#------------------------------------------------------------------------------ #$Date: 2021-10-16 01:59:07 +0300 (Sat, 16 Oct 2021) $ #$Revision: 269973 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/70/85/7708575.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_7708575 loop_ _publ_author_name 'Swaminathan, Srividya' 'Haribabu, Jebiti' 'Mohamed Kasim, Mohamed Subarkhan' 'dasararaju, gayathri' 'Balakrishnan, Nithya' 'Bhuvanesh, Nattamai' 'Echeverria, Cesar' 'Karvembu, R.' _publ_section_title ; Impact of aliphatic acyl and aromatic thioamide substituents on the anticancer activity of Ru(II)-p-cymene complexes carrying acylthiourea ligands -- In vitro and in vivo studies ; _journal_name_full 'Dalton Transactions' _journal_paper_doi 10.1039/D1DT02611A _journal_year 2021 _chemical_formula_moiety 'C28 H36 Cl2 N2 O Ru S' _chemical_formula_sum 'C28 H36 Cl2 N2 O Ru S' _chemical_formula_weight 620.62 _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_date 2021-04-16 _audit_creation_method ; Olex2 1.3 (compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272) ; _audit_update_record ; 2021-09-18 deposited with the CCDC. 2021-10-15 downloaded from the CCDC. ; _cell_angle_alpha 72.4080(10) _cell_angle_beta 75.7970(10) _cell_angle_gamma 85.5710(10) _cell_formula_units_Z 4 _cell_length_a 10.3251(3) _cell_length_b 14.2609(4) _cell_length_c 20.2233(6) _cell_measurement_reflns_used 9584 _cell_measurement_temperature 110.0 _cell_measurement_theta_max 30.498 _cell_measurement_theta_min 2.997 _cell_volume 2751.74(14) _computing_cell_refinement 'SAINT V8.38A (Bruker, 2018)' _computing_data_collection 'APEX 3 (Bruker AXS)' _computing_data_reduction 'SAINT V8.38A (Bruker, 2018)' _computing_molecular_graphics 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_structure_refinement 'XL (Sheldrick, 2008)' _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' _diffrn_ambient_temperature 110.0 _diffrn_measured_fraction_theta_full 0.998 _diffrn_measured_fraction_theta_max 0.995 _diffrn_measurement_device_type 'Bruker QUEST PHOTON-III' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0309 _diffrn_reflns_av_unetI/netI 0.0211 _diffrn_reflns_Laue_measured_fraction_full 0.998 _diffrn_reflns_Laue_measured_fraction_max 0.995 _diffrn_reflns_limit_h_max 14 _diffrn_reflns_limit_h_min -14 _diffrn_reflns_limit_k_max 20 _diffrn_reflns_limit_k_min -20 _diffrn_reflns_limit_l_max 28 _diffrn_reflns_limit_l_min -28 _diffrn_reflns_number 137278 _diffrn_reflns_point_group_measured_fraction_full 0.998 _diffrn_reflns_point_group_measured_fraction_max 0.995 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 30.543 _diffrn_reflns_theta_min 2.035 _diffrn_source_current 1.0 _diffrn_source_power 0.05 _diffrn_source_voltage 50.0 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 0.864 _exptl_absorpt_correction_T_max 0.3368 _exptl_absorpt_correction_T_min 0.2653 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1105 before and 0.0611 after correction. The Ratio of minimum to maximum transmission is 0.7877. The \l/2 correction factor is Not present. ; _exptl_crystal_colour red _exptl_crystal_colour_primary red _exptl_crystal_density_diffrn 1.498 _exptl_crystal_description block _exptl_crystal_F_000 1280 _exptl_crystal_size_max 0.561 _exptl_crystal_size_mid 0.542 _exptl_crystal_size_min 0.278 _refine_diff_density_max 1.145 _refine_diff_density_min -0.632 _refine_diff_density_rms 0.089 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.035 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 639 _refine_ls_number_reflns 16752 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.035 _refine_ls_R_factor_all 0.0300 _refine_ls_R_factor_gt 0.0244 _refine_ls_shift/su_max 0.003 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0314P)^2^+1.9438P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0634 _refine_ls_wR_factor_ref 0.0656 _reflns_Friedel_coverage 0.000 _reflns_number_gt 14619 _reflns_number_total 16752 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d1dt02611a2.cif _cod_data_source_block svphcnap _cod_database_code 7708575 _shelx_shelxl_version_number 2018/3 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_max 0.795 _shelx_estimated_absorpt_t_min 0.643 _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H) groups, All C(H,H) groups, All N(H) groups At 1.5 times of: All C(H,H,H) groups 2.a Ternary CH refined with riding coordinates: C25(H25), C25B(H25B) 2.b Secondary CH2 refined with riding coordinates: C13(H13a,H13b), C14(H14a,H14b), C15(H15a,H15b), C16(H16a,H16b), C17(H17a, H17b), C13B(H13c,H13d), C14B(H14c,H14d), C15B(H15c,H15d), C16B(H16c,H16d), C17B(H17c,H17d) 2.c Aromatic/amide H refined with riding coordinates: N1(H1), N2(H2), C3(H3), C4(H4), C5(H5), C8(H8), C9(H9), C10(H10), C11(H11), C20(H20), C21(H21), C23(H23), C24(H24), N1B(H1B), N2B(H2B), C3B(H3B), C4B(H4B), C5B(H5B), C8B(H8B), C9B(H9B), C10B(H10B), C11B(H11B), C20B(H20B), C21B(H21B), C23B(H23B), C24B(H24B) 2.d Idealised Me refined as rotating group: C18(H18a,H18b,H18c), C26(H26a,H26b,H26c), C27(H27a,H27b,H27c), C28(H28a,H28b, H28c), C18B(H18d,H18e,H18f), C26B(H26d,H26e,H26f), C27B(H27d,H27e,H27f), C28B(H28d,H28e,H28f) ; _shelx_res_file ; TITL svphcnap_a.res in P-1 svphcnap.res created by SHELXL-2018/3 at 10:19:37 on 15-Apr-2021 REM Old TITL SVPHCNAP in P-1 REM SHELXT solution in P-1: R1 0.083, Rweak 0.002, Alpha 0.044 REM 0.000 for 0 systematic absences, Orientation as input REM Formula found by SHELXT: C56 N4 O2 Cl6 Ru2 CELL 0.71073 10.3251 14.2609 20.2233 72.408 75.797 85.571 ZERR 4 0.0003 0.0004 0.0006 0.001 0.001 0.001 LATT 1 SFAC C H Cl N O Ru S UNIT 112 144 8 8 4 4 4 L.S. 8 PLAN 13 SIZE 0.561 0.542 0.278 TEMP -163.15 CONF acta wpdb -1 list 4 fmap 2 53 MORE -1 HTAB BOND $H OMIT 0 0 2 OMIT -1 1 2 OMIT -2 1 6 OMIT 2 3 6 OMIT 1 0 2 OMIT 1 4 4 OMIT 1 5 0 OMIT 1 2 6 OMIT 0 2 4 OMIT -1 4 0 OMIT -3 5 4 OMIT -1 1 0 OMIT 2 7 0 OMIT 0 -1 1 OMIT 2 -1 2 OMIT 5 -1 4 REM REM REM WGHT 0.031400 1.943800 FVAR 0.17250 RU1 6 0.713268 0.953019 0.645031 11.00000 0.01096 0.01133 = 0.01411 -0.00291 -0.00328 -0.00081 CL1 3 0.785809 0.866496 0.755158 11.00000 0.02170 0.01538 = 0.01957 -0.00023 -0.01127 -0.00515 CL2 3 0.830656 0.829082 0.591713 11.00000 0.01353 0.01629 = 0.02218 -0.00632 -0.00163 0.00501 S1 7 0.515956 0.855407 0.671865 11.00000 0.01337 0.01147 = 0.02205 -0.00161 -0.00676 -0.00133 O1 5 0.576712 0.533789 0.789757 11.00000 0.03215 0.01441 = 0.03123 -0.00231 -0.01933 -0.00243 N1 4 0.450957 0.668663 0.705963 11.00000 0.01826 0.01214 = 0.02170 -0.00156 -0.00980 -0.00205 AFIX 43 H1 2 0.457164 0.606393 0.729982 11.00000 -1.20000 AFIX 0 N2 4 0.623054 0.698254 0.752241 11.00000 0.01681 0.01313 = 0.02053 -0.00240 -0.00930 -0.00142 AFIX 43 H2 2 0.677499 0.741934 0.753430 11.00000 -1.20000 AFIX 0 C1 1 0.531322 0.732847 0.711274 11.00000 0.01364 0.01349 = 0.01527 -0.00292 -0.00405 -0.00087 C2 1 0.354588 0.695517 0.663136 11.00000 0.01552 0.01226 = 0.02142 -0.00211 -0.00879 -0.00179 C3 1 0.227896 0.723014 0.692089 11.00000 0.01836 0.01581 = 0.02095 -0.00395 -0.00407 -0.00127 AFIX 43 H3 2 0.206542 0.729111 0.739055 11.00000 -1.20000 AFIX 0 C4 1 0.129604 0.742167 0.651854 11.00000 0.01556 0.01655 = 0.02604 -0.00255 -0.00538 -0.00010 AFIX 43 H4 2 0.042391 0.762021 0.671553 11.00000 -1.20000 AFIX 0 C5 1 0.159781 0.732175 0.584546 11.00000 0.01680 0.01479 = 0.02536 0.00043 -0.00918 -0.00036 AFIX 43 H5 2 0.092405 0.743924 0.558326 11.00000 -1.20000 AFIX 0 C6 1 0.290127 0.704534 0.553179 11.00000 0.01813 0.01272 = 0.02041 -0.00046 -0.00761 -0.00096 C7 1 0.390878 0.687482 0.592702 11.00000 0.01647 0.01179 = 0.02075 -0.00156 -0.00662 -0.00074 C8 1 0.323364 0.692315 0.484078 11.00000 0.02787 0.01996 = 0.02196 -0.00215 -0.01034 -0.00140 AFIX 43 H8 2 0.257263 0.703364 0.457098 11.00000 -1.20000 AFIX 0 C9 1 0.449617 0.664768 0.455672 11.00000 0.03199 0.03061 = 0.02262 -0.00873 -0.00505 0.00072 AFIX 43 H9 2 0.469987 0.655677 0.409582 11.00000 -1.20000 AFIX 0 C10 1 0.549520 0.649821 0.494403 11.00000 0.02290 0.03541 = 0.02990 -0.01289 -0.00234 0.00470 AFIX 43 H10 2 0.637185 0.631698 0.473899 11.00000 -1.20000 AFIX 0 C11 1 0.521462 0.661161 0.561242 11.00000 0.01754 0.02256 = 0.02715 -0.00563 -0.00688 0.00176 AFIX 43 H11 2 0.589817 0.651351 0.586709 11.00000 -1.20000 AFIX 0 C12 1 0.638710 0.602205 0.791698 11.00000 0.01877 0.01492 = 0.01745 -0.00395 -0.00758 0.00100 C13 1 0.736953 0.588655 0.838046 11.00000 0.02065 0.01606 = 0.01768 -0.00486 -0.00951 0.00154 AFIX 23 H13A 2 0.698848 0.542378 0.885381 11.00000 -1.20000 H13B 2 0.750220 0.652613 0.845184 11.00000 -1.20000 AFIX 0 C14 1 0.872454 0.549384 0.806408 11.00000 0.01781 0.01861 = 0.01659 -0.00463 -0.00513 -0.00151 AFIX 23 H14A 2 0.860628 0.484758 0.799907 11.00000 -1.20000 H14B 2 0.911740 0.595265 0.759102 11.00000 -1.20000 AFIX 0 C15 1 0.966338 0.538459 0.856042 11.00000 0.01801 0.01848 = 0.02076 -0.00752 -0.00722 -0.00052 AFIX 23 H15A 2 0.978544 0.603861 0.861202 11.00000 -1.20000 H15B 2 0.923512 0.495250 0.903774 11.00000 -1.20000 AFIX 0 C16 1 1.103231 0.496228 0.830886 11.00000 0.01689 0.02216 = 0.01943 -0.00595 -0.00391 -0.00195 AFIX 23 H16A 2 1.142828 0.535435 0.781316 11.00000 -1.20000 H16B 2 1.092291 0.427992 0.830626 11.00000 -1.20000 AFIX 0 C17 1 1.199139 0.495874 0.877786 11.00000 0.01638 0.02641 = 0.03042 -0.00895 -0.00833 -0.00102 AFIX 23 H17A 2 1.290536 0.481517 0.853278 11.00000 -1.20000 H17B 2 1.199953 0.562257 0.883662 11.00000 -1.20000 AFIX 0 C18 1 1.162384 0.420836 0.951291 11.00000 0.02187 0.03856 = 0.02596 -0.00895 -0.00957 0.00413 AFIX 137 H18A 2 1.168375 0.354393 0.946111 11.00000 -1.50000 H18B 2 1.070930 0.433222 0.975358 11.00000 -1.50000 H18C 2 1.224214 0.426648 0.979666 11.00000 -1.50000 AFIX 0 C19 1 0.845104 1.078527 0.626612 11.00000 0.01456 0.01219 = 0.01883 -0.00381 -0.00345 -0.00245 C20 1 0.720325 1.085535 0.675463 11.00000 0.01798 0.01373 = 0.01740 -0.00545 -0.00330 -0.00118 AFIX 43 H20 2 0.721045 1.091068 0.721021 11.00000 -1.20000 AFIX 0 C21 1 0.596897 1.084439 0.657759 11.00000 0.01503 0.01378 = 0.02057 -0.00412 -0.00247 0.00070 AFIX 43 H21 2 0.516020 1.090830 0.690756 11.00000 -1.20000 AFIX 0 C22 1 0.593066 1.073732 0.590256 11.00000 0.01585 0.01205 = 0.02045 -0.00148 -0.00572 -0.00063 C23 1 0.714976 1.062181 0.543119 11.00000 0.01847 0.01500 = 0.01563 -0.00214 -0.00488 -0.00230 AFIX 43 H23 2 0.714088 1.051880 0.498966 11.00000 -1.20000 AFIX 0 C24 1 0.839632 1.065804 0.561046 11.00000 0.01554 0.01489 = 0.01595 -0.00216 -0.00162 -0.00195 AFIX 43 H24 2 0.920478 1.059490 0.528002 11.00000 -1.20000 AFIX 0 C25 1 0.974184 1.082217 0.648199 11.00000 0.01670 0.01811 = 0.02192 -0.00457 -0.00648 -0.00319 AFIX 13 H25 2 0.955540 1.058422 0.701465 11.00000 -1.20000 AFIX 0 C26 1 1.019911 1.189229 0.624315 11.00000 0.02898 0.02105 = 0.04168 -0.00743 -0.01589 -0.00756 AFIX 137 H26A 2 1.044712 1.212902 0.572083 11.00000 -1.50000 H26B 2 1.097318 1.193526 0.643221 11.00000 -1.50000 H26C 2 0.947003 1.229831 0.642338 11.00000 -1.50000 AFIX 0 C27 1 1.084250 1.017434 0.618997 11.00000 0.01586 0.02907 = 0.04397 -0.01525 -0.00940 0.00184 AFIX 137 H27A 2 1.049497 0.951054 0.629992 11.00000 -1.50000 H27B 2 1.159651 1.014230 0.641080 11.00000 -1.50000 H27C 2 1.114236 1.045445 0.567181 11.00000 -1.50000 AFIX 0 C28 1 0.461494 1.072603 0.571455 11.00000 0.01718 0.02187 = 0.03015 -0.00501 -0.01008 0.00021 AFIX 137 H28A 2 0.460427 1.018163 0.551431 11.00000 -1.50000 H28B 2 0.448987 1.134974 0.536193 11.00000 -1.50000 H28C 2 0.389125 1.063934 0.614461 11.00000 -1.50000 AFIX 0 RU1B 6 0.312395 0.023501 0.867558 11.00000 0.01101 0.00993 = 0.01234 -0.00237 -0.00321 -0.00110 CL1B 3 0.189478 0.150755 0.915112 11.00000 0.01264 0.01229 = 0.01636 -0.00459 -0.00092 0.00330 CL2B 3 0.245134 0.103224 0.754498 11.00000 0.01808 0.01316 = 0.01533 -0.00106 -0.00773 -0.00416 S1B 7 0.509857 0.122937 0.841070 11.00000 0.01313 0.01103 = 0.01716 -0.00153 -0.00592 -0.00135 O1B 5 0.412926 0.441290 0.727328 11.00000 0.02158 0.01315 = 0.02731 -0.00313 -0.01322 -0.00191 N1B 4 0.560756 0.314190 0.806010 11.00000 0.01482 0.01149 = 0.01785 -0.00243 -0.00811 -0.00117 AFIX 43 H1B 2 0.543427 0.375784 0.784658 11.00000 -1.20000 AFIX 0 N2B 4 0.388037 0.274208 0.765583 11.00000 0.01703 0.01226 = 0.01859 -0.00118 -0.00978 -0.00297 AFIX 43 H2B 2 0.339462 0.226768 0.764648 11.00000 -1.20000 AFIX 0 C1B 1 0.485606 0.245202 0.802731 11.00000 0.01301 0.01307 = 0.01244 -0.00290 -0.00373 -0.00164 C2B 1 0.668044 0.295946 0.841713 11.00000 0.01260 0.01151 = 0.01741 -0.00174 -0.00639 -0.00172 C3B 1 0.787963 0.259497 0.812125 11.00000 0.01647 0.01427 = 0.02073 -0.00472 -0.00422 -0.00141 AFIX 43 H3B 2 0.798000 0.241591 0.769545 11.00000 -1.20000 AFIX 0 C4B 1 0.896349 0.248638 0.844998 11.00000 0.01271 0.01478 = 0.02577 -0.00204 -0.00391 0.00000 AFIX 43 H4B 2 0.978769 0.222316 0.824978 11.00000 -1.20000 AFIX 0 C5B 1 0.882818 0.275975 0.905638 11.00000 0.01375 0.01369 = 0.02482 0.00017 -0.00940 -0.00104 AFIX 43 H5B 2 0.957044 0.270096 0.926616 11.00000 -1.20000 AFIX 0 C6B 1 0.759749 0.312949 0.937683 11.00000 0.01576 0.01182 = 0.01935 -0.00027 -0.00816 -0.00196 C7B 1 0.648787 0.321487 0.906054 11.00000 0.01432 0.01052 = 0.01686 -0.00113 -0.00664 -0.00104 C8B 1 0.742585 0.339713 1.001515 11.00000 0.02371 0.01802 = 0.02061 -0.00123 -0.01233 -0.00277 AFIX 43 H8B 2 0.816348 0.335791 1.022564 11.00000 -1.20000 AFIX 0 C9B 1 0.621177 0.371058 1.033045 11.00000 0.02903 0.02436 = 0.01860 -0.00734 -0.00799 -0.00158 AFIX 43 H9B 2 0.611000 0.388602 1.075776 11.00000 -1.20000 AFIX 0 C10B 1 0.510856 0.377357 1.002073 11.00000 0.02097 0.02428 = 0.02328 -0.00919 -0.00473 0.00193 AFIX 43 H10B 2 0.426446 0.398104 1.024676 11.00000 -1.20000 AFIX 0 C11B 1 0.524198 0.353950 0.939990 11.00000 0.01490 0.01766 = 0.02069 -0.00481 -0.00672 0.00099 AFIX 43 H11B 2 0.449436 0.359486 0.919461 11.00000 -1.20000 AFIX 0 C12B 1 0.355959 0.368429 0.729342 11.00000 0.01537 0.01418 = 0.01402 -0.00221 -0.00541 -0.00042 C13B 1 0.245024 0.370270 0.692311 11.00000 0.01780 0.01485 = 0.01887 -0.00263 -0.00980 -0.00187 AFIX 23 H13C 2 0.159158 0.356365 0.728396 11.00000 -1.20000 H13D 2 0.260894 0.317564 0.668671 11.00000 -1.20000 AFIX 0 C14B 1 0.234462 0.468346 0.637053 11.00000 0.01966 0.01609 = 0.01707 -0.00106 -0.00920 -0.00198 AFIX 23 H14C 2 0.322325 0.484512 0.603005 11.00000 -1.20000 H14D 2 0.212202 0.520316 0.661281 11.00000 -1.20000 AFIX 0 C15B 1 0.128902 0.468373 0.595697 11.00000 0.01913 0.01990 = 0.01575 -0.00299 -0.00794 -0.00037 AFIX 23 H15C 2 0.138130 0.529584 0.555392 11.00000 -1.20000 H15D 2 0.146911 0.412378 0.575334 11.00000 -1.20000 AFIX 0 C16B 1 -0.014024 0.461101 0.639560 11.00000 0.02004 0.03111 = 0.01674 -0.00636 -0.00636 0.00296 AFIX 23 H16C 2 -0.030298 0.513181 0.663783 11.00000 -1.20000 H16D 2 -0.026763 0.396694 0.676803 11.00000 -1.20000 AFIX 0 C17B 1 -0.115318 0.471717 0.594249 11.00000 0.01874 0.03223 = 0.01995 -0.00383 -0.00794 0.00190 AFIX 23 H17C 2 -0.108310 0.538782 0.560340 11.00000 -1.20000 H17D 2 -0.092273 0.424449 0.565951 11.00000 -1.20000 AFIX 0 C18B 1 -0.258587 0.454324 0.637009 11.00000 0.01885 0.05998 = 0.03018 -0.00566 -0.00700 0.00502 AFIX 137 H18D 2 -0.318316 0.465925 0.604402 11.00000 -1.50000 H18E 2 -0.281725 0.499501 0.666296 11.00000 -1.50000 H18F 2 -0.268364 0.386298 0.667980 11.00000 -1.50000 AFIX 0 C19B 1 0.179072 -0.099446 0.885300 11.00000 0.01501 0.01081 = 0.01770 -0.00186 -0.00534 -0.00270 C20B 1 0.179716 -0.084557 0.950963 11.00000 0.01434 0.01273 = 0.01590 -0.00106 -0.00251 -0.00305 AFIX 43 H20B 2 0.097489 -0.075082 0.981861 11.00000 -1.20000 AFIX 0 C21B 1 0.302245 -0.083460 0.971943 11.00000 0.01890 0.01280 = 0.01473 -0.00075 -0.00544 -0.00284 AFIX 43 H21B 2 0.300171 -0.073009 1.016412 11.00000 -1.20000 AFIX 0 C22B 1 0.426397 -0.097747 0.927265 11.00000 0.01688 0.00956 = 0.02099 -0.00054 -0.00707 -0.00080 C23B 1 0.426599 -0.110565 0.859949 11.00000 0.01576 0.01278 = 0.02144 -0.00478 -0.00334 0.00111 AFIX 43 H23B 2 0.508886 -0.118779 0.828611 11.00000 -1.20000 AFIX 0 C24B 1 0.305830 -0.111124 0.839665 11.00000 0.01939 0.01177 = 0.01795 -0.00515 -0.00434 -0.00113 AFIX 43 H24B 2 0.308237 -0.119461 0.794516 11.00000 -1.20000 AFIX 0 C25B 1 0.052603 -0.099418 0.859922 11.00000 0.01731 0.01532 = 0.01959 -0.00302 -0.00718 -0.00332 AFIX 13 H25B 2 0.077307 -0.079674 0.806593 11.00000 -1.20000 AFIX 0 C26B 1 -0.001367 -0.204417 0.886271 11.00000 0.03475 0.01809 = 0.04434 -0.00034 -0.02634 -0.00851 AFIX 137 H26D 2 0.069316 -0.249078 0.871767 11.00000 -1.50000 H26E 2 -0.076883 -0.207114 0.865524 11.00000 -1.50000 H26F 2 -0.031127 -0.224362 0.938411 11.00000 -1.50000 AFIX 0 C27B 1 -0.054181 -0.027704 0.882586 11.00000 0.01662 0.02574 = 0.03139 -0.00906 -0.00782 0.00107 AFIX 137 H27D 2 -0.090092 -0.051070 0.934299 11.00000 -1.50000 H27E 2 -0.126455 -0.023506 0.858166 11.00000 -1.50000 H27F 2 -0.014512 0.037478 0.869833 11.00000 -1.50000 AFIX 0 C28B 1 0.555854 -0.098021 0.948442 11.00000 0.01679 0.01857 = 0.02862 -0.00236 -0.01077 0.00058 AFIX 137 H28D 2 0.621739 -0.058438 0.907854 11.00000 -1.50000 H28E 2 0.588759 -0.165715 0.962917 11.00000 -1.50000 H28F 2 0.541658 -0.070089 0.988395 11.00000 -1.50000 AFIX 0 HKLF 4 REM svphcnap_a.res in P-1 REM wR2 = 0.065587, GooF = S = 1.03532, Restrained GooF = 1.03532 for all data REM R1 = 0.024435 for 14619 Fo > 4sig(Fo) and 0.030043 for all 16752 data REM 639 parameters refined using 0 restraints END WGHT 0.0313 1.9576 REM Instructions for potential hydrogen bonds HTAB N1 O1 HTAB N1 O1B HTAB N2 Cl1 HTAB N1B O1 HTAB N1B O1B HTAB N2B Cl2B REM Highest difference peak 1.145, deepest hole -0.632, 1-sigma level 0.089 Q1 1 0.8238 0.8537 0.5832 11.00000 0.05 1.10 Q2 1 0.1813 -0.1019 0.9219 11.00000 0.05 0.52 Q3 1 0.7724 1.0600 0.5577 11.00000 0.05 0.50 Q4 1 0.2197 0.0964 0.7446 11.00000 0.05 0.46 Q5 1 0.6638 1.0899 0.6609 11.00000 0.05 0.45 Q6 1 0.2778 0.1179 0.7398 11.00000 0.05 0.44 Q7 1 0.6013 1.0836 0.6206 11.00000 0.05 0.43 Q8 1 0.3370 0.0205 0.8187 11.00000 0.05 0.43 Q9 1 0.8178 0.2959 0.9176 11.00000 0.05 0.43 Q10 1 0.5676 0.3790 1.0173 11.00000 0.05 0.42 Q11 1 0.2437 -0.0834 0.9570 11.00000 0.05 0.42 Q12 1 0.2208 0.1304 0.7543 11.00000 0.05 0.42 Q13 1 0.3412 0.6872 0.5772 11.00000 0.05 0.42 ; _shelx_res_checksum 36003 _shelx_hkl_file ; -1 0 0 602.04 21.70 1 0 0 589.54 21.70 -2 0 0 483.45 17.50 2 0 0 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-3 0 6.00 1.10 -10 3 0 6.20 0.90 -10 3 0 6.20 0.90 -10 3 0 6.50 0.90 -10 3 0 11.40 2.50 9 -3 0 1.80 0.60 9 -3 0 1.50 1.70 9 -3 0 2.50 1.60 9 -3 0 1.60 0.60 9 -3 0 1.60 0.60 9 -3 0 2.80 0.60 -9 3 0 2.10 0.60 -9 3 0 0.90 1.50 -9 3 0 1.50 0.50 -9 3 0 1.80 0.60 -9 3 0 1.70 0.60 -9 3 0 2.60 0.60 -9 3 0 1.20 0.60 8 -3 0 68.89 2.70 8 -3 0 60.29 3.30 8 -3 0 63.89 2.60 8 -3 0 74.39 3.20 8 -3 0 70.99 2.70 8 -3 0 66.69 2.60 -8 3 0 62.09 2.60 -8 3 0 67.79 2.60 -8 3 0 64.59 2.60 -8 3 0 69.49 2.70 -8 3 0 64.29 2.70 -8 3 0 73.49 3.30 7 -3 0 42.90 1.80 7 -3 0 44.10 1.90 7 -3 0 42.00 2.50 7 -3 0 44.50 1.70 7 -3 0 42.30 1.80 7 -3 0 40.40 2.30 7 -3 0 42.10 1.80 -7 3 0 44.00 1.80 -7 3 0 49.30 2.70 -7 3 0 44.20 1.80 -7 3 0 45.20 1.90 -7 3 0 42.80 2.00 -7 3 0 44.20 1.80 6 -3 0 91.99 3.50 6 -3 0 93.89 3.90 6 -3 0 91.69 3.50 6 -3 0 91.39 3.50 6 -3 0 89.89 3.90 6 -3 0 94.99 3.50 -6 3 0 92.69 3.50 -6 3 0 90.29 3.50 -6 3 0 95.99 3.50 -6 3 0 95.79 3.50 -6 3 0 95.19 3.50 -6 3 0 96.09 3.90 5 -3 0 251.77 9.50 5 -3 0 249.97 9.30 5 -3 0 255.47 9.40 5 -3 0 251.57 9.40 -5 3 0 250.47 9.30 -5 3 0 254.57 9.30 -5 3 0 265.87 9.30 -5 3 0 254.37 9.40 -5 3 0 257.77 9.40 4 -3 0 11.90 0.70 4 -3 0 12.40 1.20 4 -3 0 12.60 0.90 4 -3 0 12.40 0.70 4 -3 0 12.60 0.70 -4 3 0 12.90 0.70 -4 3 0 12.90 0.70 -4 3 0 11.40 1.20 -4 3 0 13.00 0.70 -4 3 0 13.20 0.60 -4 3 0 12.90 0.60 3 -3 0 319.67 11.80 3 -3 0 322.37 11.70 -3 3 0 315.37 11.80 2 -3 0 107.79 4.00 2 -3 0 111.49 4.10 -2 3 0 108.79 4.10 -2 3 0 103.59 4.00 1 -3 0 1.60 0.40 1 -3 0 0.90 0.40 -1 3 0 0.90 0.30 -1 3 0 1.10 0.40 0 -3 0 179.78 6.80 0 -3 0 185.78 6.70 0 3 0 179.28 6.70 0 3 0 186.98 6.80 -1 -3 0 2745.33 104.19 1 3 0 2909.21 104.09 2 3 0 154.68 5.80 2 3 0 156.18 5.70 3 3 0 1985.40 71.79 3 3 0 1957.80 71.89 -4 -3 0 107.49 3.90 4 3 0 99.49 4.10 4 3 0 110.49 3.90 4 3 0 104.59 4.00 4 3 0 105.39 3.90 -5 -3 0 591.14 20.60 -5 -3 0 574.74 20.70 5 3 0 574.74 20.60 5 3 0 561.74 20.80 5 3 0 544.55 20.70 5 3 0 556.74 20.60 5 3 0 554.54 20.60 -6 -3 0 25.90 1.10 -6 -3 0 24.60 1.10 -6 -3 0 27.30 1.10 6 3 0 25.40 1.10 6 3 0 24.50 1.60 6 3 0 25.80 1.40 6 3 0 25.80 1.10 6 3 0 24.40 1.00 6 3 0 23.60 1.00 6 3 0 24.50 1.00 6 3 0 24.40 1.10 -7 -3 0 113.29 4.30 -7 -3 0 116.99 4.30 -7 -3 0 111.89 4.30 -7 -3 0 116.69 4.30 7 3 0 116.09 4.30 7 3 0 113.09 4.30 7 3 0 115.69 4.30 7 3 0 114.09 4.30 7 3 0 117.89 4.50 7 3 0 120.39 4.70 7 3 0 114.79 4.30 -8 -3 0 18.90 0.90 -8 -3 0 17.00 1.00 -8 -3 0 16.80 0.90 -8 -3 0 17.90 1.00 8 3 0 16.90 1.60 8 3 0 18.30 2.10 8 3 0 18.90 0.90 8 3 0 17.80 0.90 8 3 0 16.80 0.90 8 3 0 18.70 1.00 8 3 0 14.80 0.90 -9 -3 0 9.20 0.90 -9 -3 0 8.70 0.80 -9 -3 0 9.30 0.80 9 3 0 7.80 0.70 9 3 0 7.10 0.80 9 3 0 8.10 1.70 9 3 0 11.40 1.50 9 3 0 8.10 0.70 9 3 0 7.20 1.30 -10 -3 0 16.90 1.30 -10 -3 0 18.10 1.20 10 3 0 18.00 1.10 10 3 0 18.60 2.20 10 3 0 18.10 1.20 10 3 0 14.80 2.50 10 3 0 19.70 1.20 10 3 0 19.70 1.10 -11 -3 0 4.10 0.80 -11 -3 0 2.00 0.70 11 3 0 3.00 0.70 11 3 0 3.10 2.30 11 3 0 5.00 1.10 11 3 0 5.70 0.90 -12 -3 0 32.60 1.80 -12 -3 0 28.60 1.70 12 3 0 32.50 1.70 12 3 0 30.20 1.60 -13 -3 0 132.19 5.20 13 3 0 139.29 5.10 13 3 0 131.79 5.20 -14 -3 0 3.40 1.30 14 3 0 2.10 0.90 14 3 0 2.50 1.10 13 -4 0 1.50 1.00 13 -4 0 0.50 1.10 13 -4 0 1.00 1.20 -13 4 0 -0.40 1.10 -13 4 0 0.10 1.00 12 -4 0 49.99 2.30 12 -4 0 53.59 2.40 12 -4 0 52.19 2.40 -12 4 0 52.29 2.30 -12 4 0 49.80 2.40 -12 4 0 49.50 2.30 11 -4 0 6.00 1.20 11 -4 0 8.00 1.10 11 -4 0 5.90 1.20 11 -4 0 5.00 0.90 -11 4 0 6.60 1.10 -11 4 0 6.60 1.10 -11 4 0 5.30 0.90 10 -4 0 14.60 1.20 10 -4 0 16.00 1.30 10 -4 0 12.70 1.20 10 -4 0 9.40 2.20 10 -4 0 12.80 1.10 10 -4 0 10.50 2.10 -10 4 0 14.00 1.20 -10 4 0 12.40 2.60 -10 4 0 13.50 1.10 -10 4 0 14.40 1.10 -10 4 0 15.30 1.10 -10 4 0 14.60 1.20 9 -4 0 2.10 0.70 9 -4 0 2.20 1.80 9 -4 0 2.90 1.80 9 -4 0 1.70 0.60 9 -4 0 2.10 0.60 9 -4 0 3.20 0.70 -9 4 0 3.50 0.70 -9 4 0 1.70 0.60 -9 4 0 4.10 0.80 -9 4 0 2.00 0.60 -9 4 0 0.90 2.00 -9 4 0 2.30 0.60 8 -4 0 26.80 1.30 8 -4 0 29.20 1.30 8 -4 0 29.20 1.40 8 -4 0 27.90 2.40 8 -4 0 30.80 1.30 -8 4 0 25.80 1.30 -8 4 0 26.20 1.30 -8 4 0 27.10 1.30 -8 4 0 26.20 1.30 -8 4 0 26.80 1.30 -8 4 0 27.60 1.40 7 -4 0 55.69 2.20 7 -4 0 58.29 2.30 7 -4 0 54.39 2.20 7 -4 0 54.39 2.20 7 -4 0 55.69 2.20 7 -4 0 55.49 2.90 7 -4 0 56.09 2.90 -7 4 0 56.29 2.20 -7 4 0 53.49 2.90 -7 4 0 56.09 2.20 -7 4 0 57.89 2.20 -7 4 0 55.59 2.20 -7 4 0 55.49 2.20 -7 4 0 55.59 2.20 6 -4 0 138.99 5.20 6 -4 0 141.29 5.50 6 -4 0 140.59 5.50 6 -4 0 135.59 5.20 6 -4 0 135.69 5.20 6 -4 0 139.39 5.10 -6 4 0 135.99 5.20 -6 4 0 143.69 5.20 -6 4 0 139.09 5.50 -6 4 0 139.79 5.20 -6 4 0 135.69 5.20 -6 4 0 136.49 5.10 -6 4 0 142.49 5.20 5 -4 0 80.39 3.10 5 -4 0 80.09 3.10 5 -4 0 84.29 3.30 5 -4 0 81.79 3.50 5 -4 0 75.89 3.10 5 -4 0 82.59 3.10 -5 4 0 78.39 3.40 -5 4 0 82.29 3.10 -5 4 0 79.39 3.10 -5 4 0 83.19 3.10 -5 4 0 80.99 3.00 -5 4 0 79.09 3.00 -5 4 0 84.09 3.10 4 -4 0 70.19 3.00 4 -4 0 75.99 3.00 4 -4 0 67.99 2.70 4 -4 0 72.79 2.70 4 -4 0 71.29 2.70 -4 4 0 70.59 2.70 -4 4 0 70.39 2.70 -4 4 0 71.09 2.70 -4 4 0 74.29 3.00 -4 4 0 76.09 2.70 -4 4 0 71.39 2.70 3 -4 0 77.99 3.30 3 -4 0 81.19 3.20 -3 4 0 85.99 3.20 -3 4 0 79.99 3.30 2 -4 0 369.46 13.60 2 -4 0 374.36 13.60 -2 4 0 375.06 13.60 -2 4 0 359.16 13.60 1 -4 0 15.10 0.90 1 -4 0 12.80 0.70 -1 4 0 12.80 0.70 -1 4 0 13.20 0.90 0 -4 0 43.80 1.70 0 -4 0 46.20 1.80 0 4 0 41.30 1.80 0 4 0 41.40 1.70 -1 -4 0 1297.17 47.10 1 4 0 1255.77 47.10 1 4 0 1317.77 47.10 2 4 0 9.30 0.60 2 4 0 7.90 0.60 3 4 0 1336.17 48.70 3 4 0 1333.97 48.70 -4 -4 0 1130.69 41.00 -4 -4 0 1179.38 41.00 4 4 0 1102.29 41.00 4 4 0 1157.38 41.00 4 4 0 1082.39 41.10 4 4 0 1157.58 41.00 4 4 0 1095.39 41.00 4 4 0 1122.99 41.00 4 4 0 1090.99 41.00 -5 -4 0 325.77 11.90 -5 -4 0 333.77 12.00 -5 -4 0 327.67 12.00 5 4 0 323.37 11.90 5 4 0 327.07 12.00 5 4 0 317.17 11.90 5 4 0 317.57 12.00 5 4 0 319.27 11.90 5 4 0 336.07 12.10 5 4 0 335.97 12.00 -6 -4 0 99.29 3.60 -6 -4 0 95.79 3.60 -6 -4 0 90.39 3.60 6 4 0 93.59 3.60 6 4 0 93.49 3.50 6 4 0 91.19 3.90 6 4 0 94.09 3.60 6 4 0 95.29 3.70 6 4 0 99.79 3.60 6 4 0 99.09 3.60 6 4 0 97.49 3.60 -7 -4 0 214.58 7.50 -7 -4 0 199.88 7.50 -7 -4 0 202.38 7.50 7 4 0 203.18 7.50 7 4 0 200.68 7.50 7 4 0 203.18 7.50 7 4 0 201.58 7.50 7 4 0 197.58 7.40 7 4 0 200.88 8.00 7 4 0 204.38 7.50 -8 -4 0 46.60 1.90 -8 -4 0 43.20 1.80 -8 -4 0 43.40 1.80 8 4 0 45.90 1.80 8 4 0 44.30 1.80 8 4 0 41.20 2.30 8 4 0 47.90 1.80 8 4 0 46.80 1.90 8 4 0 47.10 2.50 8 4 0 44.50 1.90 8 4 0 45.00 1.80 -9 -4 0 65.59 2.60 -9 -4 0 66.59 2.60 -9 -4 0 67.49 2.60 9 4 0 64.29 2.60 9 4 0 70.09 3.10 9 4 0 66.29 2.70 9 4 0 64.49 2.60 9 4 0 66.49 2.60 9 4 0 66.69 3.40 9 4 0 65.99 2.60 -10 -4 0 45.70 2.00 -10 -4 0 44.30 2.00 10 4 0 44.90 2.00 10 4 0 45.00 3.40 10 4 0 43.00 1.90 10 4 0 45.40 1.90 -11 -4 0 72.29 3.00 -11 -4 0 69.19 3.00 11 4 0 76.99 3.00 11 4 0 74.89 3.00 11 4 0 74.79 3.00 -12 -4 0 5.50 0.90 -12 -4 0 5.90 1.20 12 4 0 7.50 1.10 12 4 0 5.80 1.00 -13 -4 0 81.89 3.50 13 4 0 79.29 3.30 13 4 0 83.89 3.30 -14 -4 0 13.10 2.50 -14 -4 0 17.20 2.00 13 -5 0 1.50 1.00 13 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0 -0.30 0.50 -8 5 0 0.70 0.60 7 -5 0 13.50 2.00 7 -5 0 15.20 2.10 7 -5 0 14.30 0.90 7 -5 0 14.30 1.00 7 -5 0 16.20 0.90 7 -5 0 14.90 1.00 7 -5 0 15.50 1.10 -7 5 0 14.70 1.00 -7 5 0 14.20 1.10 -7 5 0 14.70 2.10 -7 5 0 16.30 0.90 -7 5 0 14.30 0.90 -7 5 0 14.80 0.90 -7 5 0 15.00 0.90 -7 5 0 15.60 1.00 6 -5 0 67.19 2.60 6 -5 0 73.99 3.10 6 -5 0 65.89 2.60 6 -5 0 62.49 3.20 -6 5 0 65.69 2.60 -6 5 0 64.79 3.20 -6 5 0 68.39 2.60 5 -5 0 -0.30 1.10 5 -5 0 1.40 0.40 5 -5 0 0.00 0.30 5 -5 0 0.50 0.40 5 -5 0 0.60 0.40 5 -5 0 1.70 0.80 -5 5 0 0.90 0.40 -5 5 0 0.60 0.40 -5 5 0 0.30 0.30 -5 5 0 -0.50 1.10 -5 5 0 0.40 0.40 -5 5 0 1.70 0.30 -5 5 0 0.80 0.40 4 -5 0 260.77 9.60 4 -5 0 257.47 9.50 4 -5 0 261.27 9.60 4 -5 0 264.47 9.50 4 -5 0 263.47 9.70 4 -5 0 255.47 9.80 -4 5 0 265.87 9.60 -4 5 0 262.37 9.50 -4 5 0 261.97 9.50 -4 5 0 255.97 9.60 -4 5 0 258.67 9.50 -4 5 0 259.97 9.50 -4 5 0 250.17 9.80 3 -5 0 146.39 6.10 3 -5 0 158.18 5.80 3 -5 0 156.88 5.80 3 -5 0 152.28 5.80 3 -5 0 157.78 5.90 -3 5 0 159.38 5.80 -3 5 0 167.18 5.80 -3 5 0 161.88 5.80 -3 5 0 161.78 5.90 -3 5 0 161.08 5.80 -3 5 0 156.78 5.80 -3 5 0 153.38 6.10 2 -5 0 735.53 27.00 2 -5 0 745.03 26.90 -2 5 0 732.13 26.90 -2 5 0 729.03 27.00 1 -5 0 221.08 8.20 -1 5 0 220.88 8.20 0 -5 0 824.22 29.70 0 -5 0 817.02 29.70 0 5 0 801.32 29.70 0 5 0 802.62 29.70 -1 -5 0 56.19 2.30 1 5 0 59.59 2.30 1 5 0 56.19 2.30 2 5 0 747.23 27.60 2 5 0 760.82 27.60 -3 -5 0 119.29 4.40 -3 -5 0 118.09 4.40 3 5 0 116.79 4.40 3 5 0 116.59 4.40 3 5 0 119.29 4.40 3 5 0 118.39 4.50 3 5 0 120.99 4.50 3 5 0 118.69 4.40 -4 -5 0 524.25 18.10 4 5 0 478.15 18.10 4 5 0 489.05 18.10 4 5 0 480.75 18.10 4 5 0 523.95 18.10 4 5 0 492.25 18.20 4 5 0 478.95 18.10 -5 -5 0 174.08 6.20 -5 -5 0 168.88 6.20 -5 -5 0 170.68 6.20 5 5 0 168.18 6.30 5 5 0 169.88 6.20 5 5 0 166.68 6.40 5 5 0 162.28 6.20 5 5 0 170.98 6.20 5 5 0 164.08 6.20 5 5 0 169.48 6.20 -6 -5 0 607.44 22.00 -6 -5 0 608.14 22.10 -6 -5 0 624.54 22.00 6 5 0 610.14 22.20 6 5 0 608.94 22.00 6 5 0 597.74 22.00 6 5 0 607.84 22.10 6 5 0 605.64 22.00 6 5 0 586.84 22.10 6 5 0 576.74 22.00 -7 -5 0 4.30 0.70 -7 -5 0 4.20 0.60 -7 -5 0 4.10 0.70 7 5 0 4.00 0.60 7 5 0 6.70 1.50 7 5 0 4.80 0.70 7 5 0 3.40 0.50 7 5 0 4.30 0.60 7 5 0 5.80 1.30 7 5 0 5.20 0.50 7 5 0 3.70 0.60 -8 -5 0 156.38 5.80 -8 -5 0 139.69 5.80 -8 -5 0 165.38 5.90 8 5 0 166.38 6.20 8 5 0 153.28 5.80 8 5 0 157.48 5.80 8 5 0 158.58 5.90 8 5 0 152.08 5.80 8 5 0 162.78 6.00 8 5 0 149.19 5.80 8 5 0 152.08 5.80 -9 -5 0 8.60 0.90 -9 -5 0 6.90 1.00 9 5 0 7.60 0.70 9 5 0 7.50 1.60 9 5 0 7.70 0.80 9 5 0 8.50 0.90 9 5 0 9.60 0.90 -10 -5 0 7.60 0.90 -10 -5 0 9.20 1.10 -10 -5 0 8.80 1.00 10 5 0 10.50 1.10 10 5 0 10.30 0.90 10 5 0 7.40 1.30 10 5 0 6.70 2.10 10 5 0 7.90 0.90 -11 -5 0 10.50 1.10 -11 -5 0 14.00 1.30 11 5 0 7.70 1.00 11 5 0 11.80 1.20 11 5 0 11.10 1.10 -12 -5 0 9.90 1.60 -12 -5 0 14.70 2.20 12 5 0 14.80 1.20 12 5 0 14.10 1.10 12 5 0 12.10 1.50 -13 -5 0 58.89 2.70 -13 -5 0 61.69 3.60 13 5 0 56.69 2.70 13 5 0 59.19 2.50 13 -6 0 0.70 1.20 13 -6 0 0.70 1.30 13 -6 0 -0.80 1.20 13 -6 0 1.50 1.10 13 -6 0 0.70 1.20 -13 6 0 1.20 1.20 -13 6 0 2.40 1.10 -13 6 0 0.60 1.10 -13 6 0 -0.80 1.20 12 -6 0 -1.10 1.10 12 -6 0 1.20 1.10 12 -6 0 1.30 1.00 12 -6 0 -0.30 0.90 -12 6 0 -0.70 0.90 -12 6 0 0.90 1.10 -12 6 0 0.90 1.00 -12 6 0 -0.20 0.90 -12 6 0 0.40 1.00 11 -6 0 7.40 1.20 11 -6 0 5.10 1.00 11 -6 0 6.30 1.10 11 -6 0 5.60 1.20 -11 6 0 5.40 1.10 -11 6 0 5.80 1.10 -11 6 0 8.40 1.40 -11 6 0 5.70 1.10 -11 6 0 6.20 1.00 10 -6 0 4.60 0.80 10 -6 0 3.00 2.40 10 -6 0 4.90 1.10 10 -6 0 3.40 0.80 10 -6 0 1.60 1.00 -10 6 0 5.10 1.00 -10 6 0 4.30 0.80 -10 6 0 2.90 0.80 -10 6 0 3.70 0.90 -10 6 0 3.10 1.00 -10 6 0 4.70 2.40 9 -6 0 9.20 1.10 9 -6 0 6.00 1.90 9 -6 0 6.00 2.10 9 -6 0 10.20 1.10 9 -6 0 10.40 1.00 9 -6 0 7.80 1.00 -9 6 0 7.10 2.10 -9 6 0 11.00 1.10 -9 6 0 8.10 1.00 -9 6 0 10.80 0.90 -9 6 0 10.40 1.10 -9 6 0 10.30 1.10 8 -6 0 0.60 0.70 8 -6 0 -0.20 0.60 8 -6 0 0.00 1.50 8 -6 0 0.30 0.70 8 -6 0 -1.10 1.80 8 -6 0 0.70 0.60 -8 6 0 0.50 0.50 -8 6 0 1.50 1.80 -8 6 0 0.30 0.50 -8 6 0 0.80 0.60 -8 6 0 0.70 0.70 7 -6 0 4.80 0.80 7 -6 0 7.30 0.80 7 -6 0 3.50 2.70 7 -6 0 6.20 0.90 7 -6 0 5.60 0.90 -7 6 0 6.20 0.90 -7 6 0 6.90 0.60 -7 6 0 6.10 0.80 -7 6 0 5.10 0.80 -7 6 0 4.90 0.90 -7 6 0 5.90 0.70 6 -6 0 27.80 2.00 6 -6 0 25.60 1.30 6 -6 0 27.30 1.20 6 -6 0 26.40 1.20 6 -6 0 26.60 2.20 6 -6 0 28.60 1.30 6 -6 0 28.00 1.30 -6 6 0 27.00 1.20 -6 6 0 29.30 2.30 -6 6 0 27.30 1.30 -6 6 0 28.90 1.30 -6 6 0 27.00 1.20 -6 6 0 29.70 1.30 -6 6 0 30.00 1.30 -6 6 0 25.50 1.20 5 -6 0 9.70 1.50 5 -6 0 9.90 0.80 5 -6 0 10.90 0.80 5 -6 0 9.40 1.70 5 -6 0 11.00 0.80 5 -6 0 10.60 0.70 -5 6 0 10.90 0.80 -5 6 0 11.80 0.80 -5 6 0 7.90 1.80 -5 6 0 11.00 0.70 -5 6 0 10.30 0.80 -5 6 0 11.70 0.60 -5 6 0 11.50 0.70 4 -6 0 509.05 18.90 4 -6 0 522.35 18.90 4 -6 0 529.25 19.00 4 -6 0 503.75 18.90 4 -6 0 507.25 18.90 4 -6 0 519.15 19.20 -4 6 0 537.05 18.90 -4 6 0 523.65 19.20 -4 6 0 516.35 18.90 -4 6 0 505.55 18.90 -4 6 0 522.35 18.90 -4 6 0 519.45 19.00 -4 6 0 509.05 18.90 -4 6 0 512.35 18.90 3 -6 0 78.29 3.00 3 -6 0 81.99 3.00 3 -6 0 76.79 3.30 3 -6 0 79.69 2.90 3 -6 0 82.09 3.20 3 -6 0 76.19 3.00 -3 6 0 80.09 2.90 -3 6 0 79.99 3.40 -3 6 0 77.79 2.90 -3 6 0 78.99 3.00 -3 6 0 77.19 3.20 -3 6 0 74.19 3.00 -3 6 0 76.89 3.00 2 -6 0 153.88 6.10 2 -6 0 158.98 5.80 2 -6 0 156.18 5.80 2 -6 0 158.58 5.90 -2 6 0 157.38 5.80 -2 6 0 157.28 6.10 -2 6 0 157.48 6.00 -2 6 0 163.08 5.80 -2 6 0 157.78 5.80 1 -6 0 175.08 6.50 1 -6 0 164.48 6.50 -1 6 0 174.58 6.50 0 -6 0 3.70 0.80 0 -6 0 4.20 0.90 0 6 0 3.50 0.80 0 6 0 4.80 0.80 -1 -6 0 465.95 17.60 -1 -6 0 497.55 17.60 1 6 0 471.65 17.60 1 6 0 484.25 17.70 -2 -6 0 124.19 4.60 -2 -6 0 121.09 4.50 -2 -6 0 116.99 4.50 2 6 0 118.39 4.60 2 6 0 125.89 4.50 2 6 0 120.49 4.60 2 6 0 120.09 4.40 2 6 0 116.19 4.40 2 6 0 120.79 4.50 -3 -6 0 54.49 2.10 -3 -6 0 51.19 2.10 3 6 0 56.29 2.10 3 6 0 53.59 2.10 3 6 0 55.99 2.10 3 6 0 58.19 2.30 3 6 0 56.49 2.10 3 6 0 56.49 2.10 3 6 0 55.19 2.30 -4 -6 0 549.74 20.00 -4 -6 0 565.14 20.00 -4 -6 0 559.24 20.00 4 6 0 544.45 20.00 4 6 0 545.05 20.20 4 6 0 537.55 20.10 4 6 0 549.05 20.00 4 6 0 537.95 20.00 4 6 0 541.75 20.00 -5 -6 0 1.10 0.40 -5 -6 0 0.70 0.40 5 6 0 1.20 0.30 5 6 0 0.60 0.70 5 6 0 0.60 0.40 5 6 0 1.60 0.50 5 6 0 1.70 0.90 5 6 0 0.80 0.30 5 6 0 0.90 0.40 -6 -6 0 598.14 21.80 -6 -6 0 598.84 21.80 -6 -6 0 608.84 21.80 6 6 0 614.84 21.80 6 6 0 577.74 21.80 6 6 0 604.54 21.80 6 6 0 589.64 21.80 6 6 0 594.64 21.90 6 6 0 585.64 21.80 6 6 0 590.84 21.80 -7 -6 0 166.88 6.50 -7 -6 0 185.98 6.50 -7 -6 0 176.18 6.50 7 6 0 180.48 6.50 7 6 0 175.78 6.50 7 6 0 179.98 6.90 7 6 0 172.98 6.50 7 6 0 173.18 6.50 7 6 0 173.58 6.50 7 6 0 174.28 6.50 7 6 0 176.38 6.70 -8 -6 0 174.58 6.10 -8 -6 0 164.68 6.40 8 6 0 164.88 6.60 8 6 0 164.98 6.10 8 6 0 162.88 6.10 8 6 0 146.89 6.70 8 6 0 164.68 6.10 -9 -6 0 108.19 4.10 -9 -6 0 106.39 4.10 -9 -6 0 104.79 4.10 9 6 0 104.49 4.10 9 6 0 106.09 4.10 9 6 0 107.09 4.00 9 6 0 106.89 4.10 9 6 0 108.59 4.10 9 6 0 114.29 4.90 -10 -6 0 8.40 1.00 -10 -6 0 11.30 1.30 -10 -6 0 12.50 1.20 10 6 0 16.90 4.20 10 6 0 11.60 1.00 10 6 0 12.50 0.90 10 6 0 11.60 1.00 10 6 0 12.50 1.30 10 6 0 11.60 1.00 -11 -6 0 10.50 1.20 -11 -6 0 8.30 1.40 11 6 0 7.50 1.20 11 6 0 8.30 1.10 -12 -6 0 1.20 1.00 12 6 0 -0.50 0.70 12 6 0 0.90 0.80 -13 -6 0 21.60 1.90 -13 -6 0 15.80 1.90 13 6 0 17.20 1.40 13 6 0 21.20 1.50 13 -7 0 0.70 1.20 13 -7 0 1.20 1.10 13 -7 0 0.70 1.30 13 -7 0 -0.10 1.20 13 -7 0 -0.70 1.20 -13 7 0 0.80 1.10 -13 7 0 0.40 1.20 -13 7 0 -0.30 1.20 -13 7 0 -0.30 1.20 12 -7 0 -0.20 1.00 12 -7 0 1.00 1.20 12 -7 0 0.60 1.10 12 -7 0 -0.50 1.00 12 -7 0 0.50 1.10 -12 7 0 -1.00 1.00 -12 7 0 -0.40 1.00 -12 7 0 1.30 1.20 -12 7 0 -0.10 1.10 -12 7 0 0.30 1.00 11 -7 0 4.10 1.50 11 -7 0 5.30 1.00 11 -7 0 4.70 1.10 11 -7 0 4.80 1.00 -11 7 0 4.90 0.90 -11 7 0 4.90 0.90 -11 7 0 4.40 1.10 -11 7 0 3.80 1.00 10 -7 0 6.10 1.20 10 -7 0 5.30 2.50 10 -7 0 6.10 1.10 10 -7 0 5.50 1.10 10 -7 0 4.30 0.90 -10 7 0 4.70 1.00 -10 7 0 5.20 0.90 -10 7 0 4.40 0.90 -10 7 0 3.00 0.80 -10 7 0 4.50 2.40 -10 7 0 3.70 0.90 9 -7 0 95.89 3.80 9 -7 0 100.49 5.00 9 -7 0 94.99 3.80 9 -7 0 91.89 3.80 9 -7 0 96.39 3.80 -9 7 0 97.59 3.80 -9 7 0 102.89 3.80 -9 7 0 97.59 4.90 -9 7 0 95.09 3.80 -9 7 0 100.49 3.80 -9 7 0 96.39 3.80 8 -7 0 71.79 2.70 8 -7 0 65.59 2.80 8 -7 0 66.29 4.10 8 -7 0 66.79 2.80 8 -7 0 66.99 2.80 8 -7 0 71.69 3.90 -8 7 0 67.49 2.80 -8 7 0 68.49 2.80 -8 7 0 71.19 2.80 -8 7 0 74.29 2.80 -8 7 0 70.59 2.80 -8 7 0 71.09 3.90 -8 7 0 66.29 2.80 7 -7 0 3.70 0.80 7 -7 0 5.60 1.60 7 -7 0 4.20 0.90 7 -7 0 4.60 1.80 7 -7 0 4.50 0.80 7 -7 0 5.40 0.90 -7 7 0 4.70 0.60 -7 7 0 5.10 0.70 -7 7 0 4.70 0.90 -7 7 0 4.30 0.70 -7 7 0 2.00 1.80 -7 7 0 4.60 0.80 -7 7 0 3.20 0.50 6 -7 0 8.10 1.30 6 -7 0 12.80 1.90 6 -7 0 8.90 0.90 6 -7 0 11.70 2.10 6 -7 0 8.00 0.80 6 -7 0 11.60 0.90 -6 7 0 10.20 0.90 -6 7 0 8.40 0.90 -6 7 0 10.10 0.70 -6 7 0 11.10 0.90 -6 7 0 9.90 0.80 -6 7 0 10.80 2.20 5 -7 0 7.10 1.60 5 -7 0 8.40 0.70 5 -7 0 7.90 0.80 5 -7 0 5.40 1.40 5 -7 0 8.30 0.70 5 -7 0 8.20 0.60 5 -7 0 8.50 0.80 -5 7 0 8.30 0.60 -5 7 0 8.10 0.70 -5 7 0 8.20 2.00 -5 7 0 7.90 0.80 -5 7 0 8.80 0.60 -5 7 0 8.10 0.70 -5 7 0 7.90 0.70 -5 7 0 9.00 0.80 4 -7 0 53.89 2.10 4 -7 0 52.49 2.70 4 -7 0 51.69 2.00 4 -7 0 50.09 2.00 4 -7 0 50.39 2.40 4 -7 0 47.90 2.00 -4 7 0 53.69 2.10 -4 7 0 50.79 2.00 -4 7 0 50.59 2.70 -4 7 0 47.60 2.40 -4 7 0 51.49 2.10 -4 7 0 48.80 2.00 -4 7 0 50.59 2.00 -4 7 0 46.40 1.90 3 -7 0 35.10 1.70 3 -7 0 36.20 1.40 3 -7 0 37.40 1.50 3 -7 0 33.40 2.10 3 -7 0 33.60 1.50 3 -7 0 36.60 1.40 -3 7 0 35.50 1.40 -3 7 0 33.50 1.40 -3 7 0 34.30 1.40 -3 7 0 35.70 2.20 -3 7 0 35.90 1.70 -3 7 0 36.40 1.50 -3 7 0 35.20 1.40 -3 7 0 35.80 1.50 2 -7 0 6.20 0.70 2 -7 0 5.00 0.50 2 -7 0 5.40 0.70 2 -7 0 4.80 1.10 2 -7 0 5.60 0.60 2 -7 0 7.10 1.00 2 -7 0 6.30 0.40 -2 7 0 6.20 0.50 -2 7 0 5.70 0.40 -2 7 0 5.80 0.60 -2 7 0 6.80 1.00 -2 7 0 5.90 0.40 -2 7 0 6.50 1.40 -2 7 0 7.20 0.70 -2 7 0 5.50 0.60 1 -7 0 277.27 10.10 1 -7 0 281.67 10.10 1 -7 0 271.17 10.10 1 -7 0 273.27 10.10 1 -7 0 268.77 10.30 1 -7 0 290.37 10.10 1 -7 0 266.37 10.20 -1 7 0 273.67 10.10 -1 7 0 275.67 10.10 -1 7 0 269.87 10.10 -1 7 0 275.77 10.10 -1 7 0 265.07 10.30 -1 7 0 283.37 10.10 -1 7 0 272.97 10.20 0 -7 0 24.50 1.00 0 -7 0 28.00 1.40 0 -7 0 26.10 1.00 0 -7 0 25.10 1.10 0 -7 0 25.20 1.50 0 7 0 26.00 1.60 0 7 0 25.80 1.10 0 7 0 24.60 1.00 0 7 0 24.80 1.00 0 7 0 24.90 1.30 -1 -7 0 450.25 16.90 -1 -7 0 462.15 17.00 -1 -7 0 466.75 17.10 -1 -7 0 459.95 17.10 -1 -7 0 486.75 17.00 1 7 0 456.95 17.10 1 7 0 456.95 16.90 1 7 0 462.15 17.10 1 7 0 480.45 17.00 1 7 0 461.55 17.00 1 7 0 459.35 16.90 -2 -7 0 37.00 1.90 -2 -7 0 38.80 1.60 -2 -7 0 42.10 1.60 2 7 0 41.90 1.60 2 7 0 39.30 2.00 2 7 0 40.90 1.60 2 7 0 39.60 1.60 2 7 0 37.80 1.80 2 7 0 41.50 1.60 -3 -7 0 32.70 1.70 -3 -7 0 31.70 1.40 -3 -7 0 33.90 1.40 3 7 0 34.30 1.40 3 7 0 30.00 1.40 3 7 0 34.70 1.80 3 7 0 31.80 1.30 3 7 0 34.10 1.30 3 7 0 33.80 1.70 3 7 0 34.60 1.30 -4 -7 0 157.18 5.80 -4 -7 0 161.98 5.80 -4 -7 0 164.58 5.80 4 7 0 153.18 5.80 4 7 0 153.88 5.80 4 7 0 153.18 5.80 4 7 0 158.98 6.00 4 7 0 157.18 6.00 4 7 0 153.78 5.80 4 7 0 161.58 5.80 4 7 0 151.88 5.80 -5 -7 0 27.90 1.20 -5 -7 0 27.40 1.30 -5 -7 0 27.80 1.20 5 7 0 24.90 1.10 5 7 0 26.80 1.70 5 7 0 26.10 1.10 5 7 0 24.80 1.20 5 7 0 31.40 1.30 5 7 0 25.00 1.70 5 7 0 28.30 1.30 -6 -7 0 315.27 11.90 -6 -7 0 324.47 11.90 -6 -7 0 332.77 11.90 6 7 0 333.47 12.20 6 7 0 320.17 11.90 6 7 0 322.57 11.80 6 7 0 320.07 12.00 6 7 0 314.77 11.90 6 7 0 341.37 11.90 6 7 0 322.57 11.90 6 7 0 309.27 11.90 -7 -7 0 424.86 15.50 -7 -7 0 427.56 15.60 7 7 0 415.16 15.50 7 7 0 419.36 15.50 7 7 0 430.56 15.80 7 7 0 417.36 15.50 -8 -7 0 164.18 6.20 -8 -7 0 172.18 6.20 8 7 0 164.28 6.60 8 7 0 167.08 6.20 8 7 0 166.98 6.20 8 7 0 165.18 6.20 8 7 0 165.28 6.20 8 7 0 165.48 6.20 -9 -7 0 207.68 7.80 -9 -7 0 205.88 7.80 9 7 0 198.68 7.70 9 7 0 212.98 7.70 9 7 0 211.88 7.70 9 7 0 206.88 7.80 9 7 0 219.08 8.30 9 7 0 203.08 7.80 -10 -7 0 29.70 1.60 -10 -7 0 27.60 1.60 -10 -7 0 22.30 1.80 10 7 0 28.10 1.60 10 7 0 28.30 1.40 10 7 0 29.00 1.50 10 7 0 27.50 1.40 10 7 0 30.50 1.80 11 7 0 205.78 7.80 11 7 0 213.28 7.80 11 7 0 207.18 7.80 -12 -7 0 24.50 2.00 -12 -7 0 26.50 2.50 12 7 0 24.30 1.70 12 7 0 26.20 1.50 12 7 0 24.10 1.80 -13 -7 0 3.00 1.20 13 7 0 2.60 1.10 13 7 0 4.40 0.90 13 7 0 2.60 1.30 13 -8 0 1.50 1.40 13 -8 0 0.00 1.30 13 -8 0 0.80 1.20 -13 8 0 0.00 1.90 -13 8 0 0.90 1.20 12 -8 0 0.30 1.20 12 -8 0 -0.50 1.00 12 -8 0 0.20 1.10 12 -8 0 0.40 1.00 12 -8 0 -0.10 1.30 -12 8 0 0.50 1.00 -12 8 0 0.50 1.00 -12 8 0 -0.70 1.20 -12 8 0 0.90 1.10 -12 8 0 0.00 1.10 11 -8 0 0.70 1.10 11 -8 0 0.00 1.10 11 -8 0 -1.50 0.90 11 -8 0 -0.60 1.00 11 -8 0 -0.50 1.00 -11 8 0 0.60 0.90 -11 8 0 0.00 1.00 -11 8 0 -0.40 1.00 -11 8 0 0.40 1.10 -11 8 0 -0.10 0.80 10 -8 0 8.30 1.40 10 -8 0 9.80 1.40 10 -8 0 10.10 1.30 10 -8 0 9.40 1.20 -10 8 0 8.70 1.30 -10 8 0 11.60 1.40 -10 8 0 9.20 1.40 -10 8 0 9.70 1.40 -10 8 0 9.30 1.30 9 -8 0 14.60 3.20 9 -8 0 16.30 1.30 9 -8 0 16.80 1.40 9 -8 0 19.60 1.30 9 -8 0 16.40 1.50 -9 8 0 13.50 3.20 -9 8 0 19.20 1.30 -9 8 0 14.20 1.50 -9 8 0 19.00 1.30 -9 8 0 17.90 1.50 -9 8 0 15.80 1.40 8 -8 0 98.89 4.90 8 -8 0 91.89 3.70 8 -8 0 92.29 3.80 8 -8 0 98.49 3.80 8 -8 0 97.19 4.60 8 -8 0 93.59 3.70 -8 8 0 91.19 3.80 -8 8 0 99.99 3.70 -8 8 0 94.59 4.80 -8 8 0 94.69 3.70 -8 8 0 95.39 3.70 -8 8 0 98.29 3.70 -8 8 0 91.59 3.80 7 -8 0 -0.20 1.60 7 -8 0 0.10 2.10 7 -8 0 1.90 0.60 7 -8 0 0.60 0.70 -7 8 0 1.90 0.60 -7 8 0 2.30 0.70 -7 8 0 1.60 2.30 -7 8 0 1.50 0.50 6 -8 0 13.60 1.20 6 -8 0 13.80 1.00 6 -8 0 10.60 1.00 6 -8 0 11.70 1.10 6 -8 0 13.70 2.10 6 -8 0 9.80 1.90 -6 8 0 13.10 1.00 -6 8 0 15.80 2.50 -6 8 0 14.30 1.10 -6 8 0 12.90 1.10 -6 8 0 14.60 0.90 -6 8 0 12.20 1.40 -6 8 0 13.00 0.80 5 -8 0 30.70 1.30 5 -8 0 30.00 1.40 5 -8 0 30.80 2.10 5 -8 0 26.90 1.40 5 -8 0 22.90 2.40 5 -8 0 27.20 1.30 5 -8 0 29.80 1.30 -5 8 0 30.30 1.30 -5 8 0 27.50 1.40 -5 8 0 25.90 1.40 -5 8 0 30.40 1.30 -5 8 0 31.70 2.20 -5 8 0 31.80 1.40 -5 8 0 30.20 1.30 -5 8 0 30.10 2.60 -5 8 0 29.00 1.20 -5 8 0 28.20 1.30 4 -8 0 108.79 4.10 4 -8 0 110.19 4.20 4 -8 0 110.79 4.70 4 -8 0 111.19 4.40 4 -8 0 108.99 4.10 -4 8 0 104.79 4.10 -4 8 0 113.19 4.70 -4 8 0 105.19 4.10 -4 8 0 111.09 4.20 -4 8 0 113.19 4.50 -4 8 0 109.09 4.10 -4 8 0 112.99 4.20 -4 8 0 108.09 4.10 -4 8 0 104.89 4.10 3 -8 0 224.98 8.60 3 -8 0 230.78 8.80 3 -8 0 239.98 8.60 3 -8 0 228.68 8.60 3 -8 0 241.78 8.60 3 -8 0 237.58 9.00 3 -8 0 235.28 8.60 3 -8 0 236.28 8.70 3 -8 0 236.78 8.60 -3 8 0 230.28 8.60 -3 8 0 231.68 8.80 -3 8 0 233.08 8.70 -3 8 0 238.98 8.70 -3 8 0 234.28 8.60 -3 8 0 226.78 9.00 -3 8 0 240.18 8.60 -3 8 0 238.18 8.60 -3 8 0 230.28 8.60 -3 8 0 233.38 8.60 2 -8 0 2.30 0.30 2 -8 0 2.00 0.50 2 -8 0 3.80 1.20 2 -8 0 2.40 0.50 2 -8 0 2.70 0.60 2 -8 0 2.30 0.40 2 -8 0 2.60 0.40 2 -8 0 2.30 0.50 2 -8 0 2.50 0.50 2 -8 0 2.30 0.90 2 -8 0 2.70 0.40 -2 8 0 1.80 1.20 -2 8 0 2.50 0.50 -2 8 0 2.10 0.40 -2 8 0 2.70 0.50 -2 8 0 2.80 0.50 -2 8 0 1.70 0.50 -2 8 0 1.90 0.50 -2 8 0 2.10 0.40 -2 8 0 1.40 0.90 -2 8 0 2.70 0.50 1 -8 0 394.46 14.10 1 -8 0 391.46 14.00 1 -8 0 383.66 14.00 1 -8 0 379.86 14.00 1 -8 0 387.86 14.30 1 -8 0 381.86 14.20 1 -8 0 383.36 14.00 -1 8 0 394.36 14.10 -1 8 0 373.06 14.20 -1 8 0 380.76 14.10 -1 8 0 379.66 14.00 -1 8 0 386.76 14.30 -1 8 0 377.86 14.10 -1 8 0 380.16 14.00 -1 8 0 384.06 14.00 -1 8 0 382.56 14.00 0 -8 0 2.00 0.80 0 -8 0 1.00 0.40 0 -8 0 0.60 0.40 0 -8 0 1.50 0.30 0 -8 0 3.10 0.60 0 -8 0 1.00 0.30 0 8 0 0.80 0.30 0 8 0 1.60 0.40 0 8 0 2.70 0.70 0 8 0 0.90 0.40 0 8 0 1.70 0.40 0 8 0 1.00 0.30 0 8 0 4.90 1.10 -1 -8 0 568.94 21.10 -1 -8 0 572.94 21.10 -1 -8 0 596.64 21.10 -1 -8 0 570.54 21.20 1 8 0 583.74 21.10 1 8 0 575.24 21.10 1 8 0 584.94 21.20 1 8 0 573.44 21.30 1 8 0 593.44 21.10 1 8 0 560.34 21.00 1 8 0 563.14 21.10 -2 -8 0 149.29 5.40 -2 -8 0 140.59 5.40 -2 -8 0 150.18 5.60 -2 -8 0 150.88 5.60 2 8 0 142.69 5.60 2 8 0 142.39 5.40 2 8 0 146.59 5.40 2 8 0 136.29 5.30 2 8 0 147.19 5.70 2 8 0 142.49 5.30 -3 -8 0 55.49 2.20 -3 -8 0 54.49 2.50 -3 -8 0 55.89 2.10 -3 -8 0 55.09 2.10 3 8 0 54.09 2.10 3 8 0 53.49 2.20 3 8 0 52.89 2.10 3 8 0 53.79 2.40 3 8 0 52.09 2.10 3 8 0 53.39 2.10 3 8 0 50.89 2.60 3 8 0 55.89 2.10 -4 -8 0 5.60 0.80 -4 -8 0 5.00 0.80 -4 -8 0 7.00 0.60 4 8 0 6.00 0.50 4 8 0 5.80 1.20 4 8 0 6.00 0.70 4 8 0 5.60 0.50 4 8 0 6.90 0.60 4 8 0 9.30 1.50 4 8 0 6.30 0.90 4 8 0 6.10 0.80 -5 -8 0 0.60 0.40 -5 -8 0 -0.10 0.50 -5 -8 0 0.50 0.50 5 8 0 2.30 1.00 5 8 0 0.10 0.30 5 8 0 -0.10 0.40 5 8 0 0.40 0.50 5 8 0 0.90 0.60 5 8 0 -0.70 1.50 5 8 0 1.20 0.50 5 8 0 0.00 0.40 -6 -8 0 107.59 3.90 -6 -8 0 99.09 3.90 6 8 0 105.79 3.90 6 8 0 93.09 4.20 6 8 0 96.89 4.30 6 8 0 100.79 3.80 6 8 0 107.19 3.80 -7 -8 0 742.53 27.30 -7 -8 0 770.02 27.30 -7 -8 0 744.93 27.30 7 8 0 734.03 27.30 7 8 0 733.13 27.20 7 8 0 753.12 27.30 7 8 0 746.13 27.30 7 8 0 746.83 27.50 -8 -8 0 16.80 1.10 -8 -8 0 15.10 1.10 -8 -8 0 16.00 1.20 8 8 0 16.20 2.20 8 8 0 19.30 1.10 8 8 0 15.70 1.20 8 8 0 16.10 0.90 8 8 0 16.00 0.90 8 8 0 16.00 1.00 -9 -8 0 247.68 9.20 -9 -8 0 244.78 9.20 -9 -8 0 249.88 9.20 9 8 0 268.07 9.20 9 8 0 242.88 9.20 9 8 0 240.88 9.20 9 8 0 243.68 9.20 9 8 0 239.08 9.10 -10 -8 0 89.99 3.50 -10 -8 0 86.09 3.50 -10 -8 0 89.99 3.50 10 8 0 84.79 3.40 10 8 0 85.59 3.50 10 8 0 90.39 3.50 10 8 0 90.19 3.50 -11 -8 0 184.78 7.10 -11 -8 0 194.68 7.10 11 8 0 189.28 7.10 11 8 0 191.98 7.40 11 8 0 192.28 7.50 11 8 0 176.28 7.00 11 8 0 184.58 7.10 -12 -8 0 16.80 1.80 12 8 0 14.20 1.30 12 8 0 12.10 1.20 -13 -8 0 0.10 1.20 13 8 0 0.00 1.00 13 8 0 -0.70 1.10 12 -9 0 -0.20 1.30 12 -9 0 -0.60 1.00 12 -9 0 0.70 1.20 12 -9 0 0.20 1.20 -12 9 0 1.10 1.10 -12 9 0 -1.20 1.10 -12 9 0 0.30 1.20 -12 9 0 0.20 1.20 -12 9 0 0.70 1.00 11 -9 0 3.70 1.10 11 -9 0 2.50 1.10 11 -9 0 3.10 1.20 -11 9 0 3.40 1.10 -11 9 0 4.20 1.20 -11 9 0 3.70 0.90 -11 9 0 4.40 1.10 10 -9 0 2.80 0.80 10 -9 0 3.40 1.00 10 -9 0 3.90 1.00 10 -9 0 2.50 1.00 -10 9 0 3.70 1.10 -10 9 0 6.40 1.30 -10 9 0 6.30 1.30 -10 9 0 3.40 1.00 -10 9 0 6.60 1.20 9 -9 0 -0.90 2.50 9 -9 0 3.10 0.90 9 -9 0 1.70 0.90 9 -9 0 1.10 0.80 9 -9 0 1.50 0.90 -9 9 0 2.50 2.60 -9 9 0 2.10 0.90 -9 9 0 0.80 0.70 -9 9 0 1.20 0.90 -9 9 0 1.30 0.90 -9 9 0 0.60 0.90 -9 9 0 0.80 0.80 8 -9 0 15.40 1.30 8 -9 0 10.50 2.50 8 -9 0 13.10 1.20 8 -9 0 11.00 1.10 8 -9 0 11.90 1.30 -8 9 0 17.00 3.20 -8 9 0 13.00 1.30 -8 9 0 13.60 1.20 -8 9 0 13.50 1.30 -8 9 0 13.50 1.20 -8 9 0 11.20 1.00 -8 9 0 10.20 1.00 7 -9 0 39.60 1.80 7 -9 0 41.50 3.30 7 -9 0 38.30 3.10 7 -9 0 37.40 1.70 7 -9 0 36.90 1.80 -7 9 0 39.20 1.70 -7 9 0 37.10 1.80 -7 9 0 38.00 1.60 -7 9 0 38.20 1.90 -7 9 0 35.80 1.80 -7 9 0 34.30 3.30 6 -9 0 76.29 3.80 6 -9 0 74.89 3.10 6 -9 0 74.49 4.00 6 -9 0 73.19 3.00 -6 9 0 79.09 2.90 -6 9 0 75.49 3.00 -6 9 0 75.59 3.10 -6 9 0 80.29 4.10 5 -9 0 6.00 0.70 5 -9 0 4.90 0.80 5 -9 0 2.90 1.80 5 -9 0 5.30 1.00 5 -9 0 4.40 1.40 5 -9 0 3.90 0.70 5 -9 0 6.00 0.70 5 -9 0 6.10 0.90 -5 9 0 3.30 2.00 -5 9 0 5.50 1.00 -5 9 0 5.70 1.00 -5 9 0 3.90 0.70 -5 9 0 3.90 0.80 -5 9 0 5.50 1.00 -5 9 0 3.70 0.60 -5 9 0 5.70 0.70 -5 9 0 3.70 1.70 4 -9 0 100.19 3.80 4 -9 0 102.69 3.90 4 -9 0 106.49 4.60 4 -9 0 105.09 3.90 4 -9 0 105.99 4.00 4 -9 0 105.69 4.30 4 -9 0 101.09 3.90 4 -9 0 103.79 4.00 4 -9 0 99.99 3.90 -4 9 0 100.19 3.90 -4 9 0 106.09 3.90 -4 9 0 105.09 4.70 -4 9 0 97.59 4.00 -4 9 0 107.19 3.90 -4 9 0 102.79 4.00 -4 9 0 100.09 4.30 -4 9 0 100.89 3.90 -4 9 0 99.59 3.80 3 -9 0 32.50 1.40 3 -9 0 37.50 2.00 3 -9 0 33.80 1.40 3 -9 0 35.30 1.50 3 -9 0 35.00 1.40 3 -9 0 34.50 1.60 3 -9 0 34.30 1.40 3 -9 0 36.10 1.60 3 -9 0 31.20 2.50 3 -9 0 32.40 1.50 3 -9 0 35.80 1.50 -3 9 0 33.90 1.50 -3 9 0 35.70 1.40 -3 9 0 36.30 1.40 -3 9 0 35.20 2.00 -3 9 0 35.60 1.40 -3 9 0 32.80 1.60 -3 9 0 33.30 1.60 -3 9 0 35.50 1.50 -3 9 0 34.20 1.50 -3 9 0 32.70 2.50 -3 9 0 33.20 1.50 2 -9 0 0.70 0.30 2 -9 0 0.90 0.50 2 -9 0 1.10 0.40 2 -9 0 0.30 0.50 2 -9 0 0.60 0.40 2 -9 0 0.40 0.30 2 -9 0 0.60 0.40 2 -9 0 0.10 0.90 2 -9 0 1.50 0.60 2 -9 0 2.40 1.50 -2 9 0 -0.30 0.60 -2 9 0 0.80 0.60 -2 9 0 0.60 0.30 -2 9 0 0.10 0.90 -2 9 0 0.50 0.40 -2 9 0 0.40 1.60 -2 9 0 0.80 0.50 -2 9 0 0.50 0.30 -2 9 0 0.60 0.40 -2 9 0 0.70 0.40 1 -9 0 273.47 10.20 1 -9 0 277.87 10.20 1 -9 0 281.97 10.40 1 -9 0 283.77 10.20 1 -9 0 287.97 10.20 1 -9 0 280.77 10.20 1 -9 0 284.07 10.60 1 -9 0 271.97 10.20 1 -9 0 284.77 10.20 1 -9 0 270.37 10.20 1 -9 0 276.77 10.20 -1 9 0 272.97 10.20 -1 9 0 282.37 10.20 -1 9 0 277.37 10.20 -1 9 0 268.67 10.60 -1 9 0 284.17 10.20 -1 9 0 274.67 10.40 -1 9 0 278.87 10.20 -1 9 0 282.17 10.20 -1 9 0 274.37 10.20 -1 9 0 279.87 10.30 -1 9 0 266.37 10.20 0 -9 0 11.00 1.60 0 -9 0 10.70 0.90 0 -9 0 12.00 0.70 0 -9 0 11.30 0.60 0 -9 0 11.50 0.80 0 -9 0 10.70 0.80 0 -9 0 12.40 0.70 0 -9 0 13.60 0.80 0 -9 0 12.10 0.60 0 -9 0 10.70 1.30 0 -9 0 12.80 0.60 0 9 0 11.10 0.90 0 9 0 12.00 0.70 0 9 0 11.10 0.60 0 9 0 11.80 0.90 0 9 0 10.90 0.60 0 9 0 11.00 0.80 0 9 0 10.30 0.70 0 9 0 12.00 0.80 0 9 0 13.40 1.30 0 9 0 9.00 0.60 0 9 0 11.80 1.70 -1 -9 0 735.73 27.30 -1 -9 0 781.82 27.30 -1 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14.40 0.80 -5 -9 0 3.60 0.80 -5 -9 0 3.90 0.70 -5 -9 0 4.90 0.70 5 9 0 4.10 0.80 5 9 0 4.80 0.60 5 9 0 4.70 0.80 5 9 0 3.80 0.50 -6 -9 0 2.40 0.50 -6 -9 0 1.00 0.60 6 9 0 0.80 0.50 6 9 0 0.80 0.50 6 9 0 2.10 0.50 6 9 0 2.60 0.60 6 9 0 1.20 1.30 -7 -9 0 208.88 7.90 -7 -9 0 216.58 7.90 -7 -9 0 216.68 7.90 7 9 0 208.38 7.90 7 9 0 210.98 8.30 7 9 0 211.68 7.90 7 9 0 214.28 7.90 7 9 0 215.98 7.90 7 9 0 213.78 7.90 -8 -9 0 0.50 0.70 -8 -9 0 -0.10 0.70 8 9 0 1.00 0.60 8 9 0 0.40 0.60 8 9 0 0.60 0.80 8 9 0 0.30 0.50 8 9 0 -0.40 1.60 8 9 0 0.30 0.70 -9 -9 0 291.07 10.80 -9 -9 0 290.97 10.80 9 9 0 283.97 10.80 9 9 0 297.87 10.70 9 9 0 289.67 10.70 9 9 0 288.47 10.80 -10 -9 0 45.10 2.20 -10 -9 0 43.30 2.10 10 9 0 42.50 2.00 10 9 0 41.80 2.20 10 9 0 45.10 2.00 10 9 0 41.20 1.90 10 9 0 44.90 2.10 -11 -9 0 117.69 4.90 11 9 0 106.79 4.30 11 9 0 111.69 4.30 11 9 0 109.39 4.40 -12 -9 0 82.39 3.60 12 9 0 90.39 3.60 12 9 0 84.49 3.50 12 9 0 85.29 3.40 12 -10 0 -2.40 1.30 12 -10 0 0.00 1.30 12 -10 0 0.60 1.40 12 -10 0 0.60 1.60 -12 10 0 1.30 1.30 -12 10 0 0.70 1.30 -12 10 0 -0.50 1.40 -12 10 0 -0.60 1.10 -12 10 0 0.00 1.60 11 -10 0 2.40 1.20 11 -10 0 2.30 1.10 11 -10 0 2.70 1.00 11 -10 0 6.00 1.30 11 -10 0 3.40 1.10 -11 10 0 4.00 1.20 -11 10 0 3.80 1.10 -11 10 0 3.10 1.30 -11 10 0 3.70 1.00 -11 10 0 3.20 1.10 10 -10 0 2.60 1.00 10 -10 0 1.10 1.10 10 -10 0 0.90 1.00 10 -10 0 0.60 0.80 10 -10 0 2.70 1.10 -10 10 0 3.20 0.90 -10 10 0 2.40 0.90 -10 10 0 2.20 1.00 -10 10 0 1.70 1.10 -10 10 0 2.00 1.10 9 -10 0 3.40 0.90 9 -10 0 2.70 1.20 9 -10 0 1.50 0.90 9 -10 0 2.10 1.00 9 -10 0 0.70 1.20 -9 10 0 0.50 0.90 -9 10 0 0.90 0.80 -9 10 0 1.00 0.90 -9 10 0 1.10 1.10 -9 10 0 1.60 1.20 -9 10 0 1.10 1.30 8 -10 0 9.60 1.20 8 -10 0 11.80 1.40 8 -10 0 9.20 1.60 8 -10 0 12.40 2.40 -8 10 0 6.90 1.80 -8 10 0 9.70 1.20 -8 10 0 11.00 1.60 -8 10 0 13.60 1.40 -8 10 0 10.80 1.20 -8 10 0 8.60 1.00 7 -10 0 0.20 0.60 7 -10 0 0.40 0.80 7 -10 0 0.90 0.80 7 -10 0 1.40 0.80 7 -10 0 0.40 0.70 7 -10 0 -1.30 2.30 -7 10 0 0.30 0.60 -7 10 0 0.70 0.60 -7 10 0 0.50 0.90 -7 10 0 1.50 2.40 -7 10 0 0.50 0.70 -7 10 0 1.30 0.80 -7 10 0 0.90 0.80 6 -10 0 52.69 2.20 6 -10 0 52.19 2.30 6 -10 0 57.89 3.70 6 -10 0 55.29 2.20 6 -10 0 50.49 2.40 6 -10 0 49.80 3.70 6 -10 0 50.49 2.20 -6 10 0 52.09 2.20 -6 10 0 49.60 2.40 -6 10 0 49.20 2.30 -6 10 0 53.19 3.80 -6 10 0 49.60 2.20 -6 10 0 49.99 2.20 5 -10 0 16.20 2.40 5 -10 0 16.80 1.20 5 -10 0 18.20 1.30 5 -10 0 16.80 1.00 5 -10 0 17.20 2.80 5 -10 0 16.90 1.60 5 -10 0 19.60 1.10 5 -10 0 17.30 1.10 -5 10 0 18.00 1.30 -5 10 0 19.20 1.10 -5 10 0 17.90 1.10 -5 10 0 20.40 2.40 -5 10 0 17.40 3.00 -5 10 0 17.80 1.00 -5 10 0 19.80 1.20 -5 10 0 18.80 1.00 4 -10 0 18.20 1.10 4 -10 0 19.10 2.50 4 -10 0 17.60 1.20 4 -10 0 19.70 2.20 4 -10 0 20.20 1.30 4 -10 0 18.60 1.10 4 -10 0 19.70 1.00 4 -10 0 19.40 1.20 -4 10 0 17.40 1.10 -4 10 0 17.80 0.90 -4 10 0 19.60 2.20 -4 10 0 18.60 1.00 -4 10 0 17.80 1.20 -4 10 0 18.90 1.10 -4 10 0 17.80 1.40 -4 10 0 18.80 1.30 -4 10 0 17.40 2.70 3 -10 0 1.50 0.60 3 -10 0 -0.50 1.60 3 -10 0 0.30 0.50 3 -10 0 0.60 0.40 3 -10 0 0.60 0.60 3 -10 0 0.80 0.50 3 -10 0 1.60 0.60 3 -10 0 0.80 0.40 3 -10 0 0.60 1.10 3 -10 0 0.70 0.50 3 -10 0 1.10 0.40 -3 10 0 1.90 0.70 -3 10 0 0.50 0.40 -3 10 0 0.90 0.40 -3 10 0 1.20 1.20 -3 10 0 0.10 0.50 -3 10 0 1.50 1.80 -3 10 0 1.10 0.70 -3 10 0 0.40 0.70 -3 10 0 1.10 0.50 -3 10 0 0.90 0.60 -3 10 0 0.90 0.40 2 -10 0 2.20 0.40 2 -10 0 1.90 0.50 2 -10 0 2.30 0.60 2 -10 0 1.20 0.60 2 -10 0 3.10 0.50 2 -10 0 1.50 1.00 2 -10 0 1.90 1.50 2 -10 0 3.80 0.60 2 -10 0 3.30 0.60 2 -10 0 2.60 0.50 2 -10 0 2.30 0.50 -2 10 0 1.90 0.50 -2 10 0 1.90 0.50 -2 10 0 2.60 0.70 -2 10 0 2.20 0.40 -2 10 0 2.40 0.50 -2 10 0 2.40 0.50 -2 10 0 1.90 0.60 -2 10 0 0.30 1.60 -2 10 0 2.20 0.60 -2 10 0 2.80 0.60 -2 10 0 2.00 1.10 1 -10 0 156.68 5.80 1 -10 0 161.68 5.80 1 -10 0 157.38 5.80 1 -10 0 161.68 6.30 1 -10 0 154.08 5.80 1 -10 0 157.18 5.80 1 -10 0 154.58 6.10 1 -10 0 155.48 5.80 1 -10 0 155.78 5.80 1 -10 0 157.58 5.80 1 -10 0 157.38 5.80 -1 10 0 151.28 5.80 -1 10 0 149.69 5.70 -1 10 0 159.18 5.80 -1 10 0 155.48 5.80 -1 10 0 161.48 5.80 -1 10 0 155.58 6.30 -1 10 0 150.08 5.80 -1 10 0 150.88 6.10 -1 10 0 155.48 5.70 -1 10 0 158.98 5.80 -1 10 0 152.38 5.80 0 -10 0 73.69 2.70 0 -10 0 67.99 2.70 0 -10 0 69.19 2.70 0 -10 0 71.09 2.80 0 -10 0 69.49 2.80 0 -10 0 74.89 2.80 0 -10 0 75.49 2.70 0 -10 0 70.29 3.20 0 -10 0 73.29 2.80 0 -10 0 72.29 3.40 0 -10 0 70.49 2.70 0 10 0 68.09 3.20 0 10 0 72.89 2.80 0 10 0 67.79 3.60 0 10 0 70.69 2.70 0 10 0 68.69 2.70 0 10 0 71.89 2.70 0 10 0 72.69 2.80 0 10 0 70.79 2.80 0 10 0 69.19 2.80 0 10 0 75.19 2.70 0 10 0 71.59 2.70 -1 -10 0 102.69 3.70 -1 -10 0 92.39 4.20 -1 -10 0 97.39 3.70 -1 -10 0 101.59 3.70 -1 -10 0 88.09 3.80 -1 -10 0 101.69 3.70 -1 -10 0 99.39 3.80 -1 -10 0 100.39 3.80 -1 -10 0 96.29 4.10 1 10 0 101.29 3.70 1 10 0 100.79 4.30 1 10 0 99.39 3.70 1 10 0 99.59 3.80 1 10 0 101.19 3.80 1 10 0 97.29 3.70 1 10 0 92.09 3.80 1 10 0 102.99 3.70 1 10 0 101.59 3.80 1 10 0 103.29 4.10 -2 -10 0 10.50 0.70 -2 -10 0 9.20 0.70 -2 -10 0 11.30 0.80 -2 -10 0 9.60 0.90 -2 -10 0 12.40 2.00 2 10 0 10.10 0.80 2 10 0 10.40 0.90 2 10 0 12.00 0.90 2 10 0 10.20 0.80 2 10 0 11.00 0.70 2 10 0 12.20 2.20 2 10 0 9.80 0.60 -3 -10 0 212.78 7.70 -3 -10 0 198.08 8.00 -3 -10 0 205.98 7.80 -3 -10 0 209.08 8.10 3 10 0 208.18 8.10 3 10 0 220.58 7.80 3 10 0 208.18 7.70 3 10 0 205.68 7.70 3 10 0 210.48 7.70 3 10 0 216.98 7.80 3 10 0 203.48 7.80 3 10 0 204.38 8.10 3 10 0 214.18 7.70 -4 -10 0 259.27 9.30 -4 -10 0 249.18 9.30 4 10 0 249.97 9.30 4 10 0 261.67 9.30 4 10 0 241.38 9.30 4 10 0 253.07 9.70 4 10 0 249.78 9.30 -5 -10 0 64.79 3.20 -5 -10 0 63.39 2.60 -5 -10 0 66.99 2.70 -5 -10 0 68.29 2.70 5 10 0 75.19 2.70 5 10 0 62.19 2.60 5 10 0 59.69 2.70 5 10 0 69.49 3.20 5 10 0 61.09 2.50 -6 -10 0 2.30 1.50 -6 -10 0 4.20 0.90 -6 -10 0 4.00 0.70 -6 -10 0 2.90 0.70 6 10 0 2.90 1.40 6 10 0 1.70 0.50 6 10 0 2.80 0.80 6 10 0 2.80 0.50 6 10 0 2.80 0.70 6 10 0 4.80 0.90 -7 -10 0 47.30 2.00 -7 -10 0 42.80 2.00 7 10 0 43.30 2.00 7 10 0 44.30 2.00 7 10 0 46.00 1.90 7 10 0 50.59 2.90 7 10 0 46.70 1.90 7 10 0 43.90 2.00 -8 -10 0 1.40 0.80 8 10 0 0.50 0.80 8 10 0 0.50 0.60 8 10 0 0.80 0.60 -9 -10 0 161.18 6.30 -9 -10 0 170.28 6.40 9 10 0 159.28 6.30 9 10 0 169.78 6.30 9 10 0 167.78 6.30 9 10 0 171.08 6.30 9 10 0 167.98 6.20 -10 -10 0 91.59 3.60 -10 -10 0 89.09 3.70 10 10 0 76.19 4.00 10 10 0 89.79 3.60 10 10 0 84.89 3.60 10 10 0 93.49 3.60 10 10 0 92.69 3.50 -11 -10 0 47.20 2.50 -11 -10 0 43.50 2.30 11 10 0 43.10 2.30 11 10 0 46.80 2.30 11 10 0 47.80 2.20 11 10 0 45.60 2.40 11 10 0 44.20 2.00 -12 -10 0 124.89 4.70 12 10 0 118.79 4.70 12 10 0 114.49 4.80 12 10 0 119.09 4.80 12 10 0 112.09 4.60 11 -11 0 7.70 1.50 11 -11 0 11.80 1.90 11 -11 0 10.50 1.70 11 -11 0 10.20 1.50 -11 11 0 11.20 1.70 -11 11 0 9.50 1.70 -11 11 0 9.30 1.80 -11 11 0 7.10 1.50 -11 11 0 9.20 1.50 10 -11 0 1.00 0.90 10 -11 0 -0.10 1.40 10 -11 0 0.00 1.40 10 -11 0 0.50 1.20 10 -11 0 1.10 1.10 -10 11 0 -0.70 1.50 -10 11 0 0.40 0.90 -10 11 0 1.40 1.60 -10 11 0 0.20 1.20 -10 11 0 1.30 1.20 9 -11 0 0.80 0.80 9 -11 0 0.80 1.00 9 -11 0 0.70 1.10 9 -11 0 0.30 1.10 -9 11 0 1.20 1.20 -9 11 0 1.40 1.00 -9 11 0 1.50 1.10 -9 11 0 1.20 1.50 -9 11 0 -0.20 1.10 -9 11 0 1.40 0.90 8 -11 0 6.30 1.40 8 -11 0 3.60 2.90 8 -11 0 5.50 1.10 8 -11 0 5.80 1.00 8 -11 0 6.60 1.20 8 -11 0 6.80 1.20 -8 11 0 7.80 1.40 -8 11 0 3.30 3.00 -8 11 0 4.10 0.90 -8 11 0 5.30 1.10 -8 11 0 4.80 1.20 -8 11 0 5.80 0.90 -8 11 0 5.30 1.10 7 -11 0 0.60 0.90 7 -11 0 -0.30 1.00 7 -11 0 0.10 0.80 7 -11 0 0.80 0.70 7 -11 0 0.50 0.90 7 -11 0 2.50 2.90 -7 11 0 -0.30 0.90 -7 11 0 4.90 3.10 -7 11 0 0.40 0.80 -7 11 0 0.30 0.60 -7 11 0 0.70 0.70 -7 11 0 0.10 0.90 -7 11 0 -0.10 0.90 6 -11 0 16.10 1.50 6 -11 0 16.00 3.00 6 -11 0 14.40 1.00 6 -11 0 17.00 3.20 6 -11 0 14.90 1.30 6 -11 0 13.70 1.30 6 -11 0 11.90 1.30 -6 11 0 11.70 1.40 -6 11 0 16.70 3.00 -6 11 0 11.80 2.70 -6 11 0 12.90 1.00 -6 11 0 15.40 1.30 -6 11 0 13.20 1.00 -6 11 0 13.30 1.60 -6 11 0 17.40 1.30 5 -11 0 78.49 3.00 5 -11 0 75.09 3.00 5 -11 0 78.79 4.70 5 -11 0 78.29 3.00 5 -11 0 76.19 3.10 5 -11 0 78.89 3.70 -5 11 0 75.39 2.90 -5 11 0 76.89 3.00 -5 11 0 69.69 3.90 -5 11 0 72.89 2.90 -5 11 0 73.69 3.10 -5 11 0 76.89 3.10 -5 11 0 72.99 3.70 4 -11 0 9.10 0.80 4 -11 0 8.00 1.10 4 -11 0 8.20 2.10 4 -11 0 10.30 1.00 4 -11 0 8.10 0.90 4 -11 0 8.80 0.80 4 -11 0 10.40 1.00 -4 11 0 7.00 1.20 -4 11 0 8.40 1.20 -4 11 0 8.10 0.80 -4 11 0 8.50 1.00 -4 11 0 8.00 0.80 -4 11 0 7.80 1.10 -4 11 0 11.30 2.30 3 -11 0 43.20 1.70 3 -11 0 43.10 2.00 3 -11 0 42.00 1.80 3 -11 0 44.50 1.70 3 -11 0 39.80 1.90 3 -11 0 40.00 1.80 3 -11 0 37.30 3.10 3 -11 0 42.10 1.90 3 -11 0 39.80 1.70 3 -11 0 40.60 2.70 -3 11 0 42.60 1.90 -3 11 0 41.30 2.10 -3 11 0 40.00 1.80 -3 11 0 39.90 1.70 -3 11 0 43.20 1.80 -3 11 0 40.70 1.70 -3 11 0 41.40 1.90 -3 11 0 39.70 3.20 -3 11 0 41.20 1.70 -3 11 0 42.70 2.70 2 -11 0 5.60 0.90 2 -11 0 5.90 1.80 2 -11 0 6.60 0.70 2 -11 0 5.20 0.80 2 -11 0 5.00 0.70 2 -11 0 6.00 0.70 2 -11 0 4.70 0.80 2 -11 0 5.50 0.90 2 -11 0 4.70 1.00 2 -11 0 5.10 1.30 -2 11 0 6.20 0.90 -2 11 0 4.80 1.00 -2 11 0 5.20 0.70 -2 11 0 5.60 0.80 -2 11 0 6.20 0.70 -2 11 0 6.70 1.70 -2 11 0 4.50 2.00 -2 11 0 5.80 0.80 -2 11 0 5.00 1.00 -2 11 0 4.20 0.70 1 -11 0 159.98 6.00 1 -11 0 161.38 6.30 1 -11 0 162.88 6.00 1 -11 0 171.78 6.70 1 -11 0 164.88 6.00 1 -11 0 166.98 6.10 1 -11 0 161.88 6.00 1 -11 0 163.48 6.00 1 -11 0 162.68 6.00 1 -11 0 166.28 6.10 1 -11 0 158.28 6.00 -1 11 0 161.38 6.00 -1 11 0 158.88 6.00 -1 11 0 159.38 6.00 -1 11 0 156.98 6.80 -1 11 0 161.78 6.30 -1 11 0 155.68 6.10 -1 11 0 159.38 6.10 -1 11 0 160.18 6.00 -1 11 0 161.68 6.00 -1 11 0 154.98 5.90 -1 11 0 155.68 6.10 0 -11 0 10.70 0.70 0 -11 0 11.40 1.00 0 -11 0 9.70 0.70 0 -11 0 8.70 1.10 0 -11 0 10.50 0.90 0 -11 0 10.00 0.70 0 -11 0 9.20 0.70 0 -11 0 10.80 0.80 0 -11 0 11.20 2.40 0 11 0 10.10 1.10 0 11 0 9.20 0.80 0 11 0 10.30 1.50 0 11 0 9.90 0.70 0 11 0 10.90 0.70 0 11 0 11.20 0.90 0 11 0 10.70 0.70 0 11 0 7.90 2.00 0 11 0 10.60 0.70 0 11 0 11.10 1.10 -1 -11 0 1.10 0.50 -1 -11 0 2.90 1.40 -1 -11 0 1.80 0.40 -1 -11 0 1.30 1.70 -1 -11 0 1.20 0.60 -1 -11 0 2.00 0.40 -1 -11 0 1.60 0.60 -1 -11 0 1.30 0.70 1 11 0 2.30 0.50 1 11 0 0.90 0.60 1 11 0 1.20 0.60 1 11 0 1.90 0.70 1 11 0 3.50 0.50 1 11 0 2.30 1.80 1 11 0 2.30 0.50 1 11 0 1.70 0.50 1 11 0 1.70 0.40 1 11 0 1.80 0.70 1 11 0 2.20 1.30 -2 -11 0 78.09 3.10 -2 -11 0 80.09 3.80 -2 -11 0 78.89 3.10 -2 -11 0 81.89 3.20 -2 -11 0 85.99 3.90 -2 -11 0 81.99 3.10 2 11 0 85.49 4.00 2 11 0 77.19 3.10 2 11 0 81.69 3.20 2 11 0 77.89 3.10 2 11 0 78.59 3.10 2 11 0 80.29 3.20 2 11 0 84.69 3.10 2 11 0 78.49 3.70 -3 -11 0 0.30 0.60 -3 -11 0 1.40 1.60 -3 -11 0 -0.80 1.30 -3 -11 0 -0.10 0.50 -3 -11 0 0.70 0.70 -3 -11 0 0.80 0.50 3 11 0 0.10 0.80 3 11 0 0.70 0.60 3 11 0 0.70 1.80 3 11 0 0.90 0.80 3 11 0 -0.10 0.60 3 11 0 0.50 0.50 3 11 0 0.60 1.20 3 11 0 0.60 0.60 3 11 0 0.30 0.40 -4 -11 0 283.17 10.40 -4 -11 0 292.47 10.30 -4 -11 0 274.57 10.70 -4 -11 0 281.27 10.40 4 11 0 289.87 10.30 4 11 0 276.57 10.40 4 11 0 264.47 10.40 4 11 0 283.07 10.30 4 11 0 272.87 10.40 4 11 0 272.87 10.30 4 11 0 288.17 10.70 -5 -11 0 74.19 3.00 -5 -11 0 72.09 3.60 -5 -11 0 72.59 2.90 5 11 0 70.09 2.90 5 11 0 74.19 3.00 5 11 0 75.09 2.90 5 11 0 72.99 2.90 5 11 0 74.39 3.50 5 11 0 74.69 2.90 -6 -11 0 0.70 0.70 -6 -11 0 0.00 0.70 6 11 0 0.70 0.70 6 11 0 0.60 0.50 6 11 0 0.30 0.50 6 11 0 -0.10 0.70 6 11 0 0.00 0.70 -7 -11 0 11.50 1.20 -7 -11 0 13.50 1.20 7 11 0 12.60 1.00 7 11 0 13.30 1.20 7 11 0 13.10 1.10 7 11 0 12.00 0.90 7 11 0 11.80 1.20 -8 -11 0 1.70 1.00 -8 -11 0 0.10 0.90 8 11 0 1.20 0.60 8 11 0 0.70 1.00 8 11 0 0.40 0.80 8 11 0 -0.90 0.80 8 11 0 1.00 0.70 -9 -11 0 29.50 1.80 -9 -11 0 34.10 2.00 9 11 0 31.40 1.60 9 11 0 35.20 1.90 9 11 0 34.10 2.00 9 11 0 29.80 1.80 9 11 0 30.50 1.70 -10 -11 0 180.78 6.70 -10 -11 0 173.58 6.70 10 11 0 175.28 6.60 10 11 0 169.48 6.60 10 11 0 180.98 6.70 10 11 0 172.28 6.70 -11 -11 0 1.50 1.30 -11 -11 0 3.20 1.20 11 11 0 2.50 1.00 11 11 0 2.70 1.00 11 11 0 2.00 0.80 11 11 0 3.10 1.30 11 11 0 4.70 1.10 11 -12 0 1.60 1.40 11 -12 0 2.00 1.80 11 -12 0 0.60 1.60 11 -12 0 3.60 2.10 -11 12 0 0.40 2.10 -11 12 0 1.40 1.40 -11 12 0 1.10 1.80 -11 12 0 2.00 1.20 10 -12 0 -1.00 1.20 10 -12 0 0.10 0.90 10 -12 0 0.90 1.30 10 -12 0 1.30 1.20 -10 12 0 1.50 1.30 -10 12 0 0.10 0.90 -10 12 0 1.30 1.30 -10 12 0 0.00 1.30 -10 12 0 0.30 1.00 9 -12 0 0.30 1.70 9 -12 0 -1.40 1.20 -9 12 0 0.00 1.30 -9 12 0 0.80 1.10 -9 12 0 -0.10 0.80 8 -12 0 3.80 0.80 8 -12 0 2.70 1.10 8 -12 0 5.50 1.20 8 -12 0 5.10 1.10 8 -12 0 5.10 1.00 -8 12 0 6.20 1.30 -8 12 0 2.90 1.20 -8 12 0 4.20 0.90 -8 12 0 4.80 1.20 -8 12 0 4.60 1.10 -8 12 0 4.60 0.80 7 -12 0 -0.20 0.80 7 -12 0 0.40 0.80 7 -12 0 0.30 1.10 7 -12 0 1.70 3.10 7 -12 0 -0.50 0.70 -7 12 0 -0.60 0.80 -7 12 0 0.40 0.70 -7 12 0 -2.20 3.30 -7 12 0 0.30 0.70 -7 12 0 0.20 1.20 -7 12 0 -0.30 0.90 6 -12 0 4.70 0.80 6 -12 0 5.40 1.00 6 -12 0 4.70 1.00 6 -12 0 4.80 0.80 6 -12 0 4.50 2.60 6 -12 0 7.20 1.30 -6 12 0 4.80 0.90 -6 12 0 5.30 1.00 -6 12 0 3.50 1.10 -6 12 0 8.00 2.90 -6 12 0 6.40 1.40 -6 12 0 6.10 0.80 -6 12 0 6.80 1.30 5 -12 0 31.10 1.40 5 -12 0 27.10 1.60 5 -12 0 30.50 1.50 5 -12 0 29.40 1.70 5 -12 0 29.00 1.80 5 -12 0 17.70 2.90 5 -12 0 24.20 3.50 5 -12 0 27.70 1.40 -5 12 0 22.20 3.70 -5 12 0 24.70 1.40 -5 12 0 24.90 2.70 -5 12 0 27.40 1.40 -5 12 0 26.50 1.60 -5 12 0 26.50 1.50 -5 12 0 31.00 1.90 -5 12 0 29.10 1.70 4 -12 0 2.20 1.80 4 -12 0 2.90 0.60 4 -12 0 1.50 0.80 4 -12 0 0.90 0.60 4 -12 0 1.20 0.50 4 -12 0 2.10 0.50 -4 12 0 1.80 0.50 -4 12 0 3.20 1.80 -4 12 0 2.60 0.60 -4 12 0 2.20 1.00 -4 12 0 1.80 0.50 -4 12 0 2.10 0.70 3 -12 0 77.19 3.10 3 -12 0 76.99 3.00 3 -12 0 79.89 4.60 3 -12 0 79.39 3.10 3 -12 0 81.29 3.10 3 -12 0 79.39 3.20 3 -12 0 75.39 3.20 3 -12 0 75.19 3.40 3 -12 0 79.59 3.90 -3 12 0 78.59 3.10 -3 12 0 80.89 3.10 -3 12 0 69.39 3.40 -3 12 0 76.59 3.10 -3 12 0 77.29 3.10 -3 12 0 78.59 4.00 -3 12 0 80.49 3.30 -3 12 0 84.39 3.20 -3 12 0 80.19 4.80 2 -12 0 8.50 2.10 2 -12 0 9.70 1.10 2 -12 0 10.10 0.80 2 -12 0 8.80 0.90 2 -12 0 9.30 0.90 2 -12 0 9.00 1.00 2 -12 0 10.60 1.10 2 -12 0 10.80 1.10 2 -12 0 9.70 0.80 2 -12 0 12.90 2.30 -2 12 0 10.40 1.40 -2 12 0 9.60 2.40 -2 12 0 9.00 1.00 -2 12 0 9.40 0.90 -2 12 0 10.30 0.90 -2 12 0 10.90 2.30 -2 12 0 9.50 0.80 -2 12 0 11.30 1.30 -2 12 0 9.50 1.40 -2 12 0 9.90 0.80 1 -12 0 66.89 3.30 1 -12 0 70.39 2.80 1 -12 0 66.29 3.80 1 -12 0 67.89 2.80 1 -12 0 72.59 2.80 1 -12 0 70.79 2.70 1 -12 0 67.59 2.70 1 -12 0 68.09 2.70 1 -12 0 71.09 2.70 -1 12 0 67.69 2.70 -1 12 0 66.09 2.70 -1 12 0 66.09 2.70 -1 12 0 66.59 2.70 -1 12 0 65.19 3.40 -1 12 0 66.19 3.90 -1 12 0 62.69 2.80 -1 12 0 69.39 2.90 -1 12 0 72.59 2.80 -1 12 0 73.99 2.70 0 -12 0 43.30 1.80 0 -12 0 40.40 1.90 0 -12 0 41.30 2.00 0 -12 0 43.00 1.70 0 -12 0 42.10 1.70 0 -12 0 46.30 2.60 0 -12 0 39.80 3.30 0 -12 0 42.30 1.70 0 -12 0 42.80 1.90 0 12 0 43.40 1.90 0 12 0 39.20 2.60 0 12 0 36.60 3.50 0 12 0 40.30 1.70 0 12 0 42.30 1.80 0 12 0 42.20 1.70 0 12 0 41.40 2.00 0 12 0 37.90 1.70 0 12 0 38.40 2.20 -1 -12 0 1.10 0.50 -1 -12 0 1.70 0.60 -1 -12 0 1.00 1.60 -1 -12 0 1.20 0.80 -1 -12 0 1.60 0.90 -1 -12 0 0.90 1.90 -1 -12 0 1.70 0.60 -1 -12 0 0.60 0.50 1 12 0 1.80 0.60 1 12 0 1.10 0.60 1 12 0 1.60 0.50 1 12 0 1.60 0.90 1 12 0 2.50 2.10 1 12 0 0.70 0.70 -2 -12 0 122.89 4.60 -2 -12 0 117.39 5.20 -2 -12 0 124.59 4.70 -2 -12 0 120.49 4.70 -2 -12 0 125.09 4.70 -2 -12 0 125.89 5.40 -2 -12 0 126.39 4.60 2 12 0 123.49 4.70 2 12 0 111.99 4.60 2 12 0 123.19 4.70 2 12 0 118.79 4.60 2 12 0 121.79 5.50 2 12 0 126.49 4.80 2 12 0 124.29 5.10 2 12 0 124.19 4.60 2 12 0 119.79 4.70 -3 -12 0 107.89 4.10 -3 -12 0 101.99 4.00 -3 -12 0 109.89 4.80 3 12 0 101.19 4.00 3 12 0 105.59 4.10 3 12 0 103.09 4.70 3 12 0 102.29 4.00 -4 -12 0 219.48 8.60 -4 -12 0 218.28 8.10 -4 -12 0 227.18 8.20 -4 -12 0 215.38 8.20 4 12 0 221.08 8.70 4 12 0 221.78 8.20 4 12 0 217.08 8.10 4 12 0 212.78 8.10 4 12 0 217.98 8.20 4 12 0 223.58 8.20 -5 -12 0 98.49 3.90 -5 -12 0 96.69 3.90 5 12 0 102.89 3.90 5 12 0 102.59 3.90 5 12 0 100.19 3.90 5 12 0 102.19 3.90 5 12 0 97.29 3.80 -6 -12 0 8.10 1.10 -6 -12 0 9.30 1.20 6 12 0 6.80 0.90 6 12 0 4.60 2.90 6 12 0 8.30 1.20 6 12 0 8.00 0.90 6 12 0 8.90 1.20 6 12 0 10.20 1.10 -7 -12 0 6.60 1.20 -7 -12 0 3.70 1.00 7 12 0 3.20 0.70 7 12 0 3.90 0.90 7 12 0 4.00 1.00 7 12 0 2.90 0.60 7 12 0 4.70 0.90 -8 -12 0 12.60 1.40 8 12 0 11.10 1.50 8 12 0 10.20 1.20 8 12 0 10.70 1.40 8 12 0 13.40 1.40 -9 -12 0 9.50 1.70 -9 -12 0 2.70 1.60 9 12 0 6.70 1.20 9 12 0 8.90 1.60 9 12 0 7.30 1.20 9 12 0 3.80 1.70 9 12 0 6.10 1.20 -10 -12 0 106.59 4.30 -10 -12 0 108.89 4.40 10 12 0 103.29 4.30 10 12 0 111.19 4.40 10 12 0 108.09 4.40 10 12 0 105.69 4.20 10 12 0 110.99 4.30 -11 -12 0 46.00 2.40 -11 -12 0 42.00 2.40 11 12 0 41.50 2.40 11 12 0 49.20 2.50 11 12 0 43.90 2.40 11 12 0 45.90 2.30 11 12 0 45.80 2.60 10 -13 0 -0.30 1.30 10 -13 0 1.00 1.40 10 -13 0 -0.50 1.10 10 -13 0 1.30 1.50 -10 13 0 0.50 1.00 -10 13 0 -0.10 1.40 -10 13 0 0.50 1.40 -10 13 0 2.30 1.10 -10 13 0 1.50 1.30 9 -13 0 -1.20 1.40 9 -13 0 0.90 1.20 9 -13 0 -1.50 1.30 9 -13 0 -0.40 0.90 -9 13 0 0.40 1.30 -9 13 0 1.20 1.00 -9 13 0 0.60 1.20 -9 13 0 0.70 1.50 -9 13 0 -0.30 0.90 8 -13 0 -0.30 0.80 8 -13 0 0.70 1.20 8 -13 0 -0.20 1.00 8 -13 0 0.50 1.20 -8 13 0 -0.40 0.90 -8 13 0 0.30 1.00 -8 13 0 -0.80 1.70 -8 13 0 -1.10 1.30 -8 13 0 0.10 0.90 -8 13 0 -1.80 1.20 7 -13 0 -0.30 1.60 7 -13 0 0.70 0.90 7 -13 0 -0.10 1.20 7 -13 0 0.40 0.90 -7 13 0 -0.10 1.30 -7 13 0 0.40 0.90 -7 13 0 0.00 1.00 -7 13 0 1.50 1.70 -7 13 0 -0.20 0.80 6 -13 0 0.30 0.80 6 -13 0 0.70 0.90 6 -13 0 0.40 2.90 6 -13 0 0.10 1.20 6 -13 0 -1.20 0.70 6 -13 0 0.00 0.70 6 -13 0 -0.90 1.00 -6 13 0 0.40 1.00 -6 13 0 -1.00 1.20 -6 13 0 -0.60 1.10 -6 13 0 2.20 3.70 -6 13 0 0.10 0.70 -6 13 0 0.00 0.70 -6 13 0 0.00 0.80 5 -13 0 13.40 2.80 5 -13 0 17.20 1.20 5 -13 0 16.40 1.50 5 -13 0 14.10 1.70 5 -13 0 16.20 1.40 5 -13 0 18.10 1.40 5 -13 0 18.90 1.20 -5 13 0 16.60 1.80 -5 13 0 16.00 1.50 -5 13 0 18.20 1.20 -5 13 0 15.80 1.20 -5 13 0 15.50 1.30 -5 13 0 17.90 3.90 -5 13 0 15.90 1.60 4 -13 0 0.60 0.90 4 -13 0 2.00 0.90 4 -13 0 -1.80 2.50 4 -13 0 0.40 0.90 4 -13 0 1.20 2.10 4 -13 0 0.50 0.70 4 -13 0 1.90 0.60 4 -13 0 2.00 0.70 4 -13 0 1.80 0.70 -4 13 0 0.50 1.00 -4 13 0 2.00 0.70 -4 13 0 1.30 1.00 -4 13 0 1.10 0.70 -4 13 0 1.80 0.80 -4 13 0 3.50 2.10 -4 13 0 1.60 0.60 -4 13 0 0.70 2.80 -4 13 0 1.40 1.00 3 -13 0 23.10 1.40 3 -13 0 23.40 1.70 3 -13 0 24.60 1.60 3 -13 0 24.60 2.60 3 -13 0 23.80 1.40 3 -13 0 25.50 1.20 3 -13 0 26.10 1.50 -3 13 0 24.30 1.30 -3 13 0 24.00 1.30 -3 13 0 23.70 1.60 -3 13 0 24.70 1.40 -3 13 0 26.90 1.80 -3 13 0 23.60 2.70 -3 13 0 25.50 1.50 2 -13 0 7.50 1.40 2 -13 0 7.70 1.30 2 -13 0 9.20 2.60 2 -13 0 8.30 0.70 2 -13 0 8.60 0.90 2 -13 0 8.90 1.90 2 -13 0 8.80 1.40 2 -13 0 9.30 1.10 2 -13 0 8.90 0.90 -2 13 0 9.20 1.00 -2 13 0 7.10 1.50 -2 13 0 8.90 1.00 -2 13 0 9.00 1.10 -2 13 0 7.10 2.00 -2 13 0 8.80 2.80 -2 13 0 8.20 0.70 -2 13 0 10.10 1.30 -2 13 0 9.00 1.40 1 -13 0 4.80 1.00 1 -13 0 7.20 2.40 1 -13 0 4.40 0.70 1 -13 0 4.60 0.80 1 -13 0 5.50 1.10 1 -13 0 5.90 0.90 1 -13 0 5.70 0.80 1 -13 0 5.00 0.80 1 -13 0 4.50 1.10 1 -13 0 6.90 1.80 1 -13 0 4.40 0.70 -1 13 0 5.00 1.00 -1 13 0 5.90 0.70 -1 13 0 6.70 1.40 -1 13 0 3.80 1.90 -1 13 0 4.90 0.80 -1 13 0 5.80 0.90 -1 13 0 4.70 0.90 -1 13 0 6.90 2.70 -1 13 0 5.60 0.80 0 -13 0 8.40 1.30 0 -13 0 9.30 2.20 0 -13 0 7.10 0.80 0 -13 0 6.00 2.30 0 -13 0 7.70 1.00 0 -13 0 6.70 1.10 0 -13 0 10.40 1.30 0 -13 0 8.50 1.00 0 13 0 9.20 0.90 0 13 0 5.90 2.60 0 13 0 8.20 1.30 0 13 0 7.20 1.40 0 13 0 11.10 2.20 0 13 0 10.00 1.00 0 13 0 8.10 1.00 0 13 0 8.60 1.10 0 13 0 9.70 1.30 -1 -13 0 0.80 1.60 -1 -13 0 0.10 0.60 -1 -13 0 0.40 0.50 -1 -13 0 0.40 0.80 -1 -13 0 1.40 0.80 -1 -13 0 1.20 3.90 -1 -13 0 1.00 0.70 -1 -13 0 0.20 0.70 1 13 0 0.50 0.80 1 13 0 -0.10 0.60 1 13 0 1.70 2.80 1 13 0 0.10 0.90 1 13 0 0.00 0.70 1 13 0 1.30 1.60 1 13 0 0.20 0.50 1 13 0 0.50 0.90 -2 -13 0 29.00 1.50 -2 -13 0 34.30 1.70 -2 -13 0 30.30 2.70 -2 -13 0 30.10 1.60 -2 -13 0 30.50 1.60 2 13 0 30.20 1.50 2 13 0 30.30 1.60 2 13 0 31.90 1.50 2 13 0 36.00 2.60 2 13 0 32.20 1.70 2 13 0 30.80 1.80 -3 -13 0 1.90 0.80 -3 -13 0 3.10 1.80 -3 -13 0 1.70 0.70 -3 -13 0 2.10 0.60 3 13 0 2.90 0.90 3 13 0 1.60 1.70 3 13 0 2.50 0.60 3 13 0 1.90 0.80 3 13 0 2.10 0.80 3 13 0 2.40 0.60 -4 -13 0 126.79 5.00 -4 -13 0 124.09 4.90 -4 -13 0 128.49 4.90 -4 -13 0 126.59 5.80 4 13 0 132.69 4.80 4 13 0 132.39 5.70 4 13 0 125.09 4.90 4 13 0 131.09 5.00 4 13 0 131.79 5.50 4 13 0 126.09 4.90 -5 -13 0 148.29 6.00 -5 -13 0 147.39 6.30 -5 -13 0 180.78 6.30 5 13 0 152.58 5.90 5 13 0 152.98 6.30 5 13 0 155.28 6.00 5 13 0 161.98 6.20 5 13 0 154.78 6.00 -6 -13 0 18.00 1.40 -6 -13 0 18.80 1.40 6 13 0 18.70 1.70 6 13 0 15.60 1.10 6 13 0 17.10 1.50 6 13 0 18.80 1.40 6 13 0 18.70 1.20 -7 -13 0 62.99 3.00 7 13 0 55.29 2.70 7 13 0 66.19 2.70 7 13 0 57.09 3.00 7 13 0 53.99 3.40 7 13 0 55.49 3.70 -8 -13 0 3.50 1.10 -8 -13 0 5.50 1.10 8 13 0 5.20 1.10 8 13 0 5.60 1.00 8 13 0 5.00 1.10 8 13 0 6.70 1.20 8 13 0 4.70 1.10 -9 -13 0 2.10 1.10 -9 -13 0 -0.40 1.10 9 13 0 1.50 1.10 9 13 0 0.70 0.90 9 13 0 0.00 1.10 9 13 0 1.60 1.10 9 13 0 1.20 0.80 -10 -13 0 23.80 1.90 -10 -13 0 22.20 1.90 10 13 0 22.30 1.80 10 13 0 22.70 1.80 10 13 0 23.70 1.60 10 13 0 24.70 1.90 10 13 0 24.60 1.90 9 -14 0 -0.20 1.10 9 -14 0 0.00 1.00 9 -14 0 -1.00 1.40 9 -14 0 0.90 1.60 -9 14 0 1.10 1.50 -9 14 0 0.70 1.60 -9 14 0 1.50 1.00 -9 14 0 2.70 1.20 -9 14 0 1.70 1.10 8 -14 0 4.60 0.90 8 -14 0 5.70 1.30 8 -14 0 3.90 1.10 8 -14 0 4.50 1.00 -8 14 0 3.70 1.00 -8 14 0 4.20 1.40 -8 14 0 5.60 1.20 -8 14 0 6.60 1.20 7 -14 0 2.20 1.20 7 -14 0 1.90 1.00 7 -14 0 0.70 0.80 7 -14 0 0.50 1.20 -7 14 0 2.80 1.30 -7 14 0 1.40 1.30 -7 14 0 1.90 1.10 -7 14 0 0.90 0.80 -7 14 0 1.40 1.30 6 -14 0 0.10 0.90 6 -14 0 -0.50 1.30 6 -14 0 0.40 1.00 6 -14 0 0.90 1.30 6 -14 0 1.30 0.80 -6 14 0 1.10 0.80 -6 14 0 0.30 1.10 -6 14 0 0.70 1.40 -6 14 0 0.90 1.30 -6 14 0 0.60 0.80 -6 14 0 0.90 1.50 5 -14 0 0.20 0.80 5 -14 0 4.30 5.30 5 -14 0 0.50 1.00 5 -14 0 0.70 1.20 5 -14 0 0.70 1.00 5 -14 0 0.30 0.70 -5 14 0 1.60 0.70 -5 14 0 2.30 1.30 -5 14 0 0.70 1.30 -5 14 0 -1.40 1.00 -5 14 0 0.50 0.90 4 -14 0 4.10 2.80 4 -14 0 3.30 1.10 4 -14 0 4.40 1.10 4 -14 0 6.20 1.30 4 -14 0 4.20 0.90 4 -14 0 3.60 0.90 4 -14 0 5.60 1.10 4 -14 0 4.90 2.80 -4 14 0 3.10 1.10 -4 14 0 3.70 0.60 -4 14 0 3.30 0.90 -4 14 0 3.30 0.70 -4 14 0 0.20 3.10 -4 14 0 3.60 1.00 -4 14 0 5.60 1.20 -4 14 0 8.30 2.50 3 -14 0 20.00 1.30 3 -14 0 29.70 3.40 3 -14 0 20.30 1.40 3 -14 0 18.10 1.30 3 -14 0 21.60 4.30 3 -14 0 20.90 1.20 3 -14 0 18.80 1.80 3 -14 0 22.20 1.50 3 -14 0 20.50 1.80 -3 14 0 19.00 3.40 -3 14 0 21.00 1.40 -3 14 0 21.30 1.20 -3 14 0 18.60 1.90 -3 14 0 18.70 1.50 -3 14 0 19.10 1.90 -3 14 0 21.70 1.10 -3 14 0 21.40 1.50 -3 14 0 25.10 4.70 2 -14 0 45.90 2.50 2 -14 0 42.50 2.00 2 -14 0 45.40 2.30 2 -14 0 45.50 1.90 2 -14 0 46.30 2.00 2 -14 0 45.50 2.10 2 -14 0 46.00 2.20 2 -14 0 50.69 4.50 2 -14 0 46.60 3.70 2 -14 0 44.80 2.00 2 -14 0 46.20 2.00 -2 14 0 46.70 2.00 -2 14 0 48.00 3.70 -2 14 0 44.80 2.30 -2 14 0 43.30 2.10 -2 14 0 43.50 2.10 -2 14 0 49.00 2.00 -2 14 0 44.70 2.40 -2 14 0 45.70 1.90 -2 14 0 46.80 2.00 -2 14 0 45.30 4.90 1 -14 0 -1.10 2.70 1 -14 0 0.30 1.00 1 -14 0 0.30 0.70 1 -14 0 0.60 0.70 1 -14 0 1.10 0.90 1 -14 0 -0.50 2.00 1 -14 0 1.20 0.70 1 -14 0 1.20 1.00 1 -14 0 1.90 0.90 -1 14 0 0.40 0.70 -1 14 0 -2.20 3.00 -1 14 0 0.10 0.60 -1 14 0 -0.10 0.90 -1 14 0 0.40 1.10 -1 14 0 0.10 0.70 -1 14 0 1.80 1.00 -1 14 0 0.80 1.10 -1 14 0 -1.30 2.10 -1 14 0 1.10 0.50 0 -14 0 52.49 2.30 0 -14 0 63.09 5.00 0 -14 0 52.29 2.30 0 -14 0 52.59 3.70 0 -14 0 52.09 2.30 0 -14 0 53.29 2.30 0 14 0 53.49 2.60 0 14 0 50.09 2.30 0 14 0 51.49 2.30 0 14 0 51.69 2.30 0 14 0 52.99 3.40 0 14 0 51.79 3.70 -1 -14 0 -0.50 1.90 -1 -14 0 0.10 0.60 -1 -14 0 0.40 0.70 -1 -14 0 1.40 0.90 -1 -14 0 1.00 0.60 1 14 0 0.80 1.00 1 14 0 0.20 0.70 1 14 0 -0.70 1.80 1 14 0 0.10 0.80 1 14 0 0.20 0.60 -2 -14 0 7.50 1.20 -2 -14 0 8.00 1.00 -2 -14 0 7.90 1.10 -2 -14 0 9.10 1.20 -2 -14 0 6.00 1.10 2 14 0 8.30 1.60 2 14 0 5.50 1.20 2 14 0 8.60 1.30 2 14 0 7.50 0.90 2 14 0 5.20 1.10 -3 -14 0 76.99 3.30 -3 -14 0 74.69 3.20 -3 -14 0 84.69 4.30 -3 -14 0 78.49 3.20 3 14 0 79.29 3.20 3 14 0 82.79 4.20 3 14 0 80.69 3.20 3 14 0 73.99 3.30 3 14 0 81.09 3.20 3 14 0 80.29 3.40 -4 -14 0 -0.50 0.80 -4 -14 0 0.60 0.90 -4 -14 0 0.50 0.70 4 14 0 1.30 0.70 4 14 0 0.80 1.00 4 14 0 0.10 0.90 4 14 0 0.40 0.70 4 14 0 0.80 1.10 -5 -14 0 75.99 3.30 -5 -14 0 77.09 3.10 -5 -14 0 76.59 3.20 5 14 0 75.39 3.40 5 14 0 81.19 3.10 5 14 0 78.89 3.30 5 14 0 75.79 3.20 5 14 0 80.19 3.10 -6 -14 0 9.90 1.30 -6 -14 0 11.20 1.20 -6 -14 0 8.90 1.60 6 14 0 10.70 1.20 6 14 0 11.20 1.80 6 14 0 11.40 1.30 6 14 0 10.50 1.40 6 14 0 8.60 2.00 -7 -14 0 86.59 3.50 -7 -14 0 82.39 3.60 -7 -14 0 89.89 3.60 7 14 0 89.59 3.50 7 14 0 89.59 3.50 7 14 0 83.29 3.60 7 14 0 86.89 3.60 7 14 0 84.99 3.60 -8 -14 0 39.10 2.20 -8 -14 0 42.60 2.10 -8 -14 0 40.10 2.40 8 14 0 38.40 2.40 8 14 0 42.00 1.90 8 14 0 41.20 2.10 8 14 0 36.40 2.20 -9 -14 0 0.10 1.20 -9 -14 0 0.40 1.30 9 14 0 -0.70 1.00 9 14 0 1.40 1.40 9 14 0 -0.90 1.20 9 14 0 -0.10 0.90 9 -15 0 1.00 1.50 9 -15 0 -1.40 1.20 -9 15 0 -0.60 1.20 8 -15 0 2.70 1.10 8 -15 0 5.40 1.40 8 -15 0 2.60 1.20 8 -15 0 3.70 1.40 8 -15 0 4.20 1.10 -8 15 0 1.60 1.10 -8 15 0 4.40 1.10 -8 15 0 2.50 1.50 -8 15 0 2.20 1.50 -8 15 0 4.10 1.20 7 -15 0 5.80 1.30 7 -15 0 5.10 1.10 7 -15 0 6.70 1.40 7 -15 0 4.00 0.90 7 -15 0 4.00 1.50 -7 15 0 3.70 1.60 -7 15 0 7.80 1.30 -7 15 0 4.70 1.00 -7 15 0 5.30 1.50 -7 15 0 5.10 1.30 6 -15 0 0.30 1.40 6 -15 0 0.30 1.40 6 -15 0 1.00 0.80 6 -15 0 0.00 1.10 6 -15 0 -1.10 0.80 -6 15 0 0.20 0.80 -6 15 0 0.80 0.80 -6 15 0 -1.00 1.50 -6 15 0 1.40 1.60 -6 15 0 0.60 1.20 5 -15 0 0.20 1.00 5 -15 0 -0.40 1.10 5 -15 0 -1.20 1.20 5 -15 0 0.40 1.40 5 -15 0 -0.30 0.80 5 -15 0 0.60 1.20 -5 15 0 0.10 1.20 -5 15 0 -0.10 0.80 -5 15 0 2.20 1.30 -5 15 0 -0.60 1.10 -5 15 0 0.90 1.30 4 -15 0 -1.60 1.10 4 -15 0 0.70 3.60 4 -15 0 -0.30 0.80 4 -15 0 0.80 0.90 4 -15 0 0.10 0.80 4 -15 0 0.20 0.90 -4 15 0 -0.20 1.90 -4 15 0 -0.70 0.90 -4 15 0 0.10 0.80 -4 15 0 0.80 1.00 -4 15 0 -0.30 0.80 -4 15 0 -0.60 1.20 3 -15 0 13.20 1.40 3 -15 0 9.60 1.50 3 -15 0 13.70 1.60 3 -15 0 16.90 1.20 3 -15 0 10.40 3.40 3 -15 0 12.80 1.20 3 -15 0 12.00 1.80 3 -15 0 12.60 1.30 -3 15 0 12.80 1.70 -3 15 0 13.20 2.00 -3 15 0 11.40 1.10 -3 15 0 14.30 1.30 -3 15 0 8.10 3.30 -3 15 0 12.00 1.50 -3 15 0 13.10 1.50 -3 15 0 10.90 1.20 2 -15 0 36.30 2.00 2 -15 0 37.30 2.20 2 -15 0 33.60 1.60 2 -15 0 32.20 2.20 2 -15 0 37.40 1.80 2 -15 0 32.10 4.80 2 -15 0 38.00 1.80 2 -15 0 33.90 1.80 -2 15 0 32.60 5.20 -2 15 0 31.80 1.60 -2 15 0 34.40 1.90 -2 15 0 36.80 1.80 -2 15 0 33.20 1.70 -2 15 0 33.40 2.30 -2 15 0 36.80 1.90 -2 15 0 31.90 2.10 1 -15 0 3.00 0.80 1 -15 0 1.10 2.70 1 -15 0 2.20 0.70 1 -15 0 1.80 0.90 1 -15 0 1.20 0.90 1 -15 0 2.60 1.00 1 -15 0 1.60 1.00 -1 15 0 1.80 3.00 -1 15 0 2.00 0.90 -1 15 0 2.70 1.10 -1 15 0 2.60 0.90 -1 15 0 2.50 1.20 -1 15 0 2.70 1.00 -1 15 0 1.80 0.70 0 -15 0 13.80 1.20 0 -15 0 12.20 1.70 0 -15 0 12.70 1.30 0 -15 0 11.30 2.50 0 -15 0 16.40 1.40 0 -15 0 11.00 1.20 0 15 0 14.90 1.40 0 15 0 15.00 1.80 0 15 0 10.70 2.60 0 15 0 13.40 1.50 0 15 0 13.80 1.10 0 15 0 12.20 1.40 -1 -15 0 -0.10 0.70 -1 -15 0 0.50 2.10 -1 -15 0 0.60 1.00 -1 -15 0 -0.40 0.80 -1 -15 0 -0.40 1.10 -1 -15 0 -0.20 0.90 1 15 0 0.80 1.00 1 15 0 0.50 2.10 1 15 0 0.20 0.90 1 15 0 -0.30 1.20 1 15 0 0.70 1.10 1 15 0 0.30 0.70 -2 -15 0 87.49 3.60 -2 -15 0 83.29 3.40 -2 -15 0 91.09 3.70 2 15 0 87.99 3.60 2 15 0 88.89 3.40 2 15 0 83.59 3.70 -3 -15 0 112.69 4.50 -3 -15 0 126.49 4.70 -3 -15 0 109.89 4.50 3 15 0 114.19 4.40 3 15 0 117.69 4.70 3 15 0 112.59 4.50 -4 -15 0 17.30 1.60 -4 -15 0 15.10 1.30 -4 -15 0 13.50 1.50 4 15 0 16.80 1.60 4 15 0 12.50 1.90 4 15 0 12.60 1.20 4 15 0 14.50 1.70 4 15 0 17.50 1.20 -5 -15 0 32.50 1.70 -5 -15 0 32.10 1.90 -5 -15 0 34.10 2.10 5 15 0 33.40 1.70 5 15 0 25.80 2.20 5 15 0 37.10 2.30 5 15 0 29.90 1.90 -6 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1.00 -1 -16 0 6.90 1.20 -1 -16 0 3.00 1.00 -1 -16 0 4.00 1.20 1 16 0 4.20 0.80 1 16 0 5.00 1.30 1 16 0 3.30 1.20 1 16 0 3.60 1.00 1 16 0 5.40 1.20 -2 -16 0 38.80 1.90 -2 -16 0 36.90 2.00 -2 -16 0 41.40 2.40 -2 -16 0 39.50 2.00 -2 -16 0 36.10 2.10 2 16 0 42.50 2.20 2 16 0 37.00 2.10 2 16 0 38.70 2.30 2 16 0 37.60 1.90 2 16 0 38.30 2.10 -3 -16 0 51.69 2.40 -3 -16 0 51.69 2.40 -3 -16 0 46.60 2.30 -3 -16 0 47.70 2.30 3 16 0 52.59 2.30 3 16 0 46.50 2.50 3 16 0 47.40 2.20 3 16 0 46.70 2.90 3 16 0 51.09 2.40 -4 -16 0 1.10 1.20 -4 -16 0 1.10 0.90 -4 -16 0 1.30 1.10 -4 -16 0 1.20 0.90 4 16 0 1.20 1.20 4 16 0 3.00 0.90 4 16 0 2.70 0.90 4 16 0 0.90 1.20 -5 -16 0 13.20 1.50 -5 -16 0 11.30 1.80 -5 -16 0 12.20 1.60 5 16 0 9.40 1.70 5 16 0 11.60 1.60 5 16 0 12.00 1.60 5 16 0 13.20 1.70 -6 -16 0 5.00 1.40 -6 -16 0 7.90 1.60 -6 -16 0 9.50 1.40 6 16 0 7.60 1.60 6 16 0 6.20 1.10 6 16 0 6.60 1.50 6 16 0 6.70 1.40 -7 -16 0 72.89 3.20 -7 -16 0 72.19 3.30 -7 -16 0 78.39 3.40 7 16 0 72.09 3.40 7 16 0 75.29 3.10 7 16 0 73.19 3.30 7 16 0 75.19 3.20 8 16 0 158.98 6.10 6 -17 0 -0.30 1.40 6 -17 0 -0.80 1.80 6 -17 0 -1.20 1.10 6 -17 0 -0.20 1.20 -6 17 0 0.00 1.10 -6 17 0 -0.50 1.20 -6 17 0 -0.20 1.90 -6 17 0 0.80 1.60 5 -17 0 1.10 1.60 5 -17 0 1.70 1.20 -5 17 0 2.50 1.30 -5 17 0 0.70 2.40 -5 17 0 0.30 1.70 4 -17 0 -0.30 1.50 4 -17 0 -0.20 1.20 4 -17 0 0.70 0.90 4 -17 0 0.80 1.60 -4 17 0 1.10 1.70 -4 17 0 1.00 1.20 -4 17 0 -0.30 1.80 -4 17 0 0.70 0.90 3 -17 0 0.50 1.00 3 -17 0 0.40 1.70 -3 17 0 -0.50 1.00 -3 17 0 0.20 1.30 2 -17 0 2.10 1.00 2 -17 0 1.30 1.50 2 -17 0 1.40 1.20 -2 17 0 0.70 1.50 -2 17 0 2.70 1.20 -2 17 0 1.60 1.00 -2 17 0 1.00 1.60 1 -17 0 10.10 1.40 1 -17 0 9.70 1.70 1 -17 0 10.30 2.10 1 -17 0 6.80 1.50 -1 17 0 9.70 1.60 -1 17 0 8.30 1.50 -1 17 0 10.30 2.30 -1 17 0 7.40 1.30 0 -17 0 27.90 1.80 0 -17 0 30.00 1.80 0 -17 0 29.10 2.20 0 17 0 23.50 2.60 0 17 0 31.40 2.30 0 17 0 31.20 1.90 0 17 0 29.20 1.80 -1 -17 0 23.20 2.50 -1 -17 0 23.80 1.90 -1 -17 0 25.20 1.70 -1 -17 0 23.20 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4.60 1.50 -9 -10 9 4.30 1.60 -9 -10 9 3.90 1.60 8 10 -9 1.10 0.80 8 10 -9 0.40 1.10 8 10 -9 0.10 1.30 8 10 -9 0.40 1.20 -8 -10 9 -0.50 1.30 -8 -10 9 0.20 1.40 -8 -10 9 -0.10 1.30 7 10 -9 47.40 3.80 7 10 -9 46.90 2.40 7 10 -9 46.80 2.70 7 10 -9 44.90 2.20 -7 -10 9 48.80 3.20 -7 -10 9 49.20 2.60 -7 -10 9 44.60 2.70 6 10 -9 8.40 1.60 6 10 -9 8.10 1.20 6 10 -9 6.70 1.20 6 10 -9 5.10 1.00 -6 -10 9 5.40 1.00 -6 -10 9 6.40 1.20 -6 -10 9 5.70 1.20 5 10 -9 38.20 2.30 5 10 -9 40.30 2.00 5 10 -9 35.20 2.20 5 10 -9 36.60 2.10 5 10 -9 39.90 1.80 -5 -10 9 39.10 2.10 -5 -10 9 40.50 2.20 -5 -10 9 36.00 2.10 4 10 -9 60.69 3.60 4 10 -9 60.59 2.80 4 10 -9 65.09 2.50 4 10 -9 62.19 2.70 4 10 -9 58.59 2.80 -4 -10 9 60.19 2.80 -4 -10 9 64.39 2.70 -4 -10 9 62.69 2.80 3 10 -9 35.40 1.50 3 10 -9 30.70 2.80 3 10 -9 36.90 1.90 3 10 -9 32.40 1.60 3 10 -9 30.50 1.80 -3 -10 9 31.70 1.90 -3 -10 9 37.10 1.90 -3 -10 9 36.00 1.80 2 10 -9 2.00 0.60 2 10 -9 1.80 1.00 2 10 -9 1.60 0.90 2 10 -9 3.20 1.80 2 10 -9 1.80 0.80 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3.00 0.90 -12 6 -10 2.10 0.80 12 -6 10 1.20 0.90 12 -6 10 2.90 1.10 12 -6 10 4.20 0.90 12 -6 10 3.40 1.10 -13 6 -10 0.70 1.00 -13 6 -10 0.70 1.00 -13 6 -10 -0.10 1.00 -13 6 -10 2.00 1.40 13 -6 10 1.30 1.20 13 -6 10 -0.30 1.60 13 -6 10 0.00 1.00 13 -6 10 1.10 1.10 11 5 -10 2.00 1.20 11 5 -10 1.00 1.00 -11 -5 10 2.80 1.50 10 5 -10 136.39 5.10 10 5 -10 137.59 5.20 -10 -5 10 122.39 5.20 9 5 -10 0.00 1.00 9 5 -10 -0.40 0.80 9 5 -10 -0.20 0.90 -9 -5 10 0.00 1.10 -9 -5 10 0.40 1.00 8 5 -10 112.49 4.80 8 5 -10 123.79 4.70 8 5 -10 123.79 4.80 -8 -5 10 121.49 4.80 -8 -5 10 129.19 4.80 -8 -5 10 123.79 4.80 7 5 -10 0.30 1.00 7 5 -10 0.50 0.60 7 5 -10 0.70 0.90 7 5 -10 0.00 0.70 -7 -5 10 1.00 0.90 -7 -5 10 1.00 1.40 -7 -5 10 0.60 1.10 -7 -5 10 0.50 0.90 6 5 -10 63.59 2.60 6 5 -10 64.19 2.70 6 5 -10 64.29 2.80 6 5 -10 63.89 2.80 -6 -5 10 65.89 2.90 -6 -5 10 65.69 2.70 -6 -5 10 67.19 2.80 -6 -5 10 67.09 2.80 5 5 -10 80.79 3.10 5 5 -10 73.29 3.10 5 5 -10 78.49 3.00 5 5 -10 73.79 3.80 -5 -5 10 75.29 3.10 -5 -5 10 81.39 3.10 -5 -5 10 75.49 3.30 4 5 -10 5.40 0.70 4 5 -10 5.40 0.90 4 5 -10 6.10 0.80 4 5 -10 5.50 1.50 -4 -5 10 5.70 1.00 -4 -5 10 5.40 0.90 3 5 -10 39.00 1.90 3 5 -10 40.90 2.40 3 5 -10 38.60 1.50 3 5 -10 38.40 1.80 3 5 -10 35.70 1.80 3 5 -10 37.30 1.60 -3 -5 10 39.10 1.70 -3 -5 10 35.60 1.80 -3 -5 10 40.00 1.70 2 5 -10 16.70 1.00 2 5 -10 16.80 1.20 2 5 -10 15.50 1.60 2 5 -10 18.80 0.80 2 5 -10 18.20 1.20 2 5 -10 16.10 1.00 -2 -5 10 19.50 0.90 -2 -5 10 19.40 1.00 -2 -5 10 16.50 1.20 1 5 -10 249.38 9.00 1 5 -10 238.28 9.00 1 5 -10 243.78 9.00 1 5 -10 239.38 9.20 1 5 -10 243.18 9.10 1 5 -10 246.28 9.10 1 5 -10 250.47 8.90 -1 -5 10 244.38 9.00 -1 -5 10 248.18 9.00 -1 -5 10 237.08 9.10 0 5 -10 48.50 2.00 0 5 -10 46.90 1.80 0 5 -10 48.30 2.20 0 5 -10 50.89 1.90 0 5 -10 46.80 2.00 0 5 -10 46.80 1.90 0 5 -10 44.70 1.90 0 -5 10 45.10 1.80 0 -5 10 46.40 1.90 0 -5 10 47.40 2.00 0 -5 10 48.30 1.90 -1 5 -10 0.40 0.30 -1 5 -10 0.70 0.40 -1 5 -10 0.30 0.40 -1 5 -10 0.10 0.60 -1 5 -10 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14.80 2.10 2 6 -21 12.60 2.20 -2 -6 21 16.90 2.40 -2 -6 21 15.50 2.20 -2 -6 21 12.80 2.50 1 6 -21 23.00 2.50 1 6 -21 19.00 2.50 1 6 -21 19.60 2.40 -1 -6 21 19.80 2.50 -1 -6 21 18.70 2.30 -1 -6 21 18.20 2.40 0 6 -21 16.30 2.70 0 6 -21 19.90 2.40 0 6 -21 15.90 2.00 0 -6 21 13.10 2.00 0 -6 21 16.30 1.80 0 -6 21 16.40 2.80 -1 6 -21 219.08 8.50 -1 6 -21 226.38 8.60 -1 6 -21 216.38 8.70 -1 6 -21 223.88 8.70 1 -6 21 229.88 8.60 1 -6 21 221.18 8.70 1 -6 21 225.88 8.50 -2 6 -21 -0.60 1.30 -2 6 -21 0.00 1.10 -2 6 -21 1.60 1.60 -2 6 -21 -0.90 1.60 2 -6 21 -0.20 1.70 2 -6 21 1.10 1.20 2 -6 21 -0.10 1.00 -3 6 -21 232.48 9.10 -3 6 -21 247.78 9.40 -3 6 -21 240.68 9.20 -3 6 -21 242.58 9.40 3 -6 21 247.18 9.50 3 -6 21 238.58 9.20 3 -6 21 251.07 9.10 3 -6 21 250.67 9.10 -4 6 -21 2.10 1.20 -4 6 -21 0.70 1.70 -4 6 -21 2.10 1.90 -4 6 -21 0.70 1.00 4 -6 21 1.70 0.90 4 -6 21 -0.50 1.10 4 -6 21 2.30 1.90 4 -6 21 1.60 1.20 -5 6 -21 162.98 6.30 -5 6 -21 150.18 6.30 -5 6 -21 153.58 5.80 -5 6 -21 140.39 6.00 -5 6 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2.10 0 5 -21 10.00 2.10 0 5 -21 8.20 1.60 0 -5 21 14.90 2.20 0 -5 21 9.70 2.10 -1 5 -21 93.09 4.10 -1 5 -21 88.09 4.00 -1 5 -21 83.49 4.60 1 -5 21 89.19 3.70 1 -5 21 100.49 4.00 1 -5 21 91.49 4.20 1 -5 21 87.79 4.50 -2 5 -21 12.90 2.10 -2 5 -21 11.30 1.70 -2 5 -21 15.40 1.50 -2 5 -21 12.30 2.20 2 -5 21 14.60 1.50 2 -5 21 13.00 2.20 2 -5 21 14.00 1.40 2 -5 21 11.10 1.70 -3 5 -21 108.89 4.70 -3 5 -21 104.59 4.40 -3 5 -21 109.39 4.70 -3 5 -21 108.79 4.50 3 -5 21 112.39 4.80 3 -5 21 108.49 4.40 3 -5 21 112.59 4.50 -4 5 -21 21.20 2.60 -4 5 -21 20.90 1.90 -4 5 -21 24.10 2.40 4 -5 21 19.60 1.90 4 -5 21 21.00 1.40 -5 5 -21 95.89 4.70 -5 5 -21 101.69 3.90 -5 5 -21 102.39 4.10 -5 5 -21 114.39 6.10 -5 5 -21 91.59 4.90 5 -5 21 95.89 4.60 5 -5 21 102.09 3.90 5 -5 21 98.99 4.10 -6 5 -21 55.79 2.50 -6 5 -21 56.49 2.60 -6 5 -21 53.89 3.40 -6 5 -21 49.30 2.60 6 -5 21 54.99 2.40 6 -5 21 57.49 2.50 6 -5 21 57.19 2.60 -7 5 -21 13.80 1.40 -7 5 -21 9.40 1.90 -7 5 -21 15.10 2.40 -7 5 -21 10.70 1.80 -7 5 -21 11.70 1.30 7 -5 21 13.10 1.40 7 -5 21 12.20 1.30 7 -5 21 14.90 1.80 -8 5 -21 11.40 1.20 -8 5 -21 12.00 1.30 -8 5 -21 9.80 1.90 -8 5 -21 10.80 2.20 -8 5 -21 10.60 1.80 8 -5 21 10.30 1.30 8 -5 21 8.80 1.30 8 -5 21 10.10 1.20 -9 5 -21 4.80 2.00 -9 5 -21 5.80 2.00 -9 5 -21 7.20 1.30 -9 5 -21 5.20 1.20 -9 5 -21 3.00 1.20 9 -5 21 5.20 1.10 9 -5 21 6.50 1.30 9 -5 21 4.50 1.20 4 4 -21 29.90 2.70 4 4 -21 28.90 2.20 -4 -4 21 28.90 2.80 -4 -4 21 27.80 2.80 -4 -4 21 33.60 2.80 3 4 -21 -0.30 1.50 3 4 -21 -1.00 1.40 3 4 -21 -0.20 1.50 3 4 -21 -0.50 1.60 -3 -4 21 2.00 1.40 -3 -4 21 -2.20 1.60 -3 -4 21 1.20 1.50 2 4 -21 4.80 1.70 2 4 -21 8.70 2.80 2 4 -21 7.00 1.30 2 4 -21 4.10 1.40 -2 -4 21 6.10 1.80 -2 -4 21 6.00 1.60 -2 -4 21 4.10 1.40 1 4 -21 5.40 2.10 1 4 -21 4.50 1.20 1 4 -21 3.30 1.50 1 4 -21 1.90 1.50 -1 -4 21 3.00 2.00 -1 -4 21 4.00 1.20 -1 -4 21 6.00 1.60 0 4 -21 0.60 1.50 0 4 -21 0.30 1.20 0 4 -21 0.90 1.50 0 -4 21 1.90 1.50 0 -4 21 1.50 1.10 0 -4 21 0.30 1.20 -1 4 -21 82.39 3.70 -1 4 -21 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1.80 -7 5 -23 10.70 3.10 -7 5 -23 15.20 2.40 7 -5 23 12.80 1.40 7 -5 23 13.30 2.10 7 -5 23 12.20 2.10 2 4 -23 4.60 1.50 2 4 -23 1.50 2.00 2 4 -23 -0.70 2.00 2 4 -23 3.30 1.80 -2 -4 23 1.60 2.00 -2 -4 23 2.60 1.80 -2 -4 23 2.90 1.70 1 4 -23 48.10 2.90 1 4 -23 55.79 3.10 1 4 -23 49.80 3.20 -1 -4 23 48.60 2.90 -1 -4 23 43.20 3.20 -1 -4 23 47.60 2.80 0 4 -23 59.39 3.20 0 4 -23 57.69 3.40 0 4 -23 62.99 3.40 0 -4 23 59.69 3.00 0 -4 23 60.99 3.50 0 -4 23 66.69 3.20 -1 4 -23 0.90 1.70 -1 4 -23 0.50 1.50 -1 4 -23 0.50 1.90 1 -4 23 0.20 1.50 1 -4 23 1.10 1.40 1 -4 23 -1.00 1.10 1 -4 23 2.40 2.00 -2 4 -23 90.89 4.40 -2 4 -23 94.39 4.20 -2 4 -23 96.09 4.40 -2 4 -23 95.59 4.00 2 -4 23 100.39 4.50 2 -4 23 96.49 4.00 2 -4 23 93.99 4.00 2 -4 23 103.39 4.20 -3 4 -23 1.80 1.30 -3 4 -23 3.30 1.70 -3 4 -23 4.70 1.70 -3 4 -23 7.40 1.50 3 -4 23 4.00 1.20 3 -4 23 3.50 1.30 3 -4 23 4.10 1.80 3 -4 23 2.70 1.10 -4 4 -23 82.99 3.50 -4 4 -23 77.49 3.60 -4 4 -23 78.59 4.00 -4 4 -23 82.59 4.00 4 -4 23 83.09 3.60 4 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6 25 169.48 6.40 3 -7 -25 0.80 1.50 -3 7 25 0.60 1.60 -3 7 25 2.90 1.80 2 -7 -25 -0.80 1.40 -2 7 25 -1.50 1.50 -2 7 25 0.00 1.70 -1 7 25 4.60 1.50 -1 7 25 5.80 1.80 0 -7 -25 46.80 2.50 0 7 25 39.70 3.20 0 7 25 42.60 3.30 -1 -7 -25 4.00 2.50 1 7 25 6.70 1.50 -2 -7 -25 8.70 1.90 -2 -7 -25 9.00 1.70 2 7 25 9.10 1.80 2 7 25 6.30 1.60 -3 -7 -25 9.50 1.80 -3 -7 -25 10.40 1.80 3 7 25 9.70 1.50 3 7 25 8.70 5.30 3 7 25 10.10 1.70 3 7 25 12.30 2.30 -4 -7 -25 17.00 1.90 4 7 25 14.00 4.50 4 7 25 20.90 1.80 4 7 25 19.10 1.80 4 7 25 17.80 2.30 -5 -7 -25 54.99 2.70 5 7 25 55.89 3.10 5 7 25 50.59 2.60 -6 -7 -25 42.60 2.40 -6 -7 -25 40.20 2.30 6 7 25 38.90 2.40 -7 -7 -25 0.40 1.30 -7 -7 -25 0.70 1.30 7 7 25 0.30 1.20 -8 -7 -25 12.00 2.50 -8 -7 -25 14.30 1.90 8 7 25 11.60 1.70 8 7 25 13.60 1.80 -9 -7 -25 0.00 1.40 -9 -7 -25 0.70 1.50 9 7 25 -0.70 1.20 9 7 25 0.80 1.40 -10 -7 -25 128.19 4.90 -10 -7 -25 105.19 5.60 10 7 25 111.99 5.10 10 7 25 120.99 4.80 3 -8 -25 0.30 1.70 -3 8 25 0.70 1.80 -3 8 25 0.60 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1.70 1.70 3 7 27 1.70 1.50 3 7 27 0.00 2.70 -4 -7 -27 38.50 2.60 4 7 27 44.40 2.50 4 7 27 36.50 3.00 -5 -7 -27 2.40 1.40 5 7 27 0.70 1.60 5 7 27 1.20 1.80 5 7 27 1.30 1.40 -6 -7 -27 42.40 2.70 6 7 27 43.30 2.60 6 7 27 43.60 3.00 -7 -7 -27 21.40 2.70 -7 -7 -27 27.90 2.30 7 7 27 29.80 2.20 7 7 27 24.40 2.30 -8 -7 -27 3.40 1.80 8 7 27 2.20 1.50 8 7 27 2.00 1.40 1 -8 -27 7.90 1.80 -1 8 27 8.20 2.20 -1 8 27 7.80 2.00 0 -8 -27 -1.40 1.70 0 8 27 1.00 1.80 0 8 27 0.70 1.80 -1 -8 -27 13.30 2.50 -1 -8 -27 10.70 1.90 1 8 27 15.70 2.40 1 8 27 9.60 1.90 -2 -8 -27 21.10 2.70 -2 -8 -27 22.50 2.40 2 8 27 22.80 2.40 2 8 27 21.20 2.70 -3 -8 -27 13.60 2.20 3 8 27 14.30 2.50 -4 -8 -27 52.89 2.90 4 8 27 54.19 2.90 4 8 27 54.69 3.00 -5 -8 -27 5.50 1.50 5 8 27 5.80 1.70 5 8 27 7.00 1.50 -6 -8 -27 12.60 2.00 6 8 27 14.20 2.40 6 8 27 13.90 2.20 -7 -8 -27 29.20 2.40 7 8 27 28.60 2.40 7 8 27 31.60 2.60 -8 -8 -27 4.00 1.80 8 8 27 6.90 1.70 8 8 27 4.60 1.50 1 -9 -27 0.50 1.60 -1 9 27 2.60 1.70 0 -9 -27 7.30 1.70 0 9 27 6.60 1.90 0 9 27 6.50 1.90 -1 -9 -27 1.40 1.80 -1 -9 -27 -0.60 1.60 1 9 27 0.90 1.90 1 9 27 -1.70 1.80 -2 -9 -27 5.60 1.80 -2 -9 -27 6.60 1.60 2 9 27 4.10 1.80 2 9 27 7.70 1.70 -3 -9 -27 20.10 2.80 -3 -9 -27 21.60 2.50 3 9 27 18.20 2.40 3 9 27 21.30 3.40 -4 -9 -27 79.19 3.60 4 9 27 74.29 3.80 4 9 27 76.19 3.70 -5 -9 -27 13.00 2.00 5 9 27 10.50 2.30 5 9 27 14.90 2.50 -6 -9 -27 8.50 1.50 6 9 27 9.30 1.70 6 9 27 6.90 1.60 -7 -9 -27 6.40 1.70 7 9 27 7.10 1.60 7 9 27 7.40 1.60 0 -10 -27 3.20 1.50 0 10 27 1.30 1.90 0 10 27 3.10 2.80 -1 -10 -27 -0.80 1.50 1 10 27 0.00 1.80 1 10 27 0.90 1.80 -2 -10 -27 -0.30 1.60 -2 -10 -27 1.30 1.70 2 10 27 1.10 1.70 2 10 27 -0.80 1.90 2 10 27 -0.40 1.90 -3 -10 -27 25.10 2.70 -3 -10 -27 17.90 2.50 3 10 27 21.80 2.70 3 10 27 21.80 2.80 -4 -10 -27 39.00 2.50 4 10 27 39.40 3.30 4 10 27 41.10 2.80 -5 -10 -27 24.70 2.50 5 10 27 24.40 3.00 5 10 27 23.70 2.40 -6 -10 -27 0.20 1.40 6 10 27 0.60 1.70 6 10 27 0.00 1.60 7 10 27 19.30 2.40 7 10 27 16.60 2.40 -1 -11 -27 2.20 1.70 1 11 27 2.30 2.80 1 11 27 2.90 1.90 1 11 27 1.60 2.10 -2 -11 -27 22.00 2.20 -2 -11 -27 15.30 2.60 2 11 27 20.60 2.60 2 11 27 17.90 2.90 -3 -11 -27 1.50 1.50 -3 -11 -27 2.00 1.40 3 11 27 3.10 2.20 3 11 27 -0.50 1.70 -4 -11 -27 7.60 1.70 4 11 27 9.60 2.00 4 11 27 5.50 1.90 -5 -11 -27 4.20 1.60 5 11 27 2.70 1.70 5 11 27 3.80 2.10 -6 -11 -27 3.10 1.40 6 11 27 4.00 1.80 6 11 27 3.40 1.70 -2 -12 -27 0.60 1.50 -2 -12 -27 -0.40 1.80 2 12 27 0.90 2.30 -3 -12 -27 0.00 1.50 -3 -12 -27 -0.60 1.60 3 12 27 -1.60 1.90 3 12 27 0.70 2.00 -4 -12 -27 1.00 1.60 -4 -12 -27 0.50 1.60 4 12 27 0.00 2.00 4 12 27 0.00 2.00 4 12 27 -0.90 1.40 -5 -12 -27 2.20 1.60 5 12 27 3.10 1.80 5 12 27 0.40 2.10 -2 -2 -28 2.70 2.00 2 2 28 0.30 1.80 -3 -2 -28 14.70 2.70 3 2 28 16.10 2.20 3 2 28 15.90 2.20 -4 -2 -28 1.70 2.00 4 2 28 0.30 1.90 4 2 28 2.10 1.50 -5 -2 -28 3.20 2.00 5 2 28 3.00 1.40 -1 -3 -28 9.90 2.10 1 3 28 9.00 2.00 -2 -3 -28 -0.90 1.90 2 3 28 0.90 1.60 2 3 28 -1.30 1.60 -3 -3 -28 4.70 1.90 3 3 28 5.10 1.70 3 3 28 3.10 1.50 -4 -3 -28 2.40 2.10 4 3 28 1.20 1.40 4 3 28 2.00 1.40 -5 -3 -28 -1.00 2.80 -5 -3 -28 -0.50 1.90 5 3 28 0.40 1.60 5 3 28 0.20 1.40 -6 -3 -28 0.90 2.20 6 3 28 -0.70 1.60 -1 -4 -28 67.39 3.80 1 4 28 79.09 3.60 1 4 28 66.29 3.70 -2 -4 -28 6.80 1.90 2 4 28 6.10 1.90 2 4 28 6.80 1.60 -3 -4 -28 1.00 1.80 3 4 28 0.90 1.50 3 4 28 2.00 1.50 -4 -4 -28 1.90 1.80 4 4 28 2.70 1.50 4 4 28 1.50 1.50 -5 -4 -28 4.60 1.80 5 4 28 3.50 1.40 5 4 28 3.00 1.40 -6 -4 -28 11.80 2.20 6 4 28 15.30 2.40 -1 -5 -28 61.99 3.60 1 5 28 64.59 3.40 1 5 28 65.89 3.50 -2 -5 -28 17.60 3.00 2 5 28 18.00 2.30 2 5 28 21.70 2.70 -3 -5 -28 -0.50 2.00 3 5 28 -0.40 1.50 3 5 28 -0.90 1.50 -4 -5 -28 8.40 1.90 4 5 28 10.50 2.10 4 5 28 11.70 2.10 -5 -5 -28 1.60 1.70 5 5 28 1.40 1.60 5 5 28 -0.20 1.40 -6 -5 -28 6.00 2.00 -6 -5 -28 6.80 2.10 6 5 28 6.70 1.50 6 5 28 4.40 2.10 0 6 28 24.10 5.10 -1 -6 -28 -1.30 2.10 -1 -6 -28 1.50 1.70 1 6 28 0.60 1.80 1 6 28 -0.70 1.80 -2 -6 -28 21.60 2.60 2 6 28 15.90 2.40 2 6 28 20.30 2.70 -3 -6 -28 1.40 1.70 3 6 28 3.30 1.60 3 6 28 1.00 1.70 -4 -6 -28 31.40 3.00 4 6 28 28.70 2.40 4 6 28 32.10 2.50 -5 -6 -28 4.70 1.70 5 6 28 3.60 1.60 5 6 28 5.60 1.50 -6 -6 -28 5.40 2.10 6 6 28 5.30 1.60 6 6 28 3.60 1.70 -7 -6 -28 2.60 1.80 7 6 28 2.60 1.50 -1 -7 -28 0.10 1.50 -1 -7 -28 -2.10 1.80 1 7 28 -0.40 1.80 1 7 28 0.30 1.60 -2 -7 -28 66.69 3.90 2 7 28 72.39 3.50 2 7 28 68.69 3.50 -3 -7 -28 16.00 2.80 3 7 28 19.50 2.30 3 7 28 17.20 2.70 -4 -7 -28 25.20 2.50 4 7 28 25.50 2.30 4 7 28 23.30 2.60 -5 -7 -28 9.00 1.70 5 7 28 7.50 1.70 5 7 28 8.60 1.70 -6 -7 -28 3.10 1.70 6 7 28 2.30 1.70 6 7 28 2.20 1.60 -1 -8 -28 1.60 1.80 -1 -8 -28 1.30 1.70 1 8 28 2.10 1.70 -2 -8 -28 22.80 2.50 -2 -8 -28 20.70 2.30 2 8 28 22.70 2.50 2 8 28 22.80 3.00 -3 -8 -28 14.70 2.40 3 8 28 16.50 2.70 3 8 28 12.30 2.00 -4 -8 -28 50.09 3.30 4 8 28 52.79 3.30 4 8 28 55.69 3.30 -5 -8 -28 47.40 2.80 5 8 28 39.50 3.30 5 8 28 44.10 2.80 -6 -8 -28 3.80 2.80 6 8 28 5.50 2.30 6 8 28 1.90 1.90 -1 -9 -28 19.40 3.10 -1 -9 -28 27.90 2.50 1 9 28 23.70 2.60 -2 -9 -28 -0.80 1.70 -2 -9 -28 -0.20 1.50 2 9 28 0.90 1.90 -3 -9 -28 7.60 1.70 3 9 28 7.70 1.90 3 9 28 7.80 1.80 -4 -9 -28 22.70 2.30 4 9 28 17.30 3.10 4 9 28 19.50 2.50 -5 -9 -28 53.49 3.10 5 9 28 54.69 3.30 5 9 28 55.39 3.60 6 9 28 2.40 2.00 -2 -10 -28 28.00 2.60 -2 -10 -28 28.50 2.80 2 10 28 31.10 3.10 -3 -10 -28 14.40 2.20 3 10 28 6.70 2.30 -4 -10 -28 11.60 2.20 4 10 28 10.70 2.00 -5 -10 -28 31.10 2.50 5 10 28 31.80 2.90 0 0 0 0.00 0.00 _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' ; _shelx_hkl_checksum 73815 _olex2_submission_special_instructions 'No special instructions were received' loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' 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 Ru1 Ru 0.71327(2) 0.95302(2) 0.64503(2) 0.01221(3) Uani 1 1 d . . . . . Cl1 Cl 0.78581(4) 0.86650(2) 0.75516(2) 0.01854(7) Uani 1 1 d . . . . . Cl2 Cl 0.83066(3) 0.82908(2) 0.59171(2) 0.01792(7) Uani 1 1 d . . . . . S1 S 0.51596(3) 0.85541(2) 0.67186(2) 0.01583(7) Uani 1 1 d . . . . . O1 O 0.57671(12) 0.53379(8) 0.78976(7) 0.0246(2) Uani 1 1 d . . . . . N1 N 0.45096(12) 0.66866(9) 0.70596(7) 0.0171(2) Uani 1 1 d . . . . . H1 H 0.457164 0.606393 0.729982 0.021 Uiso 1 1 calc R U . . . N2 N 0.62305(12) 0.69825(9) 0.75224(7) 0.0164(2) Uani 1 1 d . . . . . H2 H 0.677499 0.741934 0.753430 0.020 Uiso 1 1 calc R U . . . C1 C 0.53132(14) 0.73285(10) 0.71127(8) 0.0143(2) Uani 1 1 d . . . . . C2 C 0.35459(14) 0.69552(10) 0.66314(8) 0.0161(3) Uani 1 1 d . . . . . C3 C 0.22790(15) 0.72301(11) 0.69209(8) 0.0187(3) Uani 1 1 d . . . . . H3 H 0.206542 0.729111 0.739055 0.022 Uiso 1 1 calc R U . . . C4 C 0.12960(15) 0.74217(11) 0.65185(9) 0.0201(3) Uani 1 1 d . . . . . H4 H 0.042391 0.762021 0.671553 0.024 Uiso 1 1 calc R U . . . C5 C 0.15978(15) 0.73218(11) 0.58455(9) 0.0196(3) Uani 1 1 d . . . . . H5 H 0.092405 0.743924 0.558326 0.024 Uiso 1 1 calc R U . . . C6 C 0.29013(15) 0.70453(10) 0.55318(8) 0.0175(3) Uani 1 1 d . . . . . C7 C 0.39088(14) 0.68748(10) 0.59270(8) 0.0166(3) Uani 1 1 d . . . . . C8 C 0.32336(17) 0.69231(12) 0.48408(9) 0.0233(3) Uani 1 1 d . . . . . H8 H 0.257263 0.703364 0.457098 0.028 Uiso 1 1 calc R U . . . C9 C 0.44962(19) 0.66477(13) 0.45567(10) 0.0285(3) Uani 1 1 d . . . . . H9 H 0.469987 0.655677 0.409582 0.034 Uiso 1 1 calc R U . . . C10 C 0.54952(18) 0.64982(14) 0.49440(10) 0.0296(4) Uani 1 1 d . . . . . H10 H 0.637185 0.631698 0.473899 0.036 Uiso 1 1 calc R U . . . C11 C 0.52146(16) 0.66116(12) 0.56124(9) 0.0226(3) Uani 1 1 d . . . . . H11 H 0.589817 0.651351 0.586709 0.027 Uiso 1 1 calc R U . . . C12 C 0.63871(15) 0.60221(10) 0.79170(8) 0.0167(3) Uani 1 1 d . . . . . C13 C 0.73695(15) 0.58865(11) 0.83805(8) 0.0173(3) Uani 1 1 d . . . . . H13A H 0.698848 0.542378 0.885381 0.021 Uiso 1 1 calc R U . . . H13B H 0.750220 0.652613 0.845184 0.021 Uiso 1 1 calc R U . . . C14 C 0.87245(15) 0.54938(11) 0.80641(8) 0.0175(3) Uani 1 1 d . . . . . H14A H 0.860628 0.484758 0.799907 0.021 Uiso 1 1 calc R U . . . H14B H 0.911740 0.595265 0.759102 0.021 Uiso 1 1 calc R U . . . C15 C 0.96634(15) 0.53846(11) 0.85604(8) 0.0182(3) Uani 1 1 d . . . . . H15A H 0.978544 0.603861 0.861202 0.022 Uiso 1 1 calc R U . . . H15B H 0.923512 0.495250 0.903774 0.022 Uiso 1 1 calc R U . . . C16 C 1.10323(15) 0.49623(11) 0.83089(8) 0.0195(3) Uani 1 1 d . . . . . H16A H 1.142828 0.535435 0.781316 0.023 Uiso 1 1 calc R U . . . H16B H 1.092291 0.427992 0.830626 0.023 Uiso 1 1 calc R U . . . C17 C 1.19914(16) 0.49587(12) 0.87779(9) 0.0237(3) Uani 1 1 d . . . . . H17A H 1.290536 0.481517 0.853278 0.028 Uiso 1 1 calc R U . . . H17B H 1.199953 0.562257 0.883662 0.028 Uiso 1 1 calc R U . . . C18 C 1.16238(17) 0.42084(14) 0.95129(10) 0.0284(3) Uani 1 1 d . . . . . H18A H 1.168375 0.354393 0.946111 0.043 Uiso 1 1 calc R U . . . H18B H 1.070930 0.433222 0.975358 0.043 Uiso 1 1 calc R U . . . H18C H 1.224214 0.426648 0.979666 0.043 Uiso 1 1 calc R U . . . C19 C 0.84510(14) 1.07853(10) 0.62661(8) 0.0153(2) Uani 1 1 d . . . . . C20 C 0.72032(14) 1.08553(10) 0.67546(8) 0.0163(3) Uani 1 1 d . . . . . H20 H 0.721045 1.091068 0.721021 0.020 Uiso 1 1 calc R U . . . C21 C 0.59690(14) 1.08444(10) 0.65776(8) 0.0170(3) Uani 1 1 d . . . . . H21 H 0.516020 1.090830 0.690756 0.020 Uiso 1 1 calc R U . . . C22 C 0.59307(14) 1.07373(10) 0.59026(8) 0.0166(3) Uani 1 1 d . . . . . C23 C 0.71498(14) 1.06218(10) 0.54312(8) 0.0166(3) Uani 1 1 d . . . . . H23 H 0.714088 1.051880 0.498966 0.020 Uiso 1 1 calc R U . . . C24 C 0.83963(14) 1.06580(10) 0.56105(8) 0.0163(3) Uani 1 1 d . . . . . H24 H 0.920478 1.059490 0.528002 0.020 Uiso 1 1 calc R U . . . C25 C 0.97418(15) 1.08222(11) 0.64820(8) 0.0187(3) Uani 1 1 d . . . . . H25 H 0.955540 1.058422 0.701465 0.022 Uiso 1 1 calc R U . . . C26 C 1.01991(18) 1.18923(12) 0.62432(11) 0.0292(4) Uani 1 1 d . . . . . H26A H 1.044712 1.212902 0.572083 0.044 Uiso 1 1 calc R U . . . H26B H 1.097318 1.193526 0.643221 0.044 Uiso 1 1 calc R U . . . H26C H 0.947003 1.229831 0.642338 0.044 Uiso 1 1 calc R U . . . C27 C 1.08425(16) 1.01743(13) 0.61900(11) 0.0283(4) Uani 1 1 d . . . . . H27A H 1.049497 0.951054 0.629992 0.042 Uiso 1 1 calc R U . . . H27B H 1.159651 1.014230 0.641080 0.042 Uiso 1 1 calc R U . . . H27C H 1.114236 1.045445 0.567181 0.042 Uiso 1 1 calc R U . . . C28 C 0.46149(15) 1.07260(12) 0.57145(9) 0.0228(3) Uani 1 1 d . . . . . H28A H 0.460427 1.018163 0.551431 0.034 Uiso 1 1 calc R U . . . H28B H 0.448987 1.134974 0.536193 0.034 Uiso 1 1 calc R U . . . H28C H 0.389125 1.063934 0.614461 0.034 Uiso 1 1 calc R U . . . Ru1B Ru 0.31240(2) 0.02350(2) 0.86756(2) 0.01115(3) Uani 1 1 d . . . . . Cl1B Cl 0.18948(3) 0.15075(2) 0.91511(2) 0.01431(6) Uani 1 1 d . . . . . Cl2B Cl 0.24513(3) 0.10322(2) 0.75450(2) 0.01531(6) Uani 1 1 d . . . . . S1B S 0.50986(3) 0.12294(2) 0.84107(2) 0.01386(6) Uani 1 1 d . . . . . O1B O 0.41293(11) 0.44129(8) 0.72733(6) 0.0198(2) Uani 1 1 d . . . . . N1B N 0.56076(12) 0.31419(8) 0.80601(7) 0.0143(2) Uani 1 1 d . . . . . H1B H 0.543427 0.375784 0.784658 0.017 Uiso 1 1 calc R U . . . N2B N 0.38804(12) 0.27421(9) 0.76558(7) 0.0155(2) Uani 1 1 d . . . . . H2B H 0.339462 0.226768 0.764648 0.019 Uiso 1 1 calc R U . . . C1B C 0.48561(13) 0.24520(10) 0.80273(7) 0.0128(2) Uani 1 1 d . . . . . C2B C 0.66804(13) 0.29595(10) 0.84171(8) 0.0138(2) Uani 1 1 d . . . . . C3B C 0.78796(14) 0.25950(10) 0.81213(8) 0.0172(3) Uani 1 1 d . . . . . H3B H 0.798000 0.241591 0.769545 0.021 Uiso 1 1 calc R U . . . C4B C 0.89635(14) 0.24864(10) 0.84500(9) 0.0188(3) Uani 1 1 d . . . . . H4B H 0.978769 0.222316 0.824978 0.023 Uiso 1 1 calc R U . . . C5B C 0.88282(14) 0.27597(10) 0.90564(8) 0.0178(3) Uani 1 1 d . . . . . H5B H 0.957044 0.270096 0.926616 0.021 Uiso 1 1 calc R U . . . C6B C 0.75975(14) 0.31295(10) 0.93768(8) 0.0158(3) Uani 1 1 d . . . . . C7B C 0.64879(14) 0.32149(10) 0.90605(8) 0.0140(2) Uani 1 1 d . . . . . C8B C 0.74259(16) 0.33971(11) 1.00152(8) 0.0203(3) Uani 1 1 d . . . . . H8B H 0.816348 0.335791 1.022564 0.024 Uiso 1 1 calc R U . . . C9B C 0.62118(17) 0.37106(12) 1.03304(9) 0.0232(3) Uani 1 1 d . . . . . H9B H 0.611000 0.388602 1.075776 0.028 Uiso 1 1 calc R U . . . C10B C 0.51086(16) 0.37736(12) 1.00207(9) 0.0225(3) Uani 1 1 d . . . . . H10B H 0.426446 0.398104 1.024676 0.027 Uiso 1 1 calc R U . . . C11B C 0.52420(14) 0.35395(11) 0.93999(8) 0.0175(3) Uani 1 1 d . . . . . H11B H 0.449436 0.359486 0.919461 0.021 Uiso 1 1 calc R U . . . C12B C 0.35596(14) 0.36843(10) 0.72934(7) 0.0146(2) Uani 1 1 d . . . . . C13B C 0.24502(14) 0.37027(10) 0.69231(8) 0.0166(3) Uani 1 1 d . . . . . H13C H 0.159158 0.356365 0.728396 0.020 Uiso 1 1 calc R U . . . H13D H 0.260894 0.317564 0.668671 0.020 Uiso 1 1 calc R U . . . C14B C 0.23446(15) 0.46835(11) 0.63705(8) 0.0175(3) Uani 1 1 d . . . . . H14C H 0.322325 0.484512 0.603005 0.021 Uiso 1 1 calc R U . . . H14D H 0.212202 0.520316 0.661281 0.021 Uiso 1 1 calc R U . . . C15B C 0.12890(15) 0.46837(11) 0.59570(8) 0.0181(3) Uani 1 1 d . . . . . H15C H 0.138130 0.529584 0.555392 0.022 Uiso 1 1 calc R U . . . H15D H 0.146911 0.412378 0.575334 0.022 Uiso 1 1 calc R U . . . C16B C -0.01402(16) 0.46110(13) 0.63956(8) 0.0226(3) Uani 1 1 d . . . . . H16C H -0.030298 0.513181 0.663783 0.027 Uiso 1 1 calc R U . . . H16D H -0.026763 0.396694 0.676803 0.027 Uiso 1 1 calc R U . . . C17B C -0.11532(16) 0.47172(13) 0.59425(9) 0.0240(3) Uani 1 1 d . . . . . H17C H -0.108310 0.538782 0.560340 0.029 Uiso 1 1 calc R U . . . H17D H -0.092273 0.424449 0.565951 0.029 Uiso 1 1 calc R U . . . C18B C -0.25859(18) 0.45432(18) 0.63701(11) 0.0381(5) Uani 1 1 d . . . . . H18D H -0.318316 0.465925 0.604402 0.057 Uiso 1 1 calc R U . . . H18E H -0.281725 0.499501 0.666296 0.057 Uiso 1 1 calc R U . . . H18F H -0.268364 0.386298 0.667980 0.057 Uiso 1 1 calc R U . . . C19B C 0.17907(14) -0.09945(10) 0.88530(8) 0.0146(2) Uani 1 1 d . . . . . C20B C 0.17972(14) -0.08456(10) 0.95096(8) 0.0151(2) Uani 1 1 d . . . . . H20B H 0.097489 -0.075082 0.981861 0.018 Uiso 1 1 calc R U . . . C21B C 0.30225(14) -0.08346(10) 0.97194(8) 0.0158(3) Uani 1 1 d . . . . . H21B H 0.300171 -0.073009 1.016412 0.019 Uiso 1 1 calc R U . . . C22B C 0.42640(14) -0.09775(10) 0.92726(8) 0.0162(3) Uani 1 1 d . . . . . C23B C 0.42660(14) -0.11057(10) 0.85995(8) 0.0170(3) Uani 1 1 d . . . . . H23B H 0.508886 -0.118779 0.828611 0.020 Uiso 1 1 calc R U . . . C24B C 0.30583(14) -0.11112(10) 0.83967(8) 0.0161(3) Uani 1 1 d . . . . . H24B H 0.308237 -0.119461 0.794516 0.019 Uiso 1 1 calc R U . . . C25B C 0.05260(15) -0.09942(10) 0.85992(8) 0.0172(3) Uani 1 1 d . . . . . H25B H 0.077307 -0.079674 0.806593 0.021 Uiso 1 1 calc R U . . . C26B C -0.00137(19) -0.20442(12) 0.88627(11) 0.0308(4) Uani 1 1 d . . . . . H26D H 0.069316 -0.249078 0.871767 0.046 Uiso 1 1 calc R U . . . H26E H -0.076883 -0.207114 0.865524 0.046 Uiso 1 1 calc R U . . . H26F H -0.031127 -0.224362 0.938411 0.046 Uiso 1 1 calc R U . . . C27B C -0.05418(16) -0.02770(12) 0.88259(10) 0.0241(3) Uani 1 1 d . . . . . H27D H -0.090092 -0.051070 0.934299 0.036 Uiso 1 1 calc R U . . . H27E H -0.126455 -0.023506 0.858166 0.036 Uiso 1 1 calc R U . . . H27F H -0.014512 0.037478 0.869833 0.036 Uiso 1 1 calc R U . . . C28B C 0.55585(15) -0.09802(11) 0.94844(9) 0.0214(3) Uani 1 1 d . . . . . H28D H 0.621739 -0.058438 0.907854 0.032 Uiso 1 1 calc R U . . . H28E H 0.588759 -0.165715 0.962917 0.032 Uiso 1 1 calc R U . . . H28F H 0.541658 -0.070089 0.988395 0.032 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 Ru1 0.01096(5) 0.01133(5) 0.01411(5) -0.00291(4) -0.00328(4) -0.00081(3) Cl1 0.02170(16) 0.01538(14) 0.01957(16) -0.00023(12) -0.01127(13) -0.00515(12) Cl2 0.01353(14) 0.01629(14) 0.02218(17) -0.00632(12) -0.00163(12) 0.00501(11) S1 0.01337(14) 0.01147(14) 0.02205(17) -0.00161(12) -0.00676(12) -0.00133(11) O1 0.0322(6) 0.0144(5) 0.0312(6) -0.0023(4) -0.0193(5) -0.0024(4) N1 0.0183(6) 0.0121(5) 0.0217(6) -0.0016(4) -0.0098(5) -0.0020(4) N2 0.0168(5) 0.0131(5) 0.0205(6) -0.0024(4) -0.0093(5) -0.0014(4) C1 0.0136(6) 0.0135(6) 0.0153(6) -0.0029(5) -0.0041(5) -0.0009(4) C2 0.0155(6) 0.0123(6) 0.0214(7) -0.0021(5) -0.0088(5) -0.0018(5) C3 0.0184(7) 0.0158(6) 0.0209(7) -0.0040(5) -0.0041(5) -0.0013(5) C4 0.0156(6) 0.0166(6) 0.0260(8) -0.0026(5) -0.0054(6) -0.0001(5) C5 0.0168(6) 0.0148(6) 0.0254(8) 0.0004(5) -0.0092(6) -0.0004(5) C6 0.0181(6) 0.0127(6) 0.0204(7) -0.0005(5) -0.0076(5) -0.0010(5) C7 0.0165(6) 0.0118(6) 0.0207(7) -0.0016(5) -0.0066(5) -0.0007(5) C8 0.0279(8) 0.0200(7) 0.0220(7) -0.0022(6) -0.0103(6) -0.0014(6) C9 0.0320(9) 0.0306(8) 0.0226(8) -0.0087(7) -0.0050(7) 0.0007(7) C10 0.0229(8) 0.0354(9) 0.0299(9) -0.0129(7) -0.0023(7) 0.0047(7) C11 0.0175(7) 0.0226(7) 0.0271(8) -0.0056(6) -0.0069(6) 0.0018(5) C12 0.0188(6) 0.0149(6) 0.0175(7) -0.0040(5) -0.0076(5) 0.0010(5) C13 0.0207(7) 0.0161(6) 0.0177(7) -0.0049(5) -0.0095(5) 0.0015(5) C14 0.0178(6) 0.0186(6) 0.0166(7) -0.0046(5) -0.0051(5) -0.0015(5) C15 0.0180(6) 0.0185(6) 0.0208(7) -0.0075(5) -0.0072(5) -0.0005(5) C16 0.0169(6) 0.0222(7) 0.0194(7) -0.0060(5) -0.0039(5) -0.0020(5) C17 0.0164(7) 0.0264(8) 0.0304(8) -0.0089(6) -0.0083(6) -0.0010(5) C18 0.0219(8) 0.0386(9) 0.0260(8) -0.0089(7) -0.0096(6) 0.0041(7) C19 0.0146(6) 0.0122(6) 0.0188(7) -0.0038(5) -0.0035(5) -0.0024(4) C20 0.0180(6) 0.0137(6) 0.0174(6) -0.0055(5) -0.0033(5) -0.0012(5) C21 0.0150(6) 0.0138(6) 0.0206(7) -0.0041(5) -0.0025(5) 0.0007(5) C22 0.0159(6) 0.0121(6) 0.0204(7) -0.0015(5) -0.0057(5) -0.0006(5) C23 0.0185(6) 0.0150(6) 0.0156(6) -0.0021(5) -0.0049(5) -0.0023(5) C24 0.0155(6) 0.0149(6) 0.0160(6) -0.0022(5) -0.0016(5) -0.0019(5) C25 0.0167(6) 0.0181(6) 0.0219(7) -0.0046(5) -0.0065(5) -0.0032(5) C26 0.0290(8) 0.0210(7) 0.0417(10) -0.0074(7) -0.0159(8) -0.0076(6) C27 0.0159(7) 0.0291(8) 0.0440(10) -0.0152(7) -0.0094(7) 0.0018(6) C28 0.0172(7) 0.0219(7) 0.0301(8) -0.0050(6) -0.0101(6) 0.0002(5) Ru1B 0.01101(5) 0.00993(5) 0.01234(5) -0.00237(4) -0.00321(4) -0.00110(3) Cl1B 0.01264(13) 0.01229(13) 0.01636(15) -0.00459(11) -0.00092(11) 0.00330(10) Cl2B 0.01808(15) 0.01316(13) 0.01533(15) -0.00106(11) -0.00773(12) -0.00416(11) S1B 0.01313(14) 0.01103(13) 0.01716(16) -0.00153(11) -0.00592(12) -0.00135(11) O1B 0.0216(5) 0.0132(4) 0.0273(6) -0.0031(4) -0.0132(4) -0.0019(4) N1B 0.0148(5) 0.0115(5) 0.0179(6) -0.0024(4) -0.0081(4) -0.0012(4) N2B 0.0170(5) 0.0123(5) 0.0186(6) -0.0012(4) -0.0098(5) -0.0030(4) C1B 0.0130(6) 0.0131(6) 0.0124(6) -0.0029(4) -0.0037(5) -0.0016(4) C2B 0.0126(6) 0.0115(5) 0.0174(6) -0.0017(5) -0.0064(5) -0.0017(4) C3B 0.0165(6) 0.0143(6) 0.0207(7) -0.0047(5) -0.0042(5) -0.0014(5) C4B 0.0127(6) 0.0148(6) 0.0258(7) -0.0020(5) -0.0039(5) 0.0000(5) C5B 0.0138(6) 0.0137(6) 0.0248(7) 0.0002(5) -0.0094(5) -0.0010(5) C6B 0.0158(6) 0.0118(6) 0.0193(7) -0.0003(5) -0.0082(5) -0.0020(5) C7B 0.0143(6) 0.0105(5) 0.0169(6) -0.0011(5) -0.0066(5) -0.0010(4) C8B 0.0237(7) 0.0180(6) 0.0206(7) -0.0012(5) -0.0123(6) -0.0028(5) C9B 0.0290(8) 0.0244(7) 0.0186(7) -0.0073(6) -0.0080(6) -0.0016(6) C10B 0.0210(7) 0.0243(7) 0.0233(8) -0.0092(6) -0.0047(6) 0.0019(6) C11B 0.0149(6) 0.0177(6) 0.0207(7) -0.0048(5) -0.0067(5) 0.0010(5) C12B 0.0154(6) 0.0142(6) 0.0140(6) -0.0022(5) -0.0054(5) -0.0004(5) C13B 0.0178(6) 0.0149(6) 0.0189(7) -0.0026(5) -0.0098(5) -0.0019(5) C14B 0.0197(7) 0.0161(6) 0.0171(7) -0.0011(5) -0.0092(5) -0.0020(5) C15B 0.0191(7) 0.0199(6) 0.0158(6) -0.0030(5) -0.0079(5) -0.0004(5) C16B 0.0200(7) 0.0311(8) 0.0167(7) -0.0064(6) -0.0064(6) 0.0030(6) C17B 0.0187(7) 0.0322(8) 0.0199(7) -0.0038(6) -0.0079(6) 0.0019(6) C18B 0.0188(8) 0.0600(13) 0.0302(9) -0.0057(9) -0.0070(7) 0.0050(8) C19B 0.0150(6) 0.0108(5) 0.0177(6) -0.0019(5) -0.0053(5) -0.0027(4) C20B 0.0143(6) 0.0127(6) 0.0159(6) -0.0011(5) -0.0025(5) -0.0031(4) C21B 0.0189(6) 0.0128(6) 0.0147(6) -0.0008(5) -0.0054(5) -0.0028(5) C22B 0.0169(6) 0.0096(5) 0.0210(7) -0.0005(5) -0.0071(5) -0.0008(4) C23B 0.0158(6) 0.0128(6) 0.0214(7) -0.0048(5) -0.0033(5) 0.0011(5) C24B 0.0194(6) 0.0118(6) 0.0180(7) -0.0051(5) -0.0043(5) -0.0011(5) C25B 0.0173(6) 0.0153(6) 0.0196(7) -0.0030(5) -0.0072(5) -0.0033(5) C26B 0.0347(9) 0.0181(7) 0.0443(11) -0.0003(7) -0.0263(8) -0.0085(6) C27B 0.0166(7) 0.0257(8) 0.0314(9) -0.0091(6) -0.0078(6) 0.0011(6) C28B 0.0168(6) 0.0186(7) 0.0286(8) -0.0024(6) -0.0108(6) 0.0006(5) 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' Cl Cl 0.1484 0.1585 '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' Ru Ru -1.2594 0.8363 '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 _geom_angle_publ_flag Cl2 Ru1 Cl1 88.604(13) . . ? S1 Ru1 Cl1 96.177(12) . . ? S1 Ru1 Cl2 85.924(13) . . ? C19 Ru1 Cl1 90.27(4) . . ? C19 Ru1 Cl2 111.56(4) . . ? C19 Ru1 S1 161.56(4) . . ? C19 Ru1 C22 81.07(5) . . ? C20 Ru1 Cl1 85.80(4) . . ? C20 Ru1 Cl2 149.03(4) . . ? C20 Ru1 S1 124.95(4) . . ? C20 Ru1 C19 38.19(5) . . ? C20 Ru1 C21 37.66(5) . . ? C20 Ru1 C22 68.16(5) . . ? C20 Ru1 C23 80.66(5) . . ? C20 Ru1 C24 67.84(6) . . ? C21 Ru1 Cl1 110.15(4) . . ? C21 Ru1 Cl2 161.21(4) . . ? C21 Ru1 S1 92.99(4) . . ? C21 Ru1 C19 68.57(5) . . ? C21 Ru1 C22 37.78(6) . . ? C22 Ru1 Cl1 147.64(4) . . ? C22 Ru1 Cl2 123.61(4) . . ? C22 Ru1 S1 84.31(4) . . ? C23 Ru1 Cl1 158.14(4) . . ? C23 Ru1 Cl2 94.21(4) . . ? C23 Ru1 S1 105.64(4) . . ? C23 Ru1 C19 68.52(5) . . ? C23 Ru1 C21 67.99(6) . . ? C23 Ru1 C22 37.50(5) . . ? C23 Ru1 C24 38.31(5) . . ? C24 Ru1 Cl1 120.24(4) . . ? C24 Ru1 Cl2 89.19(4) . . ? C24 Ru1 S1 143.13(4) . . ? C24 Ru1 C19 37.27(5) . . ? C24 Ru1 C21 80.44(5) . . ? C24 Ru1 C22 68.29(5) . . ? C1 S1 Ru1 116.03(5) . . ? C1 N1 H1 118.3 . . ? C1 N1 C2 123.34(12) . . ? C2 N1 H1 118.3 . . ? C1 N2 H2 116.6 . . ? C1 N2 C12 126.87(12) . . ? C12 N2 H2 116.6 . . ? N1 C1 S1 120.75(10) . . ? N1 C1 N2 118.32(12) . . ? N2 C1 S1 120.85(10) . . ? C3 C2 N1 119.71(14) . . ? C3 C2 C7 121.67(13) . . ? C7 C2 N1 118.53(13) . . ? C2 C3 H3 120.1 . . ? C2 C3 C4 119.86(14) . . ? C4 C3 H3 120.1 . . ? C3 C4 H4 119.9 . . ? C5 C4 C3 120.11(14) . . ? C5 C4 H4 119.9 . . ? C4 C5 H5 119.4 . . ? C4 C5 C6 121.16(14) . . ? C6 C5 H5 119.4 . . ? C5 C6 C7 119.11(14) . . ? C8 C6 C5 122.25(14) . . ? C8 C6 C7 118.63(14) . . ? C2 C7 C6 118.03(13) . . ? C11 C7 C2 122.68(13) . . ? C11 C7 C6 119.28(14) . . ? C6 C8 H8 119.6 . . ? C9 C8 C6 120.78(15) . . ? C9 C8 H8 119.6 . . ? C8 C9 H9 119.8 . . ? C8 C9 C10 120.37(16) . . ? C10 C9 H9 119.8 . . ? C9 C10 H10 119.7 . . ? C11 C10 C9 120.60(16) . . ? C11 C10 H10 119.7 . . ? C7 C11 H11 119.8 . . ? C10 C11 C7 120.31(15) . . ? C10 C11 H11 119.8 . . ? O1 C12 N2 122.65(13) . . ? O1 C12 C13 122.70(13) . . ? N2 C12 C13 114.65(12) . . ? C12 C13 H13A 109.0 . . ? C12 C13 H13B 109.0 . . ? C12 C13 C14 113.11(12) . . ? H13A C13 H13B 107.8 . . ? C14 C13 H13A 109.0 . . ? C14 C13 H13B 109.0 . . ? C13 C14 H14A 109.7 . . ? C13 C14 H14B 109.7 . . ? H14A C14 H14B 108.2 . . ? C15 C14 C13 109.92(12) . . ? C15 C14 H14A 109.7 . . ? C15 C14 H14B 109.7 . . ? C14 C15 H15A 108.7 . . ? C14 C15 H15B 108.7 . . ? H15A C15 H15B 107.6 . . ? C16 C15 C14 114.37(13) . . ? C16 C15 H15A 108.7 . . ? C16 C15 H15B 108.7 . . ? C15 C16 H16A 109.0 . . ? C15 C16 H16B 109.0 . . ? C15 C16 C17 112.92(13) . . ? H16A C16 H16B 107.8 . . ? C17 C16 H16A 109.0 . . ? C17 C16 H16B 109.0 . . ? C16 C17 H17A 108.9 . . ? C16 C17 H17B 108.9 . . ? H17A C17 H17B 107.7 . . ? C18 C17 C16 113.30(13) . . ? C18 C17 H17A 108.9 . . ? C18 C17 H17B 108.9 . . ? C17 C18 H18A 109.5 . . ? C17 C18 H18B 109.5 . . ? C17 C18 H18C 109.5 . . ? H18A C18 H18B 109.5 . . ? H18A C18 H18C 109.5 . . ? H18B C18 H18C 109.5 . . ? C20 C19 Ru1 69.03(8) . . ? C20 C19 C25 119.32(13) . . ? C24 C19 Ru1 69.96(8) . . ? C24 C19 C20 117.31(13) . . ? C24 C19 C25 123.34(13) . . ? C25 C19 Ru1 130.83(10) . . ? Ru1 C20 H20 128.3 . . ? C19 C20 Ru1 72.78(8) . . ? C19 C20 H20 119.1 . . ? C21 C20 Ru1 72.17(8) . . ? C21 C20 C19 121.86(13) . . ? C21 C20 H20 119.1 . . ? Ru1 C21 H21 130.4 . . ? C20 C21 Ru1 70.18(8) . . ? C20 C21 H21 119.9 . . ? C20 C21 C22 120.13(13) . . ? C22 C21 Ru1 72.04(8) . . ? C22 C21 H21 119.9 . . ? C21 C22 Ru1 70.18(8) . . ? C21 C22 C28 120.07(14) . . ? C23 C22 Ru1 69.46(8) . . ? C23 C22 C21 118.47(13) . . ? C23 C22 C28 121.44(14) . . ? C28 C22 Ru1 131.21(10) . . ? Ru1 C23 H23 128.4 . . ? C22 C23 Ru1 73.04(8) . . ? C22 C23 H23 119.6 . . ? C22 C23 C24 120.78(13) . . ? C24 C23 Ru1 71.20(8) . . ? C24 C23 H23 119.6 . . ? Ru1 C24 H24 130.0 . . ? C19 C24 Ru1 72.77(8) . . ? C19 C24 C23 121.35(13) . . ? C19 C24 H24 119.3 . . ? C23 C24 Ru1 70.49(8) . . ? C23 C24 H24 119.3 . . ? C19 C25 H25 107.9 . . ? C19 C25 C26 108.79(12) . . ? C19 C25 C27 113.38(13) . . ? C26 C25 H25 107.9 . . ? C27 C25 H25 107.9 . . ? C27 C25 C26 110.78(14) . . ? C25 C26 H26A 109.5 . . ? C25 C26 H26B 109.5 . . ? C25 C26 H26C 109.5 . . ? H26A C26 H26B 109.5 . . ? H26A C26 H26C 109.5 . . ? H26B C26 H26C 109.5 . . ? C25 C27 H27A 109.5 . . ? C25 C27 H27B 109.5 . . ? C25 C27 H27C 109.5 . . ? H27A C27 H27B 109.5 . . ? H27A C27 H27C 109.5 . . ? H27B C27 H27C 109.5 . . ? C22 C28 H28A 109.5 . . ? C22 C28 H28B 109.5 . . ? C22 C28 H28C 109.5 . . ? H28A C28 H28B 109.5 . . ? H28A C28 H28C 109.5 . . ? H28B C28 H28C 109.5 . . ? Cl1B Ru1B Cl2B 88.460(12) . . ? S1B Ru1B Cl1B 86.282(12) . . ? S1B Ru1B Cl2B 96.631(12) . . ? C19B Ru1B Cl1B 110.30(4) . . ? C19B Ru1B Cl2B 88.30(4) . . ? C19B Ru1B S1B 162.88(4) . . ? C19B Ru1B C22B 81.35(5) . . ? C20B Ru1B Cl1B 88.35(4) . . ? C20B Ru1B Cl2B 118.65(4) . . ? C20B Ru1B S1B 144.15(4) . . ? C20B Ru1B C19B 37.56(5) . . ? C20B Ru1B C21B 38.40(5) . . ? C20B Ru1B C22B 68.54(5) . . ? C20B Ru1B C23B 80.70(5) . . ? C21B Ru1B Cl1B 94.72(4) . . ? C21B Ru1B Cl2B 156.45(4) . . ? C21B Ru1B S1B 106.85(4) . . ? C21B Ru1B C19B 68.69(5) . . ? C21B Ru1B C22B 37.44(5) . . ? C21B Ru1B C23B 67.78(6) . . ? C22B Ru1B Cl1B 124.56(4) . . ? C22B Ru1B Cl2B 146.96(4) . . ? C22B Ru1B S1B 85.71(4) . . ? C23B Ru1B Cl1B 161.88(4) . . ? C23B Ru1B Cl2B 109.45(4) . . ? C23B Ru1B S1B 94.14(4) . . ? C23B Ru1B C19B 68.79(5) . . ? C23B Ru1B C22B 37.66(6) . . ? C24B Ru1B Cl1B 147.83(4) . . ? C24B Ru1B Cl2B 84.44(4) . . ? C24B Ru1B S1B 125.66(4) . . ? C24B Ru1B C19B 38.33(5) . . ? C24B Ru1B C20B 68.10(5) . . ? C24B Ru1B C21B 80.48(5) . . ? C24B Ru1B C22B 68.05(5) . . ? C24B Ru1B C23B 37.61(5) . . ? C1B S1B Ru1B 113.51(5) . . ? C1B N1B H1B 117.6 . . ? C1B N1B C2B 124.86(11) . . ? C2B N1B H1B 117.6 . . ? C1B N2B H2B 115.8 . . ? C1B N2B C12B 128.30(12) . . ? C12B N2B H2B 115.8 . . ? N1B C1B S1B 122.26(10) . . ? N1B C1B N2B 118.00(12) . . ? N2B C1B S1B 119.72(10) . . ? C3B C2B N1B 120.42(13) . . ? C3B C2B C7B 121.46(13) . . ? C7B C2B N1B 118.04(12) . . ? C2B C3B H3B 120.0 . . ? C2B C3B C4B 120.00(14) . . ? C4B C3B H3B 120.0 . . ? C3B C4B H4B 120.0 . . ? C5B C4B C3B 120.09(14) . . ? C5B C4B H4B 120.0 . . ? C4B C5B H5B 119.5 . . ? C4B C5B C6B 121.06(13) . . ? C6B C5B H5B 119.5 . . ? C5B C6B C7B 119.23(13) . . ? C5B C6B C8B 122.01(13) . . ? C8B C6B C7B 118.75(13) . . ? C2B C7B C6B 118.09(13) . . ? C11B C7B C2B 122.75(12) . . ? C11B C7B C6B 119.16(13) . . ? C6B C8B H8B 119.6 . . ? C9B C8B C6B 120.83(14) . . ? C9B C8B H8B 119.6 . . ? C8B C9B H9B 120.0 . . ? C8B C9B C10B 120.03(15) . . ? C10B C9B H9B 120.0 . . ? C9B C10B H10B 119.6 . . ? C11B C10B C9B 120.78(15) . . ? C11B C10B H10B 119.6 . . ? C7B C11B H11B 119.8 . . ? C10B C11B C7B 120.43(13) . . ? C10B C11B H11B 119.8 . . ? O1B C12B N2B 123.00(13) . . ? O1B C12B C13B 124.40(12) . . ? N2B C12B C13B 112.59(12) . . ? C12B C13B H13C 109.1 . . ? C12B C13B H13D 109.1 . . ? C12B C13B C14B 112.65(11) . . ? H13C C13B H13D 107.8 . . ? C14B C13B H13C 109.1 . . ? C14B C13B H13D 109.1 . . ? C13B C14B H14C 109.0 . . ? C13B C14B H14D 109.0 . . ? C13B C14B C15B 112.91(12) . . ? H14C C14B H14D 107.8 . . ? C15B C14B H14C 109.0 . . ? C15B C14B H14D 109.0 . . ? C14B C15B H15C 108.6 . . ? C14B C15B H15D 108.6 . . ? H15C C15B H15D 107.6 . . ? C16B C15B C14B 114.66(13) . . ? C16B C15B H15C 108.6 . . ? C16B C15B H15D 108.6 . . ? C15B C16B H16C 109.1 . . ? C15B C16B H16D 109.1 . . ? C15B C16B C17B 112.38(13) . . ? H16C C16B H16D 107.9 . . ? C17B C16B H16C 109.1 . . ? C17B C16B H16D 109.1 . . ? C16B C17B H17C 108.8 . . ? C16B C17B H17D 108.8 . . ? H17C C17B H17D 107.6 . . ? C18B C17B C16B 114.01(14) . . ? C18B C17B H17C 108.8 . . ? C18B C17B H17D 108.8 . . ? C17B C18B H18D 109.5 . . ? C17B C18B H18E 109.5 . . ? C17B C18B H18F 109.5 . . ? H18D C18B H18E 109.5 . . ? H18D C18B H18F 109.5 . . ? H18E C18B H18F 109.5 . . ? C20B C19B Ru1B 70.07(8) . . ? C20B C19B C24B 117.46(12) . . ? C20B C19B C25B 123.26(13) . . ? C24B C19B Ru1B 69.58(8) . . ? C24B C19B C25B 119.23(13) . . ? C25B C19B Ru1B 129.44(9) . . ? Ru1B C20B H20B 129.5 . . ? C19B C20B Ru1B 72.37(8) . . ? C19B C20B H20B 119.4 . . ? C19B C20B C21B 121.11(13) . . ? C21B C20B Ru1B 71.20(8) . . ? C21B C20B H20B 119.4 . . ? Ru1B C21B H21B 129.6 . . ? C20B C21B Ru1B 70.40(8) . . ? C20B C21B H21B 119.6 . . ? C22B C21B Ru1B 72.94(8) . . ? C22B C21B C20B 120.84(13) . . ? C22B C21B H21B 119.6 . . ? C21B C22B Ru1B 69.62(8) . . ? C21B C22B C23B 118.28(13) . . ? C21B C22B C28B 121.81(14) . . ? C23B C22B Ru1B 69.93(8) . . ? C23B C22B C28B 119.90(14) . . ? C28B C22B Ru1B 131.52(10) . . ? Ru1B C23B H23B 130.2 . . ? C22B C23B Ru1B 72.41(8) . . ? C22B C23B H23B 119.8 . . ? C24B C23B Ru1B 70.24(8) . . ? C24B C23B C22B 120.46(13) . . ? C24B C23B H23B 119.8 . . ? Ru1B C24B H24B 129.1 . . ? C19B C24B Ru1B 72.10(8) . . ? C19B C24B H24B 119.1 . . ? C23B C24B Ru1B 72.15(8) . . ? C23B C24B C19B 121.80(13) . . ? C23B C24B H24B 119.1 . . ? C19B C25B H25B 107.7 . . ? C19B C25B C26B 108.53(12) . . ? C19B C25B C27B 113.83(12) . . ? C26B C25B H25B 107.7 . . ? C27B C25B H25B 107.7 . . ? C27B C25B C26B 111.05(14) . . ? C25B C26B H26D 109.5 . . ? C25B C26B H26E 109.5 . . ? C25B C26B H26F 109.5 . . ? H26D C26B H26E 109.5 . . ? H26D C26B H26F 109.5 . . ? H26E C26B H26F 109.5 . . ? C25B C27B H27D 109.5 . . ? C25B C27B H27E 109.5 . . ? C25B C27B H27F 109.5 . . ? H27D C27B H27E 109.5 . . ? H27D C27B H27F 109.5 . . ? H27E C27B H27F 109.5 . . ? C22B C28B H28D 109.5 . . ? C22B C28B H28E 109.5 . . ? C22B C28B H28F 109.5 . . ? H28D C28B H28E 109.5 . . ? H28D C28B H28F 109.5 . . ? H28E C28B H28F 109.5 . . ? 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 Ru1 Cl1 2.4614(4) . ? Ru1 Cl2 2.4363(3) . ? Ru1 S1 2.4128(4) . ? Ru1 C19 2.2181(13) . ? Ru1 C20 2.1684(14) . ? Ru1 C21 2.1942(14) . ? Ru1 C22 2.2188(14) . ? Ru1 C23 2.1722(14) . ? Ru1 C24 2.1816(14) . ? S1 C1 1.7007(14) . ? O1 C12 1.2228(18) . ? N1 H1 0.8800 . ? N1 C1 1.3260(17) . ? N1 C2 1.4319(18) . ? N2 H2 0.8800 . ? N2 C1 1.3757(18) . ? N2 C12 1.3811(18) . ? C2 C3 1.375(2) . ? C2 C7 1.419(2) . ? C3 H3 0.9500 . ? C3 C4 1.412(2) . ? C4 H4 0.9500 . ? C4 C5 1.368(2) . ? C5 H5 0.9500 . ? C5 C6 1.421(2) . ? C6 C7 1.425(2) . ? C6 C8 1.416(2) . ? C7 C11 1.417(2) . ? C8 H8 0.9500 . ? C8 C9 1.369(2) . ? C9 H9 0.9500 . ? C9 C10 1.409(3) . ? C10 H10 0.9500 . ? C10 C11 1.367(2) . ? C11 H11 0.9500 . ? C12 C13 1.5072(19) . ? C13 H13A 0.9900 . ? C13 H13B 0.9900 . ? C13 C14 1.529(2) . ? C14 H14A 0.9900 . ? C14 H14B 0.9900 . ? C14 C15 1.527(2) . ? C15 H15A 0.9900 . ? C15 H15B 0.9900 . ? C15 C16 1.523(2) . ? C16 H16A 0.9900 . ? C16 H16B 0.9900 . ? C16 C17 1.529(2) . ? C17 H17A 0.9900 . ? C17 H17B 0.9900 . ? C17 C18 1.524(2) . ? C18 H18A 0.9800 . ? C18 H18B 0.9800 . ? C18 H18C 0.9800 . ? C19 C20 1.436(2) . ? C19 C24 1.406(2) . ? C19 C25 1.510(2) . ? C20 H20 0.9500 . ? C20 C21 1.408(2) . ? C21 H21 0.9500 . ? C21 C22 1.429(2) . ? C22 C23 1.412(2) . ? C22 C28 1.500(2) . ? C23 H23 0.9500 . ? C23 C24 1.429(2) . ? C24 H24 0.9500 . ? C25 H25 1.0000 . ? C25 C26 1.529(2) . ? C25 C27 1.527(2) . ? C26 H26A 0.9800 . ? C26 H26B 0.9800 . ? C26 H26C 0.9800 . ? C27 H27A 0.9800 . ? C27 H27B 0.9800 . ? C27 H27C 0.9800 . ? C28 H28A 0.9800 . ? C28 H28B 0.9800 . ? C28 H28C 0.9800 . ? Ru1B Cl1B 2.4350(3) . ? Ru1B Cl2B 2.4675(3) . ? Ru1B S1B 2.4302(3) . ? Ru1B C19B 2.2018(13) . ? Ru1B C20B 2.1720(14) . ? Ru1B C21B 2.1826(14) . ? Ru1B C22B 2.2258(14) . ? Ru1B C23B 2.1932(14) . ? Ru1B C24B 2.1685(14) . ? S1B C1B 1.7072(14) . ? O1B C12B 1.2183(17) . ? N1B H1B 0.8800 . ? N1B C1B 1.3255(17) . ? N1B C2B 1.4320(17) . ? N2B H2B 0.8800 . ? N2B C1B 1.3673(17) . ? N2B C12B 1.3811(17) . ? C2B C3B 1.373(2) . ? C2B C7B 1.419(2) . ? C3B H3B 0.9500 . ? C3B C4B 1.412(2) . ? C4B H4B 0.9500 . ? C4B C5B 1.368(2) . ? C5B H5B 0.9500 . ? C5B C6B 1.418(2) . ? C6B C7B 1.4239(18) . ? C6B C8B 1.421(2) . ? C7B C11B 1.417(2) . ? C8B H8B 0.9500 . ? C8B C9B 1.368(2) . ? C9B H9B 0.9500 . ? C9B C10B 1.414(2) . ? C10B H10B 0.9500 . ? C10B C11B 1.367(2) . ? C11B H11B 0.9500 . ? C12B C13B 1.5093(19) . ? C13B H13C 0.9900 . ? C13B H13D 0.9900 . ? C13B C14B 1.5193(19) . ? C14B H14C 0.9900 . ? C14B H14D 0.9900 . ? C14B C15B 1.5279(19) . ? C15B H15C 0.9900 . ? C15B H15D 0.9900 . ? C15B C16B 1.517(2) . ? C16B H16C 0.9900 . ? C16B H16D 0.9900 . ? C16B C17B 1.523(2) . ? C17B H17C 0.9900 . ? C17B H17D 0.9900 . ? C17B C18B 1.516(2) . ? C18B H18D 0.9800 . ? C18B H18E 0.9800 . ? C18B H18F 0.9800 . ? C19B C20B 1.408(2) . ? C19B C24B 1.435(2) . ? C19B C25B 1.5157(19) . ? C20B H20B 0.9500 . ? C20B C21B 1.4322(19) . ? C21B H21B 0.9500 . ? C21B C22B 1.416(2) . ? C22B C23B 1.427(2) . ? C22B C28B 1.500(2) . ? C23B H23B 0.9500 . ? C23B C24B 1.406(2) . ? C24B H24B 0.9500 . ? C25B H25B 1.0000 . ? C25B C26B 1.529(2) . ? C25B C27B 1.527(2) . ? C26B H26D 0.9800 . ? C26B H26E 0.9800 . ? C26B H26F 0.9800 . ? C27B H27D 0.9800 . ? C27B H27E 0.9800 . ? C27B H27F 0.9800 . ? C28B H28D 0.9800 . ? C28B H28E 0.9800 . ? C28B H28F 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 _geom_torsion_publ_flag Ru1 S1 C1 N1 -156.16(10) . . . . ? Ru1 S1 C1 N2 26.97(14) . . . . ? Ru1 C19 C20 C21 -55.24(12) . . . . ? Ru1 C19 C24 C23 53.24(12) . . . . ? Ru1 C19 C25 C26 -177.56(12) . . . . ? Ru1 C19 C25 C27 58.70(19) . . . . ? Ru1 C20 C21 C22 -53.97(12) . . . . ? Ru1 C21 C22 C23 -51.70(11) . . . . ? Ru1 C21 C22 C28 126.91(13) . . . . ? Ru1 C22 C23 C24 -54.98(12) . . . . ? Ru1 C23 C24 C19 -54.28(12) . . . . ? O1 C12 C13 C14 78.97(19) . . . . ? N1 C2 C3 C4 -175.10(13) . . . . ? N1 C2 C7 C6 173.60(12) . . . . ? N1 C2 C7 C11 -4.9(2) . . . . ? N2 C12 C13 C14 -101.79(15) . . . . ? C1 N1 C2 C3 -88.91(18) . . . . ? C1 N1 C2 C7 94.65(17) . . . . ? C1 N2 C12 O1 6.1(2) . . . . ? C1 N2 C12 C13 -173.14(14) . . . . ? C2 N1 C1 S1 5.1(2) . . . . ? C2 N1 C1 N2 -177.97(14) . . . . ? C2 C3 C4 C5 0.8(2) . . . . ? C2 C7 C11 C10 176.83(15) . . . . ? C3 C2 C7 C6 -2.8(2) . . . . ? C3 C2 C7 C11 178.73(14) . . . . ? C3 C4 C5 C6 -1.3(2) . . . . ? C4 C5 C6 C7 -0.3(2) . . . . ? C4 C5 C6 C8 179.06(14) . . . . ? C5 C6 C7 C2 2.3(2) . . . . ? C5 C6 C7 C11 -179.18(13) . . . . ? C5 C6 C8 C9 -179.41(15) . . . . ? C6 C7 C11 C10 -1.7(2) . . . . ? C6 C8 C9 C10 -1.2(3) . . . . ? C7 C2 C3 C4 1.2(2) . . . . ? C7 C6 C8 C9 0.0(2) . . . . ? C8 C6 C7 C2 -177.11(13) . . . . ? C8 C6 C7 C11 1.4(2) . . . . ? C8 C9 C10 C11 1.0(3) . . . . ? C9 C10 C11 C7 0.5(3) . . . . ? C12 N2 C1 S1 174.41(12) . . . . ? C12 N2 C1 N1 -2.5(2) . . . . ? C12 C13 C14 C15 179.57(12) . . . . ? C13 C14 C15 C16 177.94(12) . . . . ? C14 C15 C16 C17 174.26(13) . . . . ? C15 C16 C17 C18 70.73(18) . . . . ? C19 C20 C21 Ru1 55.52(12) . . . . ? C19 C20 C21 C22 1.5(2) . . . . ? C20 C19 C24 Ru1 -51.89(11) . . . . ? C20 C19 C24 C23 1.4(2) . . . . ? C20 C19 C25 C26 -90.84(17) . . . . ? C20 C19 C25 C27 145.43(14) . . . . ? C20 C21 C22 Ru1 53.11(12) . . . . ? C20 C21 C22 C23 1.4(2) . . . . ? C20 C21 C22 C28 -179.98(13) . . . . ? C21 C22 C23 Ru1 52.04(11) . . . . ? C21 C22 C23 C24 -2.9(2) . . . . ? C22 C23 C24 Ru1 55.84(12) . . . . ? C22 C23 C24 C19 1.6(2) . . . . ? C24 C19 C20 Ru1 52.34(11) . . . . ? C24 C19 C20 C21 -2.9(2) . . . . ? C24 C19 C25 C26 90.93(17) . . . . ? C24 C19 C25 C27 -32.8(2) . . . . ? C25 C19 C20 Ru1 -126.00(12) . . . . ? C25 C19 C20 C21 178.75(13) . . . . ? C25 C19 C24 Ru1 126.38(13) . . . . ? C25 C19 C24 C23 179.62(13) . . . . ? C28 C22 C23 Ru1 -126.55(13) . . . . ? C28 C22 C23 C24 178.47(13) . . . . ? Ru1B S1B C1B N1B 156.80(10) . . . . ? Ru1B S1B C1B N2B -24.94(13) . . . . ? Ru1B C19B C20B C21B -54.07(11) . . . . ? Ru1B C19B C24B C23B 54.59(12) . . . . ? Ru1B C19B C25B C26B 179.46(12) . . . . ? Ru1B C19B C25B C27B -56.33(18) . . . . ? Ru1B C20B C21B C22B -54.87(12) . . . . ? Ru1B C21B C22B C23B -52.00(11) . . . . ? Ru1B C21B C22B C28B 126.99(13) . . . . ? Ru1B C22B C23B C24B -53.28(12) . . . . ? Ru1B C23B C24B C19B -54.57(12) . . . . ? O1B C12B C13B C14B 14.6(2) . . . . ? N1B C2B C3B C4B 175.29(12) . . . . ? N1B C2B C7B C6B -173.61(12) . . . . ? N1B C2B C7B C11B 6.99(19) . . . . ? N2B C12B C13B C14B -164.60(13) . . . . ? C1B N1B C2B C3B 74.86(19) . . . . ? C1B N1B C2B C7B -108.42(16) . . . . ? C1B N2B C12B O1B -1.5(2) . . . . ? C1B N2B C12B C13B 177.71(14) . . . . ? C2B N1B C1B S1B -0.7(2) . . . . ? C2B N1B C1B N2B -178.99(13) . . . . ? C2B C3B C4B C5B -1.1(2) . . . . ? C2B C7B C11B C10B 179.79(14) . . . . ? C3B C2B C7B C6B 3.1(2) . . . . ? C3B C2B C7B C11B -176.32(13) . . . . ? C3B C4B C5B C6B 1.7(2) . . . . ? C4B C5B C6B C7B 0.1(2) . . . . ? C4B C5B C6B C8B 178.57(14) . . . . ? C5B C6B C7B C2B -2.42(19) . . . . ? C5B C6B C7B C11B 176.99(13) . . . . ? C5B C6B C8B C9B -177.07(14) . . . . ? C6B C7B C11B C10B 0.4(2) . . . . ? C6B C8B C9B C10B -0.1(2) . . . . ? C7B C2B C3B C4B -1.3(2) . . . . ? C7B C6B C8B C9B 1.4(2) . . . . ? C8B C6B C7B C2B 179.03(12) . . . . ? C8B C6B C7B C11B -1.55(19) . . . . ? C8B C9B C10B C11B -1.1(2) . . . . ? C9B C10B C11B C7B 0.9(2) . . . . ? C12B N2B C1B S1B -177.90(12) . . . . ? C12B N2B C1B N1B 0.4(2) . . . . ? C12B C13B C14B C15B 175.95(13) . . . . ? C13B C14B C15B C16B 68.17(17) . . . . ? C14B C15B C16B C17B 174.29(13) . . . . ? C15B C16B C17B C18B 173.96(16) . . . . ? C19B C20B C21B Ru1B 54.61(12) . . . . ? C19B C20B C21B C22B -0.3(2) . . . . ? C20B C19B C24B Ru1B -52.88(11) . . . . ? C20B C19B C24B C23B 1.7(2) . . . . ? C20B C19B C25B C26B -89.87(17) . . . . ? C20B C19B C25B C27B 34.33(19) . . . . ? C20B C21B C22B Ru1B 53.70(11) . . . . ? C20B C21B C22B C23B 1.7(2) . . . . ? C20B C21B C22B C28B -179.31(13) . . . . ? C21B C22B C23B Ru1B 51.86(11) . . . . ? C21B C22B C23B C24B -1.4(2) . . . . ? C22B C23B C24B Ru1B 54.28(12) . . . . ? C22B C23B C24B C19B -0.3(2) . . . . ? C24B C19B C20B Ru1B 52.65(11) . . . . ? C24B C19B C20B C21B -1.43(19) . . . . ? C24B C19B C25B C26B 92.76(17) . . . . ? C24B C19B C25B C27B -143.04(14) . . . . ? C25B C19B C20B Ru1B -124.77(13) . . . . ? C25B C19B C20B C21B -178.84(12) . . . . ? C25B C19B C24B Ru1B 124.64(12) . . . . ? C25B C19B C24B C23B 179.23(12) . . . . ? C28B C22B C23B Ru1B -127.16(12) . . . . ? C28B C22B C23B C24B 179.56(13) . . . . ?