48 -5 -10 12 3.84 1.93 5 -10 12 1.26 1.65 -5 -10 12 1.66 1.33 -5 10 -12 4.7 1.88 -5 -10 13 4.51 2.04 5 -10 13 2.22 1.79 -5 -10 13 0.44 1.39 -5 10 -13 0.32 1.46 -5 -10 14 3.33 1.81 5 -10 14 0.93 1.62 -5 -10 14 2.74 2.07 -5 -10 15 10.48 2.81 -5 -10 15 9.08 2.47 -5 -10 16 1.56 1.73 5 -10 16 1.02 1.57 -5 -10 16 -0.5 1.71 -6 -10 0 13.87 1.99 -6 -10 0 18.14 1.62 -6 10 0 22.38 2.03 -6 10 0 20.74 1.96 -6 10 0 20.32 2.05 6 10 0 21.55 2.16 -6 -10 1 195.82 9.3 -6 -10 -1 182.41 9.14 6 10 1 200.05 9.3 -6 10 1 176.55 8.54 -6 10 -1 199.39 9.03 -6 -10 1 172.95 7.75 -6 10 -1 172.05 8.33 -6 10 1 181.56 8.62 -6 10 -1 182.16 8.38 -6 10 -1 185.13 9.16 6 10 1 184.49 8.41 -6 10 1 198.02 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9.31 -6 -12 -3 164.64 9.16 -6 12 3 164.07 8.69 -6 12 -3 179.21 8.33 -6 12 -3 177.86 8.93 -6 12 3 173.98 8.79 6 12 3 175.19 8.58 -6 12 3 166.12 8.3 -6 12 -3 180.26 9.03 6 12 -3 178.46 8.84 6 12 3 173.92 9.1 6 12 -3 178.51 8.65 -6 -12 4 13.6 2.12 -6 -12 -4 14.93 2.37 -6 12 4 13.81 2.02 -6 -12 4 12.28 2.21 -6 12 -4 17.01 2.16 6 12 4 14.17 1.91 -6 12 -4 12.12 1.96 -6 12 4 14.29 1.76 6 12 4 12.04 1.95 -6 12 4 16.61 2.26 6 12 -4 12.98 1.92 -6 -12 5 81.26 5.44 -6 -12 -5 80.87 5.48 -6 -12 5 82.1 5.96 6 12 5 84.89 5.56 -6 12 -5 92.96 5.71 6 12 -5 78.52 5.07 -6 12 5 73.95 5.46 -6 -12 6 4.19 1.62 -6 12 6 5.63 1.55 6 12 6 5.14 1.46 6 12 6 5.08 1.53 -6 12 -6 5.03 1.51 -6 -12 6 4.71 1.52 -6 -12 -6 5.38 1.54 -6 -12 7 42.47 3.73 -6 -12 -7 41.46 3.77 6 -12 7 43.14 3.94 6 12 7 47.94 4.01 -6 -12 7 45.46 4.34 6 12 7 41.29 3.84 -6 12 -7 41.59 3.93 -6 12 7 46.51 3.96 -6 -12 8 2.25 1.47 6 -12 8 2.66 1.53 -6 12 8 3.2 1.32 6 -12 8 2.5 1.36 -6 -12 8 3.41 1.61 -6 12 -8 3.65 1.35 6 12 8 1.42 1.09 6 12 9 63.98 4.79 -6 -12 9 46.48 4.87 -6 -12 9 57.35 5.2 6 -12 9 59.3 5.29 -6 12 -9 65.46 5.05 -6 12 9 70.46 4.99 -6 -12 10 -0.41 1.7 -6 12 -10 0.98 1.25 6 12 10 1.73 1.16 -6 -12 10 2.07 1.58 6 -12 10 0.83 1.63 -6 12 10 1.23 1.13 -6 12 -11 96.27 6.36 6 12 11 79.25 5.64 -6 -12 11 73.3 6.36 -6 -12 11 74.38 6.37 6 -12 11 74 6.29 -6 -12 12 -0.92 1.52 6 -12 12 -0.91 1.51 -6 -12 12 3.61 1.86 -6 12 -12 0.35 1.29 -6 -12 13 17.8 3.32 6 -12 13 16.13 3.06 -6 -12 13 22.14 3.48 -6 12 -13 25.04 3.34 -6 -12 14 -1.01 2.09 6 -12 14 0.5 1.89 -6 -12 14 -2.45 2.17 -6 -12 15 24.87 3.97 6 -12 15 26.47 3.99 -6 -12 15 20.36 3.59 -7 12 0 8.97 1.45 -7 12 0 3.11 1.38 7 12 0 6.96 1.47 -7 12 0 7.28 1.33 -7 12 0 9.03 1.56 -7 -12 0 4.73 1.47 -7 12 1 1.97 0.9 -7 12 -1 4.09 1.09 -7 12 -1 2.44 0.92 -7 12 -1 3.38 1.18 7 12 -1 2.08 1.22 -7 12 -1 3.05 1.33 7 12 -1 2.25 1 7 12 1 5.27 1.38 -7 12 1 1.4 0.85 7 12 1 2.22 1.01 -7 12 1 2.18 1.1 -7 12 -1 4.19 1.24 -7 -12 1 2.22 1.18 -7 -12 -1 4.46 1.46 -7 12 2 10.76 1.64 -7 12 -2 7.95 1.34 -7 12 -2 8.3 1.58 7 12 -2 6.96 1.59 -7 12 -2 6.07 1.51 7 12 2 9.44 1.68 7 12 -2 10.55 1.68 -7 12 2 10.78 1.69 7 12 2 7.45 1.4 -7 12 -2 8.08 1.66 -7 12 2 6.75 1.42 -7 -12 2 6.36 1.62 -7 -12 -2 8.91 1.84 -7 -12 -3 6.96 1.73 -7 -12 3 2.47 1.23 -7 12 3 4.81 1.29 -7 12 -3 6.21 1.44 7 12 3 6.59 1.36 -7 12 3 5.79 1.38 -7 12 3 6.18 1.26 -7 12 -3 1.93 1.06 7 12 3 11.15 1.78 7 12 -3 2.81 1.09 7 12 -3 4.02 1.2 -7 -12 -4 16.93 2.46 -7 -12 4 20.97 2.57 7 12 4 19.81 2.44 -7 -12 4 16.06 2.49 -7 12 4 16.82 1.89 -7 12 -4 16.96 2.28 -7 12 4 19.53 2.47 7 12 -4 14.22 1.96 -7 -12 -5 26.22 2.92 -7 -12 5 9.98 1.92 -7 -12 5 12.96 2.32 7 12 5 27.98 3.15 -7 12 -5 12.95 2.09 -7 12 5 17.26 2.44 -7 -12 6 12.53 1.98 -7 -12 -6 12.6 2.16 -7 -12 6 12.38 2.33 7 12 6 10.04 2 7 12 6 14.4 2.16 -7 12 -6 10.77 2 -7 12 6 15.08 2.35 -7 -12 7 5.17 1.72 7 -12 7 6.16 1.6 7 12 7 6.93 1.68 -7 12 7 7.72 1.71 -7 12 -7 8.95 1.88 -7 -12 7 5.52 1.55 -7 -12 -7 5.43 1.56 -7 -12 8 10.49 2.22 7 -12 8 10.64 2.22 -7 12 8 11.35 2.07 7 12 8 12.39 2.1 -7 12 -8 9.93 2.04 -7 -12 8 8.43 2.16 -7 -12 9 2.37 1.42 -7 12 9 2.67 1.26 7 -12 9 1.99 1.38 7 12 9 3.46 1.28 -7 12 -9 3.13 1.45 -7 -12 9 3.2 1.57 -7 -12 10 1.66 1.43 7 -12 10 0.83 1.38 7 12 10 1.16 1 -7 12 -10 2.27 1.53 -7 -12 10 1.25 1.39 -7 -12 11 3.48 2.13 7 -12 11 2.16 1.97 7 12 11 6.17 1.72 -7 -12 11 5.69 2.14 -7 12 -11 6.69 1.91 -7 -12 12 0.46 1.52 7 -12 12 1.81 1.56 -7 -12 12 -0.46 1.4 -7 12 -12 1.38 1.65 -7 -12 13 2.4 1.78 7 -12 13 0.95 1.38 -7 -12 13 2.39 1.77 -7 12 -13 1.06 1.56 -7 -12 14 1.51 1.68 7 -12 14 0.99 1.83 -7 -12 14 0.99 1.59 -7 -12 15 3.7 1.95 7 -12 15 2.58 1.91 -8 -12 0 245.37 11.51 -8 12 0 217.1 10.3 -8 12 0 206.49 10.56 -8 12 0 221.65 10.5 -8 12 0 224.53 10.65 8 12 0 236.78 10.9 -8 12 1 2.53 0.9 -8 12 -1 6.77 1.26 -8 12 -1 5.76 1.59 -8 12 -1 5.17 1.23 8 12 -1 -1.29 1.58 -8 12 -1 7.04 1.8 8 12 -1 0.67 0.78 8 12 1 1.2 0.83 -8 12 1 1.25 0.89 -8 12 1 0.81 0.92 -8 12 -1 8.52 1.59 -8 -12 1 0.28 0.98 -8 -12 -1 1.14 0.98 -8 -12 2 67.48 5.02 -8 -12 -2 69.46 5.1 -8 12 -2 73.56 4.29 -8 12 2 73.83 4.75 8 12 2 74.46 4.95 8 12 -2 71.13 4.94 -8 12 -2 63.07 4.71 8 12 2 73.7 4.46 -8 12 2 70.08 4.45 -8 12 -2 71.94 4.8 8 12 -2 71.34 4.64 8 12 3 19.48 2.37 -8 -12 3 16.3 2.32 -8 -12 -3 19.89 2.57 8 12 3 13.01 1.87 -8 12 3 14.83 2.12 -8 12 3 14.07 1.89 -8 12 -3 21.02 2.47 8 12 -3 19.32 2.25 8 12 -3 19.18 2.18 -8 -12 4 129.93 7.42 -8 -12 -4 126.2 7.42 8 12 4 132.58 7.34 -8 -12 4 125.53 7.73 -8 12 4 118.98 7.11 -8 12 4 127.97 6.48 -8 12 -4 117.7 7.01 -8 12 4 116.69 7.27 8 12 -4 122.39 6.74 -8 -12 -5 11.57 2.06 -8 -12 5 9.94 1.85 -8 -12 5 10.72 2.06 8 12 5 12.29 2.05 -8 12 -5 10.62 1.89 -8 12 5 9.41 1.87 -8 -12 6 13.98 2.49 -8 12 6 16.94 2.56 -8 -12 6 14.99 2.2 -8 -12 -6 15.99 2.37 -8 -12 7 6.72 1.99 -8 12 7 4.6 1.44 8 12 7 8.79 1.79 -8 12 -7 5.76 1.61 -8 -12 -7 4.43 1.42 -8 -12 7 5.37 1.46 8 12 8 61.03 4.74 -8 -12 8 57.96 5.24 -8 -12 8 54.5 4.98 8 -12 8 52.77 5.06 -8 12 -8 64.01 4.86 -8 12 8 64.02 4.85 -8 -12 9 13.42 2.53 8 -12 9 21.13 3.02 -8 12 9 15.4 2.4 8 12 9 14.31 2.26 -8 12 -9 13.66 2.43 -8 -12 9 13.38 2.65 -8 -12 10 30.22 3.86 8 -12 10 24.08 3.45 8 12 10 25.11 3 -8 12 -10 33.09 3.52 -8 -12 10 25.82 3.58 -8 -12 11 8.27 2.18 8 -12 11 7.37 2.17 8 12 11 5.31 1.59 -8 12 -11 8.95 2.2 -8 -12 11 7.54 2.26 -8 -12 12 56.22 5.4 8 -12 12 52.93 5.34 -8 12 -12 50.8 4.73 -8 -12 12 52.46 5.27 -8 -12 13 4.32 1.84 8 -12 13 5.67 2.1 -8 -12 13 6.78 2.24 -8 12 -13 5.24 1.78 -8 -12 14 24.67 3.82 8 -12 14 18.75 3.46 -8 -12 14 16.64 3.34 -8 -12 15 4.21 2.18 -9 12 0 2.47 0.95 -9 12 0 3.1 0.97 -9 12 0 1.51 1.15 9 12 0 1.53 1.13 -9 12 0 1.48 1.23 9 12 0 0.46 0.91 -9 12 0 2.18 1.12 -9 -12 0 3.78 1.34 -9 -12 1 22.29 2.76 -9 -12 -1 21.53 2.72 -9 12 -1 21.85 2.13 -9 12 1 23.74 2.42 9 12 -1 21.34 2.35 -9 12 -1 19.16 2.35 -9 12 1 23.35 2.44 9 12 1 19.34 2.41 9 12 -1 17.97 2.41 -9 12 -1 24.24 2.65 -9 12 2 10.91 1.75 -9 -12 2 13.28 2.22 -9 -12 -2 10.18 2.11 -9 12 2 9.3 1.63 -9 12 -2 15.97 2.12 9 12 -2 8.37 1.58 9 12 -2 12.29 1.92 -9 12 -2 11.99 1.94 9 12 2 15.05 2.1 9 12 -3 1.66 0.96 9 12 3 2.34 1.07 9 12 -3 1.67 0.99 -9 12 3 5.44 1.41 9 12 3 1.94 0.95 -9 12 -3 3.72 1.26 -9 12 3 3.78 1.2 -9 -12 3 0.57 0.96 -9 -12 -3 0.58 0.97 -9 -12 4 6.84 1.73 -9 -12 -4 12.17 2.15 -9 -12 4 9.42 2.01 9 12 4 12.17 2 -9 12 4 7.89 1.66 -9 12 4 5.19 1.2 -9 12 -4 9.03 1.71 9 12 -4 9.1 1.67 -9 12 5 18.66 2.66 -9 -12 5 17.52 2.71 9 12 5 24.82 2.85 -9 12 5 17.56 2.55 -9 12 -5 25.17 2.79 -9 -12 5 15.83 2.39 -9 -12 -5 19.06 2.59 -9 12 6 12.16 2.14 -9 -12 6 10.18 2.13 -9 -12 -6 8.89 2 -9 12 6 10.91 2.05 -9 12 -6 10.01 1.88 -9 -12 6 6.99 1.82 -9 -12 -7 0.57 1.17 -9 -12 7 0.28 1.02 -9 -12 7 1.51 1.31 9 12 7 1.19 1.23 -9 12 -7 0.29 1.07 -9 12 7 0.29 1.28 -9 -12 8 0.37 1.46 9 -12 8 -0.38 1.75 -9 12 8 2.04 1.17 9 12 8 1.79 1.29 -9 12 -8 2.1 1.35 -9 -12 8 -1.18 1.74 -9 -12 9 10.62 2.3 9 -12 9 12.76 2.52 -9 12 9 11.21 2.11 9 12 9 9.77 1.99 -9 12 -9 10.24 2.25 -9 -12 9 8.22 2.08 -9 -12 10 1.24 1.38 9 -12 10 2.08 1.54 9 12 10 2.06 1.31 -9 12 -10 0.64 1.54 -9 -12 10 4.73 1.86 -9 -12 11 26.54 3.69 9 -12 11 25.6 3.55 9 12 11 23.65 2.91 -9 12 -11 28.73 3.46 -9 -12 11 22.53 3.41 -9 12 -12 4.41 1.86 -9 -12 12 4.56 1.98 9 -12 12 1.81 1.62 -9 -12 12 3.29 1.79 -9 12 -13 3.47 1.73 -9 -12 13 6.24 2.26 9 -12 13 3.78 1.91 -9 -12 13 5.4 2.03 -9 -12 14 4.02 1.91 9 -12 14 -0.49 1.44 -9 -12 14 2.55 1.76 10 12 0 59.37 4.11 10 12 0 49.52 4.06 -10 12 0 42.86 3.82 -10 12 0 52.35 3.83 -10 12 0 53.94 3.91 -10 -12 0 48.04 4.19 10 12 -1 33.1 2.99 -10 12 1 41.34 3.25 -10 -12 1 34.61 3.48 -10 -12 -1 38.02 3.61 -10 12 -1 33.43 3.11 -10 12 1 35.2 3.04 10 12 1 37.49 3.21 10 12 -1 28.62 3.14 -10 12 -1 31.22 3.25 10 12 -2 21.27 2.26 10 12 -2 18.64 2.34 -10 12 -2 17.41 2.32 10 12 2 18.31 2.34 -10 12 2 15.39 2.1 -10 12 -2 17.18 2.31 -10 12 2 16.76 2.1 -10 -12 2 20.04 2.69 -10 -12 -2 16.03 2.4 10 12 -3 26.66 2.82 10 12 -3 24.93 2.57 -10 12 3 31.65 3.04 10 12 3 31.89 3.07 10 12 3 30.56 2.73 -10 12 -3 36.48 3.22 -10 12 3 27.85 2.62 10 -12 -3 27.24 2.71 -10 -12 3 32.28 3.27 -10 -12 -3 23.74 2.97 -10 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4.11 1.52 -11 12 -5 5.48 1.51 -11 12 5 5.27 1.72 11 12 -5 3.82 1.26 -11 12 6 10.89 2.07 -11 12 6 7.74 1.87 -11 -12 6 8.57 2.1 -11 12 -6 11.06 1.98 -11 -12 6 14.95 2.26 -11 -12 -6 9.01 1.9 -11 12 7 2.36 1.3 -11 -12 7 -0.39 1.13 -11 12 7 0.32 0.95 -11 12 -7 0.88 1.08 -11 -12 7 -1.16 1.39 -11 -12 -7 2.38 1.55 -11 -12 8 5.68 1.86 -11 12 8 11.14 2.15 -11 12 8 10.21 2.11 -11 12 -8 7.87 1.88 11 12 8 10.43 2.03 -11 -12 9 1.69 1.66 -11 -12 9 1.17 1.4 11 -12 9 4.37 1.84 -11 12 9 3.2 1.61 -11 12 -9 5.94 1.83 11 12 9 5.17 1.64 -11 -12 10 1.24 1.21 11 -12 10 3.75 1.77 11 12 10 3.01 1.39 -11 12 -10 7.08 1.95 -11 -12 10 3.09 1.73 -11 12 -11 5.62 1.79 -11 -12 11 5.2 1.93 11 -12 11 3.04 2.05 -11 -12 11 5.54 2.05 -11 12 -12 7.8 2.08 -11 -12 12 10 2.43 11 -12 12 9.03 2.41 -11 -12 12 6.77 2.21 -11 12 -13 -1.04 1.63 -11 -12 13 0.95 1.59 11 -12 13 -0.47 1.57 -11 -12 13 1.51 1.61 -11 -12 14 4.5 2.17 11 -12 14 4.41 2.17 -11 -12 14 3.14 1.94 -12 12 0 1.4 1.12 12 12 0 0.76 1.02 -12 12 0 0.24 1.17 12 12 0 -0.23 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49.98 4.34 -12 -12 8 40.18 4.48 12 12 8 53.95 4.58 -12 -12 9 13.25 2.68 -12 -12 9 10.84 2.41 12 -12 9 8.72 2.29 -12 12 -9 11.93 2.23 12 12 9 10.51 2.12 -12 12 9 12.66 2.47 -12 -12 10 50.03 4.99 12 -12 10 56.99 5.32 -12 12 10 54.93 5.02 -12 12 -10 57.18 4.8 -12 -12 10 45.63 4.98 12 12 10 55.81 4.68 -12 12 11 10.13 2.22 -12 -12 11 12.08 2.58 12 -12 11 6.93 2.22 -12 12 -11 9.94 2.15 -12 -12 11 12.17 2.76 -12 12 12 13.32 2.62 -12 -12 12 20.39 3.29 12 -12 12 16.7 3.01 -12 12 -12 16.62 2.71 -12 -12 12 15.15 2.98 -12 12 13 1.67 1.49 -12 -12 13 1.43 1.52 12 -12 13 2.35 1.62 -12 -12 13 2.04 1.76 -12 -12 14 15.41 3.31 12 -12 14 11.72 2.96 13 12 0 0.93 1.05 -13 12 0 -0.24 1.13 -13 -12 0 0.95 1.27 13 12 -1 4.86 1.37 -13 12 -1 8.41 1.72 -13 12 1 8.79 1.68 -13 12 1 5.4 1.52 -13 -12 1 4.74 1.76 -13 -12 -1 4.12 1.77 -13 12 2 12.64 2.06 -13 12 2 14.25 2.03 -13 12 -2 12.04 2.05 -13 -12 2 11.96 2.29 -13 -12 -2 10.46 2.28 -13 -12 3 7.82 1.99 -13 -12 -3 0.95 1.44 -13 12 3 7.89 1.75 -13 -12 -3 6.35 1.55 -13 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2.11 -3 14 11 5.65 1.94 3 -14 11 7.35 2.14 -3 -14 11 5.81 1.9 -3 14 -11 4.45 1.82 -3 -14 12 13.38 3 3 -14 12 18.27 3.32 -3 -14 12 18.48 3.2 -3 14 -12 22.51 3.48 -3 -14 13 13.93 3.08 3 -14 13 18.95 3.4 -3 14 -13 15.29 3.07 -3 -14 13 21.04 3.48 -3 14 -14 5.2 2.41 -3 -14 14 9.88 2.59 -4 -14 0 87.8 6.12 -4 14 0 91.95 5.62 -4 14 0 88.58 5.54 4 14 0 87.65 5.88 -4 -14 1 9.76 2.28 -4 -14 -1 10.72 2.29 4 14 1 18.99 2.6 -4 14 1 13.11 2.03 -4 14 -1 12.87 1.94 -4 14 -1 16.12 2.31 -4 14 1 14.16 2.08 4 14 -1 17.47 2.4 -4 -14 2 104.38 6.67 -4 -14 -2 102.94 6.67 -4 14 2 86.51 5.88 -4 14 -2 99.98 5.9 -4 14 2 104.52 5.9 -4 14 2 102.03 5.79 -4 14 -2 109.82 6.39 -4 14 2 97.5 6.55 4 14 -2 100.11 6.3 4 14 2 99.64 6.39 -4 -14 3 9.69 2.3 -4 -14 -3 12.25 2.38 4 14 3 8.85 1.94 -4 14 3 10.77 1.89 -4 14 -3 8.5 1.9 -4 14 3 12.17 2.11 4 14 -3 9.71 1.87 -4 -14 4 24.4 3.04 -4 -14 -4 22.33 3.04 4 14 4 22.7 2.88 -4 14 4 27.77 2.94 4 14 4 26.65 3.06 -4 14 -4 27.77 3.09 -4 14 4 21.07 2.97 4 14 -4 22.58 2.87 -4 14 5 1.58 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14 0 61.29 4.33 -5 -14 1 58.01 4.62 -5 -14 -1 47.08 4.23 -5 14 1 49.25 3.83 -5 14 -1 39.78 3.47 -5 14 -1 55.65 4.07 -5 14 1 42.33 3.57 5 14 -1 45.92 3.94 5 14 1 46.48 3.99 -5 -14 2 3.07 1.51 -5 -14 -2 3.4 1.72 5 14 2 8.64 1.93 -5 14 2 9.26 1.61 -5 14 -2 5.94 1.59 -5 14 2 2.9 1.28 5 14 -2 5.68 1.69 -5 14 -2 4.96 1.29 -5 14 2 8.31 1.64 -5 -14 3 20.79 3 -5 -14 -3 17.31 2.8 -5 14 -3 23.04 2.83 -5 14 3 26.38 3.12 5 14 -3 25.62 2.87 5 14 3 27.42 3.01 -5 14 3 25.52 2.8 -5 -14 -4 27.47 3.33 -5 -14 4 29.77 3.37 -5 14 4 31.9 3.14 -5 14 -4 33.68 3.36 5 14 -4 32.25 3.27 -5 14 4 35.25 3.61 5 14 4 30.71 3.29 -5 -14 5 19.9 2.83 -5 -14 -5 26.77 3.2 5 14 5 28.88 3.22 -5 14 5 24.17 2.78 5 14 5 23.92 3 -5 14 -5 29.1 3.25 -5 14 5 24.58 3.05 -5 -14 6 1.54 1.29 5 14 6 2.85 1.34 -5 14 -6 3.13 1.26 -5 -14 6 2.99 1.35 -5 -14 -6 1.53 1.44 -5 14 6 0.96 1.36 5 14 6 4.82 1.63 -5 -14 7 2.39 1.61 5 14 7 3.47 1.37 -5 14 7 7.79 1.85 5 14 7 3.3 1.43 -5 14 -7 4.87 1.83 -5 -14 -7 0.91 1.49 -5 14 8 9.57 2.1 5 14 8 11.23 2.21 -5 14 -8 12.48 2.38 -5 -14 8 9.5 2.29 5 -14 8 6.77 1.98 5 14 8 10.75 2.12 5 14 9 47.28 4.28 -5 -14 9 40.52 4.53 -5 14 -9 45.98 4.48 -5 14 9 53.45 4.59 -5 -14 10 8.62 2.35 5 -14 10 8.18 2.36 -5 14 10 9.68 2.19 -5 -14 10 9.73 2.44 -5 14 -10 7.56 2.1 5 14 10 8.34 1.97 -5 -14 11 2.85 1.7 5 -14 11 4.27 1.96 -5 -14 11 1.83 1.34 -5 14 -11 5.58 2.01 5 14 11 1.63 1.35 -5 14 -12 11.51 2.55 -5 -14 12 8.44 2.48 5 -14 12 5.42 2.06 -5 -14 12 8.53 2.34 -5 14 -13 25.2 3.72 -5 -14 13 24.27 3.85 5 -14 13 26.57 4.01 -5 -14 13 27.49 3.91 -5 14 -14 2.79 1.81 -5 -14 14 6.08 2.25 6 14 0 4.66 1.4 -6 14 0 5.66 1.45 -6 -14 0 3.46 1.55 -6 14 0 5.8 1.44 6 14 -1 14.8 2.17 6 14 1 11.5 2.06 -6 14 -1 10.56 1.76 -6 14 1 15.25 2.03 -6 14 -1 12.38 1.98 -6 14 1 14.74 2.03 -6 -14 1 11.28 2.29 -6 -14 -1 8.19 2.09 -6 -14 2 -0.31 1.33 -6 -14 -2 0.63 1.37 6 14 2 2.3 1.33 -6 14 2 8.63 1.63 -6 14 -2 3.53 1.12 -6 14 2 5.53 1.39 -6 14 2 2.73 1.23 -6 14 -2 4.4 1.46 6 14 -2 2.39 1.25 -6 -14 3 97.75 6.63 -6 -14 -3 99.02 6.7 -6 14 3 105.35 6.29 -6 14 3 97.89 6.13 -6 14 -3 112.11 6.61 6 14 3 104.59 6.59 -6 14 3 103.98 6.87 6 14 -3 102 6.34 -6 -14 4 2.77 1.46 -6 -14 -4 1.25 1.45 6 14 4 4.59 1.55 -6 14 4 2.34 1.25 -6 14 -4 4.82 1.58 -6 14 4 5.76 1.68 6 14 -4 5.43 1.57 -6 -14 5 42.39 4.01 -6 -14 -5 37.35 3.95 6 14 5 43.03 3.98 6 14 5 41.68 4 -6 14 -5 49.18 4.14 -6 14 5 41.23 4.05 -6 14 6 3.55 1.58 6 14 6 4.5 1.49 6 14 6 1.61 1.23 -6 -14 6 3.13 1.61 -6 14 -6 3.41 1.49 -6 -14 6 -0.3 1.34 -6 -14 -6 1.55 1.34 -6 -14 7 91.27 6.37 -6 -14 -7 100.87 6.66 -6 -14 7 104.58 7.3 6 14 7 88.8 6.43 6 14 7 104.85 6.83 -6 14 -7 109.12 6.94 -6 14 7 110.15 6.98 -6 14 -8 5.04 1.8 -6 -14 8 3.76 1.78 6 14 8 7.7 1.82 6 14 9 36.21 3.78 -6 -14 9 38.48 4.38 -6 14 -9 31.74 3.83 -6 14 9 39.71 3.99 -6 -14 10 3.62 2.01 6 -14 10 4.99 2.06 -6 14 10 5.86 1.92 6 14 10 3.87 1.53 -6 14 -10 2.16 1.82 -6 -14 10 4.48 1.81 -6 -14 11 12.81 2.8 6 -14 11 11.84 2.65 6 14 11 12.03 2.26 -6 -14 11 8.84 2.35 -6 14 -11 8.88 2.2 -6 -14 12 1.98 1.52 6 -14 12 2.96 1.82 -6 -14 12 1.44 1.72 -6 14 -12 5.69 1.95 -6 -14 13 21.66 3.53 6 -14 13 14.28 3.2 -6 14 -13 21.25 3.3 -6 -14 13 16.92 3.25 -6 14 -14 2.75 1.85 -7 -14 0 21.05 2.86 -7 14 0 22.92 2.59 7 14 0 24.26 2.76 -7 14 0 21.99 2.45 -7 -14 1 39.78 3.81 -7 -14 -1 32.58 3.6 -7 14 1 36.88 3.19 -7 14 -1 26.12 2.72 -7 14 1 33.73 3.17 -7 14 -1 35.32 3.29 7 14 -1 39.44 3.53 7 14 1 34.92 3.37 -7 -14 2 49.45 4.36 -7 -14 -2 39.92 4.09 -7 14 2 46.24 3.75 -7 14 2 44.88 3.74 -7 14 2 48.8 3.75 -7 14 -2 55.65 4.19 7 14 -2 47.75 3.91 7 14 2 46.59 4 -7 -14 3 39.75 3.9 -7 -14 -3 38.61 3.98 -7 14 3 32.23 3.25 -7 14 3 43.01 3.59 -7 14 3 35.52 3.15 -7 14 -3 39.81 3.63 7 14 3 36.26 3.61 -7 14 3 40.56 3.94 7 14 -3 43.92 3.73 7 14 4 30.96 3.41 -7 14 4 27.41 3.32 -7 14 4 37.1 3.45 -7 14 -4 39.8 3.69 -7 -14 -4 32.5 3.62 -7 -14 4 38.22 3.77 7 14 5 14.74 2.32 -7 14 5 14.95 2.44 -7 14 -5 10.95 2.08 -7 -14 5 8.07 2.04 -7 -14 -5 14.58 2.46 -7 -14 6 68.6 5.22 -7 -14 -6 65.73 5.19 7 14 6 68.25 5.3 7 14 6 71.38 5.4 -7 -14 6 65.25 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14 2 86.77 5.42 -8 14 2 85.81 5.39 -8 14 2 81.62 5.18 -8 14 -2 82.76 5.52 8 14 -2 85.57 5.51 8 14 2 83.77 5.69 8 14 -3 32.48 3.15 -8 14 3 31.52 3.16 -8 -14 3 39.73 3.9 -8 -14 -3 25.28 3.34 -8 14 3 29.52 2.85 -8 14 -3 39.07 3.52 8 14 3 33.71 3.46 8 14 4 84.39 5.86 -8 14 4 79.18 5.98 -8 14 4 86.02 5.75 -8 14 -4 97.09 6.05 -8 -14 4 85.91 6.12 -8 -14 -4 86.33 6.14 8 14 5 9.13 2.01 -8 14 5 10.17 2.04 -8 14 5 10.55 2.01 -8 14 -5 10.09 1.94 -8 -14 5 10.42 2.12 -8 -14 -5 12.56 2.26 -8 -14 -6 53.46 4.61 -8 -14 6 49.59 4.36 8 14 6 46.66 4.4 -8 -14 6 51.61 4.89 8 14 6 52.04 4.49 -8 14 -6 45.31 4.22 -8 14 6 50.3 4.48 -8 -14 7 6.62 1.92 -8 14 7 4.27 1.62 -8 14 -7 11.5 2.31 -8 -14 -7 5.07 1.81 -8 -14 7 4 1.59 8 14 7 5.99 1.72 -8 -14 8 40.22 4.55 8 14 8 50.14 4.4 -8 14 -8 48.96 4.5 -8 14 8 44.03 4.23 -8 14 9 4.36 1.68 8 14 9 4.92 1.7 -8 -14 9 4.87 2.05 -8 14 -9 9.24 2.22 -8 14 -10 36 4.11 8 14 10 34 3.67 -8 -14 10 40.01 4.61 -8 -14 11 5.19 2.19 8 -14 11 6.61 2.14 8 14 11 5.24 1.67 -8 14 -11 6.53 2.15 -8 -14 11 2.86 1.98 -8 -14 12 6.91 2.27 8 14 12 9.56 2.06 -8 -14 12 9.38 2.61 -8 14 -12 13.76 2.58 -8 -14 13 4.13 2.33 8 -14 13 1.02 1.7 -8 14 -13 3.04 1.86 -8 -14 13 1.02 1.63 -8 14 -14 6.17 2.15 -9 14 0 13.52 1.87 9 14 0 12.72 2.12 -9 14 0 12.51 2.05 -9 -14 0 16.87 2.53 -9 -14 1 50.18 4.39 -9 -14 -1 47.72 4.32 -9 14 1 48.78 3.75 -9 14 1 46.04 3.57 -9 14 -1 37.71 3.58 -9 14 1 43.39 3.65 9 14 -1 39.32 3.63 9 14 1 47.08 3.96 9 14 -2 71.43 4.97 -9 14 2 67.27 4.81 -9 14 -2 64.99 4.87 -9 14 2 79.25 4.93 -9 -14 2 84.82 5.82 -9 -14 -2 61.59 5.25 9 14 2 66.15 4.99 -9 14 3 161.54 8.83 -9 -14 3 162.47 9.35 -9 -14 -3 169.26 9.53 -9 14 3 168.75 8.46 -9 14 -3 175.17 9.12 9 14 3 157.39 9 9 14 4 5.82 1.61 -9 14 4 4.26 1.64 -9 14 4 4.23 1.51 -9 14 -4 9.81 1.89 -9 -14 4 3.89 1.48 -9 -14 -4 3.62 1.59 9 14 5 2.22 1.28 -9 14 5 3.9 1.55 -9 14 5 3.64 1.56 -9 14 -5 7.76 1.73 -9 -14 5 5.46 1.66 -9 -14 -5 4.92 1.64 -9 -14 6 7.93 1.88 -9 -14 -6 11.71 2.25 -9 14 6 7.6 1.88 -9 -14 6 8.9 2.29 9 14 6 8.83 2.11 -9 14 -6 8.04 1.83 -9 14 6 9.61 2.23 -9 -14 -7 59.99 4.95 -9 -14 7 56.69 4.78 -9 -14 7 57.33 5.47 9 14 7 61.53 5.09 -9 14 7 64.02 5.13 -9 14 -7 70.1 5.19 -9 14 7 55.79 5.02 -9 14 8 2.65 1.62 -9 -14 8 1.73 1.6 -9 14 -8 2.32 1.56 9 14 8 2.01 1.42 -9 14 9 27.1 3.46 -9 -14 9 25.06 3.74 9 14 9 27.28 3.36 -9 14 -9 26.97 3.41 -9 14 -10 9.85 2.45 9 14 10 11.22 2.22 -9 -14 11 26.34 3.8 9 -14 11 27.8 3.86 -9 -14 11 20.78 3.44 -9 14 -11 27.81 3.6 9 14 11 23.71 3.14 -9 14 -12 0.74 2.05 -9 -14 12 2 1.66 -9 -14 12 3.45 1.82 9 -14 12 3.92 1.87 -9 14 -13 22.28 3.43 -9 -14 13 18.61 3.37 -9 -14 13 19.52 3.67 9 -14 13 13.71 3.08 -9 14 -14 8.43 2.23 10 14 0 1.63 1.23 -10 14 0 1.25 1.15 -10 -14 0 4.05 1.53 10 14 -1 13.84 2.1 10 14 1 15.17 2.29 -10 14 -1 11.44 2.06 -10 14 1 15.56 2.26 -10 -14 1 12.77 2.42 -10 -14 -1 15.52 2.64 -10 14 1 16.39 2.22 10 14 -2 1.52 1.14 10 14 2 3.47 1.38 -10 14 2 4.39 1.41 -10 14 -2 0.27 1.39 -10 14 2 4.79 1.52 -10 -14 2 -1.67 1.8 -10 -14 -2 -2.7 2.07 -10 14 3 76.19 5.39 -10 -14 3 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1.52 0 21 2 0.78 1.29 0 21 -2 -0.84 1.5 0 21 2 0.43 1.64 0 21 3 -0.78 1.44 0 21 -3 -1.25 1.38 0 21 3 -0.87 1.65 0 21 -4 0.4 1.27 0 21 4 -0.79 1.26 0 21 4 -1.75 1.89 0 21 -5 0.41 1.48 0 21 5 0.4 1.32 1 21 0 -0.39 1.39 -1 21 0 0.43 1.25 1 21 0 0.42 1.34 -1 21 1 1.86 1.38 1 21 1 1.57 1.54 -1 21 -1 0.85 1.42 1 21 -1 1.26 1.39 -1 21 1 1.72 1.54 1 21 1 -0.42 1.75 1 21 2 1.19 1.46 -1 21 2 4.15 1.7 -1 21 -2 1.69 1.66 1 21 -2 0.42 1.44 -1 21 2 -1.3 1.78 1 21 2 1.28 1.42 1 21 3 -0.4 1.28 -1 21 3 0.38 1.37 -1 21 -3 -0.42 1.34 1 21 -3 0.82 1.32 -1 21 3 -0.44 1.39 1 21 3 -1.73 1.49 -1 21 4 -1.16 1.33 1 21 4 -1.21 1.44 -1 21 -4 0.78 1.2 1 21 -4 1.2 1.52 -1 21 -4 1.65 1.57 -1 21 4 -2.19 1.98 1 21 4 0.44 1.71 -1 21 -5 2.85 1.72 1 21 -5 1.24 1.47 -1 21 5 -0.39 1.3 2 21 0 3.59 1.77 -2 21 0 2.16 1.6 2 21 0 2.5 1.68 2 21 1 5.26 1.98 -2 21 1 2.18 1.35 -2 21 -1 4.3 1.73 -2 21 1 3.47 1.79 2 21 -1 3.31 1.83 2 21 1 1.69 1.51 2 21 2 -0.41 1.55 -2 21 2 2.21 1.48 -2 21 -2 0.43 1.36 2 21 -2 1.23 1.42 -2 21 2 0.43 1.39 2 21 2 1.28 1.42 2 21 3 1.64 1.46 -2 21 3 1.87 1.38 -2 21 -3 1.5 1.54 -2 21 -3 2.94 1.82 -2 21 3 -0.87 2.02 2 21 3 0.43 1.38 2 21 4 -1.23 1.47 -2 21 4 -0.38 1.36 -2 21 -4 0.39 1.39 2 21 -4 0.8 1.42 -2 21 -4 -0.83 1.27 -2 21 4 1.76 1.68 2 21 4 -0.87 1.75 -2 21 -5 0.4 1.34 2 21 -5 0.82 1.47 -2 21 5 0.38 1.12 3 21 0 0.41 1.31 -3 21 0 0.87 1.33 3 21 0 0.41 1.33 3 21 1 1.66 1.48 3 21 -1 2.42 1.67 -3 21 -1 2.16 1.55 -3 21 1 1.75 1.4 3 21 -1 3.28 1.89 3 21 1 -0.84 1.6 3 21 2 2.93 1.81 -3 21 2 3.6 1.79 -3 21 -2 5.99 2.02 -3 21 2 5.7 1.99 3 21 -2 3.65 1.64 3 21 2 2.54 1.84 3 21 3 -0.42 1.28 -3 21 3 -0.37 1.17 -3 21 -3 1.12 1.33 -3 21 -3 -0.42 1.29 -3 21 3 -2.2 2.26 3 21 3 -0.43 1.43 3 21 4 3.36 1.74 -3 21 4 3.73 1.62 -3 21 -4 6.57 1.93 3 21 -4 4.79 1.95 -3 21 -4 5.45 1.94 -3 21 4 2.65 1.69 3 21 4 3.04 1.8 -3 21 -5 0.8 1.48 3 21 -5 -0.41 1.52 -3 21 5 1.14 1.48 4 21 0 0.42 1.4 -4 21 0 0.44 1.46 4 21 0 0.82 1.37 4 21 1 1.7 1.66 -4 21 -1 -0.43 1.44 -4 21 1 0.88 1.52 4 21 -1 -0.81 1.5 4 21 1 0.83 1.59 4 21 2 -0.43 1.42 -4 21 2 3.88 1.63 -4 21 2 -0.44 1.91 -4 21 -2 2.58 1.68 4 21 2 -0.42 1.61 4 21 3 -3 2.6 -4 21 3 1.44 1.1 -4 21 -3 0.37 1.24 -4 21 -3 -0.43 1.42 -4 21 3 -0.44 1.53 4 21 3 0.86 1.31 -4 21 -4 -0.38 1.33 4 21 -4 0.4 1.48 4 21 4 -0.86 1.48 -4 21 4 -0.37 1.18 -4 21 4 -0.44 1.42 4 21 4 -0.87 1.39 -4 21 -5 3.58 1.73 4 21 -5 1.65 1.67 -4 21 5 4.5 1.73 -5 21 0 0.44 1.47 5 21 0 -0.41 1.36 5 21 1 3.03 1.88 -5 21 1 -0.44 1.36 -5 21 -1 1.31 1.33 5 21 -1 -0.4 1.58 5 21 1 0.83 1.43 5 21 2 5.24 1.98 -5 21 2 4.9 2.02 -5 21 -2 3.02 1.87 5 21 2 1.26 1.35 5 21 3 1.32 1.4 -5 21 3 1.42 1.27 -5 21 -3 1.11 1.24 -5 21 3 -0.45 1.37 5 21 3 0.86 1.48 -5 21 -4 3.07 1.7 5 21 4 3.5 1.77 -5 21 4 4.35 1.74 5 21 4 3.48 1.76 -5 21 -5 1.19 1.51 -6 21 0 -0.89 1.58 6 21 0 -0.81 1.68 -6 21 1 -0.89 1.65 -6 21 -1 0.88 1.28 6 21 -1 0.8 1.39 6 21 1 -0.41 1.21 6 21 2 -0.45 1.89 -6 21 2 -0.45 1.49 -6 21 -2 -0.43 1.5 6 21 2 -0.84 1.4 -6 21 3 -0.35 1.29 6 21 3 0.45 1.55 -6 21 -3 -0.74 1.33 -6 21 3 0.9 1.66 6 21 3 1.28 1.53 -6 21 -4 2.3 1.62 6 21 4 -0.87 1.5 -7 21 0 -1.33 1.42 7 21 0 -1.62 1.98 -7 21 1 1.35 1.76 -7 21 -1 0.88 1.63 7 21 1 0.82 1.37 7 21 2 3.19 1.93 -7 21 2 -0.45 1.5 7 21 2 0.42 1.29 -7 21 -3 1.11 1.41 7 21 3 -0.46 1.52 7 21 3 0.86 1.37 -7 21 -4 0.77 1.28 -8 21 0 -0.45 1.6 8 21 0 -0.4 1.39 -8 21 1 2.71 1.62 8 21 1 5.36 1.94 8 21 2 2.94 1.69 -8 21 -3 6.69 2.04 8 21 3 3.83 1.81 -8 21 -4 1.92 1.37 9 21 1 1.65 1.61 9 21 2 1.25 1.44 -9 21 -3 4.83 1.89 9 21 3 5.92 1.92 10 21 1 2.86 1.73 -10 21 -2 -0.36 1.52 10 21 2 -0.41 1.58 -10 21 -3 17.47 2.96 -11 21 -2 -1.08 1.33 11 21 2 1.24 1.52 -12 21 -2 0.36 1.26 0 22 -1 0.44 1.45 0 22 1 -0.39 1.36 0 22 -2 26.43 3.85 0 22 2 29.87 3.84 0 22 -3 0.43 1.53 1 22 0 10.44 2.92 1 22 -1 -0.86 1.59 -1 22 -1 0.44 1.63 1 22 1 0.4 1.45 -1 22 -2 6.99 2.14 1 22 -2 6.43 2.21 1 22 2 3.68 2.11 -1 22 2 4.66 2.01 -1 22 -3 6.5 2.31 2 22 0 -0.43 1.55 2 22 0 -0.82 1.47 2 22 -1 8.56 2.4 2 22 1 13.3 2.84 2 22 -2 2.97 1.8 -2 22 2 3.42 1.61 3 22 0 2.15 1.77 3 22 0 0.84 1.46 3 22 -1 4.25 1.8 3 22 1 2.13 2.01 4 22 0 8.98 2.51 4 22 0 4.75 2.16 4 22 -1 0.84 1.4 5 22 0 1.27 1.71 5 22 0 -2.65 2.41 6 22 0 1.27 1.61 loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle_publ_flag O2 In01 O4 82.6(3) . . ? O2 In01 O5 136.0(3) . . ? O2 In01 O3 88.5(3) . . ? O2 In01 O1 56.6(3) . . ? O2 In01 O6 166.6(3) . . ? O2 In01 N1 93.2(3) . . ? O2 In01 N2 87.3(3) . . ? O2 In01 C10 83.3(3) . . ? O2 In01 C1 28.3(3) . . ? O2 In01 C19 164.4(3) . . ? O4 In01 O1 119.0(3) . . ? O4 In01 C10 27.9(4) . . ? O4 In01 C1 100.8(3) . . ? O4 In01 C19 108.9(3) . . ? O5 In01 O4 124.0(3) . . ? O5 In01 O1 79.4(3) . . ? O5 In01 C10 104.9(4) . . ? O5 In01 C1 107.7(3) . . ? O5 In01 C19 28.5(3) . . ? O3 In01 O4 57.0(3) . . ? O3 In01 O5 81.2(3) . . ? O3 In01 O1 76.9(3) . . ? O3 In01 O6 95.4(3) . . ? O3 In01 N1 150.9(3) . . ? O3 In01 N2 138.2(4) . . ? O3 In01 C10 29.2(4) . . ? O3 In01 C1 80.6(3) . . ? O3 In01 C19 89.2(3) . . ? O1 In01 C10 97.9(4) . . ? O1 In01 C1 28.3(3) . . ? O1 In01 C19 107.9(3) . . ? O6 In01 O4 88.8(3) . . ? O6 In01 O5 57.4(3) . . ? O6 In01 O1 136.9(2) . . ? O6 In01 N1 89.5(3) . . ? O6 In01 N2 81.2(3) . . ? O6 In01 C10 94.0(3) . . ? O6 In01 C1 165.1(3) . . ? O6 In01 C19 29.0(3) . . ? N1 In01 O4 152.0(4) . . ? N1 In01 O5 77.5(3) . . ? N1 In01 O1 79.9(4) . . ? N1 In01 N2 70.9(4) . . ? N1 In01 C10 176.5(3) . . ? N1 In01 C1 87.3(4) . . ? N1 In01 C19 81.4(3) . . ? N2 In01 O4 81.2(4) . . ? N2 In01 O5 127.5(3) . . ? N2 In01 O1 131.9(3) . . ? N2 In01 C10 109.0(4) . . ? N2 In01 C1 111.4(3) . . ? N2 In01 C19 104.6(3) . . ? C10 In01 C1 89.5(3) . . ? C19 In01 C10 102.0(3) . . ? C19 In01 C1 136.2(3) . . ? O8 In02 O12 80.1(3) . . ? O8 In02 O9 120.9(3) . . ? O8 In02 C47 101.4(4) . . ? O8 In02 C56 28.0(3) . . ? O8 In02 C38 107.6(3) . . ? O7 In02 O8 56.6(3) . . ? O7 In02 O12 136.4(3) . . ? O7 In02 O9 83.3(3) . . ? O7 In02 N4 87.4(3) . . ? O7 In02 C47 86.9(3) . . ? O7 In02 C56 28.7(3) . . ? O7 In02 C38 162.4(3) . . ? O11 In02 O8 136.0(2) . . ? O11 In02 O7 165.7(3) . . ? O11 In02 O12 56.0(3) . . ? O11 In02 O9 83.4(3) . . ? O11 In02 N4 85.4(3) . . ? O11 In02 N3 91.6(4) . . ? O11 In02 C47 83.8(4) . . ? O11 In02 C56 162.6(3) . . ? O11 In02 C38 28.4(3) . . ? O12 In02 C47 97.6(4) . . ? O12 In02 C56 107.8(3) . . ? O12 In02 C38 27.6(3) . . ? O10 In02 O8 79.6(3) . . ? O10 In02 O7 89.6(3) . . ? O10 In02 O11 87.2(3) . . ? O10 In02 O12 76.5(4) . . ? O10 In02 O9 56.5(4) . . ? O10 In02 N4 136.4(4) . . ? O10 In02 N3 150.2(4) . . ? O10 In02 C47 28.2(4) . . ? O10 In02 C56 82.4(3) . . ? O10 In02 C38 78.9(4) . . ? O9 In02 O12 119.2(3) . . ? O9 In02 C47 28.4(4) . . ? O9 In02 C56 102.2(3) . . ? O9 In02 C38 101.0(3) . . ? N4 In02 O8 131.6(3) . . ? N4 In02 O12 130.6(3) . . ? N4 In02 O9 79.9(4) . . ? N4 In02 C47 108.2(4) . . ? N4 In02 C56 111.7(3) . . ? N4 In02 C38 110.2(3) . . ? N3 In02 O8 80.7(4) . . ? N3 In02 O7 98.0(3) . . ? N3 In02 O12 78.3(4) . . ? N3 In02 O9 152.8(4) . . ? N3 In02 N4 73.0(4) . . ? N3 In02 C47 175.1(4) . . ? N3 In02 C56 90.6(3) . . ? N3 In02 C38 86.0(4) . . ? C47 In02 C56 93.3(3) . . ? C47 In02 C38 89.1(4) . . ? C56 In02 C38 134.8(4) . . ? C12 S3 C11 100.6(6) . . ? C3 S1 C2 103.3(5) . . ? C21 S5 C20 105.1(6) . . ? C58 S11 C57 103.1(5) . . ? C49 S9 C48 101.0(7) . . ? C40 S7 C39 107.1(7) . . ? C56 O8 In02 89.4(6) . . ? C1 O2 In01 95.6(6) . . ? C10 O4 In01 90.1(9) . . ? C19 O5 In01 88.9(6) . . ? C10 O3 In01 91.9(9) . . ? C1 O1 In01 86.5(6) . . ? C56 O7 In02 92.4(6) . . ? C19 O6 In01 90.9(6) . . ? C38 O11 In02 94.9(6) . . ? C38 O12 In02 86.7(7) . . ? C47 O10 In02 93.0(9) . . ? C47 O9 In02 86.1(8) . . ? C28 C29 H29 120.7 . . ? C28 C29 C30 118.6(13) . . ? C30 C29 H29 120.7 . . ? C33 N1 In01 119.5(10) . . ? C33 N1 C37 119.3(12) . . ? C37 N1 In01 121.2(9) . . ? C28 N2 In01 123.6(10) . . ? C28 N2 C32 118.0(11) . . ? C32 N2 In01 118.2(9) . . ? C69 N4 In02 116.4(9) . . ? C65 N4 In02 125.5(10) . . ? C65 N4 C69 118.1(12) . . ? C29 C28 H28 118.2 . . ? N2 C28 C29 123.5(14) . . ? N2 C28 H28 118.2 . . ? N1 C33 C32 116.0(13) . . ? N1 C33 C34 122.1(13) . . ? C34 C33 C32 121.8(13) . . ? C68 C67 H67 120.5 . . ? C66 C67 H67 120.5 . . ? C66 C67 C68 119.0(13) . . ? C74 N3 In02 122.3(10) . . ? C74 N3 C70 121.7(13) . . ? C70 N3 In02 115.7(10) . . ? O4 C10 In01 62.0(8) . . ? O4 C10 O3 120.5(14) . . ? O4 C10 C11 124.2(14) . . ? O3 C10 In01 58.8(7) . . ? O3 C10 C11 115.2(13) . . ? C11 C10 In01 170.2(9) . . ? N2 C32 C33 115.0(12) . . ? N2 C32 C31 122.8(12) . . ? C31 C32 C33 122.2(13) . . ? C45 C44 H44 119.3 . . ? C45 C44 C43 121.4(13) . . ? C43 C44 H44 119.3 . . ? N1 C37 H37 119.2 . . ? C36 C37 N1 121.7(12) . . ? C36 C37 H37 119.2 . . ? C27 C22 C21 120.5(11) . . ? C23 C22 C21 120.6(11) . . ? C23 C22 C27 118.9(11) . . ? S6 C21 S5 123.3(7) . . ? C22 C21 S5 111.8(8) . . ? C22 C21 S6 124.8(9) . . ? O2 C1 In01 56.0(5) . . ? O2 C1 C2 117.7(9) . . ? O1 C1 In01 65.3(5) . . ? O1 C1 O2 121.1(10) . . ? O1 C1 C2 121.1(10) . . ? C2 C1 In01 171.6(8) . . ? C71 C72 H72 120.2 . . ? C71 C72 C73 119.6(13) . . ? C73 C72 H72 120.2 . . ? C22 C27 H27 119.3 . . ? C26 C27 C22 121.5(12) . . ? C26 C27 H27 119.3 . . ? C13 C14 H14 119.4 . . ? C15 C14 H14 119.4 . . ? C15 C14 C13 121.2(13) . . ? S12 C58 S11 123.2(7) . . ? C59 C58 S11 113.0(8) . . ? C59 C58 S12 123.8(9) . . ? C72 C71 H71 119.6 . . ? C72 C71 C70 120.7(13) . . ? C70 C71 H71 119.6 . . ? C46 C41 C40 119.2(14) . . ? C42 C41 C46 121.9(13) . . ? C42 C41 C40 118.8(13) . . ? O10 C47 In02 58.8(7) . . ? O10 C47 O9 124.3(12) . . ? O10 C47 C48 115.7(12) . . ? O9 C47 In02 65.5(7) . . ? O9 C47 C48 120.0(12) . . ? C48 C47 In02 172.8(9) . . ? C41 C46 H46 121.4 . . ? C45 C46 C41 117.3(14) . . ? C45 C46 H46 121.4 . . ? S3 C11 H11A 109.6 . . ? S3 C11 H11B 109.6 . . ? C10 C11 S3 110.4(10) . . ? C10 C11 H11A 109.6 . . ? C10 C11 H11B 109.6 . . ? H11A C11 H11B 108.1 . . ? C59 C64 H64 119.7 . . ? C59 C64 C63 120.6(12) . . ? C63 C64 H64 119.7 . . ? C32 C31 H31 120.8 . . ? C32 C31 C30 118.4(13) . . ? C30 C31 H31 120.8 . . ? O8 C56 In02 62.6(6) . . ? O8 C56 O7 121.3(10) . . ? O8 C56 C57 121.2(10) . . ? O7 C56 In02 58.9(5) . . ? O7 C56 C57 117.5(9) . . ? C57 C56 In02 173.8(8) . . ? O11 C38 In02 56.7(5) . . ? O11 C38 C39 117.1(9) . . ? O12 C38 In02 65.7(6) . . ? O12 C38 O11 122.0(10) . . ? O12 C38 C39 120.8(11) . . ? C39 C38 In02 171.4(9) . . ? C14 C13 C12 121.2(12) . . ? C18 C13 C14 117.6(12) . . ? C18 C13 C12 121.1(12) . . ? S8 C40 S7 122.9(8) . . ? C41 C40 S8 125.0(11) . . ? C41 C40 S7 111.9(10) . . ? C37 C36 H36 120.3 . . ? C37 C36 C35 119.5(12) . . ? C35 C36 H36 120.3 . . ? C64 C59 C58 122.3(11) . . ? C64 C59 C60 118.8(11) . . ? C60 C59 C58 118.9(11) . . ? S1 C2 H2A 108.3 . . ? S1 C2 H2B 108.3 . . ? C1 C2 S1 115.8(8) . . ? C1 C2 H2A 108.3 . . ? C1 C2 H2B 108.3 . . ? H2A C2 H2B 107.4 . . ? S9 C48 H48A 109.3 . . ? S9 C48 H48B 109.3 . . ? C47 C48 S9 111.6(10) . . ? C47 C48 H48A 109.3 . . ? C47 C48 H48B 109.3 . . ? H48A C48 H48B 108.0 . . ? O5 C19 In01 62.6(6) . . ? O5 C19 O6 122.6(10) . . ? O5 C19 C20 120.5(10) . . ? O6 C19 In01 60.1(5) . . ? O6 C19 C20 116.9(9) . . ? C20 C19 In01 176.3(8) . . ? C41 C42 H42 118.8 . . ? C41 C42 C43 122.3(14) . . ? C43 C42 H42 118.8 . . ? N4 C69 C68 119.4(12) . . ? N4 C69 C70 116.3(11) . . ? C68 C69 C70 124.4(13) . . ? C50 C51 H51 120.0 . . ? C50 C51 C52 120.0(12) . . ? C52 C51 H51 120.0 . . ? C72 C73 H73 120.6 . . ? C72 C73 C74 118.8(14) . . ? C74 C73 H73 120.6 . . ? C67 C68 C69 121.4(14) . . ? C67 C68 H68 119.3 . . ? C69 C68 H68 119.3 . . ? S4 C12 S3 125.0(8) . . ? C13 C12 S3 113.3(9) . . ? C13 C12 S4 121.7(9) . . ? C22 C23 H23 119.8 . . ? C24 C23 C22 120.4(12) . . ? C24 C23 H23 119.8 . . ? C54 C53 H53 119.4 . . ? C52 C53 H53 119.4 . . ? C52 C53 C54 121.3(13) . . ? S10 C49 S9 124.2(8) . . ? C50 C49 S9 113.0(9) . . ? C50 C49 S10 122.8(10) . . ? C9 C4 C3 122.0(13) . . ? C9 C4 C5 119.2(12) . . ? C5 C4 C3 118.8(11) . . ? S5 C20 H20A 108.8 . . ? S5 C20 H20B 108.8 . . ? C19 C20 S5 113.8(8) . . ? C19 C20 H20A 108.8 . . ? C19 C20 H20B 108.8 . . ? H20A C20 H20B 107.7 . . ? C44 C45 C46 120.9(15) . . ? C44 C45 H45 119.6 . . ? C46 C45 H45 119.6 . . ? C44 C43 H43 121.9 . . ? C42 C43 C44 116.2(13) . . ? C42 C43 H43 121.9 . . ? C53 C54 H54 120.7 . . ? C55 C54 C53 118.7(11) . . ? C55 C54 H54 120.7 . . ? C51 C50 C49 119.1(11) . . ? C55 C50 C51 120.2(12) . . ? C55 C50 C49 120.7(11) . . ? C9 C8 H8 120.4 . . ? C7 C8 H8 120.4 . . ? C7 C8 C9 119.2(14) . . ? C33 C34 H34 120.9 . . ? C33 C34 C35 118.3(14) . . ? C35 C34 H34 120.9 . . ? C14 C15 H15 119.9 . . ? C14 C15 C16 120.3(13) . . ? C16 C15 H15 119.9 . . ? C16 C17 H17 119.9 . . ? C16 C17 C18 120.3(14) . . ? C18 C17 H17 119.9 . . ? S11 C57 H57A 108.4 . . ? S11 C57 H57B 108.4 . . ? C56 C57 S11 115.3(7) . . ? C56 C57 H57A 108.4 . . ? C56 C57 H57B 108.4 . . ? H57A C57 H57B 107.5 . . ? C27 C26 H26 121.3 . . ? C25 C26 C27 117.4(12) . . ? C25 C26 H26 121.3 . . ? N3 C74 C73 121.5(14) . . ? N3 C74 H74 119.2 . . ? C73 C74 H74 119.2 . . ? S7 C39 H39A 108.2 . . ? S7 C39 H39B 108.2 . . ? C38 C39 S7 116.2(9) . . ? C38 C39 H39A 108.2 . . ? C38 C39 H39B 108.2 . . ? H39A C39 H39B 107.4 . . ? C4 C9 C8 121.2(14) . . ? C4 C9 H9 119.4 . . ? C8 C9 H9 119.4 . . ? N3 C70 C71 117.6(13) . . ? N3 C70 C69 118.4(13) . . ? C71 C70 C69 124.0(13) . . ? C5 C6 H6 119.0 . . ? C7 C6 H6 119.0 . . ? C7 C6 C5 122.0(14) . . ? C51 C52 H52 120.4 . . ? C53 C52 C51 119.2(13) . . ? C53 C52 H52 120.4 . . ? S2 C3 S1 126.9(8) . . ? C4 C3 S1 110.5(9) . . ? C4 C3 S2 122.5(10) . . ? C54 C55 H55 119.8 . . ? C50 C55 C54 120.4(12) . . ? C50 C55 H55 119.8 . . ? C29 C30 C31 118.6(13) . . ? C29 C30 H30 120.7 . . ? C31 C30 H30 120.7 . . ? C64 C63 H63 120.5 . . ? C62 C63 C64 119.0(12) . . ? C62 C63 H63 120.5 . . ? C15 C16 H16 120.3 . . ? C17 C16 C15 119.3(14) . . ? C17 C16 H16 120.3 . . ? C13 C18 C17 121.2(13) . . ? C13 C18 H18 119.4 . . ? C17 C18 H18 119.4 . . ? C4 C5 H5 121.1 . . ? C6 C5 C4 117.7(12) . . ? C6 C5 H5 121.1 . . ? N4 C65 H65 118.2 . . ? N4 C65 C66 123.7(14) . . ? C66 C65 H65 118.2 . . ? C36 C35 C34 119.1(13) . . ? C36 C35 H35 120.5 . . ? C34 C35 H35 120.5 . . ? C59 C60 H60 119.6 . . ? C61 C60 C59 120.8(12) . . ? C61 C60 H60 119.6 . . ? C67 C66 C65 118.4(13) . . ? C67 C66 H66 120.8 . . ? C65 C66 H66 120.8 . . ? C26 C25 H25 119.1 . . ? C24 C25 C26 121.8(12) . . ? C24 C25 H25 119.1 . . ? C23 C24 H24 120.1 . . ? C25 C24 C23 119.8(13) . . ? C25 C24 H24 120.1 . . ? C63 C62 H62 119.0 . . ? C63 C62 C61 121.9(12) . . ? C61 C62 H62 119.0 . . ? C8 C7 H7 119.7 . . ? C6 C7 C8 120.6(13) . . ? C6 C7 H7 119.7 . . ? C60 C61 C62 118.8(12) . . ? C60 C61 H61 120.6 . . ? C62 C61 H61 120.6 . . ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 _geom_bond_publ_flag In01 O2 2.217(7) . ? In01 O4 2.327(9) . ? In01 O5 2.325(7) . ? In01 O3 2.257(10) . ? In01 O1 2.421(7) . ? In01 O6 2.270(7) . ? In01 N1 2.290(12) . ? In01 N2 2.314(10) . ? In01 C10 2.636(15) . ? In01 C1 2.661(11) . ? In01 C19 2.618(10) . ? In02 O8 2.357(7) . ? In02 O7 2.274(7) . ? In02 O11 2.232(7) . ? In02 O12 2.428(8) . ? In02 O10 2.227(10) . ? In02 O9 2.371(9) . ? In02 N4 2.289(11) . ? In02 N3 2.272(12) . ? In02 C47 2.599(13) . ? In02 C56 2.654(10) . ? In02 C38 2.660(11) . ? S3 C11 1.815(13) . ? S3 C12 1.720(13) . ? S1 C2 1.800(12) . ? S1 C3 1.729(14) . ? S2 C3 1.624(13) . ? S5 C21 1.748(12) . ? S5 C20 1.792(10) . ? S11 C58 1.742(12) . ? S11 C57 1.787(11) . ? S9 C48 1.786(13) . ? S9 C49 1.731(13) . ? S6 C21 1.652(12) . ? S12 C58 1.646(12) . ? S10 C49 1.638(13) . ? S4 C12 1.640(12) . ? S8 C40 1.657(13) . ? S7 C40 1.747(14) . ? S7 C39 1.794(12) . ? O8 C56 1.246(12) . ? O2 C1 1.269(12) . ? O4 C10 1.234(17) . ? O5 C19 1.249(12) . ? O3 C10 1.288(17) . ? O1 C1 1.263(12) . ? O7 C56 1.275(12) . ? O6 C19 1.269(12) . ? O11 C38 1.271(13) . ? O12 C38 1.236(13) . ? O10 C47 1.229(15) . ? O9 C47 1.238(16) . ? C29 H29 0.9500 . ? C29 C28 1.363(18) . ? C29 C30 1.39(2) . ? N1 C33 1.332(18) . ? N1 C37 1.359(16) . ? N2 C28 1.324(17) . ? N2 C32 1.353(16) . ? N4 C69 1.360(16) . ? N4 C65 1.333(17) . ? C28 H28 0.9500 . ? C33 C32 1.513(17) . ? C33 C34 1.373(18) . ? C67 H67 0.9500 . ? C67 C68 1.361(18) . ? C67 C66 1.35(2) . ? N3 C74 1.317(17) . ? N3 C70 1.363(18) . ? C10 C11 1.494(19) . ? C32 C31 1.360(18) . ? C44 H44 0.9500 . ? C44 C45 1.38(2) . ? C44 C43 1.420(19) . ? C37 H37 0.9500 . ? C37 C36 1.350(17) . ? C22 C21 1.455(15) . ? C22 C27 1.402(16) . ? C22 C23 1.384(16) . ? C1 C2 1.511(14) . ? C72 H72 0.9500 . ? C72 C71 1.352(18) . ? C72 C73 1.377(19) . ? C27 H27 0.9500 . ? C27 C26 1.396(16) . ? C14 H14 0.9500 . ? C14 C13 1.390(16) . ? C14 C15 1.365(16) . ? C58 C59 1.481(15) . ? C71 H71 0.9500 . ? C71 C70 1.429(19) . ? C41 C46 1.43(2) . ? C41 C40 1.466(17) . ? C41 C42 1.32(2) . ? C47 C48 1.558(19) . ? C46 H46 0.9500 . ? C46 C45 1.393(19) . ? C11 H11A 0.9900 . ? C11 H11B 0.9900 . ? C64 H64 0.9500 . ? C64 C59 1.380(16) . ? C64 C63 1.398(17) . ? C31 H31 0.9500 . ? C31 C30 1.400(18) . ? C56 C57 1.520(14) . ? C38 C39 1.521(16) . ? C13 C12 1.482(17) . ? C13 C18 1.386(17) . ? C36 H36 0.9500 . ? C36 C35 1.384(18) . ? C59 C60 1.400(16) . ? C2 H2A 0.9900 . ? C2 H2B 0.9900 . ? C48 H48A 0.9900 . ? C48 H48B 0.9900 . ? C19 C20 1.523(14) . ? C42 H42 0.9500 . ? C42 C43 1.418(17) . ? C69 C68 1.414(18) . ? C69 C70 1.461(18) . ? C51 H51 0.9500 . ? C51 C50 1.390(17) . ? C51 C52 1.395(17) . ? C73 H73 0.9500 . ? C73 C74 1.399(18) . ? C68 H68 0.9500 . ? C23 H23 0.9500 . ? C23 C24 1.381(16) . ? C53 H53 0.9500 . ? C53 C54 1.397(18) . ? C53 C52 1.367(18) . ? C49 C50 1.497(18) . ? C4 C9 1.370(17) . ? C4 C3 1.497(16) . ? C4 C5 1.42(2) . ? C20 H20A 0.9900 . ? C20 H20B 0.9900 . ? C45 H45 0.9500 . ? C43 H43 0.9500 . ? C54 H54 0.9500 . ? C54 C55 1.394(16) . ? C50 C55 1.367(16) . ? C8 H8 0.9500 . ? C8 C9 1.407(18) . ? C8 C7 1.37(2) . ? C34 H34 0.9500 . ? C34 C35 1.398(17) . ? C15 H15 0.9500 . ? C15 C16 1.400(19) . ? C17 H17 0.9500 . ? C17 C16 1.352(19) . ? C17 C18 1.394(18) . ? C57 H57A 0.9900 . ? C57 H57B 0.9900 . ? C26 H26 0.9500 . ? C26 C25 1.391(18) . ? C74 H74 0.9500 . ? C39 H39A 0.9900 . ? C39 H39B 0.9900 . ? C9 H9 0.9500 . ? C6 H6 0.9500 . ? C6 C5 1.403(16) . ? C6 C7 1.353(19) . ? C52 H52 0.9500 . ? C55 H55 0.9500 . ? C30 H30 0.9500 . ? C63 H63 0.9500 . ? C63 C62 1.356(16) . ? C16 H16 0.9500 . ? C18 H18 0.9500 . ? C5 H5 0.9500 . ? C65 H65 0.9500 . ? C65 C66 1.408(19) . ? C35 H35 0.9500 . ? C60 H60 0.9500 . ? C60 C61 1.372(16) . ? C66 H66 0.9500 . ? C25 H25 0.9500 . ? C25 C24 1.380(17) . ? C24 H24 0.9500 . ? C62 H62 0.9500 . ? C62 C61 1.388(17) . ? C7 H7 0.9500 . ? C61 H61 0.9500 . ? 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 _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion_publ_flag In01 O2 C1 O1 4.8(13) . . . . ? In01 O2 C1 C2 -173.5(8) . . . . ? In01 O4 C10 O3 -6.1(10) . . . . ? In01 O4 C10 C11 171.1(10) . . . . ? In01 O5 C19 O6 -4.5(11) . . . . ? In01 O5 C19 C20 177.7(9) . . . . ? In01 O3 C10 O4 6.3(10) . . . . ? In01 O3 C10 C11 -171.1(9) . . . . ? In01 O1 C1 O2 -4.4(12) . . . . ? In01 O1 C1 C2 173.9(10) . . . . ? In01 O6 C19 O5 4.6(11) . . . . ? In01 O6 C19 C20 -177.5(9) . . . . ? In01 N1 C33 C32 0.6(13) . . . . ? In01 N1 C33 C34 -177.1(9) . . . . ? In01 N1 C37 C36 178.5(9) . . . . ? In01 N2 C28 C29 -173.9(8) . . . . ? In01 N2 C32 C33 -6.6(11) . . . . ? In01 N2 C32 C31 172.8(8) . . . . ? In02 O8 C56 O7 -5.5(11) . . . . ? In02 O8 C56 C57 174.5(9) . . . . ? In02 O7 C56 O8 5.7(12) . . . . ? In02 O7 C56 C57 -174.3(8) . . . . ? In02 O11 C38 O12 -7.4(15) . . . . ? In02 O11 C38 C39 173.0(11) . . . . ? In02 O12 C38 O11 6.8(14) . . . . ? In02 O12 C38 C39 -173.7(12) . . . . ? In02 O10 C47 O9 -3.6(11) . . . . ? In02 O10 C47 C48 174.6(9) . . . . ? In02 O9 C47 O10 3.4(11) . . . . ? In02 O9 C47 C48 -174.7(10) . . . . ? In02 N4 C69 C68 179.5(8) . . . . ? In02 N4 C69 C70 0.1(12) . . . . ? In02 N4 C65 C66 -178.2(8) . . . . ? In02 N3 C74 C73 173.0(10) . . . . ? In02 N3 C70 C71 -172.6(8) . . . . ? In02 N3 C70 C69 5.6(13) . . . . ? S11 C58 C59 C64 -19.6(15) . . . . ? S11 C58 C59 C60 159.8(10) . . . . ? S9 C49 C50 C51 145.6(10) . . . . ? S9 C49 C50 C55 -33.0(15) . . . . ? S12 C58 C59 C64 159.4(10) . . . . ? S12 C58 C59 C60 -21.1(17) . . . . ? S10 C49 C50 C51 -34.6(16) . . . . ? S10 C49 C50 C55 146.8(10) . . . . ? O8 C56 C57 S11 -23.2(14) . . . . ? O2 C1 C2 S1 157.2(9) . . . . ? O4 C10 C11 S3 9.4(15) . . . . ? O5 C19 C20 S5 -14.2(14) . . . . ? O3 C10 C11 S3 -173.4(8) . . . . ? O1 C1 C2 S1 -21.2(15) . . . . ? O7 C56 C57 S11 156.8(9) . . . . ? O6 C19 C20 S5 167.9(8) . . . . ? O11 C38 C39 S7 -157.2(11) . . . . ? O12 C38 C39 S7 23.2(19) . . . . ? O10 C47 C48 S9 172.0(8) . . . . ? O9 C47 C48 S9 -9.7(14) . . . . ? N1 C33 C32 N2 3.9(14) . . . . ? N1 C33 C32 C31 -175.4(10) . . . . ? N1 C33 C34 C35 -2.1(19) . . . . ? N1 C37 C36 C35 -0.5(19) . . . . ? N2 C32 C31 C30 2.1(16) . . . . ? N4 C69 C68 C67 -0.5(17) . . . . ? N4 C69 C70 N3 -3.9(15) . . . . ? N4 C69 C70 C71 174.2(11) . . . . ? N4 C65 C66 C67 -2.0(18) . . . . ? C28 C29 C30 C31 -0.4(17) . . . . ? C28 N2 C32 C33 178.8(9) . . . . ? C28 N2 C32 C31 -1.8(15) . . . . ? C33 N1 C37 C36 -1.8(18) . . . . ? C33 C32 C31 C30 -178.6(10) . . . . ? C33 C34 C35 C36 -0.3(18) . . . . ? C32 N2 C28 C29 0.4(15) . . . . ? C32 C33 C34 C35 -179.7(10) . . . . ? C32 C31 C30 C29 -0.9(16) . . . . ? C37 N1 C33 C32 -179.1(10) . . . . ? C37 N1 C33 C34 3.1(18) . . . . ? C37 C36 C35 C34 1.6(18) . . . . ? C22 C27 C26 C25 0.1(17) . . . . ? C22 C23 C24 C25 -1.9(18) . . . . ? C21 S5 C20 C19 -78.9(9) . . . . ? C21 C22 C27 C26 175.6(10) . . . . ? C21 C22 C23 C24 -174.7(11) . . . . ? C72 C71 C70 N3 -0.1(18) . . . . ? C72 C71 C70 C69 -178.2(11) . . . . ? C72 C73 C74 N3 -2(2) . . . . ? C27 C22 C21 S5 -37.9(13) . . . . ? C27 C22 C21 S6 146.1(10) . . . . ? C27 C22 C23 C24 4.4(18) . . . . ? C27 C26 C25 C24 2.6(18) . . . . ? C14 C13 C12 S3 37.5(14) . . . . ? C14 C13 C12 S4 -141.5(10) . . . . ? C14 C13 C18 C17 -3.6(18) . . . . ? C14 C15 C16 C17 -2.5(19) . . . . ? C58 S11 C57 C56 -70.0(9) . . . . ? C58 C59 C60 C61 178.9(11) . . . . ? C71 C72 C73 C74 2.0(19) . . . . ? C41 C46 C45 C44 -1.4(18) . . . . ? C41 C42 C43 C44 0(2) . . . . ? C46 C41 C40 S8 -145.9(11) . . . . ? C46 C41 C40 S7 37.6(16) . . . . ? C46 C41 C42 C43 -1(2) . . . . ? C11 S3 C12 S4 11.0(10) . . . . ? C11 S3 C12 C13 -168.0(8) . . . . ? C64 C59 C60 C61 -2(2) . . . . ? C64 C63 C62 C61 3(2) . . . . ? C13 C14 C15 C16 2.9(18) . . . . ? C40 S7 C39 C38 75.6(12) . . . . ? C40 C41 C46 C45 178.2(12) . . . . ? C40 C41 C42 C43 -177.3(12) . . . . ? C59 C64 C63 C62 -1.9(19) . . . . ? C59 C60 C61 C62 3(2) . . . . ? C2 S1 C3 S2 -2.2(10) . . . . ? C2 S1 C3 C4 -179.8(9) . . . . ? C48 S9 C49 S10 -8.8(10) . . . . ? C48 S9 C49 C50 171.0(9) . . . . ? C42 C41 C46 C45 2(2) . . . . ? C42 C41 C40 S8 30.3(19) . . . . ? C42 C41 C40 S7 -146.2(12) . . . . ? C69 N4 C65 C66 0.7(17) . . . . ? C51 C50 C55 C54 3.2(18) . . . . ? C73 C72 C71 C70 -1.2(18) . . . . ? C68 C67 C66 C65 1.9(18) . . . . ? C68 C69 C70 N3 176.8(10) . . . . ? C68 C69 C70 C71 -5.2(18) . . . . ? C12 S3 C11 C10 -176.4(8) . . . . ? C12 C13 C18 C17 -178.1(11) . . . . ? C23 C22 C21 S5 141.2(10) . . . . ? C23 C22 C21 S6 -34.8(15) . . . . ? C23 C22 C27 C26 -3.6(18) . . . . ? C53 C54 C55 C50 -5.2(18) . . . . ? C49 S9 C48 C47 176.3(8) . . . . ? C49 C50 C55 C54 -178.2(11) . . . . ? C20 S5 C21 S6 -5.2(9) . . . . ? C20 S5 C21 C22 178.7(8) . . . . ? C45 C44 C43 C42 0.9(18) . . . . ? C43 C44 C45 C46 -0.1(18) . . . . ? C54 C53 C52 C51 1(2) . . . . ? C50 C51 C52 C53 -3(2) . . . . ? C34 C33 C32 N2 -178.3(11) . . . . ? C34 C33 C32 C31 2.3(17) . . . . ? C15 C14 C13 C12 174.6(11) . . . . ? C15 C14 C13 C18 0.2(18) . . . . ? C57 S11 C58 S12 -2.9(9) . . . . ? C57 S11 C58 C59 176.2(8) . . . . ? C26 C25 C24 C23 -1.8(19) . . . . ? C74 N3 C70 C71 0.5(16) . . . . ? C74 N3 C70 C69 178.7(11) . . . . ? C39 S7 C40 S8 3.7(11) . . . . ? C39 S7 C40 C41 -179.7(10) . . . . ? C9 C4 C3 S1 -36.8(15) . . . . ? C9 C4 C3 S2 145.5(11) . . . . ? C9 C4 C5 C6 0.6(18) . . . . ? C9 C8 C7 C6 -2(2) . . . . ? C70 N3 C74 C73 0.4(18) . . . . ? C70 C69 C68 C67 178.8(11) . . . . ? C52 C51 C50 C49 -177.8(12) . . . . ? C52 C51 C50 C55 0.7(19) . . . . ? C52 C53 C54 C55 3(2) . . . . ? C3 S1 C2 C1 -76.8(9) . . . . ? C3 C4 C9 C8 177.3(12) . . . . ? C3 C4 C5 C6 -177.6(11) . . . . ? C30 C29 C28 N2 0.7(17) . . . . ? C63 C64 C59 C58 -179.3(10) . . . . ? C63 C64 C59 C60 1(2) . . . . ? C63 C62 C61 C60 -3(2) . . . . ? C16 C17 C18 C13 4(2) . . . . ? C18 C13 C12 S3 -148.2(10) . . . . ? C18 C13 C12 S4 32.7(16) . . . . ? C18 C17 C16 C15 -1(2) . . . . ? C5 C4 C9 C8 -0.8(19) . . . . ? C5 C4 C3 S1 141.4(10) . . . . ? C5 C4 C3 S2 -36.3(16) . . . . ? C5 C6 C7 C8 2(2) . . . . ? C65 N4 C69 C68 0.5(15) . . . . ? C65 N4 C69 C70 -178.8(10) . . . . ? C66 C67 C68 C69 -0.7(18) . . . . ? C7 C8 C9 C4 2(2) . . . . ? C7 C6 C5 C4 -1.1(19) . . . . ?