#------------------------------------------------------------------------------ #$Date: 2019-10-07 12:07:06 +0300 (Mon, 07 Oct 2019) $ #$Revision: 219127 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/23/44/7234415.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_7234415 loop_ _publ_author_name 'Rawad K. Hallani' 'Karl J. Thorley' 'Anna K. Hailey' 'Sean R. Parkin' 'Yueh-Lin Loo' 'John E. Anthony' _publ_section_title ; The effect of regioisomerism on the crystal packing and device performance of desymmetrized anthradithiophenes ; _journal_name_full 'Journal of Materials Chemistry C' _journal_page_first 8956 _journal_page_last 8962 _journal_paper_doi 10.1039/C5TC02145F _journal_volume 3 _journal_year 2015 _chemical_formula_moiety 'C32 H36 S2 Si' _chemical_formula_sum 'C32 H36 S2 Si' _chemical_formula_weight 512.82 _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2yn' _space_group_name_H-M_alt 'P 1 21/n 1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _cell_angle_alpha 90 _cell_angle_beta 106.5718(4) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 13.8929(1) _cell_length_b 8.6826(1) _cell_length_c 24.1422(2) _cell_measurement_reflns_used 73441 _cell_measurement_temperature 90.0(2) _cell_measurement_theta_max 27.48 _cell_measurement_theta_min 1.00 _cell_volume 2791.23(4) _computing_cell_refinement 'SCALEPACK (Otwinowski & Minor, 2006)' _computing_data_collection 'COLLECT (Nonius, 1998)' _computing_data_reduction 'DENZO-SMN (Otwinowski & Minor, 2006)' _computing_molecular_graphics 'XP in SHELXTL (Sheldrick, 2008)' _computing_publication_material 'SHELX (Sheldrick, 2008) and CIFFIX (Parkin, 2013)' _computing_structure_refinement 'SHELXL-2013 (Sheldrick, 2008)' _computing_structure_solution 'SHELXS-97 (Sheldrick, 2008)' _diffrn_ambient_temperature 90.0(2) _diffrn_detector_area_resol_mean 9.1 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 0.999 _diffrn_measurement_device_type 'Nonius KappaCCD diffractometer' _diffrn_measurement_method '\f and \w scans at fixed \c = 55\%' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0567 _diffrn_reflns_av_unetI/netI 0.0329 _diffrn_reflns_Laue_measured_fraction_full 1.000 _diffrn_reflns_Laue_measured_fraction_max 0.999 _diffrn_reflns_limit_h_max 18 _diffrn_reflns_limit_h_min -18 _diffrn_reflns_limit_k_max 11 _diffrn_reflns_limit_k_min -11 _diffrn_reflns_limit_l_max 31 _diffrn_reflns_limit_l_min -31 _diffrn_reflns_number 74901 _diffrn_reflns_point_group_measured_fraction_full 1.000 _diffrn_reflns_point_group_measured_fraction_max 0.999 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.505 _diffrn_reflns_theta_min 1.531 _diffrn_source 'fine-focus sealed-tube' _exptl_absorpt_coefficient_mu 0.253 _exptl_absorpt_correction_T_max 0.970 _exptl_absorpt_correction_T_min 0.821 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details 'SADABS (Sheldrick, 2008)' _exptl_crystal_colour red _exptl_crystal_density_diffrn 1.220 _exptl_crystal_density_meas . _exptl_crystal_density_method . _exptl_crystal_description rod _exptl_crystal_F_000 1096 _exptl_crystal_size_max 0.220 _exptl_crystal_size_mid 0.200 _exptl_crystal_size_min 0.160 _exptl_transmission_factor_max . _exptl_transmission_factor_min . _refine_diff_density_max 0.637 _refine_diff_density_min -0.693 _refine_diff_density_rms 0.065 _refine_ls_extinction_coef . _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.140 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 368 _refine_ls_number_reflns 6415 _refine_ls_number_restraints 235 _refine_ls_restrained_S_all 1.161 _refine_ls_R_factor_all 0.0955 _refine_ls_R_factor_gt 0.0686 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.1181P)^2^+0.9426P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1991 _refine_ls_wR_factor_ref 0.2216 _reflns_Friedel_coverage 0.000 _reflns_Friedel_fraction_full . _reflns_Friedel_fraction_max . _reflns_number_gt 4301 _reflns_number_total 6415 _reflns_threshold_expression 'I > 2\s(I)' _iucr_refine_instructions_details ; TITL k13119s in P21/n CELL 0.71073 13.8929 8.6826 24.1422 90.000 106.5718 90.000 ZERR 4.00 0.0001 0.0001 0.0002 0.000 0.0004 0.000 LATT 1 SYMM 1/2-X, 1/2+Y, 1/2-Z SFAC C H SI S UNIT 128 144 4 8 TEMP -183 SIZE 0.22 0.20 0.16 REM COLR red REM FORM rod REM Cell: 73441, 1.00, 27.48 L.S. 24 BOND $H CONF HTAB ACTA LIST 4 FMAP 2 PLAN 10 SADI 0.020 SI1 C23 Si1 C27 si1 C31 si1 C27' si1 C31' WGHT 0.118100 0.942600 FVAR 0.42675 0.70793 0.75710 0.67020 0.70310 SI1 3 0.524556 0.817800 0.287343 11.00000 0.06682 0.06710 = 0.06126 0.02831 0.02509 0.00261 C1 1 0.494046 0.450269 0.411652 11.00000 0.03070 0.03188 = 0.03582 -0.00280 0.01381 -0.00077 C2 1 0.577966 0.353242 0.432161 11.00000 0.02637 0.03202 = 0.03961 -0.00213 0.01463 -0.00072 C3 1 0.664386 0.366124 0.411977 11.00000 0.03177 0.03541 = 0.04754 -0.00413 0.02073 -0.00268 AFIX 43 H3 2 0.667202 0.443132 0.384529 11.00000 -1.20000 AFIX 0 EXYZ C4 C4' EXYZ C8 C8' EADP C4 C4' EADP S5 C5' EADP C6 C6' EADP C7 S7' EADP C8 C8' SAME 0.020 C8' S7' C6' C5' C4' RIGU 0.010 C4 > C8' PART 1 C4 1 0.743078 0.267841 0.432079 21.00000 0.02884 0.03810 = 0.05258 -0.01141 0.01890 -0.00413 S5 4 0.853447 0.263383 0.410379 21.00000 0.02929 0.05108 = 0.06955 -0.00853 0.02870 -0.00016 C6 1 0.897599 0.109776 0.457431 21.00000 0.02943 0.04664 = 0.07551 -0.01047 0.02084 0.00272 AFIX 43 H6 2 0.960587 0.061364 0.461576 21.00000 -1.20000 AFIX 0 C7 1 0.832396 0.065734 0.487874 21.00000 0.02730 0.04524 = 0.07938 -0.00805 0.01606 0.01104 AFIX 43 H7 2 0.846451 -0.015113 0.515537 21.00000 -1.20000 AFIX 0 C8 1 0.742184 0.152271 0.474126 21.00000 0.02725 0.03706 = 0.05131 -0.00808 0.01212 0.00167 PART 2 C4' 1 0.743078 0.267841 0.432079 -21.00000 0.02884 0.03810 = 0.05258 -0.01141 0.01890 -0.00413 C5' 1 0.834688 0.261398 0.419696 -21.00000 0.02929 0.05108 = 0.06955 -0.00853 0.02870 -0.00016 AFIX 43 H5' 2 0.851496 0.329714 0.393149 -21.00000 -1.20000 AFIX 0 C6' 1 0.899077 0.149211 0.448597 -21.00000 0.02943 0.04664 = 0.07551 -0.01047 0.02084 0.00272 AFIX 43 H6' 2 0.963920 0.132052 0.444033 -21.00000 -1.20000 AFIX 0 S7' 4 0.848960 0.041739 0.494547 -21.00000 0.02730 0.04524 = 0.07938 -0.00805 0.01606 0.01104 C8' 1 0.742184 0.152271 0.474126 -21.00000 0.02725 0.03706 = 0.05131 -0.00808 0.01212 0.00167 PART 0 C9 1 0.660496 0.137969 0.495007 11.00000 0.03180 0.03396 = 0.04371 -0.00014 0.01123 0.00335 AFIX 43 H9 2 0.660544 0.062233 0.523415 11.00000 -1.20000 AFIX 0 C10 1 0.575488 0.236274 0.474269 11.00000 0.02765 0.03278 = 0.03798 -0.00367 0.01129 0.00062 C11 1 0.490625 0.222327 0.493655 11.00000 0.03345 0.03207 = 0.03818 0.00113 0.01382 -0.00094 AFIX 43 H11 2 0.490045 0.146501 0.521926 11.00000 -1.20000 AFIX 0 C12 1 0.406567 0.315820 0.472987 11.00000 0.02913 0.03205 = 0.03854 -0.00581 0.01503 -0.00253 C13 1 0.319658 0.296990 0.492328 11.00000 0.03399 0.03809 = 0.04723 -0.00408 0.02042 -0.00367 AFIX 43 H13 2 0.318508 0.220711 0.520342 11.00000 -1.20000 AFIX 0 EXYZ C14 C14' EXYZ C18 C18' EADP C14 C14' EADP S15 C15' EADP C16 C16' EADP C17 S17' EADP C18 C18' SAME 0.020 C18' S17' C16' C15' C14' RIGU 0.010 C14 > C18' PART 1 C14 1 0.238197 0.388656 0.470545 31.00000 0.02762 0.03951 = 0.04938 -0.01374 0.02001 -0.00471 S15 4 0.125197 0.379925 0.488368 31.00000 0.02932 0.04548 = 0.07167 -0.00901 0.02763 -0.00189 C16 1 0.078552 0.534678 0.441401 31.00000 0.02836 0.04545 = 0.07345 -0.01390 0.01803 0.00265 AFIX 43 H16 2 0.013405 0.576839 0.435941 31.00000 -1.20000 AFIX 0 C17 1 0.141669 0.586492 0.414662 31.00000 0.03704 0.05292 = 0.06468 -0.01486 0.01707 0.00206 AFIX 43 H17 2 0.125827 0.669622 0.388015 31.00000 -1.20000 AFIX 0 C18 1 0.238707 0.506738 0.428868 31.00000 0.02818 0.03574 = 0.04994 -0.01213 0.01160 0.00032 PART 2 C14' 1 0.238197 0.388656 0.470545 -31.00000 0.02762 0.03951 = 0.04938 -0.01374 0.02001 -0.00471 C15' 1 0.138638 0.403840 0.480424 -31.00000 0.02932 0.04548 = 0.07167 -0.00901 0.02763 -0.00189 AFIX 43 H15' 2 0.120325 0.343291 0.508599 -31.00000 -1.20000 AFIX 0 C16' 1 0.077442 0.502921 0.449150 -31.00000 0.02836 0.04545 = 0.07345 -0.01390 0.01803 0.00265 AFIX 43 H16' 2 0.010568 0.515441 0.451122 -31.00000 -1.20000 AFIX 0 S17' 4 0.126915 0.612561 0.402808 -31.00000 0.03704 0.05292 = 0.06468 -0.01486 0.01707 0.00206 C18' 1 0.238707 0.506738 0.428868 -31.00000 0.02818 0.03574 = 0.04994 -0.01213 0.01160 0.00032 PART 0 C19 1 0.321041 0.527697 0.409605 11.00000 0.03247 0.03389 = 0.04518 -0.00338 0.01148 0.00194 AFIX 43 H19 2 0.320775 0.605614 0.381936 11.00000 -1.20000 AFIX 0 C20 1 0.406964 0.433424 0.430804 11.00000 0.02622 0.03298 = 0.03905 -0.00498 0.01249 -0.00088 C21 1 0.498208 0.570194 0.371180 11.00000 0.03224 0.04318 = 0.04307 -0.00024 0.01550 0.00340 C22 1 0.506340 0.669920 0.338156 11.00000 0.04854 0.05468 = 0.04964 0.01086 0.02102 0.00305 SAME 0.010 C27 C28 C29 C30 SAME 0.010 C31 c32 c33 c34 C23 1 0.663401 0.805931 0.292534 11.00000 0.07635 0.07751 = 0.06578 0.00683 0.03722 -0.01564 AFIX 13 H23 2 0.674898 0.697843 0.281599 11.00000 -1.20000 AFIX 0 C24 1 0.691579 0.910599 0.246933 11.00000 0.09114 0.14792 = 0.08568 0.03627 0.04119 -0.02400 AFIX 137 H24A 2 0.698852 1.017323 0.260715 11.00000 -1.50000 H24B 2 0.638469 0.904881 0.210190 11.00000 -1.50000 H24C 2 0.755104 0.875302 0.241267 11.00000 -1.50000 AFIX 0 C25 1 0.732571 0.828679 0.351406 11.00000 0.07547 0.07812 = 0.07423 0.00484 0.03148 -0.00950 AFIX 23 H25A 2 0.705796 0.771219 0.379205 11.00000 -1.20000 H25B 2 0.732668 0.939338 0.361307 11.00000 -1.20000 AFIX 0 C26 1 0.840556 0.778078 0.359378 11.00000 0.08312 0.08692 = 0.08788 -0.00432 0.02900 0.00365 AFIX 137 H26A 2 0.842203 0.667173 0.352162 11.00000 -1.50000 H26B 2 0.880797 0.800545 0.398996 11.00000 -1.50000 H26C 2 0.868206 0.833932 0.332109 11.00000 -1.50000 AFIX 0 SAME 0.005 C27' C28' C29' C30' RIGU 0.005 C27 > C30' EADP C27 C27' EADP C28 C28' EADP C29 C29' EADP C30 C30' PART 1 C27 1 0.442798 0.772274 0.214132 41.00000 0.08417 0.07282 = 0.06467 0.03909 0.01983 0.01082 AFIX 13 H27 2 0.449975 0.855534 0.186965 41.00000 -1.20000 AFIX 0 C28 1 0.330282 0.763865 0.214452 41.00000 0.09342 0.11361 = 0.09298 0.01807 0.02004 -0.00034 AFIX 137 H28A 2 0.287090 0.752398 0.174755 41.00000 -1.50000 H28B 2 0.312437 0.858642 0.231247 41.00000 -1.50000 H28C 2 0.320956 0.675297 0.237552 41.00000 -1.50000 AFIX 0 C29 1 0.476869 0.623283 0.194988 41.00000 0.08223 0.09168 = 0.06166 0.01496 0.00722 -0.00608 AFIX 23 H29A 2 0.475290 0.543702 0.224083 41.00000 -1.20000 H29B 2 0.547705 0.635319 0.194937 41.00000 -1.20000 AFIX 0 C30 1 0.417930 0.564581 0.136716 41.00000 0.10689 0.10550 = 0.05734 0.01241 0.00921 -0.01755 AFIX 137 H30A 2 0.454860 0.480393 0.124997 41.00000 -1.50000 H30B 2 0.407906 0.648245 0.108390 41.00000 -1.50000 H30C 2 0.352536 0.526773 0.138709 41.00000 -1.50000 AFIX 0 PART 2 C27' 1 0.466514 0.715280 0.212752 -41.00000 0.08417 0.07282 = 0.06467 0.03909 0.01983 0.01082 AFIX 13 H27' 2 0.469921 0.794750 0.183389 -41.00000 -1.20000 AFIX 0 C28' 1 0.526754 0.574283 0.198605 -41.00000 0.09342 0.11361 = 0.09298 0.01807 0.02004 -0.00034 AFIX 33 H28D 2 0.590656 0.564023 0.228890 -41.00000 -1.50000 H28E 2 0.539855 0.591096 0.161271 -41.00000 -1.50000 H28F 2 0.487247 0.479966 0.196849 -41.00000 -1.50000 AFIX 0 C29' 1 0.357799 0.675290 0.198541 -41.00000 0.08223 0.09168 = 0.06166 0.01496 0.00722 -0.00608 AFIX 23 H29C 2 0.320600 0.771143 0.200934 -41.00000 -1.20000 H29D 2 0.349083 0.605598 0.229208 -41.00000 -1.20000 AFIX 0 C30' 1 0.307933 0.601221 0.141462 -41.00000 0.10689 0.10550 = 0.05734 0.01241 0.00921 -0.01755 AFIX 33 H30D 2 0.236919 0.630746 0.128868 -41.00000 -1.50000 H30E 2 0.313384 0.488995 0.145468 -41.00000 -1.50000 H30F 2 0.340901 0.635508 0.112740 -41.00000 -1.50000 AFIX 0 PART 0 SAME 0.005 C31' C32' C33' C34' EADP C31 C31' EADP C32 C32' EADP C33 C33' EADP C34 C34' RIGU 0.005 C31 > C34' PART 1 C31 1 0.488196 1.009363 0.313631 51.00000 0.14093 0.07693 = 0.10382 0.05523 0.05410 0.04763 AFIX 13 H31 2 0.551160 1.045577 0.342406 51.00000 -1.20000 AFIX 0 C32 1 0.407763 1.004885 0.349021 51.00000 0.13993 0.08153 = 0.07871 0.00431 0.02181 0.04728 AFIX 137 H32A 2 0.344254 0.963582 0.324451 51.00000 -1.50000 H32B 2 0.396951 1.109390 0.361375 51.00000 -1.50000 H32C 2 0.432476 0.938921 0.383063 51.00000 -1.50000 AFIX 0 C33 1 0.469679 1.125287 0.266716 51.00000 0.28841 0.11585 = 0.19677 0.10964 0.11250 0.08166 AFIX 23 H33A 2 0.532398 1.186021 0.274222 51.00000 -1.20000 H33B 2 0.464369 1.066292 0.230875 51.00000 -1.20000 AFIX 0 C34 1 0.388119 1.237584 0.251741 51.00000 0.27803 0.12979 = 0.20746 0.10190 0.12620 0.06362 AFIX 137 H34A 2 0.377174 1.271036 0.211648 51.00000 -1.50000 H34B 2 0.405879 1.326761 0.277530 51.00000 -1.50000 H34C 2 0.326558 1.190331 0.255993 51.00000 -1.50000 AFIX 0 PART 2 C31' 1 0.442461 0.987404 0.289442 -51.00000 0.14093 0.07693 = 0.10382 0.05523 0.05410 0.04763 AFIX 13 H31' 2 0.371551 0.952146 0.282832 -51.00000 -1.20000 AFIX 0 C32' 1 0.490446 1.025045 0.355950 -51.00000 0.13993 0.08153 = 0.07871 0.00431 0.02181 0.04728 AFIX 33 H32D 2 0.467303 0.949228 0.379380 -51.00000 -1.50000 H32E 2 0.469843 1.128385 0.364288 -51.00000 -1.50000 H32F 2 0.563821 1.020763 0.365251 -51.00000 -1.50000 AFIX 0 C33' 1 0.445197 1.118312 0.249930 -51.00000 0.28841 0.11585 = 0.19677 0.10964 0.11250 0.08166 AFIX 23 H33C 2 0.413630 1.081219 0.210101 -51.00000 -1.20000 H33D 2 0.400501 1.199215 0.257668 -51.00000 -1.20000 AFIX 0 C34' 1 0.539120 1.194608 0.249471 -51.00000 0.27803 0.12979 = 0.20746 0.10190 0.12620 0.06362 AFIX 33 H34D 2 0.526682 1.263251 0.215945 -51.00000 -1.50000 H34E 2 0.588931 1.116798 0.247163 -51.00000 -1.50000 H34F 2 0.564524 1.254769 0.284998 -51.00000 -1.50000 PART 0 AFIX 0 HKLF 4 REM k13119s in P21/n REM R1 = 0.0686 for 4301 Fo > 4sig(Fo) and 0.0955 for all 6415 data REM 368 parameters refined using 235 restraints END WGHT 0.1181 0.9334 REM Instructions for potential hydrogen bonds EQIV $1 -x+2, -y, -z+1 HTAB C6' S7'_$1 REM Highest difference peak 0.637, deepest hole -0.693, 1-sigma level 0.065 Q1 1 0.4174 1.0876 0.3182 11.00000 0.05 0.64 Q2 1 0.6550 0.8974 0.3167 11.00000 0.05 0.52 Q3 1 0.7263 0.7262 0.3312 11.00000 0.05 0.52 Q4 1 0.4682 0.9571 0.2889 11.00000 0.05 0.47 Q5 1 0.5635 1.1593 0.2796 11.00000 0.05 0.46 Q6 1 0.5001 1.0165 0.3365 11.00000 0.05 0.41 Q7 1 0.5145 1.0425 0.3212 11.00000 0.05 0.37 Q8 1 0.7929 0.8726 0.2419 11.00000 0.05 0.36 Q9 1 0.2702 0.5911 0.1539 11.00000 0.05 0.34 Q10 1 0.4611 0.8405 0.2683 11.00000 0.05 0.29 ; _cod_data_source_file J-Mater-Chem-C-2015-3-8956.cif _cod_data_source_block k13119 _cod_original_sg_symbol_H-M 'P 21/n' _cod_database_code 7234415 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_min 0.946 _shelx_estimated_absorpt_t_max 0.961 _shelxl_version_number 2013-4 _shelx_res_checksum 63761 _shelx_hkl_file ; 2 0 0 567.52 26.28 0.969 -2 0 0 538.08 26.48 0.969 2 0 0 545.65 26.22 0.969 -2 0 0 555.27 26.44 0.969 -2 0 0 554.60 25.85 0.969 -2 0 0 569.82 26.65 0.969 2 0 0 582.30 25.38 0.969 -2 0 0 555.59 24.59 0.969 2 0 0 566.78 27.22 0.969 -2 0 0 559.41 23.38 0.969 2 0 0 587.50 28.28 0.969 2 0 0 579.67 28.64 0.969 -2 0 0 554.40 27.43 0.969 2 0 0 579.24 30.65 0.969 2 0 0 561.08 61.82 0.969 2 0 0 556.32 58.92 0.969 -2 0 0 557.38 58.24 0.969 4 0 0 182.58 8.03 0.960 -4 0 0 171.06 8.55 0.960 4 0 0 184.98 10.90 0.960 4 0 0 179.00 7.93 0.960 4 0 0 188.17 9.59 0.960 -4 0 0 164.08 7.41 0.960 4 0 0 167.32 8.03 0.960 -4 0 0 165.39 7.82 0.960 -4 0 0 169.10 8.08 0.960 4 0 0 194.03 11.21 0.960 -4 0 0 174.78 8.18 0.960 -4 0 0 176.77 7.97 0.960 4 0 0 165.50 7.88 0.960 -4 0 0 173.43 7.56 0.960 4 0 0 168.07 21.00 0.959 4 0 0 179.08 20.33 0.959 -4 0 0 179.83 19.66 0.959 -6 0 0 1082.93 46.85 0.970 -6 0 0 1086.79 53.39 0.970 -6 0 0 1119.37 47.32 0.970 6 0 0 1181.04 49.95 0.970 6 0 0 1110.17 46.79 0.970 6 0 0 1201.04 50.90 0.970 -6 0 0 1102.99 45.43 0.970 -6 0 0 1104.16 48.33 0.970 -6 0 0 1090.42 49.96 0.970 -8 0 0 792.49 36.79 0.970 8 0 0 885.50 41.85 0.970 -8 0 0 798.23 34.47 0.970 8 0 0 775.72 36.21 0.970 -8 0 0 828.21 33.20 0.970 -8 0 0 790.94 36.05 0.970 -8 0 0 806.86 33.89 0.970 -8 0 0 789.51 34.58 0.970 8 0 0 864.71 35.25 0.970 10 0 0 100.37 6.59 0.971 10 0 0 94.25 5.49 0.971 -10 0 0 103.75 4.33 0.971 -10 0 0 92.62 5.86 0.971 -10 0 0 100.74 7.23 0.971 10 0 0 88.61 5.54 0.971 -10 0 0 94.63 6.18 0.971 -10 0 0 98.12 5.75 0.971 -10 0 0 99.97 5.49 0.971 -12 0 0 582.99 29.21 0.968 12 0 0 559.26 24.15 0.968 -12 0 0 508.32 26.94 0.968 12 0 0 531.27 23.20 0.968 12 0 0 545.63 26.05 0.968 -12 0 0 524.85 27.42 0.968 -12 0 0 556.85 30.42 0.968 -12 0 0 553.11 28.63 0.968 -14 0 0 9.66 4.28 1.064 14 0 0 13.19 5.67 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3 -1 0 57.03 2.94 0.983 3 -1 0 63.97 3.63 0.983 -3 1 0 60.60 3.42 0.983 -3 1 0 59.53 3.20 0.983 -3 1 0 62.36 3.68 0.983 -3 1 0 57.98 3.36 0.983 3 1 0 60.65 3.47 0.983 -3 1 0 56.60 3.04 0.983 3 1 0 60.17 3.68 0.983 -3 1 0 60.70 3.36 0.983 3 1 0 61.88 4.38 0.983 -3 1 0 62.62 2.88 0.983 3 1 0 60.70 2.78 0.982 3 1 0 54.18 3.15 0.982 3 -1 0 53.57 7.86 0.982 -3 -1 0 48.84 6.53 0.982 3 -1 0 54.64 7.49 0.982 -3 -1 0 43.96 6.74 0.982 3 1 0 54.34 6.42 0.982 -3 1 0 63.05 7.87 0.982 -3 1 0 44.47 7.38 0.982 3 1 0 50.66 6.73 0.982 4 -1 0 6.47 1.37 0.968 4 -1 0 4.48 1.47 0.969 4 -1 0 4.05 1.47 0.968 4 -1 0 5.01 1.05 0.970 -4 -1 0 5.22 1.00 0.970 4 -1 0 3.31 0.79 0.968 -4 -1 0 5.15 1.05 0.968 -4 -1 0 3.16 0.95 0.968 4 -1 0 2.37 1.26 0.969 -4 -1 0 6.95 1.32 0.969 -4 -1 0 4.26 1.00 0.967 -4 1 0 6.79 1.16 0.969 4 1 0 1.84 1.47 0.969 -4 1 0 6.99 1.21 0.968 4 1 0 4.43 0.42 0.970 4 1 0 3.69 1.16 0.969 -4 1 0 5.69 0.95 0.970 4 1 0 6.06 1.32 0.970 4 1 0 4.90 0.42 0.970 -4 1 0 4.48 1.11 0.969 4 1 0 4.64 1.16 0.970 -4 1 0 6.80 1.21 0.970 -4 1 0 4.53 1.21 0.970 4 1 0 2.95 0.84 0.969 -4 1 0 3.43 0.58 0.970 4 -1 0 2.79 6.32 0.968 -4 -1 0 2.53 4.22 0.970 -4 -1 0 0.96 2.28 0.967 4 -1 0 1.11 4.04 0.970 -4 1 0 4.87 3.33 0.968 4 1 0 5.52 2.82 0.970 4 1 0 1.72 4.28 0.970 -4 1 0 -0.32 3.64 0.969 5 -1 0 62.74 4.44 0.985 -5 -1 0 60.92 4.07 0.985 5 -1 0 64.07 3.69 0.985 5 -1 0 57.22 4.34 0.985 5 -1 0 60.37 3.10 0.985 -5 -1 0 56.73 3.21 0.985 5 -1 0 60.31 3.53 0.985 -5 -1 0 62.67 3.43 0.985 5 -1 0 60.09 4.17 0.985 -5 -1 0 57.89 3.85 0.985 -5 -1 0 56.93 3.37 0.985 -5 1 0 62.76 3.74 0.985 5 1 0 62.97 2.68 0.985 5 1 0 68.70 4.12 0.985 5 1 0 55.64 3.48 0.985 -5 1 0 60.08 3.21 0.985 -5 1 0 60.89 3.21 0.985 5 1 0 62.44 4.44 0.985 5 1 0 66.08 3.74 0.985 5 1 0 60.78 3.64 0.985 -5 1 0 59.01 3.43 0.985 -5 1 0 57.19 3.58 0.985 -5 1 0 56.23 4.01 0.985 -5 1 0 57.89 3.37 0.985 5 1 0 65.48 4.55 0.985 -5 -1 0 70.97 9.65 0.985 -5 -1 0 46.14 8.04 0.985 5 -1 0 46.99 8.60 0.985 5 -1 0 49.07 8.64 0.985 5 1 0 53.11 9.68 0.985 5 1 0 57.50 9.29 0.985 -5 1 0 53.98 9.90 0.985 -5 1 0 58.00 10.43 0.985 -6 -1 0 0.39 1.22 1.019 6 -1 0 0.94 1.16 1.019 6 -1 0 0.55 0.83 1.019 -6 -1 0 0.00 1.00 1.019 -6 -1 0 0.89 1.11 1.019 -6 -1 0 1.27 1.22 1.019 6 1 0 0.17 0.33 1.019 6 1 0 1.38 1.66 1.019 -6 1 0 2.10 1.49 1.018 -6 1 0 0.33 0.83 1.018 -6 1 0 -1.60 1.60 1.018 -6 1 0 1.11 0.72 1.018 -6 1 0 4.04 1.77 1.018 -6 1 0 -1.77 1.77 1.018 -6 1 0 -1.44 1.44 1.019 6 1 0 1.77 1.55 1.018 -7 -1 0 10.04 1.80 1.032 7 -1 0 4.94 1.96 1.032 -7 -1 0 5.84 1.63 1.033 7 -1 0 4.77 1.23 1.033 -7 -1 0 7.46 2.08 1.033 -7 -1 0 8.53 2.41 1.033 -7 1 0 7.69 1.57 1.033 7 1 0 3.82 2.02 1.033 7 1 0 8.13 1.80 1.032 -7 1 0 7.01 1.35 1.033 -7 1 0 6.90 1.63 1.033 -7 1 0 7.74 1.74 1.033 -7 1 0 4.77 1.63 1.033 -7 1 0 7.74 1.29 1.033 -8 -1 0 155.36 7.51 0.960 8 -1 0 151.08 6.84 0.960 -8 -1 0 145.18 7.78 0.960 8 -1 0 163.13 7.83 0.960 -8 -1 0 153.22 7.88 0.960 -8 -1 0 145.91 7.93 0.960 8 1 0 144.76 10.18 0.960 -8 1 0 152.12 7.62 0.960 8 1 0 149.40 7.20 0.960 -8 1 0 160.68 7.93 0.960 -8 1 0 154.36 9.18 0.960 -8 1 0 158.69 7.62 0.960 -8 1 0 141.47 7.83 0.960 -8 1 0 138.34 7.51 0.960 9 -1 0 42.84 3.30 0.981 -9 -1 0 43.58 3.68 0.981 -9 -1 0 46.25 3.89 0.981 -9 -1 0 42.90 3.36 0.981 -9 -1 0 40.18 3.68 0.981 9 -1 0 44.33 4.16 0.981 -9 1 0 39.00 4.00 0.981 -9 1 0 37.99 3.68 0.981 -9 1 0 47.37 3.36 0.981 -9 1 0 48.70 3.20 0.981 9 1 0 46.46 3.68 0.981 -9 1 0 46.68 4.05 0.981 -9 1 0 48.81 2.93 0.981 -9 1 0 43.96 4.00 0.981 -10 -1 0 43.08 3.57 0.995 -10 -1 0 42.54 4.70 0.995 -10 -1 0 50.27 3.89 0.995 10 -1 0 54.12 4.38 0.995 10 -1 0 52.99 4.60 0.995 10 -1 0 51.32 4.00 0.995 -10 -1 0 47.10 4.71 0.995 10 -1 0 48.24 3.62 0.995 -10 1 0 50.79 5.14 0.995 -10 1 0 51.55 3.84 0.995 -10 1 0 47.38 4.65 0.996 -10 1 0 50.31 3.52 0.996 -10 1 0 47.76 4.60 0.996 10 1 0 41.49 5.41 0.996 -10 1 0 50.69 3.19 0.996 -10 1 0 45.11 4.87 0.996 -11 -1 0 424.15 21.80 0.969 -11 -1 0 429.73 24.90 0.969 -11 -1 0 426.47 19.95 0.969 11 -1 0 445.97 19.85 0.969 11 -1 0 447.56 19.12 0.969 -11 -1 0 432.10 23.48 0.969 11 -1 0 442.07 20.59 0.969 11 1 0 409.95 21.85 0.969 -11 1 0 406.75 22.69 0.969 11 1 0 426.59 22.11 0.969 -11 1 0 420.66 23.43 0.969 -11 1 0 424.35 22.64 0.969 -11 1 0 444.94 22.22 0.969 -11 1 0 437.72 21.22 0.969 11 1 0 423.54 21.01 0.969 -11 1 0 392.51 20.90 0.969 -12 -1 0 55.66 7.06 0.984 -12 -1 0 55.08 6.04 0.984 12 -1 0 65.62 6.26 0.984 -12 -1 0 71.45 5.40 0.984 -12 -1 0 78.82 5.78 0.984 12 -1 0 63.64 5.19 0.984 12 -1 0 70.11 5.30 0.984 -12 1 0 70.32 5.67 0.984 -12 1 0 69.84 6.79 0.984 -12 1 0 51.23 5.35 0.984 12 1 0 68.82 5.67 0.984 12 1 0 56.57 5.78 0.984 -12 1 0 53.47 5.94 0.984 12 1 0 68.07 6.04 0.984 -12 1 0 54.59 6.52 0.984 -12 1 0 56.94 5.40 0.984 13 -1 0 10.98 3.40 1.042 13 -1 0 12.91 3.74 1.042 -13 -1 0 12.85 4.58 1.042 -13 -1 0 21.45 4.02 1.042 -13 -1 0 14.21 3.51 1.042 13 -1 0 11.78 3.79 1.042 -13 -1 0 18.06 3.68 1.042 13 1 0 17.43 4.53 1.042 -13 1 0 15.06 4.36 1.042 -13 1 0 19.82 6.12 1.042 13 1 0 12.45 4.64 1.042 -13 1 0 10.19 3.57 1.042 13 1 0 18.62 4.58 1.042 -14 -1 0 17.33 3.96 1.025 14 -1 0 23.34 5.57 1.025 -14 -1 0 15.93 4.57 1.025 14 -1 0 29.53 5.02 1.025 14 -1 0 29.08 5.57 1.025 -14 1 0 22.29 5.96 1.025 14 1 0 25.13 5.02 1.025 -14 1 0 17.05 5.68 1.025 14 1 0 16.16 4.90 1.025 -14 1 0 18.33 6.13 1.025 14 1 0 14.32 5.29 1.025 -15 -1 0 -4.08 6.76 1.028 15 -1 0 12.29 7.15 1.028 15 -1 0 9.49 6.14 1.028 -15 -1 0 2.68 5.86 1.028 15 -1 0 -1.45 5.64 1.028 -15 1 0 0.73 5.70 1.028 -15 1 0 4.63 6.09 1.028 15 1 0 4.02 4.69 1.028 15 1 0 8.82 6.25 1.028 15 1 0 7.71 5.36 1.028 -15 1 0 9.66 6.31 1.028 -16 -1 0 15.86 6.29 1.043 16 -1 0 20.34 5.66 1.043 -16 -1 0 3.23 5.38 1.043 16 -1 0 18.19 8.10 1.043 16 -1 0 33.19 5.78 1.042 -16 1 0 9.41 7.65 1.043 -16 1 0 9.07 7.31 1.043 16 1 0 17.51 5.44 1.043 16 1 0 7.71 6.12 1.043 16 1 0 14.23 6.74 1.043 17 -1 0 3.59 5.44 1.031 17 -1 0 5.72 8.96 1.031 17 -1 0 8.79 5.60 1.031 -17 -1 0 3.81 10.20 1.032 -17 -1 0 -4.48 7.84 1.031 17 1 0 -2.13 7.40 1.031 -17 1 0 7.01 9.42 1.031 -17 1 0 6.44 7.90 1.031 17 1 0 -0.78 8.41 1.032 17 1 0 -4.09 8.46 1.032 0 -2 0 845.58 43.16 0.970 0 -2 0 862.97 38.31 0.970 0 -2 0 856.69 42.31 0.970 0 -2 0 875.66 46.59 0.970 0 -2 0 812.95 40.63 0.970 0 -2 0 824.59 37.15 0.970 0 -2 0 821.90 37.37 0.970 0 2 0 924.12 46.42 0.970 0 2 0 860.73 40.68 0.970 0 2 0 904.36 38.84 0.970 0 2 0 865.78 38.78 0.970 0 2 0 848.81 38.41 0.970 0 -2 0 896.20 98.79 0.970 0 -2 0 917.03 98.50 0.970 0 2 0 950.58 98.03 0.970 0 2 0 955.33 99.62 0.970 -1 -2 0 1.04 1.09 1.006 1 -2 0 3.28 0.71 1.006 -1 -2 0 3.23 0.98 1.006 1 -2 0 3.82 0.93 1.005 1 -2 0 5.90 0.98 1.006 -1 -2 0 3.22 0.49 1.003 1 -2 0 4.59 0.66 1.006 1 -2 0 5.03 0.49 1.006 1 -2 0 5.29 1.09 1.004 -1 -2 0 3.93 0.87 1.006 -1 -2 0 3.44 0.98 1.006 -1 -2 0 4.21 0.38 1.007 -1 -2 0 4.92 0.38 1.006 1 -2 0 4.81 0.87 1.006 -1 -2 0 3.65 0.44 1.004 -1 -2 0 5.03 0.38 1.006 -1 2 0 4.21 0.82 1.005 -1 2 0 3.61 0.77 1.007 1 2 0 3.71 0.60 1.005 1 2 0 4.48 0.33 1.005 1 2 0 2.35 0.71 1.005 -1 2 0 3.87 0.93 1.003 1 2 0 4.31 1.04 1.004 1 2 0 2.84 1.15 1.004 1 2 0 3.28 0.93 1.007 1 2 0 4.36 0.33 1.004 -1 2 0 3.88 0.71 1.006 -1 2 0 3.76 1.04 1.004 1 -2 0 -0.08 3.94 1.005 -1 -2 0 4.56 2.88 1.003 1 -2 0 -0.56 4.31 1.006 -1 -2 0 2.95 2.81 1.006 1 2 0 2.46 2.81 1.007 -1 2 0 3.15 4.62 1.005 -1 2 0 6.14 4.62 1.005 1 2 0 5.48 3.04 1.004 -2 -2 0 42.08 1.87 0.984 2 -2 0 44.43 2.62 0.984 2 -2 0 35.24 2.62 0.984 2 -2 0 39.89 2.35 0.984 -2 -2 0 40.27 2.35 0.984 -2 -2 0 46.04 1.92 0.984 2 -2 0 39.20 2.14 0.984 -2 -2 0 40.32 2.62 0.984 2 -2 0 42.35 2.09 0.984 -2 -2 0 42.14 2.51 0.984 2 -2 0 46.85 2.83 0.984 2 -2 0 42.52 2.51 0.984 -2 -2 0 43.59 2.41 0.984 -2 2 0 43.53 2.67 0.984 2 2 0 40.81 2.35 0.984 2 2 0 41.29 3.16 0.984 -2 2 0 41.93 2.30 0.984 2 2 0 45.19 3.05 0.984 -2 2 0 42.68 2.78 0.984 2 2 0 45.83 2.35 0.984 -2 2 0 40.86 2.73 0.984 2 2 0 41.29 3.05 0.984 -2 2 0 41.02 2.46 0.984 2 2 0 45.56 1.98 0.984 2 2 0 44.87 1.98 0.984 2 2 0 44.12 2.46 0.984 2 2 0 45.83 1.98 0.984 2 2 0 44.87 2.09 0.984 2 2 0 40.11 2.67 0.984 -2 -2 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2.40 0.982 1 -4 0 41.53 2.88 0.982 1 -4 0 40.84 2.94 0.982 -1 -4 0 41.69 2.24 0.982 -1 -4 0 36.94 2.67 0.982 1 -4 0 40.89 2.14 0.982 -1 -4 0 39.77 2.08 0.982 1 4 0 41.38 3.10 0.983 -1 4 0 43.45 3.20 0.982 1 4 0 42.60 6.67 0.982 1 4 0 37.90 2.24 0.982 -1 4 0 33.74 3.63 0.982 -1 4 0 39.66 2.88 0.982 -1 4 0 37.85 3.79 0.982 2 -4 0 1.13 0.49 0.560 -2 -4 0 0.67 1.10 0.560 -2 -4 0 1.22 0.79 0.560 2 -4 0 0.76 0.58 0.558 -2 -4 0 0.91 0.27 0.560 -2 -4 0 1.85 0.67 0.560 -2 -4 0 1.39 0.88 0.558 -2 -4 0 1.00 0.27 0.560 2 -4 0 -0.03 0.79 0.561 -2 -4 0 1.19 0.27 0.560 2 -4 0 0.09 0.88 0.560 -2 -4 0 0.36 0.27 0.558 2 -4 0 0.85 0.46 0.560 2 -4 0 1.04 0.61 0.560 2 4 0 0.82 0.67 0.560 -2 4 0 0.40 0.73 0.559 -2 4 0 0.40 1.03 0.559 -2 4 0 1.76 0.88 0.560 2 4 0 1.37 0.55 0.559 -2 4 0 0.42 0.79 0.559 2 4 0 2.95 1.06 0.559 3 -4 0 23.46 2.58 1.030 -3 -4 0 25.48 2.63 1.031 3 -4 0 23.68 2.41 1.030 -3 -4 0 24.14 2.01 1.031 -3 -4 0 27.99 2.69 1.030 3 -4 0 22.11 2.13 1.030 3 -4 0 27.43 2.07 1.030 -3 -4 0 26.43 3.14 1.030 3 -4 0 25.31 2.24 1.030 -3 4 0 28.39 3.36 1.030 -3 4 0 26.71 3.14 1.030 3 4 0 21.22 2.63 1.031 -3 4 0 23.13 2.58 1.031 3 4 0 23.29 2.63 1.030 3 4 0 23.12 2.07 1.030 -3 4 0 23.79 2.80 1.030 -4 -4 0 80.38 5.05 0.979 4 -4 0 93.26 4.89 0.979 -4 -4 0 94.69 5.43 0.979 4 -4 0 85.54 5.37 0.979 4 -4 0 88.41 5.11 0.979 4 -4 0 89.16 4.42 0.979 -4 -4 0 90.32 5.58 0.979 4 -4 0 85.53 5.11 0.979 4 4 0 98.78 5.22 0.979 -4 4 0 100.96 5.75 0.979 4 4 0 88.57 5.11 0.979 -4 4 0 92.34 5.27 0.979 -4 4 0 87.77 5.00 0.979 4 4 0 97.83 6.01 0.979 4 4 0 95.11 3.88 0.979 -4 4 0 101.34 6.27 0.979 4 4 0 95.22 3.78 0.979 5 -4 0 -0.25 0.78 0.757 5 -4 0 0.00 1.57 0.759 5 -4 0 1.85 0.95 0.758 5 -4 0 -0.91 0.91 0.758 -5 -4 0 1.15 1.15 0.759 5 -4 0 0.21 0.87 0.758 -5 -4 0 2.31 1.73 0.759 -5 4 0 0.37 1.36 0.758 5 4 0 0.70 1.03 0.758 5 4 0 0.87 0.50 0.758 5 4 0 0.74 0.49 0.758 5 4 0 0.45 0.45 0.759 5 4 0 0.29 1.11 0.759 -5 4 0 -0.16 0.82 0.757 5 4 0 -0.08 1.19 0.756 5 4 0 0.95 0.45 0.757 -5 4 0 0.86 0.99 0.757 -5 4 0 0.29 1.28 0.757 -6 -4 0 34.11 3.62 1.009 -6 -4 0 34.44 3.56 1.009 6 -4 0 33.78 2.41 1.009 6 -4 0 36.53 3.24 1.009 6 -4 0 30.22 3.18 1.009 6 -4 0 34.88 3.24 1.009 6 4 0 26.49 2.09 1.009 6 4 0 30.50 2.14 1.009 6 4 0 30.99 3.51 1.009 -6 4 0 34.34 3.40 1.010 -6 4 0 34.66 2.80 1.009 6 4 0 29.95 2.03 1.009 -6 4 0 36.86 3.46 1.009 6 4 0 34.22 2.36 1.009 6 4 0 35.48 2.96 1.009 -6 4 0 31.75 3.34 1.009 -6 4 0 31.15 3.78 1.009 -6 4 0 34.55 3.29 1.009 -7 -4 0 23.07 3.32 1.036 7 -4 0 26.17 3.32 1.036 7 -4 0 21.84 3.21 1.036 -7 -4 0 25.66 2.87 1.036 7 -4 0 22.91 3.21 1.036 7 -4 0 24.59 3.32 1.036 -7 4 0 18.01 3.38 1.036 7 4 0 26.17 3.09 1.036 7 4 0 23.19 2.53 1.036 -7 4 0 33.04 3.43 1.036 7 4 0 26.62 2.48 1.036 -7 4 0 28.81 3.04 1.036 -7 4 0 23.92 3.38 1.036 7 4 0 21.95 2.42 1.036 7 4 0 18.06 2.70 1.036 7 4 0 23.97 1.74 1.036 7 4 0 22.23 2.19 1.036 7 4 0 24.98 1.69 1.036 -7 4 0 32.07 3.37 1.036 -7 4 0 22.05 3.15 1.035 8 -4 0 87.36 5.90 0.969 8 -4 0 87.99 5.69 0.969 -8 -4 0 88.89 6.27 0.969 -8 -4 0 100.43 6.06 0.969 -8 -4 0 88.17 6.16 0.969 8 -4 0 90.92 6.11 0.969 -8 -4 0 88.60 6.27 0.969 8 -4 0 93.88 5.90 0.970 -8 4 0 85.62 6.38 0.970 -8 4 0 98.74 6.06 0.970 -8 4 0 83.89 5.27 0.970 -8 4 0 92.85 5.74 0.970 -8 4 0 79.68 6.06 0.970 8 4 0 87.05 6.75 0.970 8 4 0 91.43 4.74 0.970 8 4 0 94.02 6.48 0.970 -8 4 0 90.38 6.27 0.970 8 4 0 92.23 4.80 0.970 -9 -4 0 212.55 12.42 0.960 -9 -4 0 220.17 11.58 0.960 -9 -4 0 221.94 12.26 0.960 9 -4 0 252.52 11.69 0.960 -9 -4 0 210.67 11.95 0.960 9 -4 0 212.44 11.22 0.960 9 -4 0 220.90 12.00 0.960 9 -4 0 221.93 12.95 0.960 9 4 0 225.06 11.01 0.960 -9 4 0 204.40 11.84 0.960 9 4 0 206.16 10.38 0.960 -9 4 0 213.61 11.74 0.960 -9 4 0 212.26 12.26 0.960 -9 4 0 216.01 13.04 0.960 -9 4 0 222.01 13.83 0.960 9 4 0 224.30 10.12 0.960 9 4 0 213.66 10.07 0.960 -10 -4 0 23.47 4.25 1.056 10 -4 0 12.57 3.44 1.056 -10 -4 0 24.56 5.17 1.056 -10 -4 0 11.24 3.90 1.056 10 -4 0 20.99 4.24 1.056 -10 -4 0 24.55 4.53 1.055 10 -4 0 13.36 3.44 1.056 10 -4 0 15.31 3.67 1.055 -10 4 0 17.83 4.41 1.055 10 4 0 15.48 3.55 1.055 10 4 0 15.08 2.52 1.055 -10 4 0 23.22 4.64 1.055 -10 4 0 12.79 3.04 1.055 10 4 0 13.70 2.52 1.055 -10 4 0 18.41 3.67 1.055 11 -4 0 2.26 2.47 0.947 -11 -4 0 2.67 3.70 0.947 11 -4 0 4.01 2.78 0.946 -11 -4 0 4.16 3.34 0.946 -11 -4 0 -0.72 4.06 0.946 11 -4 0 4.01 2.98 0.946 11 -4 0 4.32 2.62 0.946 -11 -4 0 4.16 3.81 0.946 -11 4 0 -1.80 3.81 0.947 -11 4 0 1.65 3.55 0.946 -11 4 0 -1.80 3.13 0.945 -11 4 0 2.16 2.57 0.946 11 4 0 2.36 3.13 0.945 12 -4 0 80.71 7.17 0.978 -12 -4 0 89.64 7.33 0.978 -12 -4 0 74.71 6.43 0.978 12 -4 0 78.01 6.59 0.978 12 -4 0 85.77 6.91 0.978 -12 -4 0 78.70 7.44 0.978 -12 -4 0 80.88 7.65 0.978 -12 4 0 68.23 7.71 0.978 -12 4 0 82.95 7.28 0.978 -12 4 0 80.61 6.96 0.978 12 4 0 68.29 8.02 0.978 -12 4 0 68.55 7.55 0.978 -13 -4 0 9.33 4.89 0.928 13 -4 0 -0.10 2.77 0.927 -13 -4 0 3.88 4.63 0.927 -13 -4 0 3.07 3.78 0.927 13 -4 0 7.45 4.13 0.926 13 -4 0 -1.55 3.26 0.923 -13 -4 0 -1.36 3.82 0.925 -13 4 0 -2.91 2.91 0.924 -13 4 0 -0.20 2.82 0.925 -13 4 0 -2.76 4.62 0.924 13 4 0 3.26 4.82 0.924 -13 4 0 0.75 4.42 0.925 14 -4 0 15.68 7.01 1.049 14 -4 0 12.43 6.38 1.049 14 -4 0 11.85 6.27 1.049 -14 -4 0 17.49 6.10 1.049 -14 -4 0 7.92 5.75 1.049 -14 -4 0 12.53 6.55 1.048 -14 -4 0 8.89 5.01 1.048 -14 4 0 21.81 6.43 1.048 -14 4 0 15.60 7.34 1.048 14 4 0 10.42 5.86 1.048 -14 4 0 10.98 5.24 1.048 -14 4 0 10.64 6.09 1.048 15 -4 0 26.39 8.78 1.042 -15 -4 0 26.89 9.11 1.042 -15 -4 0 18.17 8.09 1.042 15 -4 0 20.66 7.47 1.042 15 -4 0 21.51 7.64 1.042 -15 4 0 33.74 7.02 1.042 -15 4 0 20.10 6.96 1.042 -15 4 0 30.85 7.98 1.042 -15 4 0 18.17 7.92 1.042 15 4 0 22.19 6.91 1.042 16 -4 0 0.53 5.66 0.973 -16 -4 0 -3.75 5.39 0.973 -16 -4 0 -0.42 5.07 0.973 16 -4 0 -2.64 5.97 0.973 16 -4 0 -1.43 5.92 0.973 -16 4 0 -0.26 8.88 0.973 -16 4 0 8.83 9.04 0.973 16 4 0 -1.85 5.71 0.973 -16 4 0 7.40 8.09 0.973 -16 4 0 0.26 5.92 0.972 -1 -5 0 129.11 6.02 0.963 -1 -5 0 115.35 7.27 0.963 1 -5 0 124.41 7.59 0.963 -1 -5 0 132.69 5.96 0.963 1 -5 0 125.62 5.87 0.963 1 -5 0 140.28 7.12 0.963 -1 -5 0 129.08 6.13 0.963 1 -5 0 131.44 5.87 0.963 -1 -5 0 126.20 7.53 0.963 1 -5 0 131.07 6.13 0.963 -1 -5 0 129.50 7.12 0.963 1 -5 0 124.43 6.75 0.963 1 5 0 132.23 7.07 0.963 -1 5 0 124.90 6.49 0.963 -1 5 0 128.11 6.65 0.963 1 5 0 126.11 6.91 0.963 2 -5 0 346.28 15.97 0.964 -2 -5 0 347.35 20.06 0.964 2 -5 0 343.54 14.72 0.964 2 -5 0 339.17 15.66 0.964 -2 -5 0 361.54 14.50 0.964 2 -5 0 341.51 14.97 0.964 2 -5 0 338.71 16.28 0.963 -2 -5 0 355.80 14.39 0.963 2 -5 0 354.10 15.23 0.963 -2 -5 0 322.46 18.00 0.963 -2 -5 0 356.67 14.28 0.963 -2 -5 0 349.73 14.28 0.963 -2 -5 0 330.44 16.64 0.963 -2 -5 0 332.09 16.96 0.963 -2 5 0 353.51 18.83 0.963 2 5 0 358.76 16.85 0.963 -2 5 0 332.63 15.22 0.963 2 5 0 358.97 15.22 0.963 -3 -5 0 493.94 29.42 0.968 3 -5 0 473.91 21.99 0.968 3 -5 0 506.31 25.36 0.968 3 -5 0 440.44 21.36 0.968 -3 -5 0 483.63 25.42 0.968 3 -5 0 490.74 23.00 0.968 3 -5 0 471.79 21.99 0.968 -3 -5 0 487.11 22.36 0.968 3 -5 0 500.37 24.41 0.968 -3 -5 0 468.74 23.42 0.968 -3 5 0 496.10 21.52 0.968 3 5 0 508.47 24.26 0.968 3 5 0 512.21 23.78 0.968 -3 5 0 483.00 23.10 0.968 -4 -5 0 92.16 6.74 0.969 -4 -5 0 95.48 5.89 0.969 4 -5 0 89.11 5.84 0.969 4 -5 0 103.00 5.06 0.969 4 -5 0 108.21 5.37 0.969 4 -5 0 107.69 6.94 0.969 4 -5 0 95.16 6.05 0.969 4 -5 0 102.63 5.73 0.969 -4 5 0 100.16 6.10 0.969 4 5 0 95.89 5.68 0.969 -4 5 0 106.84 5.95 0.969 4 5 0 100.05 6.00 0.969 5 -5 0 62.56 3.48 0.984 -5 -5 0 53.11 4.65 0.984 5 -5 0 46.15 3.96 0.984 5 -5 0 57.26 4.17 0.984 -5 -5 0 55.46 4.60 0.984 5 -5 0 52.34 4.97 0.984 5 -5 0 55.49 3.69 0.984 -5 5 0 55.49 4.60 0.984 5 5 0 54.65 3.85 0.984 5 5 0 62.35 4.33 0.984 -5 5 0 58.74 4.81 0.984 6 -5 0 165.78 7.62 0.961 6 -5 0 165.51 7.31 0.961 6 -5 0 147.65 9.40 0.961 6 -5 0 158.62 8.67 0.961 -6 -5 0 143.47 9.03 0.961 -6 -5 0 147.33 9.92 0.961 6 -5 0 165.98 8.67 0.961 6 5 0 152.20 8.71 0.961 6 5 0 145.51 7.83 0.961 -6 5 0 163.67 9.08 0.961 -6 5 0 157.50 8.62 0.961 -7 -5 0 2.70 3.13 0.993 -7 -5 0 2.16 2.43 0.994 7 -5 0 -1.30 2.81 0.994 7 -5 0 6.64 2.16 0.993 7 -5 0 -0.38 1.51 0.993 7 -5 0 2.05 2.00 0.994 -7 5 0 1.84 2.81 0.993 -7 5 0 0.81 2.97 0.993 -7 5 0 -0.16 2.70 0.994 7 5 0 3.72 2.43 0.993 -7 5 0 7.99 2.43 0.993 7 5 0 1.08 1.56 0.993 7 5 0 1.56 0.92 0.993 8 -5 0 49.60 3.58 0.984 8 -5 0 57.67 4.60 0.984 8 -5 0 43.61 4.44 0.984 -8 -5 0 51.05 5.83 0.984 8 -5 0 59.92 4.49 0.984 -8 -5 0 55.49 5.02 0.984 -8 5 0 49.13 5.08 0.984 -8 5 0 51.85 5.45 0.984 8 5 0 69.92 5.51 0.984 -8 5 0 43.94 4.60 0.984 8 5 0 49.23 4.86 0.984 -8 5 0 47.57 4.38 0.984 -9 -5 0 -1.59 2.08 0.562 9 -5 0 -0.24 1.01 0.561 9 -5 0 -0.03 1.84 0.564 9 -5 0 -0.15 1.67 0.560 -9 -5 0 -1.51 1.51 0.565 9 -5 0 -0.40 1.84 0.563 -9 5 0 -0.40 1.35 0.564 -9 5 0 2.73 1.50 0.564 -9 5 0 0.24 1.89 0.560 -9 5 0 -0.34 1.89 0.561 9 5 0 1.35 1.75 0.565 -10 -5 0 -0.59 1.22 0.311 10 -5 0 -0.40 0.79 0.309 10 -5 0 -0.19 0.79 0.310 10 -5 0 0.08 0.91 0.310 10 -5 0 -0.36 0.78 0.312 -10 -5 0 0.39 0.88 0.312 10 5 0 1.14 0.78 0.312 -10 5 0 -0.32 1.39 0.311 -10 5 0 -0.74 1.15 0.311 -10 5 0 -0.89 1.06 0.310 -10 5 0 0.00 1.21 0.310 11 -5 0 19.90 4.65 1.043 11 -5 0 13.15 5.22 1.043 -11 -5 0 19.11 5.16 1.043 -11 -5 0 16.78 5.05 1.043 11 -5 0 13.61 5.05 1.043 11 -5 0 14.06 3.85 1.043 -11 5 0 19.39 5.33 1.043 11 5 0 17.97 4.25 1.043 -11 5 0 6.46 4.82 1.043 -11 5 0 17.68 3.51 1.043 -11 5 0 20.07 4.87 1.043 12 -5 0 52.46 6.58 0.984 12 -5 0 40.27 5.99 0.984 -12 -5 0 56.09 6.74 0.984 12 -5 0 61.22 6.36 0.984 -12 -5 0 57.53 7.06 0.984 12 -5 0 65.39 7.91 0.984 -12 5 0 45.77 7.70 0.984 -12 5 0 46.41 6.10 0.984 12 5 0 46.46 6.26 0.984 -12 5 0 32.83 6.90 0.984 -12 5 0 54.53 5.67 0.984 13 -5 0 38.21 5.66 1.002 13 -5 0 27.05 6.97 1.002 -13 -5 0 26.67 5.99 1.002 13 -5 0 30.16 6.42 1.002 -13 -5 0 31.35 4.79 1.002 13 5 0 27.97 6.97 1.002 -13 5 0 37.44 5.44 1.002 -13 5 0 25.36 5.50 1.001 -13 5 0 27.64 8.38 1.001 -13 5 0 20.51 6.64 1.001 14 -5 0 5.74 4.99 1.056 14 -5 0 6.31 7.46 1.055 -14 -5 0 11.81 6.31 1.055 14 -5 0 17.26 6.82 1.055 -14 -5 0 8.03 6.65 1.055 -14 5 0 11.81 6.19 1.055 14 5 0 15.94 5.68 1.055 -14 5 0 14.50 7.51 1.055 -14 5 0 11.12 7.11 1.055 -14 5 0 8.77 6.53 1.055 -15 -5 0 11.49 7.47 0.961 -15 -5 0 13.53 5.02 0.962 15 -5 0 2.45 7.31 0.961 15 -5 0 5.90 7.26 0.961 15 -5 0 4.70 7.21 0.962 15 5 0 3.23 8.25 0.960 -15 5 0 8.42 5.86 0.962 -15 5 0 4.44 6.16 0.962 -15 5 0 9.13 7.99 0.961 -15 5 0 2.30 5.07 0.961 0 -6 0 2.31 1.21 1.015 0 -6 0 3.75 1.27 1.014 0 -6 0 0.99 1.76 1.013 0 -6 0 3.25 1.10 1.014 0 -6 0 7.00 2.37 1.014 0 -6 0 2.98 1.87 1.014 0 6 0 -2.15 2.70 1.014 0 6 0 1.10 2.64 1.014 0 6 0 3.03 1.27 1.013 1 -6 0 78.36 5.43 0.970 -1 -6 0 87.96 5.06 0.971 1 -6 0 83.11 5.12 0.971 -1 -6 0 77.10 5.96 0.971 -1 -6 0 86.49 4.75 0.971 1 -6 0 89.81 4.59 0.971 -1 -6 0 89.08 4.69 0.971 -1 -6 0 84.81 5.27 0.971 -1 -6 0 94.19 5.70 0.971 -1 -6 0 87.02 5.70 0.971 1 -6 0 88.02 4.96 0.971 1 -6 0 74.36 5.75 0.971 -1 -6 0 85.97 5.70 0.971 1 -6 0 89.29 5.85 0.971 -1 6 0 90.61 5.70 0.971 1 6 0 86.49 4.59 0.971 -1 6 0 83.80 5.43 0.971 1 6 0 82.85 5.91 0.971 2 -6 0 10.70 2.04 1.042 -2 -6 0 9.68 1.87 1.042 -2 -6 0 11.43 1.19 1.042 -2 -6 0 10.69 2.60 1.041 2 -6 0 10.75 1.47 1.042 -2 -6 0 10.98 1.19 1.042 2 -6 0 9.28 2.66 1.042 -2 -6 0 10.07 2.83 1.042 2 -6 0 8.89 2.26 1.042 -2 -6 0 11.09 1.13 1.042 -2 -6 0 6.79 3.45 1.041 2 -6 0 11.66 2.15 1.041 2 -6 0 8.37 2.77 1.041 -2 -6 0 11.20 1.13 1.041 -2 6 0 12.05 2.55 1.041 2 6 0 8.20 3.06 1.041 2 6 0 6.39 1.53 1.041 -2 6 0 7.24 2.26 1.041 3 -6 0 7.50 2.96 1.046 -3 -6 0 20.80 3.86 1.046 3 -6 0 11.65 3.41 1.046 3 -6 0 15.18 2.56 1.046 3 -6 0 12.11 1.88 1.046 3 -6 0 15.46 1.71 1.046 -3 -6 0 15.52 3.41 1.046 3 -6 0 14.33 2.62 1.047 -3 -6 0 9.95 2.62 1.046 -3 6 0 12.39 3.07 1.046 3 6 0 12.28 2.39 1.046 -3 6 0 8.87 2.45 1.047 4 -6 0 179.49 9.12 0.959 4 -6 0 189.28 8.34 0.959 -4 -6 0 161.82 10.79 0.959 -4 -6 0 173.08 10.43 0.959 4 -6 0 163.48 9.81 0.959 4 -6 0 153.84 9.54 0.959 4 -6 0 183.82 8.50 0.959 -4 6 0 173.35 8.55 0.959 4 6 0 175.69 9.64 0.959 -4 6 0 184.04 9.17 0.960 4 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7.16 3.30 1.046 -8 6 0 7.61 3.58 1.046 -8 6 0 8.30 3.01 1.046 -8 6 0 8.58 3.98 1.046 -8 6 0 15.34 4.49 1.046 8 6 0 6.48 4.43 1.046 9 -6 0 90.93 7.04 0.967 9 -6 0 108.33 7.10 0.967 9 -6 0 94.04 8.15 0.967 9 -6 0 100.98 7.62 0.967 -9 -6 0 93.62 8.73 0.967 -9 -6 0 105.50 8.04 0.967 -9 6 0 98.14 8.20 0.967 -9 6 0 85.64 8.04 0.967 -9 6 0 93.36 7.94 0.967 9 6 0 106.66 7.67 0.967 9 6 0 101.99 7.99 0.968 -9 6 0 98.10 8.20 0.968 10 -6 0 2.40 3.29 1.027 -10 -6 0 2.73 3.12 1.027 10 -6 0 9.76 4.58 1.027 10 -6 0 5.02 3.29 1.027 -10 -6 0 6.81 3.46 1.027 10 -6 0 7.70 3.79 1.027 -10 6 0 5.85 3.85 1.026 -10 6 0 4.07 4.85 1.026 -10 6 0 6.64 4.85 1.026 10 6 0 7.25 3.96 1.026 -10 6 0 1.50 4.46 1.026 10 6 0 7.64 4.85 1.026 11 -6 0 -4.24 4.50 0.941 -11 -6 0 4.18 4.79 0.939 11 -6 0 8.22 4.49 0.940 -11 -6 0 3.99 5.16 0.940 11 -6 0 11.11 4.79 0.938 11 -6 0 11.29 4.90 0.940 -11 6 0 -0.31 2.81 0.939 11 6 0 1.48 3.31 0.938 -11 6 0 0.77 3.16 0.939 -11 6 0 -2.04 5.20 0.939 11 6 0 7.24 5.41 0.939 -11 6 0 2.04 3.77 0.938 12 -6 0 6.35 3.82 0.913 -12 -6 0 5.06 5.41 0.913 12 -6 0 3.53 4.37 0.914 12 -6 0 -1.84 4.32 0.913 -12 -6 0 2.28 4.61 0.913 12 -6 0 2.63 3.97 0.913 12 6 0 -0.99 5.26 0.913 -12 6 0 -4.32 4.62 0.913 -12 6 0 -2.13 5.21 0.913 -12 6 0 -1.04 3.78 0.915 12 6 0 2.73 4.27 0.914 -12 6 0 -0.20 3.38 0.914 -13 -6 0 0.17 0.82 0.139 -13 -6 0 0.50 0.87 0.136 13 -6 0 -0.40 0.52 0.137 13 -6 0 0.13 0.59 0.138 -13 6 0 0.70 0.72 0.140 13 6 0 -0.88 0.88 0.140 -13 6 0 0.27 0.95 0.141 -13 6 0 -0.65 0.92 0.134 -13 6 0 0.40 0.70 0.138 13 6 0 -0.03 0.57 0.136 -14 -6 0 23.39 7.74 1.040 14 -6 0 23.84 6.67 1.040 -14 -6 0 18.31 6.16 1.040 14 -6 0 21.02 6.55 1.040 14 6 0 30.01 8.59 1.040 -14 6 0 25.77 8.87 1.040 14 6 0 13.62 7.46 1.040 -14 6 0 32.56 8.87 1.040 -14 6 0 27.69 9.38 1.040 -14 6 0 13.17 8.99 1.040 1 -7 0 5.80 1.11 1.026 1 -7 0 10.25 1.95 1.025 1 -7 0 1.39 3.23 1.025 -1 -7 0 4.79 2.95 1.025 -1 -7 0 6.52 1.50 1.025 1 -7 0 5.02 3.68 1.026 -1 -7 0 2.95 2.67 1.025 -1 -7 0 7.80 1.56 1.026 -1 -7 0 8.75 1.67 1.025 1 -7 0 7.91 2.51 1.025 -1 -7 0 7.08 3.40 1.025 -1 -7 0 7.47 1.73 1.026 1 -7 0 10.54 2.17 1.026 -1 7 0 8.03 2.62 1.027 1 7 0 6.30 1.45 1.026 -1 7 0 4.07 2.56 1.025 1 7 0 6.80 2.23 1.026 1 7 0 6.41 2.73 1.025 2 -7 0 38.14 5.03 0.984 -2 -7 0 50.06 2.78 0.984 -2 -7 0 47.70 2.67 0.984 -2 -7 0 52.14 2.51 0.984 -2 -7 0 42.94 4.17 0.984 2 -7 0 41.07 4.28 0.984 -2 -7 0 53.74 2.89 0.984 2 -7 0 45.29 3.53 0.984 -2 -7 0 37.53 4.49 0.984 -2 -7 0 41.38 4.49 0.984 2 -7 0 51.17 3.64 0.984 2 -7 0 42.51 4.60 0.984 2 7 0 47.11 5.29 0.984 2 7 0 47.11 4.06 0.984 -2 7 0 42.89 4.28 0.984 -2 7 0 39.26 4.17 0.984 3 -7 0 3.10 1.84 0.966 3 -7 0 2.10 2.99 0.966 3 -7 0 2.73 1.21 0.966 -3 -7 0 0.79 2.36 0.966 -3 -7 0 2.57 2.89 0.966 3 -7 0 4.46 2.47 0.966 -3 -7 0 0.53 2.05 0.966 3 -7 0 5.67 2.78 0.966 -3 7 0 -0.53 2.94 0.966 3 7 0 1.99 1.47 0.966 3 7 0 4.30 2.57 0.966 -3 7 0 2.52 3.47 0.967 4 -7 0 17.35 4.51 1.024 -4 -7 0 17.30 4.39 1.024 4 -7 0 31.31 2.45 1.023 -4 -7 0 22.47 3.89 1.023 4 -7 0 28.80 3.39 1.023 4 -7 0 21.41 3.11 1.023 4 -7 0 23.02 3.78 1.023 -4 7 0 25.07 4.73 1.023 -4 7 0 28.24 4.23 1.023 4 7 0 25.80 4.89 1.023 4 7 0 20.01 2.95 1.023 5 -7 0 -0.88 1.69 0.706 5 -7 0 0.23 1.39 0.708 -5 -7 0 -1.65 1.65 0.707 5 -7 0 0.00 0.84 0.704 -5 -7 0 -2.57 2.57 0.706 5 -7 0 1.96 1.84 0.706 5 -7 0 -0.04 2.11 0.707 5 7 0 1.69 2.27 0.708 5 7 0 0.11 1.84 0.706 -5 7 0 -2.38 2.61 0.707 -5 7 0 1.53 1.57 0.705 6 -7 0 11.76 3.15 1.056 6 -7 0 13.71 2.70 1.056 -6 -7 0 11.64 3.56 1.056 6 -7 0 10.38 3.38 1.056 6 -7 0 12.39 4.07 1.056 -6 -7 0 17.95 3.61 1.056 6 -7 0 9.92 2.70 1.056 -6 7 0 17.84 4.70 1.056 6 7 0 7.63 3.27 1.056 6 7 0 6.08 4.42 1.056 -6 7 0 14.57 4.82 1.056 7 -7 0 0.10 0.26 0.098 7 -7 0 -0.23 0.24 0.097 -7 -7 0 0.39 0.45 0.097 7 -7 0 0.05 0.39 0.098 -7 -7 0 -0.04 0.40 0.098 7 -7 0 -0.12 0.22 0.098 7 7 0 -0.19 0.35 0.097 7 7 0 0.23 0.23 0.098 -7 7 0 0.07 0.28 0.098 -7 7 0 0.18 0.27 0.098 8 -7 0 0.22 4.20 1.004 -8 -7 0 -3.00 4.04 1.005 8 -7 0 -0.44 3.60 1.004 -8 -7 0 2.24 4.59 1.005 8 -7 0 1.47 3.88 1.005 -8 7 0 0.33 2.46 1.005 -8 7 0 -1.26 4.53 1.004 8 7 0 2.07 4.26 1.005 -8 7 0 6.06 3.33 1.005 8 7 0 -1.42 3.39 1.005 -8 7 0 5.67 4.42 1.003 -9 -7 0 22.88 6.36 1.010 9 -7 0 18.49 4.94 1.010 -9 -7 0 11.91 6.09 1.010 9 -7 0 31.39 5.21 1.010 9 -7 0 16.41 5.27 1.010 9 7 0 13.94 4.94 1.010 9 7 0 39.13 6.75 1.010 -9 7 0 21.35 5.54 1.010 -9 7 0 13.06 5.21 1.010 -9 7 0 20.03 5.38 1.010 -9 7 0 15.09 5.98 1.010 -10 -7 0 4.62 4.29 1.025 10 -7 0 3.73 5.18 1.025 10 -7 0 1.78 4.68 1.024 -10 -7 0 7.57 4.62 1.024 10 -7 0 -2.17 5.06 1.024 10 7 0 3.73 5.51 1.025 -10 7 0 3.23 6.12 1.024 10 7 0 1.84 5.57 1.024 -10 7 0 -2.62 3.56 1.024 -10 7 0 1.67 3.95 1.024 -10 7 0 -1.89 3.73 1.025 11 -7 0 1.15 3.80 0.706 11 -7 0 6.30 3.69 0.707 -11 -7 0 -1.34 4.27 0.707 -11 -7 0 0.92 3.96 0.707 11 -7 0 1.57 4.10 0.705 -11 7 0 -2.38 2.92 0.706 -11 7 0 3.37 4.48 0.705 11 7 0 0.00 3.38 0.707 -11 7 0 3.18 2.91 0.705 -11 7 0 -1.31 4.50 0.707 11 7 0 -0.19 3.25 0.704 12 -7 0 -1.85 1.93 0.454 -12 -7 0 1.83 2.10 0.454 12 -7 0 0.32 2.07 0.453 -12 -7 0 2.24 2.49 0.454 12 -7 0 -0.39 1.88 0.455 -12 7 0 -1.92 1.92 0.454 -12 7 0 1.76 3.40 0.457 -12 7 0 0.22 3.20 0.457 -12 7 0 0.00 1.58 0.454 12 7 0 1.22 2.85 0.456 12 7 0 -2.20 2.20 0.456 -13 -7 0 0.68 0.77 0.098 13 -7 0 0.13 0.65 0.098 13 -7 0 0.04 0.75 0.100 -13 -7 0 -0.49 0.49 0.100 -13 7 0 -0.51 0.64 0.100 -13 7 0 0.40 0.62 0.100 13 7 0 -0.38 0.82 0.098 -13 7 0 0.62 0.55 0.098 13 7 0 -0.83 0.83 0.100 -13 7 0 -0.17 0.87 0.100 0 -8 0 37.05 3.32 0.987 0 -8 0 27.13 5.04 0.987 0 -8 0 39.30 3.49 0.987 0 -8 0 31.75 5.68 0.987 0 -8 0 40.59 5.15 0.987 0 -8 0 35.12 2.90 0.987 0 -8 0 33.78 2.79 0.987 0 8 0 35.34 4.88 0.987 0 8 0 31.00 4.29 0.987 1 -8 0 -2.52 2.52 0.893 1 -8 0 -1.41 3.44 0.893 1 -8 0 3.74 1.80 0.895 1 -8 0 1.41 1.84 0.894 1 -8 0 1.79 3.68 0.891 -1 -8 0 -0.49 1.94 0.893 -1 -8 0 1.11 2.46 0.887 -1 -8 0 2.43 2.73 0.896 1 8 0 -1.26 3.30 0.893 -1 8 0 3.45 1.94 0.893 -1 8 0 4.40 2.27 0.889 1 8 0 1.64 2.22 0.889 2 -8 0 97.39 6.07 0.971 -2 -8 0 74.63 7.92 0.971 2 -8 0 92.21 7.71 0.971 2 -8 0 86.57 7.49 0.971 -2 -8 0 86.88 7.60 0.971 -2 -8 0 88.84 7.02 0.971 2 -8 0 85.25 7.18 0.972 2 -8 0 102.20 5.86 0.972 -2 8 0 112.18 7.70 0.972 -2 8 0 105.37 7.70 0.972 2 8 0 92.75 7.50 0.972 2 8 0 82.30 7.71 0.972 3 -8 0 6.62 3.28 1.041 -3 -8 0 6.79 3.40 1.041 3 -8 0 1.13 2.60 1.041 3 -8 0 3.73 1.75 1.041 -3 -8 0 8.49 4.19 1.041 3 -8 0 7.53 1.98 1.041 -3 8 0 1.41 4.02 1.042 -3 8 0 1.19 4.02 1.041 3 8 0 7.53 4.58 1.042 4 -8 0 72.08 5.61 0.983 4 -8 0 77.10 5.77 0.983 -4 -8 0 58.40 5.82 0.983 4 -8 0 69.35 6.63 0.983 4 -8 0 67.22 6.63 0.983 -4 -8 0 68.55 8.34 0.983 4 8 0 78.92 7.00 0.983 -4 8 0 58.40 6.30 0.983 -4 8 0 70.00 6.57 0.983 5 -8 0 21.26 4.98 1.054 -5 -8 0 18.28 4.53 1.054 5 -8 0 33.52 4.35 1.054 5 -8 0 29.97 3.84 1.055 -5 -8 0 17.36 4.64 1.055 5 -8 0 12.49 4.70 1.055 -5 8 0 27.62 5.73 1.055 5 8 0 25.90 5.27 1.055 -5 8 0 32.95 5.90 1.055 6 -8 0 27.95 5.14 1.039 6 -8 0 22.87 4.12 1.039 6 -8 0 15.81 3.84 1.039 -6 -8 0 25.36 5.08 1.039 -6 -8 0 32.25 5.93 1.040 6 -8 0 35.08 5.03 1.040 -6 8 0 23.22 6.16 1.040 -6 8 0 28.42 6.55 1.040 6 8 0 20.40 4.63 1.040 7 -8 0 0.20 0.81 0.188 -7 -8 0 -0.51 0.51 0.186 -7 -8 0 -0.85 1.04 0.190 7 -8 0 0.33 0.73 0.188 7 -8 0 1.22 1.04 0.190 -7 8 0 0.35 0.87 0.187 -7 8 0 -0.17 0.87 0.187 7 8 0 -0.64 0.64 0.190 8 -8 0 12.69 5.57 1.047 8 -8 0 7.73 4.95 1.047 -8 -8 0 6.09 6.26 1.047 8 -8 0 -0.63 3.70 1.047 -8 -8 0 6.37 5.00 1.047 -8 8 0 8.30 6.48 1.047 8 8 0 1.36 5.97 1.046 -8 8 0 4.78 4.66 1.046 -8 8 0 9.78 6.08 1.047 -8 8 0 7.39 4.21 1.046 -9 -8 0 67.81 7.96 0.983 9 -8 0 64.29 7.05 0.983 9 -8 0 55.43 6.99 0.983 9 -8 0 54.73 7.26 0.983 -9 -8 0 53.51 7.58 0.983 -9 8 0 43.20 7.80 0.983 -9 8 0 59.33 7.58 0.983 -9 8 0 49.77 7.32 0.983 -9 8 0 53.99 7.10 0.983 9 8 0 58.53 7.85 0.983 10 -8 0 64.11 7.44 0.985 10 -8 0 48.22 6.42 0.985 -10 -8 0 45.55 7.23 0.985 -10 -8 0 53.31 7.07 0.985 10 -8 0 76.81 6.74 0.985 10 8 0 56.78 8.29 0.985 -10 8 0 50.26 9.47 0.985 -10 8 0 70.87 9.64 0.985 -10 8 0 59.53 8.08 0.985 -10 8 0 57.12 7.98 0.985 11 -8 0 0.32 0.66 0.101 -11 -8 0 -0.08 0.83 0.109 11 -8 0 0.04 0.53 0.111 11 -8 0 -0.55 0.55 0.104 -11 -8 0 -0.19 0.72 0.106 -11 8 0 -0.15 0.76 0.103 11 8 0 1.30 0.80 0.111 -11 8 0 0.11 0.52 0.101 -11 8 0 -0.17 0.56 0.107 -11 8 0 -0.81 0.81 0.106 -12 -8 0 -0.86 5.69 0.988 12 -8 0 12.03 6.66 0.988 -12 -8 0 15.73 6.71 0.988 12 -8 0 11.49 8.48 0.988 12 -8 0 1.88 9.18 0.988 -12 8 0 -0.81 5.58 0.988 -12 8 0 -1.24 7.41 0.989 12 8 0 8.80 8.21 0.988 -12 8 0 -4.78 8.22 0.988 -12 8 0 5.15 5.91 0.988 1 -9 0 101.89 9.82 0.967 1 -9 0 108.41 9.40 0.967 -1 -9 0 107.14 9.77 0.967 -1 -9 0 104.83 8.67 0.967 1 -9 0 117.60 9.88 0.967 1 9 0 113.81 9.24 0.967 -1 9 0 114.08 8.20 0.967 -1 9 0 116.45 8.67 0.967 -2 -9 0 54.10 6.53 0.985 2 -9 0 68.28 8.56 0.985 2 -9 0 63.31 6.21 0.985 -2 -9 0 57.04 6.96 0.985 -2 9 0 59.94 7.38 0.985 2 9 0 59.83 6.90 0.985 -2 9 0 83.70 7.44 0.985 2 9 0 77.97 7.17 0.985 3 -9 0 10.62 3.56 1.023 -3 -9 0 5.79 6.06 1.024 3 -9 0 9.11 3.61 1.022 3 -9 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20.13 2.70 1.056 -8 -2 -2 14.11 3.15 1.056 -8 2 -2 19.04 2.01 1.056 -8 2 -2 16.63 2.64 1.056 8 2 2 15.03 2.87 1.056 8 2 2 14.97 2.12 1.056 -8 2 -2 16.58 2.87 1.056 8 2 2 13.88 2.18 1.055 -8 2 -2 18.98 2.75 1.055 -8 2 -2 22.53 2.70 1.055 -8 2 -2 21.39 2.70 1.055 -8 2 -2 16.17 2.98 1.055 -9 -2 -2 101.32 6.96 0.971 9 -2 2 108.45 6.07 0.971 9 -2 2 111.87 6.44 0.971 -9 -2 -2 110.91 6.70 0.971 -9 -2 -2 112.92 6.70 0.971 9 -2 2 111.11 6.70 0.971 -9 -2 -2 106.36 6.33 0.971 9 -2 2 119.43 6.70 0.971 -9 2 -2 113.10 9.13 0.971 9 2 2 125.38 6.70 0.971 -9 2 -2 117.26 7.12 0.971 9 2 2 108.97 5.96 0.971 -9 2 -2 103.48 6.75 0.971 9 2 2 109.12 5.75 0.971 -9 2 -2 101.20 7.28 0.971 -9 2 -2 102.25 6.75 0.971 -9 2 -2 116.28 7.86 0.970 -9 2 -2 118.59 6.17 0.970 -10 -2 -2 9.54 2.73 1.027 10 -2 2 7.64 2.84 1.026 -10 -2 -2 5.24 3.01 1.026 10 -2 2 9.15 2.34 1.027 -10 -2 -2 4.02 2.96 1.027 10 -2 2 5.52 3.07 1.027 -10 -2 -2 8.48 2.23 1.027 10 2 2 5.69 2.84 1.027 10 2 2 8.37 2.23 1.027 10 2 2 3.46 2.34 1.027 -10 2 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4.60 1.046 13 -2 2 21.31 6.02 1.046 13 -2 2 17.28 6.14 1.046 -13 2 -2 17.11 5.06 1.046 -13 2 -2 28.36 4.60 1.046 -13 2 -2 13.07 5.57 1.046 13 2 2 20.23 4.60 1.046 13 2 2 11.14 4.38 1.046 13 2 2 25.29 6.14 1.046 -13 2 -2 21.71 5.80 1.046 14 -2 2 -2.64 3.48 0.915 14 -2 2 5.07 4.68 0.916 14 -2 2 6.92 5.47 0.916 -14 -2 -2 -2.14 4.53 0.916 -14 -2 -2 6.87 5.32 0.916 -14 2 -2 4.13 4.68 0.916 -14 2 -2 2.14 3.19 0.917 14 2 2 9.20 4.53 0.916 -14 2 -2 1.34 3.39 0.916 -14 2 -2 1.34 4.88 0.916 14 2 2 4.03 4.13 0.916 14 2 2 3.04 3.64 0.917 -15 -2 -2 16.52 7.10 1.045 15 -2 2 35.42 7.78 1.045 15 -2 2 12.32 5.45 1.045 15 -2 2 21.74 5.28 1.045 -15 -2 -2 23.22 8.06 1.045 -15 2 -2 13.97 5.73 1.045 15 2 2 28.21 6.93 1.045 -15 2 -2 16.29 6.36 1.045 -15 2 -2 15.84 5.85 1.045 16 -2 2 0.36 0.89 0.155 -16 -2 -2 2.78 1.27 0.151 16 -2 2 -1.06 1.06 0.155 16 -2 2 -0.86 0.97 0.153 -16 -2 -2 0.84 1.25 0.155 -16 2 -2 0.21 1.30 0.155 -16 2 -2 0.75 1.12 0.156 16 2 2 -0.69 1.36 0.155 -16 2 -2 -0.05 0.97 0.152 16 -3 -2 7.27 7.16 1.029 16 -3 -2 0.45 8.17 1.029 -16 -3 2 8.78 8.06 1.030 -16 -3 2 9.23 8.39 1.029 16 -3 -2 9.18 5.93 1.030 -16 3 2 5.93 5.49 1.030 -16 3 2 -0.45 8.05 1.029 -16 3 2 5.26 4.87 1.030 16 3 -2 11.75 6.38 1.030 15 -3 -2 38.29 6.47 1.001 15 -3 -2 39.54 6.80 1.001 -15 -3 2 35.52 6.20 1.001 -15 -3 2 29.32 5.49 1.001 15 -3 -2 30.35 7.13 1.001 -15 3 2 31.23 7.51 1.001 15 3 -2 32.04 7.18 1.001 -15 3 2 36.94 7.94 1.001 -15 3 2 22.95 6.85 1.001 -15 3 2 29.05 7.29 1.001 14 -3 -2 86.87 7.63 0.975 -14 -3 2 75.90 7.69 0.975 -14 -3 2 93.55 8.43 0.975 -14 -3 2 72.03 8.64 0.975 14 -3 -2 74.47 7.84 0.975 14 -3 -2 84.54 7.58 0.975 -14 -3 2 79.87 7.84 0.975 -14 3 2 73.73 8.00 0.975 -14 3 2 74.04 8.37 0.975 -14 3 2 76.43 9.43 0.975 14 3 -2 100.65 9.12 0.975 -14 3 2 93.87 8.75 0.975 13 -3 -2 14.43 5.17 1.046 -13 -3 2 10.97 4.94 1.046 -13 -3 2 15.12 4.21 1.046 -13 -3 2 26.88 5.06 1.046 13 -3 -2 18.07 4.83 1.046 -13 -3 2 21.82 4.66 1.046 13 -3 -2 19.50 4.15 1.046 13 3 -2 16.20 4.26 1.046 -13 3 2 20.29 5.80 1.046 -13 3 2 16.54 5.40 1.046 13 3 -2 20.28 4.32 1.046 -13 3 2 9.61 5.06 1.046 -13 3 2 20.58 4.89 1.046 12 -3 -2 -1.48 4.09 0.908 -12 -3 2 3.60 3.99 0.907 12 -3 -2 1.13 2.37 0.907 -12 -3 2 0.99 1.73 0.908 -12 -3 2 1.23 3.06 0.908 12 -3 -2 -3.94 3.94 0.907 12 -3 -2 -3.11 3.25 0.908 -12 -3 2 9.97 4.09 0.908 12 3 -2 1.38 2.76 0.908 -12 3 2 -2.91 3.45 0.908 -12 3 2 -0.89 2.86 0.908 -12 3 2 -0.94 2.66 0.908 -12 3 2 0.35 3.51 0.908 -11 -3 2 128.83 9.39 0.960 -11 -3 2 131.13 8.66 0.960 11 -3 -2 146.12 8.40 0.960 -11 -3 2 145.80 8.77 0.960 11 -3 -2 149.41 8.71 0.960 11 -3 -2 131.57 8.19 0.960 11 -3 -2 149.89 8.98 0.961 -11 -3 2 150.62 8.66 0.961 -11 3 2 131.42 9.65 0.961 -11 3 2 133.87 9.13 0.961 -11 3 2 140.98 9.35 0.961 -11 3 2 124.38 8.82 0.961 11 3 -2 148.38 8.98 0.961 10 -3 -2 177.88 9.61 0.961 -10 -3 2 154.49 8.82 0.961 -10 -3 2 150.94 8.82 0.961 -10 -3 2 149.74 7.98 0.961 -10 -3 2 145.21 8.30 0.961 10 -3 -2 141.97 9.71 0.961 -10 3 2 147.40 9.46 0.961 -10 3 2 150.18 9.97 0.961 -10 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3 3 -2 334.93 14.18 0.963 3 3 -2 345.25 15.22 0.963 3 3 -2 326.53 13.60 0.963 -3 3 2 298.49 13.97 0.963 3 3 -2 315.86 14.85 0.963 3 3 -2 337.99 15.54 0.963 3 3 -2 316.02 15.80 0.963 3 3 -2 335.06 14.75 0.963 3 3 -2 329.56 14.49 0.963 -3 3 2 349.07 14.91 0.963 3 3 -2 331.14 16.74 0.963 -2 -3 2 359.30 17.74 0.969 2 -3 -2 367.35 16.74 0.969 2 -3 -2 361.71 18.43 0.969 -2 -3 2 352.76 16.01 0.969 2 -3 -2 357.65 16.59 0.969 -2 -3 2 365.50 18.22 0.969 -2 -3 2 365.23 18.54 0.969 -2 -3 2 352.75 16.16 0.969 -2 -3 2 357.96 15.69 0.969 2 -3 -2 366.81 16.37 0.969 2 -3 -2 357.07 16.48 0.969 -2 -3 2 359.86 16.16 0.969 -2 -3 2 363.17 15.69 0.969 2 -3 -2 379.54 15.85 0.969 -2 3 2 357.85 16.05 0.969 -2 3 2 398.92 17.32 0.969 2 3 -2 346.95 16.74 0.969 -2 3 2 354.47 15.32 0.969 2 3 -2 394.91 18.80 0.969 -2 3 2 370.69 19.53 0.969 2 3 -2 374.11 15.69 0.969 2 3 -2 388.43 19.90 0.969 2 3 -2 393.05 16.22 0.969 2 3 -2 380.79 15.79 0.969 -2 3 2 391.79 16.69 0.969 2 3 -2 359.88 16.32 0.969 -2 -3 2 433.79 44.33 0.969 2 -3 -2 347.81 43.67 0.969 2 -3 -2 388.74 42.93 0.969 -2 -3 2 411.74 43.31 0.969 -2 3 2 371.99 44.79 0.969 -2 3 2 402.70 45.37 0.969 2 3 -2 382.63 41.91 0.969 2 3 -2 415.33 41.80 0.969 -1 -3 2 19.18 1.35 1.035 -1 -3 2 15.69 1.91 1.035 1 -3 -2 15.41 1.86 1.035 -1 -3 2 12.88 1.80 1.035 -1 -3 2 19.01 1.24 1.035 1 -3 -2 16.76 1.46 1.035 -1 -3 2 13.39 1.63 1.035 1 -3 -2 16.93 1.80 1.035 1 -3 -2 15.75 1.86 1.035 1 -3 -2 15.47 1.86 1.035 -1 -3 2 13.11 1.01 1.035 -1 -3 2 13.33 1.69 1.035 -1 -3 2 17.33 1.29 1.035 -1 -3 2 17.67 1.29 1.035 -1 3 2 15.70 1.35 1.036 1 3 -2 13.84 1.07 1.036 1 3 -2 12.04 1.13 1.036 -1 3 2 15.98 1.91 1.036 1 3 -2 14.46 1.58 1.036 1 3 -2 20.37 2.76 1.036 1 3 -2 11.14 2.36 1.036 -1 3 2 14.74 1.80 1.036 -1 3 2 19.87 2.42 1.036 1 3 -2 13.40 1.24 1.036 1 3 -2 19.53 2.19 1.036 -1 3 2 16.37 1.91 1.036 -1 3 2 18.85 1.69 1.036 1 -3 -2 20.58 6.76 1.035 -1 -3 2 7.60 4.83 1.036 -1 -3 2 21.43 5.83 1.036 1 -3 -2 9.79 5.80 1.036 -1 3 2 10.89 6.06 1.036 1 3 -2 12.07 5.03 1.036 1 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577.45 25.44 0.969 -3 2 3 545.85 23.06 0.969 3 2 -3 523.10 22.01 0.969 -3 2 3 496.56 22.65 0.969 3 2 -3 508.76 24.23 0.969 3 2 -3 538.56 22.54 0.969 3 2 -3 508.27 25.07 0.969 3 2 -3 548.60 24.69 0.969 -3 2 3 552.48 26.74 0.969 3 2 -3 561.11 25.16 0.969 -3 2 3 505.07 23.85 0.969 3 2 -3 545.29 24.69 0.969 3 2 -3 560.28 23.80 0.969 -3 -2 3 549.23 58.07 0.969 -3 -2 3 542.60 59.25 0.969 3 -2 -3 587.07 58.58 0.969 3 -2 -3 554.59 58.92 0.969 -3 2 3 547.50 59.81 0.969 3 2 -3 569.40 58.29 0.969 -3 2 3 551.85 60.29 0.969 3 2 -3 536.43 62.63 0.969 -2 -2 3 353.63 15.95 0.969 2 -2 -3 366.63 18.43 0.969 -2 -2 3 356.84 16.59 0.969 -2 -2 3 350.20 16.05 0.969 2 -2 -3 350.63 16.05 0.969 2 -2 -3 351.89 15.53 0.969 -2 -2 3 350.01 15.32 0.969 -2 -2 3 347.79 17.16 0.969 2 -2 -3 327.15 16.74 0.969 2 -2 -3 356.33 16.90 0.969 -2 -2 3 367.17 18.80 0.969 -2 -2 3 352.16 19.27 0.969 2 -2 -3 364.86 15.27 0.969 -2 -2 3 349.80 15.01 0.969 2 2 -3 376.02 15.75 0.969 -2 2 3 342.49 15.48 0.969 2 2 -3 357.01 16.33 0.969 2 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64.51 0.971 0 -2 -4 1341.11 53.26 0.971 0 2 4 1258.41 56.79 0.971 0 2 -4 1340.52 52.11 0.971 0 2 4 1280.02 56.79 0.971 0 2 4 1279.85 63.65 0.971 0 2 4 1325.13 57.22 0.971 0 2 4 1341.69 56.79 0.970 0 2 -4 1393.73 68.30 0.971 0 2 -4 1355.96 50.79 0.971 0 2 -4 1318.39 60.65 0.971 0 2 -4 1258.68 54.37 0.971 0 2 4 1290.79 58.63 0.970 0 2 -4 1275.13 57.64 0.971 0 -2 -4 1439.92 143.99 0.970 0 -2 4 1357.14 148.30 0.971 0 -2 -4 1426.62 141.70 0.970 0 -2 4 1180.02 144.43 0.971 0 2 -4 1388.30 143.74 0.971 0 2 4 1403.72 141.90 0.970 0 2 4 1376.23 144.27 0.970 0 2 -4 1379.57 147.53 0.971 -1 -2 -4 4660.18 218.92 0.971 -1 -2 -4 4583.20 220.82 0.971 1 -2 4 4852.35 212.64 0.971 1 -2 4 4846.59 234.53 0.971 1 -2 4 4607.58 212.21 0.971 1 -2 4 4573.40 210.52 0.971 -1 2 -4 5276.12 209.67 0.971 -1 2 -4 5013.43 201.12 0.971 -1 2 -4 5034.50 198.65 0.971 1 2 4 4693.37 234.05 0.971 1 2 4 5032.06 224.86 0.971 1 2 4 4997.27 203.81 0.971 -1 2 -4 4704.49 219.06 0.971 -1 2 -4 5075.86 219.48 0.971 1 -2 4 5280.80 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6.62 0.990 12 -3 -4 11.64 3.27 1.055 -12 -3 4 17.66 3.96 1.056 -12 -3 4 17.72 3.78 1.055 -12 -3 4 21.11 3.27 1.056 -12 -3 4 14.46 4.13 1.056 12 -3 -4 13.88 4.42 1.056 -12 3 4 24.10 4.42 1.056 -12 3 4 15.55 3.27 1.056 12 3 -4 11.65 3.50 1.056 -12 3 4 16.46 4.93 1.056 -12 3 4 16.12 5.22 1.056 -11 -3 4 161.72 9.91 0.965 -11 -3 4 134.34 9.18 0.965 11 -3 -4 157.79 10.02 0.965 -11 -3 4 168.25 9.23 0.965 -11 -3 4 137.50 8.45 0.965 11 -3 -4 137.98 8.23 0.966 -11 3 4 138.92 8.29 0.966 -11 3 4 147.37 10.13 0.966 11 3 -4 158.50 9.34 0.966 -11 3 4 140.55 10.49 0.966 -11 3 4 147.85 9.70 0.966 -10 -3 4 491.88 24.26 0.968 -10 -3 4 514.24 24.47 0.968 10 -3 -4 533.03 24.89 0.968 10 -3 -4 512.14 27.89 0.968 -10 -3 4 490.31 23.00 0.968 -10 -3 4 508.99 24.58 0.968 -10 3 4 502.05 23.05 0.968 -10 3 4 482.74 23.31 0.968 -10 3 4 508.73 23.47 0.968 -10 3 4 502.05 25.88 0.968 10 3 -4 518.83 23.89 0.968 10 3 -4 518.68 25.10 0.968 -9 -3 4 4.79 2.95 1.026 9 -3 -4 3.46 1.78 1.026 -9 -3 4 7.81 2.73 1.026 -9 -3 4 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1.033 1 2 -29 15.82 10.21 1.033 -1 2 29 6.18 7.19 1.033 -1 2 29 -7.08 7.08 1.033 -1 2 29 11.90 7.07 1.033 1 2 -29 7.69 8.47 1.033 -1 2 29 -4.38 6.68 1.033 0 -2 29 -6.29 6.29 0.950 0 -2 29 6.51 7.80 0.951 0 -2 -29 -3.00 5.21 0.950 0 -2 29 -0.52 6.51 0.951 0 -2 29 -3.10 6.77 0.951 0 -2 29 8.31 7.75 0.950 0 -2 -29 10.43 9.14 0.950 0 2 29 -0.41 5.47 0.950 0 2 29 8.63 7.08 0.951 0 2 29 9.24 8.06 0.950 0 2 -29 -4.91 5.79 0.951 0 2 -29 -2.12 6.66 0.950 0 2 29 -1.14 4.13 0.950 1 -2 29 -0.26 0.37 0.047 1 -2 29 0.18 0.33 0.050 -1 -2 -29 -0.09 0.32 0.047 1 -2 29 0.01 0.38 0.049 1 -2 29 -0.25 0.29 0.049 1 -2 29 0.38 0.31 0.048 -1 -2 -29 -0.09 0.24 0.047 1 2 29 0.23 0.37 0.050 1 2 29 0.40 0.25 0.048 -1 2 -29 0.38 0.50 0.050 1 2 29 -0.28 0.38 0.048 -1 2 -29 0.88 0.46 0.049 1 2 29 -0.17 0.37 0.048 9 -3 -29 -1.83 4.78 0.733 -9 -3 29 -1.83 3.54 0.733 -9 -3 29 -1.15 4.18 0.733 -9 3 29 14.69 6.33 0.733 9 3 -29 -0.52 4.38 0.733 -9 3 29 4.15 5.82 0.734 8 -3 -29 3.34 7.29 0.945 -8 -3 29 -6.88 6.88 0.945 -8 -3 29 4.62 8.11 0.945 8 3 -29 6.06 7.91 0.945 -8 3 29 3.80 7.29 0.945 -8 3 29 7.55 6.37 0.945 -7 -3 29 -3.65 3.95 0.692 -7 -3 29 2.93 4.44 0.692 7 -3 -29 -4.15 4.98 0.695 -7 -3 29 1.36 3.73 0.694 -7 -3 29 4.66 3.91 0.692 7 -3 -29 1.24 6.54 0.692 -7 3 29 -3.62 4.75 0.693 7 3 -29 -5.31 5.31 0.693 -7 3 29 -0.45 5.38 0.693 -6 -3 29 -0.16 2.16 0.326 -6 -3 29 1.29 1.50 0.329 6 -3 -29 2.25 1.80 0.328 -6 -3 29 0.34 1.69 0.326 -6 -3 29 -0.87 1.45 0.326 6 -3 -29 -1.03 1.69 0.328 6 3 -29 3.24 2.89 0.328 -6 3 29 0.48 2.42 0.328 -6 3 29 3.75 2.43 0.327 -5 -3 29 8.39 6.12 1.023 -5 -3 29 3.39 7.06 1.024 -5 -3 29 4.33 8.06 1.023 -5 -3 29 1.22 5.00 1.023 5 -3 -29 -1.17 4.78 1.024 5 -3 -29 6.45 7.29 1.024 -5 3 29 0.11 5.17 1.023 5 3 -29 22.81 8.90 1.024 -5 3 29 7.46 5.62 1.024 4 -3 -29 9.85 8.23 1.030 -4 -3 29 11.34 8.38 1.029 4 -3 -29 10.97 7.39 1.030 -4 -3 29 6.32 7.44 1.029 -4 -3 29 17.39 6.88 1.029 -4 -3 29 10.01 7.49 1.029 -4 3 29 4.87 4.75 1.029 -4 3 29 3.36 5.59 1.029 4 3 -29 12.25 8.33 1.029 -3 -3 29 5.51 6.02 1.056 -3 -3 29 16.01 7.29 1.056 -3 -3 29 11.70 5.16 1.056 -3 -3 29 9.06 8.20 1.056 3 -3 -29 3.50 9.75 1.056 3 -3 -29 21.22 9.75 1.056 3 3 -29 8.83 6.60 1.055 -3 3 29 7.17 7.86 1.055 -3 3 29 3.10 6.25 1.055 -2 -3 29 0.37 0.98 0.167 2 -3 -29 0.88 0.95 0.168 -2 -3 29 1.12 0.86 0.167 -2 -3 29 -0.04 0.90 0.165 -2 -3 29 -0.03 0.87 0.168 2 -3 -29 -0.10 1.39 0.168 -2 3 29 0.30 1.21 0.167 2 3 -29 0.20 0.89 0.163 -2 3 29 -0.95 0.98 0.167 -2 3 29 0.85 1.34 0.162 1 -3 -29 -0.17 0.41 0.051 -1 -3 29 -0.35 0.35 0.053 -1 -3 29 -0.25 0.43 0.052 -1 -3 29 -0.23 0.23 0.051 -1 -3 29 -0.24 0.24 0.052 1 -3 -29 -0.30 0.30 0.051 1 3 -29 -0.25 0.31 0.053 -1 3 29 0.35 0.32 0.053 -1 3 29 0.26 0.27 0.051 -1 3 29 -0.17 0.22 0.051 -7 -4 29 -0.37 0.37 0.068 -7 -4 29 0.13 0.46 0.070 7 -4 -29 0.52 0.62 0.070 -7 -4 29 -0.31 0.47 0.069 -7 -4 29 0.00 0.36 0.070 -7 4 29 -0.55 0.60 0.070 -7 4 29 0.37 0.53 0.070 -6 -4 29 -2.94 5.69 0.703 -6 -4 29 -2.68 4.02 0.704 6 -4 -29 -1.91 3.90 0.704 6 -4 -29 -2.45 4.05 0.704 -6 -4 29 -1.72 3.89 0.702 -6 -4 29 -2.10 5.89 0.704 -6 4 29 -5.04 5.04 0.703 -6 4 29 3.94 5.85 0.704 6 4 -29 -5.65 5.65 0.703 5 -4 -29 2.84 7.74 0.950 5 -4 -29 -3.10 7.64 0.950 -5 -4 29 14.09 8.98 0.950 -5 -4 29 7.12 7.74 0.949 -5 -4 29 11.72 7.85 0.951 -5 -4 29 -4.18 7.28 0.950 -5 4 29 3.15 4.96 0.950 -5 4 29 -3.51 4.54 0.950 5 4 -29 2.22 7.95 0.950 -4 -4 29 -2.38 8.45 1.043 -4 -4 29 12.02 9.07 1.043 -4 -4 29 11.90 7.43 1.043 4 -4 -29 19.33 9.92 1.043 4 -4 -29 -0.91 9.52 1.043 -4 -4 29 30.82 8.61 1.043 -4 4 29 9.30 6.92 1.043 -4 4 29 0.85 9.13 1.043 4 4 -29 5.72 9.97 1.043 -3 -4 29 0.36 4.67 0.544 -3 -4 29 1.51 4.02 0.544 3 -4 -29 -0.97 3.84 0.543 3 -4 -29 5.20 3.22 0.544 -3 -4 29 4.49 4.17 0.544 -3 -4 29 -1.83 4.52 0.544 -3 4 29 1.09 4.23 0.544 -3 4 29 5.68 4.52 0.544 3 4 -29 3.67 3.37 0.544 -8 0 30 7.20 5.00 0.920 -8 0 30 3.30 4.50 0.920 8 0 -30 -3.65 7.15 0.920 8 0 -30 -0.75 6.35 0.920 6 0 -30 -1.06 8.54 1.028 -6 0 30 8.99 7.99 1.028 -6 0 30 9.44 6.76 1.028 6 0 -30 12.85 7.82 1.028 -4 0 30 7.81 4.52 0.904 -4 0 30 -2.05 4.06 0.900 4 0 -30 -0.15 7.55 0.903 -4 0 30 4.52 4.28 0.905 4 0 -30 -0.39 4.96 0.903 -4 0 30 -4.13 4.13 0.904 -2 0 30 -7.24 7.24 0.939 -2 0 30 -0.66 6.59 0.940 2 0 -30 9.94 7.85 0.939 -2 0 30 5.11 7.45 0.940 -2 0 30 -2.60 6.43 0.939 2 0 -30 6.53 6.94 0.940 0 0 30 -0.87 6.63 0.945 0 0 30 -1.13 6.99 0.946 0 0 30 8.02 7.46 0.946 0 0 -30 4.63 7.09 0.946 0 0 30 -4.21 7.29 0.945 0 0 30 -3.80 6.01 0.945 0 0 -30 1.90 6.63 0.946 -9 -1 30 6.47 9.15 1.026 9 -1 -30 1.00 8.64 1.026 -9 -1 30 5.30 8.37 1.027 -9 1 30 12.27 6.03 1.027 -9 1 30 11.88 6.47 1.026 9 1 -30 16.13 9.99 1.027 -8 -1 30 -4.88 4.88 0.664 8 -1 -30 3.07 5.31 0.665 -8 -1 30 8.09 5.20 0.665 8 -1 -30 -2.05 4.14 0.662 8 1 -30 -0.14 5.38 0.665 -8 1 30 1.36 3.69 0.660 -8 1 30 5.06 4.01 0.665 7 -1 -30 -0.23 0.31 0.057 -7 -1 30 -0.25 0.25 0.057 -7 -1 30 -0.08 0.29 0.058 7 -1 -30 0.12 0.37 0.059 7 1 -30 -0.04 0.48 0.059 -7 1 30 0.29 0.26 0.055 -7 1 30 0.32 0.33 0.059 -6 -1 30 12.48 5.56 1.054 6 -1 -30 17.70 9.34 1.054 6 -1 -30 12.48 5.44 1.054 -6 -1 30 5.21 5.44 1.054 -6 1 30 0.17 4.70 1.054 6 1 -30 19.93 9.11 1.054 -6 1 30 7.45 5.61 1.054 5 -1 -30 8.46 6.87 1.045 -5 -1 30 1.76 7.78 1.046 -5 -1 30 -6.70 6.70 1.045 -5 -1 30 0.40 5.74 1.045 -5 -1 30 10.73 6.02 1.045 5 -1 -30 3.63 9.37 1.045 5 1 -30 19.88 6.87 1.045 5 1 -30 16.98 10.68 1.045 -5 1 30 7.04 5.23 1.046 -5 1 30 12.61 5.28 1.046 4 -1 -30 3.82 6.64 0.763 -4 -1 30 5.43 5.97 0.764 -4 -1 30 1.74 5.40 0.764 -4 -1 30 2.12 3.61 0.764 -4 -1 30 1.58 3.69 0.764 4 -1 -30 -1.33 6.68 0.764 -4 1 30 -1.49 3.03 0.764 -4 1 30 -0.58 3.66 0.765 4 1 -30 -4.40 5.77 0.764 4 1 -30 -1.29 7.68 0.764 -3 -1 30 4.14 6.58 0.917 3 -1 -30 6.63 8.47 0.917 -3 -1 30 -6.58 6.58 0.918 3 -1 -30 11.86 8.33 0.917 -3 -1 30 -6.67 6.67 0.916 -3 -1 30 -4.73 6.72 0.917 3 1 -30 0.15 6.43 0.917 -3 1 30 1.69 6.17 0.916 -3 1 30 4.73 6.33 0.917 3 1 -30 1.64 5.38 0.916 -3 1 30 0.60 7.12 0.917 -3 1 30 0.30 7.12 0.917 2 -1 -30 -1.42 4.96 0.652 -2 -1 30 3.87 3.77 0.654 2 -1 -30 4.33 6.28 0.653 -2 -1 30 3.06 3.41 0.655 -2 -1 30 -2.44 4.99 0.652 -2 -1 30 3.72 4.60 0.652 -2 1 30 7.12 3.27 0.655 -2 1 30 -1.39 5.12 0.654 -2 1 30 -1.74 2.87 0.653 2 1 -30 3.53 4.20 0.656 -2 1 30 -4.48 4.87 0.655 2 1 -30 2.18 5.60 0.656 -1 -1 30 -1.28 6.03 1.027 -1 -1 30 1.56 7.53 1.027 -1 -1 30 17.51 8.31 1.026 1 -1 -30 1.56 9.21 1.027 -1 -1 30 0.22 5.24 1.026 1 -1 -30 30.46 10.21 1.027 1 1 -30 13.06 10.72 1.027 -1 1 30 2.62 10.09 1.026 1 1 -30 4.24 6.75 1.027 -1 1 30 0.00 6.92 1.027 -1 1 30 4.91 6.03 1.028 -1 1 30 1.62 6.14 1.028 -1 1 30 6.08 7.87 1.027 -8 -2 30 -2.10 4.26 0.560 -8 -2 30 2.16 3.98 0.560 8 -2 -30 -1.13 3.41 0.560 -8 2 30 -0.03 4.26 0.560 -8 2 30 -3.26 4.66 0.560 8 2 -30 -0.18 2.92 0.560 -7 -2 30 -1.80 6.13 1.034 -7 -2 30 -0.06 5.73 1.035 7 -2 -30 10.12 7.93 1.035 7 -2 -30 4.39 7.76 1.035 7 2 -30 10.46 8.99 1.035 -7 2 30 9.84 7.36 1.035 -7 2 30 7.64 8.37 1.034 6 -2 -30 2.62 7.84 1.024 -6 -2 30 6.62 5.12 1.024 -6 -2 30 -1.45 5.18 1.024 -6 -2 30 -5.34 5.34 1.024 -6 -2 30 7.46 5.90 1.024 6 -2 -30 2.50 8.68 1.024 6 2 -30 1.45 6.62 1.024 -6 2 30 0.00 7.35 1.024 -6 2 30 -6.90 6.90 1.024 -5 -2 30 3.04 4.63 0.947 5 -2 -30 -2.47 7.36 0.947 -5 -2 30 0.98 5.40 0.947 -5 -2 30 -2.62 5.25 0.947 5 -2 -30 -4.74 4.74 0.947 -5 -2 30 3.81 4.84 0.947 -5 2 30 -1.08 6.95 0.947 5 2 -30 3.40 5.20 0.947 -5 2 30 -1.59 6.53 0.947 4 -2 -30 -0.34 3.69 0.622 -4 -2 30 1.62 3.31 0.622 -4 -2 30 4.66 3.58 0.621 -4 -2 30 3.39 3.29 0.624 4 -2 -30 1.49 4.87 0.622 -4 -2 30 1.05 3.56 0.623 4 2 -30 -4.24 5.15 0.624 -4 2 30 -0.78 3.51 0.622 -4 2 30 -0.58 3.45 0.623 -3 -2 30 16.91 8.31 1.027 3 -2 -30 6.75 8.65 1.027 -3 -2 30 12.37 6.07 1.026 -3 -2 30 3.01 8.08 1.026 3 -2 -30 8.53 6.63 1.026 -3 -2 30 2.45 6.30 1.027 -3 2 30 5.02 5.80 1.026 -3 2 30 6.52 5.69 1.026 3 2 -30 5.91 6.41 1.026 -2 -2 30 -5.20 5.20 0.742 2 -2 -30 6.04 6.60 0.736 -2 -2 30 6.60 5.24 0.741 2 -2 -30 -3.76 3.76 0.737 -2 -2 30 -0.28 5.78 0.739 -2 -2 30 -1.28 5.44 0.737 -2 2 30 0.36 5.83 0.741 2 2 -30 -0.40 4.78 0.740 -2 2 30 4.67 6.28 0.740 -2 2 30 -1.37 4.06 0.740 1 -2 -30 1.44 2.23 0.326 -1 -2 30 -0.21 1.76 0.327 1 -2 -30 -1.94 1.94 0.325 -1 -2 30 1.38 1.75 0.326 -1 -2 30 -0.41 1.96 0.326 -1 -2 30 3.23 2.02 0.328 -1 2 30 1.10 1.81 0.326 -1 2 30 0.98 1.70 0.327 1 2 -30 -0.86 3.48 0.330 -1 2 30 -1.29 1.91 0.326 -1 2 30 0.97 2.02 0.326 -7 -3 30 25.85 9.11 1.055 -6 -3 30 2.28 3.17 0.384 -6 -3 30 -3.06 3.06 0.383 -6 -3 30 -1.40 3.27 0.384 6 -3 -30 -3.25 3.59 0.386 -6 -3 30 -2.47 3.04 0.386 6 -3 -30 -3.41 3.41 0.385 -6 3 30 0.87 1.94 0.383 6 3 -30 4.06 3.53 0.387 -6 3 30 -1.34 2.11 0.385 -5 -3 30 -1.63 5.56 1.033 5 -3 -30 3.65 6.06 1.033 -5 -3 30 -3.76 7.91 1.032 -5 -3 30 17.22 8.52 1.032 5 -3 -30 -0.84 8.18 1.032 -5 -3 30 5.55 5.83 1.032 5 3 -30 2.97 8.86 1.032 -5 3 30 -1.18 5.55 1.032 -5 3 30 -0.78 6.34 1.032 4 -3 -30 15.52 7.56 1.046 -4 -3 30 37.62 8.70 1.046 4 -3 -30 25.18 9.66 1.046 -4 -3 30 17.85 8.41 1.046 -4 -3 30 21.89 7.11 1.046 -4 -3 30 15.46 8.81 1.046 -4 3 30 23.54 8.81 1.046 4 3 -30 17.34 6.88 1.046 -4 3 30 24.45 7.96 1.046 -3 -3 30 7.27 7.77 1.029 3 -3 -30 8.33 10.34 1.029 -3 -3 30 8.44 7.04 1.029 3 -3 -30 7.94 9.67 1.029 -3 -3 30 -0.28 9.11 1.029 -3 -3 30 -2.80 6.99 1.029 -3 3 30 2.52 7.54 1.029 -3 3 30 4.42 7.43 1.029 7 0 -31 0.21 0.50 0.084 7 0 -31 -0.21 0.71 0.085 -7 0 31 -0.07 0.47 0.087 -7 0 31 -0.06 0.37 0.085 -5 0 31 -3.07 5.33 0.925 -5 0 31 -2.36 5.33 0.925 5 0 -31 -4.42 6.98 0.925 5 0 -31 9.76 6.74 0.926 -3 0 31 -0.47 0.47 0.094 -3 0 31 -0.59 0.74 0.093 3 0 -31 0.31 0.71 0.093 -3 0 31 1.40 0.79 0.094 -3 0 31 -0.41 0.41 0.093 3 0 -31 0.56 0.90 0.094 -7 -1 31 -2.68 8.22 1.029 7 -1 -31 10.18 8.05 1.029 7 -1 -31 5.37 6.83 1.030 -7 -1 31 10.12 9.06 1.029 7 1 -31 5.26 10.41 1.030 -7 1 31 -4.98 4.98 1.030 7 1 -31 5.82 9.84 1.029 -7 1 31 -4.81 5.37 1.030 6 -1 -31 3.66 5.77 0.923 -6 -1 31 -6.78 6.78 0.924 6 -1 -31 5.72 8.62 0.923 -6 -1 31 -7.38 7.38 0.923 6 1 -31 2.26 6.27 0.924 -6 1 31 7.57 5.62 0.923 6 1 -31 1.96 7.38 0.924 -6 1 31 -5.42 5.42 0.923 -5 -1 31 17.43 7.92 1.041 -5 -1 31 9.39 6.11 1.041 -5 -1 31 -3.79 5.71 1.041 5 -1 -31 4.98 9.39 1.041 -5 -1 31 11.04 8.72 1.042 5 -1 -31 9.85 7.47 1.042 -5 1 31 11.60 7.75 1.042 5 1 -31 10.92 8.83 1.042 5 1 -31 10.13 5.38 1.042 -5 1 31 -2.60 8.60 1.042 4 -1 -31 -0.21 5.83 0.949 -4 -1 31 7.22 5.16 0.949 -4 -1 31 9.80 7.84 0.949 -4 -1 31 -2.37 4.49 0.949 -4 -1 31 0.57 5.16 0.949 4 -1 -31 17.96 11.92 0.950 4 1 -31 -0.05 7.38 0.949 -4 1 31 5.11 6.92 0.950 4 1 -31 27.20 9.29 0.950 -4 1 31 11.56 8.88 0.950 3 -1 -31 2.28 5.34 0.511 -3 -1 31 -3.00 3.00 0.512 -3 -1 31 1.84 3.26 0.513 -3 -1 31 -3.66 3.72 0.510 -3 1 31 -1.48 3.04 0.513 3 1 -31 -0.33 3.40 0.513 -3 1 31 -2.83 2.83 0.511 ; _shelx_hkl_checksum 66727 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Si1 Si 0.52456(7) 0.81780(11) 0.28734(4) 0.0636(3) Uani 1 1 d D . . . . C1 C 0.49405(16) 0.4503(3) 0.41165(9) 0.0319(5) Uani 1 1 d . . . . . C2 C 0.57797(15) 0.3532(3) 0.43216(9) 0.0316(5) Uani 1 1 d . . . . . C3 C 0.66439(17) 0.3661(3) 0.41198(10) 0.0363(5) Uani 1 1 d . . . . . H3 H 0.6672 0.4431 0.3845 0.044 Uiso 1 1 calc R U . A 1 C4 C 0.74308(16) 0.2678(3) 0.43208(11) 0.0383(5) Uani 0.708(3) 1 d D U P B 1 S5 S 0.85345(9) 0.26338(16) 0.41038(6) 0.0469(4) Uani 0.708(3) 1 d D U P B 1 C6 C 0.8976(5) 0.1098(8) 0.4574(5) 0.0493(14) Uani 0.708(3) 1 d D U P B 1 H6 H 0.9606 0.0614 0.4616 0.059 Uiso 0.708(3) 1 calc R U P B 1 C7 C 0.8324(8) 0.0657(15) 0.4879(6) 0.0505(10) Uani 0.708(3) 1 d D U P B 1 H7 H 0.8465 -0.0151 0.5155 0.061 Uiso 0.708(3) 1 calc R U P B 1 C8 C 0.74218(16) 0.1523(3) 0.47413(11) 0.0383(5) Uani 0.708(3) 1 d D U P B 1 C4' C 0.74308(16) 0.2678(3) 0.43208(11) 0.0383(5) Uani 0.292(3) 1 d D U P B 2 C5' C 0.8347(10) 0.2614(19) 0.4197(7) 0.0469(4) Uani 0.292(3) 1 d D U P B 2 H5' H 0.8515 0.3297 0.3931 0.056 Uiso 0.292(3) 1 calc R U P B 2 C6' C 0.8991(14) 0.149(2) 0.4486(12) 0.0493(14) Uani 0.292(3) 1 d D U P B 2 H6' H 0.9639 0.1321 0.4440 0.059 Uiso 0.292(3) 1 calc R U P B 2 S7' S 0.8490(5) 0.0417(9) 0.4945(4) 0.0505(10) Uani 0.292(3) 1 d D U P B 2 C8' C 0.74218(16) 0.1523(3) 0.47413(11) 0.0383(5) Uani 0.292(3) 1 d D U P B 2 C9 C 0.66050(17) 0.1380(3) 0.49501(10) 0.0364(5) Uani 1 1 d . . . . . H9 H 0.6605 0.0622 0.5234 0.044 Uiso 1 1 calc R U . B 1 C10 C 0.57549(16) 0.2363(3) 0.47427(9) 0.0324(5) Uani 1 1 d . . . . . C11 C 0.49063(16) 0.2223(3) 0.49366(10) 0.0338(5) Uani 1 1 d . . . . . H11 H 0.4900 0.1465 0.5219 0.041 Uiso 1 1 calc R U . . . C12 C 0.40657(16) 0.3158(3) 0.47299(9) 0.0321(5) Uani 1 1 d . . . . . C13 C 0.31966(17) 0.2970(3) 0.49233(10) 0.0379(5) Uani 1 1 d . . . . . H13 H 0.3185 0.2207 0.5203 0.046 Uiso 1 1 calc R U . C 1 C14 C 0.23820(16) 0.3887(3) 0.47055(10) 0.0370(5) Uani 0.757(3) 1 d D U P D 1 S15 S 0.12520(9) 0.37993(16) 0.48837(7) 0.0461(4) Uani 0.757(3) 1 d D U P D 1 C16 C 0.0786(5) 0.5347(10) 0.4414(5) 0.0484(12) Uani 0.757(3) 1 d D U P D 1 H16 H 0.0134 0.5768 0.4359 0.058 Uiso 0.757(3) 1 calc R U P D 1 C17 C 0.1417(8) 0.5865(15) 0.4147(5) 0.0510(13) Uani 0.757(3) 1 d D U P D 1 H17 H 0.1258 0.6696 0.3880 0.061 Uiso 0.757(3) 1 calc R U P D 1 C18 C 0.23871(16) 0.5067(3) 0.42887(10) 0.0379(5) Uani 0.757(3) 1 d D U P D 1 C14' C 0.23820(16) 0.3887(3) 0.47055(10) 0.0370(5) Uani 0.243(3) 1 d D U P D 2 C15' C 0.1386(12) 0.404(2) 0.4804(10) 0.0461(4) Uani 0.243(3) 1 d D U P D 2 H15' H 0.1203 0.3433 0.5086 0.055 Uiso 0.243(3) 1 calc R U P D 2 C16' C 0.0774(17) 0.503(4) 0.4492(17) 0.0484(12) Uani 0.243(3) 1 d D U P D 2 H16' H 0.0106 0.5154 0.4511 0.058 Uiso 0.243(3) 1 calc R U P D 2 S17' S 0.1269(7) 0.6126(11) 0.4028(4) 0.0510(13) Uani 0.243(3) 1 d D U P D 2 C18' C 0.23871(16) 0.5067(3) 0.42887(10) 0.0379(5) Uani 0.243(3) 1 d D U P D 2 C19 C 0.32104(17) 0.5277(3) 0.40961(10) 0.0371(5) Uani 1 1 d . . . . . H19 H 0.3208 0.6056 0.3819 0.045 Uiso 1 1 calc R U . D 1 C20 C 0.40696(15) 0.4334(3) 0.43080(9) 0.0321(5) Uani 1 1 d . . . . . C21 C 0.49821(17) 0.5702(3) 0.37118(10) 0.0385(5) Uani 1 1 d . . . . . C22 C 0.5063(2) 0.6699(3) 0.33816(12) 0.0495(6) Uani 1 1 d . . . . . C23 C 0.6634(2) 0.8059(4) 0.29253(13) 0.0697(9) Uani 1 1 d D . . . . H23 H 0.6749 0.6978 0.2816 0.084 Uiso 1 1 calc R U . . . C24 C 0.6916(3) 0.9106(6) 0.24693(18) 0.1049(15) Uani 1 1 d D . . . . H24A H 0.6989 1.0173 0.2607 0.157 Uiso 1 1 calc R U . . . H24B H 0.6385 0.9049 0.2102 0.157 Uiso 1 1 calc R U . . . H24C H 0.7551 0.8753 0.2413 0.157 Uiso 1 1 calc R U . . . C25 C 0.7326(3) 0.8287(4) 0.35141(14) 0.0738(9) Uani 1 1 d D . . . . H25A H 0.7058 0.7712 0.3792 0.089 Uiso 1 1 calc R U . . . H25B H 0.7327 0.9393 0.3613 0.089 Uiso 1 1 calc R U . . . C26 C 0.8406(3) 0.7781(5) 0.35938(17) 0.0850(11) Uani 1 1 d D . . . . H26A H 0.8422 0.6672 0.3522 0.128 Uiso 1 1 calc R U . . . H26B H 0.8808 0.8005 0.3990 0.128 Uiso 1 1 calc R U . . . H26C H 0.8682 0.8339 0.3321 0.128 Uiso 1 1 calc R U . . . C27 C 0.4428(4) 0.7723(6) 0.2141(2) 0.0742(16) Uani 0.670(4) 1 d D U P E 1 H27 H 0.4500 0.8555 0.1870 0.089 Uiso 0.670(4) 1 calc R U P E 1 C28 C 0.3303(5) 0.7639(9) 0.2145(3) 0.101(2) Uani 0.670(4) 1 d D U P E 1 H28A H 0.2871 0.7524 0.1748 0.152 Uiso 0.670(4) 1 calc R U P E 1 H28B H 0.3124 0.8586 0.2312 0.152 Uiso 0.670(4) 1 calc R U P E 1 H28C H 0.3210 0.6753 0.2376 0.152 Uiso 0.670(4) 1 calc R U P E 1 C29 C 0.4769(5) 0.6233(7) 0.1950(2) 0.0813(15) Uani 0.670(4) 1 d D U P E 1 H29A H 0.4753 0.5437 0.2241 0.098 Uiso 0.670(4) 1 calc R U P E 1 H29B H 0.5477 0.6353 0.1949 0.098 Uiso 0.670(4) 1 calc R U P E 1 C30 C 0.4179(5) 0.5646(8) 0.1367(2) 0.0929(17) Uani 0.670(4) 1 d D U P E 1 H30A H 0.4549 0.4804 0.1250 0.139 Uiso 0.670(4) 1 calc R U P E 1 H30B H 0.4079 0.6482 0.1084 0.139 Uiso 0.670(4) 1 calc R U P E 1 H30C H 0.3525 0.5268 0.1387 0.139 Uiso 0.670(4) 1 calc R U P E 1 C27' C 0.4665(8) 0.7153(13) 0.2128(5) 0.0742(16) Uani 0.330(4) 1 d D U P E 2 H27' H 0.4699 0.7947 0.1834 0.089 Uiso 0.330(4) 1 calc R U P E 2 C28' C 0.5268(10) 0.5743(16) 0.1986(7) 0.101(2) Uani 0.330(4) 1 d D U P E 2 H28D H 0.5907 0.5640 0.2289 0.152 Uiso 0.330(4) 1 calc R U P E 2 H28E H 0.5399 0.5911 0.1613 0.152 Uiso 0.330(4) 1 calc R U P E 2 H28F H 0.4872 0.4800 0.1968 0.152 Uiso 0.330(4) 1 calc R U P E 2 C29' C 0.3578(7) 0.6753(15) 0.1985(4) 0.0813(15) Uani 0.330(4) 1 d D U P E 2 H29C H 0.3206 0.7711 0.2009 0.098 Uiso 0.330(4) 1 calc R U P E 2 H29D H 0.3491 0.6056 0.2292 0.098 Uiso 0.330(4) 1 calc R U P E 2 C30' C 0.3079(9) 0.6012(15) 0.1415(4) 0.0929(17) Uani 0.330(4) 1 d D U P E 2 H30D H 0.2369 0.6307 0.1289 0.139 Uiso 0.330(4) 1 calc R U P E 2 H30E H 0.3134 0.4890 0.1455 0.139 Uiso 0.330(4) 1 calc R U P E 2 H30F H 0.3409 0.6355 0.1127 0.139 Uiso 0.330(4) 1 calc R U P E 2 C31 C 0.4882(6) 1.0094(7) 0.3136(3) 0.103(3) Uani 0.703(5) 1 d D U P E 1 H31 H 0.5512 1.0456 0.3424 0.124 Uiso 0.703(5) 1 calc R U P E 1 C32 C 0.4078(6) 1.0049(7) 0.3490(3) 0.102(2) Uani 0.703(5) 1 d D U P E 1 H32A H 0.3443 0.9636 0.3245 0.153 Uiso 0.703(5) 1 calc R U P E 1 H32B H 0.3970 1.1094 0.3614 0.153 Uiso 0.703(5) 1 calc R U P E 1 H32C H 0.4325 0.9389 0.3831 0.153 Uiso 0.703(5) 1 calc R U P E 1 C33 C 0.4697(10) 1.1253(15) 0.2667(5) 0.191(4) Uani 0.703(5) 1 d D U P E 1 H33A H 0.5324 1.1860 0.2742 0.230 Uiso 0.703(5) 1 calc R U P E 1 H33B H 0.4644 1.0663 0.2309 0.230 Uiso 0.703(5) 1 calc R U P E 1 C34 C 0.3881(8) 1.2376(10) 0.2517(5) 0.193(4) Uani 0.703(5) 1 d D U P E 1 H34A H 0.3772 1.2710 0.2116 0.290 Uiso 0.703(5) 1 calc R U P E 1 H34B H 0.4059 1.3268 0.2775 0.290 Uiso 0.703(5) 1 calc R U P E 1 H34C H 0.3266 1.1903 0.2560 0.290 Uiso 0.703(5) 1 calc R U P E 1 C31' C 0.4425(13) 0.9874(16) 0.2894(6) 0.103(3) Uani 0.297(5) 1 d D U P E 2 H31' H 0.3716 0.9521 0.2828 0.124 Uiso 0.297(5) 1 calc R U P E 2 C32' C 0.4904(14) 1.0250(18) 0.3560(6) 0.102(2) Uani 0.297(5) 1 d D U P E 2 H32D H 0.4673 0.9492 0.3794 0.153 Uiso 0.297(5) 1 calc R U P E 2 H32E H 0.4698 1.1284 0.3643 0.153 Uiso 0.297(5) 1 calc R U P E 2 H32F H 0.5638 1.0208 0.3653 0.153 Uiso 0.297(5) 1 calc R U P E 2 C33' C 0.4452(18) 1.118(3) 0.2499(10) 0.191(4) Uani 0.297(5) 1 d D U P E 2 H33C H 0.4136 1.0812 0.2101 0.230 Uiso 0.297(5) 1 calc R U P E 2 H33D H 0.4005 1.1992 0.2577 0.230 Uiso 0.297(5) 1 calc R U P E 2 C34' C 0.5391(19) 1.195(2) 0.2495(11) 0.193(4) Uani 0.297(5) 1 d D U P E 2 H34D H 0.5267 1.2633 0.2159 0.290 Uiso 0.297(5) 1 calc R U P E 2 H34E H 0.5889 1.1168 0.2472 0.290 Uiso 0.297(5) 1 calc R U P E 2 H34F H 0.5645 1.2548 0.2850 0.290 Uiso 0.297(5) 1 calc R U P E 2 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 Si1 0.0668(6) 0.0671(6) 0.0613(5) 0.0283(4) 0.0251(4) 0.0026(4) C1 0.0307(11) 0.0319(11) 0.0358(11) -0.0028(9) 0.0138(9) -0.0008(9) C2 0.0264(10) 0.0320(11) 0.0396(12) -0.0021(9) 0.0146(9) -0.0007(8) C3 0.0318(11) 0.0354(12) 0.0475(13) -0.0041(10) 0.0207(10) -0.0027(9) C4 0.0288(11) 0.0381(12) 0.0526(14) -0.0114(10) 0.0189(10) -0.0041(9) S5 0.0293(6) 0.0511(6) 0.0695(8) -0.0085(5) 0.0287(4) -0.0002(4) C6 0.0294(13) 0.047(4) 0.076(4) -0.010(3) 0.0208(16) 0.003(2) C7 0.027(2) 0.045(2) 0.079(2) -0.0080(15) 0.0161(18) 0.0110(13) C8 0.0273(11) 0.0371(12) 0.0513(14) -0.0081(10) 0.0121(10) 0.0017(9) C4' 0.0288(11) 0.0381(12) 0.0526(14) -0.0114(10) 0.0189(10) -0.0041(9) C5' 0.0293(6) 0.0511(6) 0.0695(8) -0.0085(5) 0.0287(4) -0.0002(4) C6' 0.0294(13) 0.047(4) 0.076(4) -0.010(3) 0.0208(16) 0.003(2) S7' 0.027(2) 0.045(2) 0.079(2) -0.0080(15) 0.0161(18) 0.0110(13) C8' 0.0273(11) 0.0371(12) 0.0513(14) -0.0081(10) 0.0121(10) 0.0017(9) C9 0.0318(11) 0.0340(12) 0.0437(12) -0.0001(10) 0.0112(10) 0.0033(9) C10 0.0277(11) 0.0328(12) 0.0380(11) -0.0037(9) 0.0113(9) 0.0006(9) C11 0.0334(11) 0.0321(11) 0.0382(12) 0.0011(9) 0.0138(9) -0.0009(9) C12 0.0291(11) 0.0321(11) 0.0385(11) -0.0058(9) 0.0150(9) -0.0025(9) C13 0.0340(12) 0.0381(13) 0.0472(13) -0.0041(10) 0.0204(10) -0.0037(10) C14 0.0276(11) 0.0395(12) 0.0494(13) -0.0137(10) 0.0200(10) -0.0047(9) S15 0.0293(5) 0.0455(7) 0.0717(7) -0.0090(5) 0.0276(4) -0.0019(4) C16 0.0284(12) 0.045(4) 0.073(4) -0.014(2) 0.0180(14) 0.0027(19) C17 0.037(2) 0.053(3) 0.065(3) -0.0149(19) 0.017(2) 0.0021(16) C18 0.0282(11) 0.0357(12) 0.0499(13) -0.0121(10) 0.0116(10) 0.0003(9) C14' 0.0276(11) 0.0395(12) 0.0494(13) -0.0137(10) 0.0200(10) -0.0047(9) C15' 0.0293(5) 0.0455(7) 0.0717(7) -0.0090(5) 0.0276(4) -0.0019(4) C16' 0.0284(12) 0.045(4) 0.073(4) -0.014(2) 0.0180(14) 0.0027(19) S17' 0.037(2) 0.053(3) 0.065(3) -0.0149(19) 0.017(2) 0.0021(16) C18' 0.0282(11) 0.0357(12) 0.0499(13) -0.0121(10) 0.0116(10) 0.0003(9) C19 0.0325(11) 0.0339(12) 0.0452(13) -0.0034(10) 0.0115(10) 0.0019(9) C20 0.0262(10) 0.0330(11) 0.0391(11) -0.0050(9) 0.0125(9) -0.0009(9) C21 0.0322(12) 0.0432(13) 0.0431(12) -0.0002(11) 0.0155(10) 0.0034(10) C22 0.0485(15) 0.0547(16) 0.0496(14) 0.0109(13) 0.0210(12) 0.0030(13) C23 0.076(2) 0.078(2) 0.0658(19) 0.0068(17) 0.0372(17) -0.0156(18) C24 0.091(3) 0.148(4) 0.086(3) 0.036(3) 0.041(2) -0.024(3) C25 0.075(2) 0.078(2) 0.074(2) 0.0048(18) 0.0315(18) -0.0095(19) C26 0.083(3) 0.087(3) 0.088(3) -0.004(2) 0.029(2) 0.004(2) C27 0.084(3) 0.073(4) 0.065(2) 0.039(3) 0.020(2) 0.011(3) C28 0.093(4) 0.114(5) 0.093(4) 0.018(4) 0.020(3) 0.000(4) C29 0.082(4) 0.092(4) 0.062(3) 0.015(3) 0.007(3) -0.006(3) C30 0.107(4) 0.106(4) 0.057(2) 0.012(3) 0.009(3) -0.018(3) C27' 0.084(3) 0.073(4) 0.065(2) 0.039(3) 0.020(2) 0.011(3) C28' 0.093(4) 0.114(5) 0.093(4) 0.018(4) 0.020(3) 0.000(4) C29' 0.082(4) 0.092(4) 0.062(3) 0.015(3) 0.007(3) -0.006(3) C30' 0.107(4) 0.106(4) 0.057(2) 0.012(3) 0.009(3) -0.018(3) C31 0.141(7) 0.077(3) 0.104(5) 0.055(4) 0.054(5) 0.048(4) C32 0.140(6) 0.082(3) 0.079(3) 0.004(3) 0.022(4) 0.047(4) C33 0.288(10) 0.116(5) 0.197(8) 0.110(6) 0.113(7) 0.082(6) C34 0.278(10) 0.130(6) 0.207(9) 0.102(6) 0.126(8) 0.064(6) C31' 0.141(7) 0.077(3) 0.104(5) 0.055(4) 0.054(5) 0.048(4) C32' 0.140(6) 0.082(3) 0.079(3) 0.004(3) 0.022(4) 0.047(4) C33' 0.288(10) 0.116(5) 0.197(8) 0.110(6) 0.113(7) 0.082(6) C34' 0.278(10) 0.130(6) 0.207(9) 0.102(6) 0.126(8) 0.064(6) 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' Si Si 0.0817 0.0704 '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_ _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 C22 Si1 C27 108.9(2) . . C22 Si1 C31' 109.3(5) . . C22 Si1 C31 106.7(2) . . C27 Si1 C31 110.9(3) . . C22 Si1 C23 104.36(13) . . C27 Si1 C23 112.7(2) . . C31' Si1 C23 131.0(6) . . C31 Si1 C23 112.8(3) . . C22 Si1 C27' 101.3(4) . . C31' Si1 C27' 106.7(6) . . C23 Si1 C27' 100.3(4) . . C2 C1 C20 121.4(2) . . C2 C1 C21 118.78(19) . . C20 C1 C21 119.86(19) . . C1 C2 C3 121.8(2) . . C1 C2 C10 118.97(18) . . C3 C2 C10 119.2(2) . . C4 C3 C2 119.9(2) . . C4 C3 H3 120.1 . . C2 C3 H3 120.1 . . C3 C4 C8 121.6(2) . . C3 C4 S5 126.0(2) . . C8 C4 S5 112.42(17) . . C6 S5 C4 89.8(2) . . C7 C6 S5 113.4(5) . . C7 C6 H6 123.3 . . S5 C6 H6 123.3 . . C6 C7 C8 113.7(9) . . C6 C7 H7 123.2 . . C8 C7 H7 123.2 . . C9 C8 C7 129.4(6) . . C9 C8 C4 120.0(2) . . C7 C8 C4 110.6(6) . . C6' C5' H5' 122.5 . . C5' C6' S7' 112.6(10) . . C5' C6' H6' 123.7 . . S7' C6' H6' 123.7 . . C8 C9 C10 120.3(2) . . C8 C9 H9 119.8 . . C10 C9 H9 119.8 . . C11 C10 C9 121.7(2) . . C11 C10 C2 119.36(19) . . C9 C10 C2 118.9(2) . . C10 C11 C12 122.2(2) . . C10 C11 H11 118.9 . . C12 C11 H11 118.9 . . C11 C12 C13 121.3(2) . . C11 C12 C20 119.58(19) . . C13 C12 C20 119.2(2) . . C14 C13 C12 119.7(2) . . C14 C13 H13 120.1 . . C12 C13 H13 120.1 . . C13 C14 C18 121.2(2) . . C13 C14 S15 125.97(19) . . C18 C14 S15 112.84(17) . . C14 S15 C16 90.0(2) . . C17 C16 S15 113.9(5) . . C17 C16 H16 123.0 . . S15 C16 H16 123.0 . . C16 C17 C18 115.0(7) . . C16 C17 H17 122.5 . . C18 C17 H17 122.5 . . C19 C18 C14 120.4(2) . . C19 C18 C17 131.4(5) . . C14 C18 C17 108.2(5) . . C16' C15' H15' 121.4 . . C15' C16' S17' 115.0(13) . . C15' C16' H16' 122.5 . . S17' C16' H16' 122.5 . . C18 C19 C20 120.1(2) . . C18 C19 H19 119.9 . . C20 C19 H19 119.9 . . C19 C20 C1 122.1(2) . . C19 C20 C12 119.41(19) . . C1 C20 C12 118.52(19) . . C22 C21 C1 177.0(3) . . C21 C22 Si1 177.1(2) . . C25 C23 C24 111.9(3) . . C25 C23 Si1 115.1(2) . . C24 C23 Si1 112.1(3) . . C25 C23 H23 105.6 . . C24 C23 H23 105.6 . . Si1 C23 H23 105.6 . . C23 C24 H24A 109.5 . . C23 C24 H24B 109.5 . . H24A C24 H24B 109.5 . . C23 C24 H24C 109.5 . . H24A C24 H24C 109.5 . . H24B C24 H24C 109.5 . . C23 C25 C26 115.4(3) . . C23 C25 H25A 108.4 . . C26 C25 H25A 108.4 . . C23 C25 H25B 108.4 . . C26 C25 H25B 108.4 . . H25A C25 H25B 107.5 . . C25 C26 H26A 109.5 . . C25 C26 H26B 109.5 . . H26A C26 H26B 109.5 . . C25 C26 H26C 109.5 . . H26A C26 H26C 109.5 . . H26B C26 H26C 109.5 . . C29 C27 C28 111.4(5) . . C29 C27 Si1 108.5(3) . . C28 C27 Si1 110.3(4) . . C29 C27 H27 108.9 . . C28 C27 H27 108.9 . . Si1 C27 H27 108.9 . . C27 C28 H28A 109.5 . . C27 C28 H28B 109.5 . . H28A C28 H28B 109.5 . . C27 C28 H28C 109.5 . . H28A C28 H28C 109.5 . . H28B C28 H28C 109.5 . . C27 C29 C30 116.6(5) . . C27 C29 H29A 108.1 . . C30 C29 H29A 108.1 . . C27 C29 H29B 108.1 . . C30 C29 H29B 108.1 . . H29A C29 H29B 107.3 . . C29 C30 H30A 109.5 . . C29 C30 H30B 109.5 . . H30A C30 H30B 109.5 . . C29 C30 H30C 109.5 . . H30A C30 H30C 109.5 . . H30B C30 H30C 109.5 . . C29' C27' C28' 109.6(7) . . C29' C27' Si1 116.1(8) . . C28' C27' Si1 116.5(8) . . C29' C27' H27' 104.3 . . C28' C27' H27' 104.3 . . Si1 C27' H27' 104.3 . . C27' C28' H28D 109.5 . . C27' C28' H28E 109.5 . . H28D C28' H28E 109.5 . . C27' C28' H28F 109.5 . . H28D C28' H28F 109.5 . . H28E C28' H28F 109.5 . . C27' C29' C30' 118.9(7) . . C27' C29' H29C 107.6 . . C30' C29' H29C 107.6 . . C27' C29' H29D 107.6 . . C30' C29' H29D 107.6 . . H29C C29' H29D 107.0 . . C29' C30' H30D 109.5 . . C29' C30' H30E 109.5 . . H30D C30' H30E 109.5 . . C29' C30' H30F 109.5 . . H30D C30' H30F 109.5 . . H30E C30' H30F 109.5 . . C33 C31 C32 115.6(5) . . C33 C31 Si1 110.1(7) . . C32 C31 Si1 116.9(5) . . C33 C31 H31 104.1 . . C32 C31 H31 104.1 . . Si1 C31 H31 104.1 . . C31 C32 H32A 109.5 . . C31 C32 H32B 109.5 . . H32A C32 H32B 109.5 . . C31 C32 H32C 109.5 . . H32A C32 H32C 109.5 . . H32B C32 H32C 109.5 . . C34 C33 C31 126.6(8) . . C34 C33 H33A 105.7 . . C31 C33 H33A 105.7 . . C34 C33 H33B 105.7 . . C31 C33 H33B 105.7 . . H33A C33 H33B 106.1 . . C33 C34 H34A 109.5 . . C33 C34 H34B 109.5 . . H34A C34 H34B 109.5 . . C33 C34 H34C 109.5 . . H34A C34 H34C 109.5 . . H34B C34 H34C 109.5 . . C33' C31' C32' 114.2(8) . . C33' C31' Si1 117.1(14) . . C32' C31' Si1 96.1(9) . . C33' C31' H31' 109.6 . . C32' C31' H31' 109.6 . . Si1 C31' H31' 109.6 . . C31' C32' H32D 109.5 . . C31' C32' H32E 109.5 . . H32D C32' H32E 109.5 . . C31' C32' H32F 109.5 . . H32D C32' H32F 109.5 . . H32E C32' H32F 109.5 . . C34' C33' C31' 122.3(11) . . C34' C33' H33C 106.8 . . C31' C33' H33C 106.8 . . C34' C33' H33D 106.8 . . C31' C33' H33D 106.8 . . H33C C33' H33D 106.6 . . C33' C34' H34D 109.5 . . C33' C34' H34E 109.5 . . H34D C34' H34E 109.5 . . C33' C34' H34F 109.5 . . H34D C34' H34F 109.5 . . H34E C34' H34F 109.5 . . loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 Si1 C22 1.842(3) . Si1 C27 1.851(5) . Si1 C31' 1.872(12) . Si1 C31 1.899(7) . Si1 C23 1.900(3) . Si1 C27' 1.964(10) . C1 C2 1.409(3) . C1 C20 1.421(3) . C1 C21 1.440(3) . C2 C3 1.423(3) . C2 C10 1.444(3) . C3 C4 1.362(3) . C3 H3 0.9500 . C4 C8 1.430(4) . C4 S5 1.757(2) . S5 C6 1.746(6) . C6 C7 1.374(14) . C6 H6 0.9500 . C7 C8 1.417(9) . C7 H7 0.9500 . C8 C9 1.373(3) . C5' C6' 1.371(18) . C5' H5' 0.9500 . C6' S7' 1.740(17) . C6' H6' 0.9500 . C9 C10 1.427(3) . C9 H9 0.9500 . C10 C11 1.392(3) . C11 C12 1.393(3) . C11 H11 0.9500 . C12 C13 1.423(3) . C12 C20 1.443(3) . C13 C14 1.361(3) . C13 H13 0.9500 . C14 C18 1.438(4) . C14 S15 1.744(2) . S15 C16 1.758(6) . C16 C17 1.308(12) . C16 H16 0.9500 . C17 C18 1.467(10) . C17 H17 0.9500 . C18 C19 1.364(3) . C15' C16' 1.29(2) . C15' H15' 0.9500 . C16' S17' 1.752(19) . C16' H16' 0.9500 . C19 C20 1.417(3) . C19 H19 0.9500 . C21 C22 1.204(4) . C23 C25 1.484(4) . C23 C24 1.561(4) . C23 H23 1.0000 . C24 H24A 0.9800 . C24 H24B 0.9800 . C24 H24C 0.9800 . C25 C26 1.522(5) . C25 H25A 0.9900 . C25 H25B 0.9900 . C26 H26A 0.9800 . C26 H26B 0.9800 . C26 H26C 0.9800 . C27 C29 1.495(6) . C27 C28 1.567(6) . C27 H27 1.0000 . C28 H28A 0.9800 . C28 H28B 0.9800 . C28 H28C 0.9800 . C29 C30 1.501(6) . C29 H29A 0.9900 . C29 H29B 0.9900 . C30 H30A 0.9800 . C30 H30B 0.9800 . C30 H30C 0.9800 . C27' C29' 1.491(7) . C27' C28' 1.574(8) . C27' H27' 1.0000 . C28' H28D 0.9800 . C28' H28E 0.9800 . C28' H28F 0.9800 . C29' C30' 1.499(7) . C29' H29C 0.9900 . C29' H29D 0.9900 . C30' H30D 0.9800 . C30' H30E 0.9800 . C30' H30F 0.9800 . C31 C33 1.482(6) . C31 C32 1.589(6) . C31 H31 1.0000 . C32 H32A 0.9800 . C32 H32B 0.9800 . C32 H32C 0.9800 . C33 C34 1.460(8) . C33 H33A 0.9900 . C33 H33B 0.9900 . C34 H34A 0.9800 . C34 H34B 0.9800 . C34 H34C 0.9800 . C31' C33' 1.491(7) . C31' C32' 1.587(8) . C31' H31' 1.0000 . C32' H32D 0.9800 . C32' H32E 0.9800 . C32' H32F 0.9800 . C33' C34' 1.466(10) . C33' H33C 0.9900 . C33' H33D 0.9900 . C34' H34D 0.9800 . C34' H34E 0.9800 . C34' H34F 0.9800 . loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 C20 C1 C2 C3 178.1(2) . . . . C21 C1 C2 C3 -2.9(3) . . . . C20 C1 C2 C10 -1.1(3) . . . . C21 C1 C2 C10 177.9(2) . . . . C1 C2 C3 C4 -178.6(2) . . . . C10 C2 C3 C4 0.5(3) . . . . C2 C3 C4 C8 -1.1(3) . . . . C2 C3 C4 S5 177.94(18) . . . . C3 C4 S5 C6 -179.5(4) . . . . C8 C4 S5 C6 -0.4(4) . . . . C4 S5 C6 C7 -0.3(10) . . . . S5 C6 C7 C8 1.0(15) . . . . C6 C7 C8 C9 178.6(7) . . . . C6 C7 C8 C4 -1.2(13) . . . . C3 C4 C8 C9 0.3(3) . . . . S5 C4 C8 C9 -178.85(19) . . . . C3 C4 C8 C7 -179.9(7) . . . . S5 C4 C8 C7 1.0(7) . . . . C7 C8 C9 C10 -178.7(8) . . . . C4 C8 C9 C10 1.0(3) . . . . C8 C9 C10 C11 178.5(2) . . . . C8 C9 C10 C2 -1.6(3) . . . . C1 C2 C10 C11 -0.1(3) . . . . C3 C2 C10 C11 -179.3(2) . . . . C1 C2 C10 C9 180.0(2) . . . . C3 C2 C10 C9 0.8(3) . . . . C9 C10 C11 C12 -178.9(2) . . . . C2 C10 C11 C12 1.2(3) . . . . C10 C11 C12 C13 178.4(2) . . . . C10 C11 C12 C20 -1.1(3) . . . . C11 C12 C13 C14 -178.9(2) . . . . C20 C12 C13 C14 0.6(3) . . . . C12 C13 C14 C18 -1.1(3) . . . . C12 C13 C14 S15 178.99(18) . . . . C13 C14 S15 C16 179.1(5) . . . . C18 C14 S15 C16 -0.8(5) . . . . C14 S15 C16 C17 0.5(11) . . . . S15 C16 C17 C18 -0.1(16) . . . . C13 C14 C18 C19 1.0(3) . . . . S15 C14 C18 C19 -179.11(18) . . . . C13 C14 C18 C17 -179.1(6) . . . . S15 C14 C18 C17 0.8(6) . . . . C16 C17 C18 C19 179.5(8) . . . . C16 C17 C18 C14 -0.4(13) . . . . C14 C18 C19 C20 -0.3(3) . . . . C17 C18 C19 C20 179.8(8) . . . . C18 C19 C20 C1 179.5(2) . . . . C18 C19 C20 C12 -0.2(3) . . . . C2 C1 C20 C19 -178.5(2) . . . . C21 C1 C20 C19 2.5(3) . . . . C2 C1 C20 C12 1.2(3) . . . . C21 C1 C20 C12 -177.7(2) . . . . C11 C12 C20 C19 179.6(2) . . . . C13 C12 C20 C19 0.1(3) . . . . C11 C12 C20 C1 -0.1(3) . . . . C13 C12 C20 C1 -179.64(19) . . . . C22 Si1 C23 C25 -57.2(3) . . . . C27 Si1 C23 C25 -175.2(3) . . . . C31' Si1 C23 C25 75.1(6) . . . . C31 Si1 C23 C25 58.3(3) . . . . C27' Si1 C23 C25 -161.8(5) . . . . C22 Si1 C23 C24 173.4(3) . . . . C27 Si1 C23 C24 55.4(4) . . . . C31' Si1 C23 C24 -54.3(6) . . . . C31 Si1 C23 C24 -71.2(4) . . . . C27' Si1 C23 C24 68.8(5) . . . . C24 C23 C25 C26 -66.1(5) . . . . Si1 C23 C25 C26 164.4(3) . . . . C22 Si1 C27 C29 -64.6(4) . . . . C31' Si1 C27 C29 -174.6(7) . . . . C31 Si1 C27 C29 178.2(4) . . . . C23 Si1 C27 C29 50.7(4) . . . . C27' Si1 C27 C29 2.6(15) . . . . C22 Si1 C27 C28 57.7(4) . . . . C31' Si1 C27 C28 -52.3(6) . . . . C31 Si1 C27 C28 -59.5(5) . . . . C23 Si1 C27 C28 173.0(3) . . . . C27' Si1 C27 C28 124.9(17) . . . . C28 C27 C29 C30 57.0(7) . . . . Si1 C27 C29 C30 178.7(5) . . . . C28' C27' C29' C30' -47.2(15) . . . . Si1 C27' C29' C30' 178.1(10) . . . . C22 Si1 C31 C33 -162.2(7) . . . . C27 Si1 C31 C33 -43.8(8) . . . . C31' Si1 C31 C33 -62.3(16) . . . . C23 Si1 C31 C33 83.7(8) . . . . C27' Si1 C31 C33 -42.1(9) . . . . C22 Si1 C31 C32 -27.6(6) . . . . C27 Si1 C31 C32 90.9(6) . . . . C31' Si1 C31 C32 72.4(16) . . . . C23 Si1 C31 C32 -141.6(5) . . . . C27' Si1 C31 C32 92.6(7) . . . . C32 C31 C33 C34 3(2) . . . . Si1 C31 C33 C34 137.8(14) . . . . C22 Si1 C31' C33' -178.7(11) . . . . C27 Si1 C31' C33' -69.0(11) . . . . C31 Si1 C31' C33' 93.8(17) . . . . C23 Si1 C31' C33' 50.7(13) . . . . C27' Si1 C31' C33' -69.9(12) . . . . C22 Si1 C31' C32' 60.2(11) . . . . C27 Si1 C31' C32' 169.8(11) . . . . C31 Si1 C31' C32' -27.4(11) . . . . C23 Si1 C31' C32' -70.5(11) . . . . C27' Si1 C31' C32' 168.9(10) . . . . C32' C31' C33' C34' 57(3) . . . . Si1 C31' C33' C34' -54(3) . . . .