# Electronic Supplementary Material (ESI) for Dalton Transactions # This journal is © The Royal Society of Chemistry 2014 ####################################################################### # # Cambridge Crystallographic Data Centre # CCDC # ####################################################################### # # This CIF contains data from an original supplementary publication # deposited with the CCDC, and may include chemical, crystal, # experimental, refinement, atomic coordinates, # anisotropic displacement parameters and molecular geometry data, # as required by the journal to which it was submitted. # # This CIF is provided on the understanding that it is used for bona # fide research purposes only. It may contain copyright material # of the CCDC or of third parties, and may not be copied or further # disseminated in any form, whether machine-readable or not, # except for the purpose of generating routine backup copies # on your local computer system. # # For further information on the CCDC, data deposition and # data retrieval see: # www.ccdc.cam.ac.uk # # Bona fide researchers may freely download Mercury and enCIFer # from this site to visualise CIF-encoded structures and # to carry out CIF format checking respectively. # data_mm148 _audit_creation_method SHELXL-2013 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'C40 H78 Ce Li O6 Si4' _chemical_formula_weight 914.44 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' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Li Li -0.0003 0.0001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Ce Ce -0.2486 2.6331 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_H-M_alt 'P -1' _space_group_name_Hall '-P 1' _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. ; loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 11.744(4) _cell_length_b 12.376(4) _cell_length_c 18.533(6) _cell_angle_alpha 99.150(7) _cell_angle_beta 102.147(7) _cell_angle_gamma 98.922(6) _cell_volume 2549.7(14) _cell_formula_units_Z 2 _cell_measurement_temperature 200(2) _cell_measurement_reflns_used 4510 _cell_measurement_theta_min 3.71 _cell_measurement_theta_max 30.47 _exptl_crystal_description needle _exptl_crystal_colour green _exptl_crystal_density_meas n/a _exptl_crystal_density_method ? _exptl_crystal_density_diffrn 1.191 _exptl_crystal_F_000 966 _exptl_transmission_factor_min ? _exptl_transmission_factor_max ? _exptl_crystal_size_max 0.240 _exptl_crystal_size_mid 0.080 _exptl_crystal_size_min 0.070 _exptl_absorpt_coefficient_mu 1.023 _shelx_estimated_absorpt_T_min 0.791 _shelx_estimated_absorpt_T_max 0.932 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.6376 _exptl_absorpt_correction_T_max 0.7461 _exptl_absorpt_process_details 'SADABS, Bruker (2003)' _exptl_special_details ; Data collection is performed with four batch runs at phi = 0.00 deg (600 frames), at phi = 90.00 deg (600 frames), at phi = 180.00 deg (600 frames), and at phi = 270.00 deg (600 frames). A fifth batch run is collected at phi = 0.00 deg (50 frames) to monitor crystal and diffractometer stability. Frame width = 0.30 deg in omega. Data is merged, corrected for decay (if any), and treated with multi-scan absorption corrections (if required). All symmetry-equivalent reflections are merged for centrosymmetric data. Friedel pairs are not merged for noncentrosymmetric data. ; _diffrn_ambient_temperature 200(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_source ? _diffrn_measurement_device_type 'Bruker APEX-II CCD' _diffrn_measurement_method '\f and \w scans' _diffrn_detector_area_resol_mean ? _diffrn_reflns_number 33388 _diffrn_reflns_av_unetI/netI 0.0483 _diffrn_reflns_av_R_equivalents 0.0313 _diffrn_reflns_limit_h_min -16 _diffrn_reflns_limit_h_max 15 _diffrn_reflns_limit_k_min -17 _diffrn_reflns_limit_k_max 17 _diffrn_reflns_limit_l_min -25 _diffrn_reflns_limit_l_max 26 _diffrn_reflns_theta_min 1.699 _diffrn_reflns_theta_max 30.555 _diffrn_reflns_theta_full 25.242 _diffrn_measured_fraction_theta_max 0.878 _diffrn_measured_fraction_theta_full 0.986 _diffrn_reflns_Laue_measured_fraction_max 0.878 _diffrn_reflns_Laue_measured_fraction_full 0.986 _diffrn_reflns_point_group_measured_fraction_max 0.878 _diffrn_reflns_point_group_measured_fraction_full 0.986 _reflns_number_total 13751 _reflns_number_gt 11104 _reflns_threshold_expression 'I > 2\s(I)' _reflns_Friedel_coverage 0.000 _reflns_Friedel_fraction_max . _reflns_Friedel_fraction_full . _reflns_special_details ; Reflections were merged by SHELXL according to the crystal class for the calculation of statistics and refinement. _reflns_Friedel_fraction is defined as the number of unique Friedel pairs measured divided by the number that would be possible theoretically, ignoring centric projections and systematic absences. ; _computing_data_collection 'APEX II, Bruker (2009)' _computing_cell_refinement 'APEX II, Bruker (2009)' _computing_data_reduction 'XPREP, Bruker (2009)' _computing_structure_solution 'SHELXS-03 (Sheldrick, 2003)' _computing_structure_refinement 'SHELXL-2013 (Sheldrick, 2013)' _computing_molecular_graphics 'SHELXTL, Bruker (2004)' _computing_publication_material 'SHELXTL, Bruker (2004)' _refine_special_details ; ? ; _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme calc _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0374P)^2^+0.6013P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary ? _atom_sites_solution_secondary ? _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment constr _refine_ls_extinction_method none _refine_ls_extinction_coef . _refine_ls_number_reflns 13751 _refine_ls_number_parameters 469 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0530 _refine_ls_R_factor_gt 0.0362 _refine_ls_wR_factor_ref 0.0819 _refine_ls_wR_factor_gt 0.0757 _refine_ls_goodness_of_fit_ref 1.023 _refine_ls_restrained_S_all 1.023 _refine_ls_shift/su_max 0.004 _refine_ls_shift/su_mean 0.000 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 Ce1 Ce 0.85889(2) 0.63457(2) 0.74180(2) 0.02682(4) Uani 1 1 d . . . . . Si1 Si 0.77728(7) 0.36424(6) 0.55258(4) 0.03725(16) Uani 1 1 d . . . . . Si2 Si 0.53492(7) 0.71429(6) 0.78747(4) 0.03945(17) Uani 1 1 d . . . . . Si3 Si 0.80953(7) 0.88990(6) 0.61530(4) 0.04120(17) Uani 1 1 d . . . . . Si4 Si 1.07196(8) 0.76837(6) 0.96089(4) 0.0466(2) Uani 1 1 d . . . . . C1 C 0.7511(2) 0.43353(18) 0.64363(13) 0.0293(5) Uani 1 1 d . . . . . C2 C 0.6666(2) 0.50460(18) 0.63486(13) 0.0303(5) Uani 1 1 d . . . . . H2A H 0.6352 0.5039 0.5831 0.036 Uiso 1 1 calc R U . . . C3 C 0.6160(2) 0.57610(18) 0.68137(13) 0.0307(5) Uani 1 1 d . . . . . H3A H 0.5609 0.6108 0.6525 0.037 Uiso 1 1 calc R U . . . C4 C 0.6261(2) 0.60954(18) 0.75995(13) 0.0296(5) Uani 1 1 d . . . . . C5 C 0.6947(2) 0.57649(19) 0.82315(14) 0.0320(5) Uani 1 1 d . . . . . H5A H 0.6845 0.6143 0.8694 0.038 Uiso 1 1 calc R U . . . C6 C 0.7734(2) 0.5025(2) 0.83451(14) 0.0347(5) Uani 1 1 d . . . . . H6A H 0.7992 0.4996 0.8862 0.042 Uiso 1 1 calc R U . . . C7 C 0.8236(2) 0.4313(2) 0.78776(14) 0.0358(6) Uani 1 1 d . . . . . H7A H 0.8754 0.3927 0.8157 0.043 Uiso 1 1 calc R U . . . C8 C 0.8153(2) 0.40383(18) 0.70978(14) 0.0333(5) Uani 1 1 d . . . . . H8A H 0.8647 0.3529 0.6983 0.040 Uiso 1 1 calc R U . . . C9 C 0.7683(3) 0.4586(3) 0.48275(17) 0.0597(8) Uani 1 1 d . . . . . H9A H 0.8275 0.5276 0.5037 0.090 Uiso 1 1 calc R U . . . H9B H 0.6888 0.4763 0.4718 0.090 Uiso 1 1 calc R U . . . H9C H 0.7841 0.4211 0.4362 0.090 Uiso 1 1 calc R U . . . C10 C 0.6635(3) 0.2323(2) 0.51229(19) 0.0647(9) Uani 1 1 d . . . . . H10A H 0.6683 0.1826 0.5486 0.097 Uiso 1 1 calc R U . . . H10B H 0.6788 0.1952 0.4655 0.097 Uiso 1 1 calc R U . . . H10C H 0.5840 0.2504 0.5018 0.097 Uiso 1 1 calc R U . . . C11 C 0.9281(3) 0.3267(3) 0.5650(2) 0.0664(9) Uani 1 1 d . . . . . H11A H 0.9893 0.3944 0.5857 0.100 Uiso 1 1 calc R U . . . H11B H 0.9382 0.2913 0.5162 0.100 Uiso 1 1 calc R U . . . H11C H 0.9356 0.2747 0.5997 0.100 Uiso 1 1 calc R U . . . C12 C 0.6297(3) 0.8492(2) 0.84524(19) 0.0597(9) Uani 1 1 d . . . . . H12A H 0.6823 0.8816 0.8163 0.090 Uiso 1 1 calc R U . . . H12B H 0.6776 0.8351 0.8916 0.090 Uiso 1 1 calc R U . . . H12C H 0.5788 0.9013 0.8579 0.090 Uiso 1 1 calc R U . . . C13 C 0.4383(3) 0.6609(3) 0.8480(2) 0.0684(10) Uani 1 1 d . . . . . H13A H 0.4881 0.6447 0.8930 0.103 Uiso 1 1 calc R U . . . H13B H 0.3829 0.5926 0.8195 0.103 Uiso 1 1 calc R U . . . H13C H 0.3935 0.7176 0.8631 0.103 Uiso 1 1 calc R U . . . C14 C 0.4343(4) 0.7428(4) 0.7025(2) 0.0977(16) Uani 1 1 d . . . . . H14A H 0.4820 0.7714 0.6697 0.146 Uiso 1 1 calc R U . . . H14B H 0.3889 0.7984 0.7186 0.146 Uiso 1 1 calc R U . . . H14C H 0.3795 0.6736 0.6751 0.146 Uiso 1 1 calc R U . . . C15 C 0.9079(2) 0.82705(19) 0.68414(13) 0.0314(5) Uani 1 1 d . . . . . C16 C 0.9153(2) 0.86539(18) 0.76231(13) 0.0315(5) Uani 1 1 d . . . . . H16A H 0.8725 0.9237 0.7696 0.038 Uiso 1 1 calc R U . . . C17 C 0.9693(2) 0.83978(18) 0.83201(13) 0.0319(5) Uani 1 1 d . . . . . H17A H 0.9517 0.8847 0.8732 0.038 Uiso 1 1 calc R U . . . C18 C 1.0434(2) 0.76450(19) 0.85700(13) 0.0330(5) Uani 1 1 d . . . . . C19 C 1.0969(2) 0.6878(2) 0.81618(15) 0.0371(6) Uani 1 1 d . . . . . H19A H 1.1445 0.6509 0.8484 0.045 Uiso 1 1 calc R U . . . C20 C 1.0972(2) 0.6524(2) 0.73966(16) 0.0388(6) Uani 1 1 d . . . . . H20A H 1.1464 0.5992 0.7335 0.047 Uiso 1 1 calc R U . . . C21 C 1.0422(2) 0.6770(2) 0.67034(15) 0.0378(6) Uani 1 1 d . . . . . H21A H 1.0632 0.6360 0.6289 0.045 Uiso 1 1 calc R U . . . C22 C 0.9640(2) 0.74718(19) 0.64772(14) 0.0345(5) Uani 1 1 d . . . . . H22A H 0.9430 0.7396 0.5945 0.041 Uiso 1 1 calc R U . . . C23 C 0.7236(4) 0.9831(4) 0.6619(2) 0.0845(13) Uani 1 1 d . . . . . H23A H 0.6739 1.0136 0.6238 0.127 Uiso 1 1 calc R U . . . H23B H 0.7789 1.0445 0.6988 0.127 Uiso 1 1 calc R U . . . H23C H 0.6731 0.9402 0.6875 0.127 Uiso 1 1 calc R U . . . C24 C 0.9006(3) 0.9781(3) 0.5671(2) 0.0754(11) Uani 1 1 d . . . . . H24A H 0.9472 0.9327 0.5414 0.113 Uiso 1 1 calc R U . . . H24B H 0.9545 1.0399 0.6045 0.113 Uiso 1 1 calc R U . . . H24C H 0.8482 1.0081 0.5302 0.113 Uiso 1 1 calc R U . . . C25 C 0.7017(3) 0.7808(3) 0.5409(2) 0.0795(12) Uani 1 1 d . . . . . H25A H 0.7448 0.7307 0.5159 0.119 Uiso 1 1 calc R U . . . H25B H 0.6569 0.8165 0.5038 0.119 Uiso 1 1 calc R U . . . H25C H 0.6468 0.7379 0.5639 0.119 Uiso 1 1 calc R U . . . C26 C 0.9342(4) 0.7799(4) 0.9958(2) 0.1001(15) Uani 1 1 d . . . . . H26A H 0.9515 0.7814 1.0501 0.150 Uiso 1 1 calc R U . . . H26B H 0.8712 0.7155 0.9697 0.150 Uiso 1 1 calc R U . . . H26C H 0.9081 0.8487 0.9859 0.150 Uiso 1 1 calc R U . . . C27 C 1.1196(5) 0.6410(4) 0.9870(2) 0.1161(19) Uani 1 1 d . . . . . H27A H 1.1920 0.6318 0.9704 0.174 Uiso 1 1 calc R U . . . H27B H 1.0566 0.5758 0.9626 0.174 Uiso 1 1 calc R U . . . H27C H 1.1353 0.6479 1.0417 0.174 Uiso 1 1 calc R U . . . C28 C 1.1865(5) 0.8914(4) 1.0153(2) 0.128(2) Uani 1 1 d . . . . . H28A H 1.2608 0.8889 0.9995 0.192 Uiso 1 1 calc R U . . . H28B H 1.1998 0.8903 1.0691 0.192 Uiso 1 1 calc R U . . . H28C H 1.1592 0.9599 1.0058 0.192 Uiso 1 1 calc R U . . . Li1 Li 0.3303(4) 0.2013(3) 0.7861(3) 0.0410(10) Uani 1 1 d . . . . . O1 O 0.38782(18) 0.35661(16) 0.86723(11) 0.0517(5) Uani 1 1 d . . . . . O2 O 0.16625(17) 0.24105(15) 0.81785(11) 0.0511(5) Uani 1 1 d . . . . . O3 O 0.35239(19) 0.08974(17) 0.86799(13) 0.0602(6) Uani 1 1 d . . . . . O4 O 0.23734(19) 0.04881(16) 0.72084(12) 0.0574(6) Uani 1 1 d . . . . . O5 O 0.50189(18) 0.20503(17) 0.77125(12) 0.0535(5) Uani 1 1 d . . . . . O6 O 0.32549(19) 0.28053(16) 0.69062(11) 0.0549(5) Uani 1 1 d . . . . . C29 C 0.5083(3) 0.3951(3) 0.91073(18) 0.0615(9) Uani 1 1 d . . . . . H29A H 0.5148 0.4671 0.9437 0.092 Uiso 1 1 calc R U . . . H29B H 0.5613 0.4037 0.8768 0.092 Uiso 1 1 calc R U . . . H29C H 0.5309 0.3406 0.9414 0.092 Uiso 1 1 calc R U . . . C30 C 0.3032(3) 0.3876(3) 0.90671(18) 0.0576(8) Uani 1 1 d . . . . . H30A H 0.3221 0.4691 0.9267 0.069 Uiso 1 1 calc R U . . . H30B H 0.3043 0.3488 0.9496 0.069 Uiso 1 1 calc R U . . . C31 C 0.1831(3) 0.3555(2) 0.85316(19) 0.0576(8) Uani 1 1 d . . . . . H31A H 0.1208 0.3663 0.8807 0.069 Uiso 1 1 calc R U . . . H31B H 0.1780 0.4029 0.8147 0.069 Uiso 1 1 calc R U . . . C32 C 0.0469(3) 0.1944(3) 0.7763(2) 0.0648(9) Uani 1 1 d . . . . . H32A H -0.0083 0.2262 0.8024 0.097 Uiso 1 1 calc R U . . . H32B H 0.0321 0.1133 0.7721 0.097 Uiso 1 1 calc R U . . . H32C H 0.0351 0.2119 0.7258 0.097 Uiso 1 1 calc R U . . . C33 C 0.3829(4) 0.1199(4) 0.9473(2) 0.0925(14) Uani 1 1 d . . . . . H33A H 0.3857 0.0527 0.9688 0.139 Uiso 1 1 calc R U . . . H33B H 0.3232 0.1583 0.9641 0.139 Uiso 1 1 calc R U . . . H33C H 0.4609 0.1698 0.9642 0.139 Uiso 1 1 calc R U . . . C34 C 0.2534(4) -0.0001(3) 0.8405(2) 0.0780(12) Uani 1 1 d . . . . . H34A H 0.1801 0.0255 0.8477 0.094 Uiso 1 1 calc R U . . . H34B H 0.2645 -0.0609 0.8685 0.094 Uiso 1 1 calc R U . . . C35 C 0.2427(4) -0.0410(2) 0.7602(2) 0.0773(11) Uani 1 1 d . . . . . H35A H 0.3118 -0.0748 0.7536 0.093 Uiso 1 1 calc R U . . . H35B H 0.1699 -0.0992 0.7393 0.093 Uiso 1 1 calc R U . . . C36 C 0.2321(4) 0.0137(3) 0.6430(2) 0.0859(13) Uani 1 1 d . . . . . H36A H 0.1830 -0.0613 0.6246 0.129 Uiso 1 1 calc R U . . . H36B H 0.3125 0.0124 0.6362 0.129 Uiso 1 1 calc R U . . . H36C H 0.1973 0.0658 0.6145 0.129 Uiso 1 1 calc R U . . . C37 C 0.5814(4) 0.1368(4) 0.7962(3) 0.1034(16) Uani 1 1 d . . . . . H37A H 0.6557 0.1574 0.7811 0.155 Uiso 1 1 calc R U . . . H37B H 0.5459 0.0585 0.7737 0.155 Uiso 1 1 calc R U . . . H37C H 0.5978 0.1470 0.8512 0.155 Uiso 1 1 calc R U . . . C38 C 0.5182(3) 0.2387(3) 0.7039(2) 0.0704(11) Uani 1 1 d . . . . . H38A H 0.4933 0.1738 0.6614 0.085 Uiso 1 1 calc R U . . . H38B H 0.6030 0.2704 0.7093 0.085 Uiso 1 1 calc R U . . . C39 C 0.4446(3) 0.3245(3) 0.68926(19) 0.0714(11) Uani 1 1 d . . . . . H39A H 0.4765 0.3933 0.7283 0.086 Uiso 1 1 calc R U . . . H39B H 0.4466 0.3434 0.6395 0.086 Uiso 1 1 calc R U . . . C40 C 0.2457(5) 0.3518(4) 0.6682(2) 0.1008(15) Uani 1 1 d . . . . . H40A H 0.2614 0.3776 0.6233 0.151 Uiso 1 1 calc R U . . . H40B H 0.2572 0.4162 0.7091 0.151 Uiso 1 1 calc R U . . . H40C H 0.1637 0.3104 0.6568 0.151 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 Ce1 0.02386(7) 0.02767(7) 0.02880(7) 0.00754(5) 0.00702(5) 0.00174(5) Si1 0.0409(4) 0.0361(3) 0.0356(4) 0.0034(3) 0.0119(3) 0.0101(3) Si2 0.0373(4) 0.0462(4) 0.0373(4) 0.0051(3) 0.0115(3) 0.0156(3) Si3 0.0491(4) 0.0474(4) 0.0342(4) 0.0201(3) 0.0134(3) 0.0136(3) Si4 0.0552(5) 0.0450(4) 0.0313(4) 0.0142(3) -0.0020(3) -0.0047(4) C1 0.0300(12) 0.0267(10) 0.0317(12) 0.0046(9) 0.0097(10) 0.0048(9) C2 0.0276(12) 0.0336(11) 0.0274(12) 0.0060(9) 0.0051(9) 0.0016(9) C3 0.0234(11) 0.0335(11) 0.0342(13) 0.0082(9) 0.0055(9) 0.0031(9) C4 0.0260(11) 0.0315(11) 0.0319(12) 0.0075(9) 0.0092(9) 0.0029(9) C5 0.0317(12) 0.0350(12) 0.0315(12) 0.0088(10) 0.0128(10) 0.0039(10) C6 0.0352(13) 0.0405(13) 0.0302(13) 0.0153(10) 0.0077(10) 0.0043(10) C7 0.0360(13) 0.0348(12) 0.0390(14) 0.0187(10) 0.0056(11) 0.0076(10) C8 0.0342(13) 0.0279(11) 0.0405(14) 0.0095(10) 0.0102(11) 0.0100(10) C9 0.086(2) 0.0605(18) 0.0463(18) 0.0157(14) 0.0340(17) 0.0253(17) C10 0.079(2) 0.0498(17) 0.0530(19) -0.0069(14) 0.0123(17) -0.0015(16) C11 0.060(2) 0.088(2) 0.058(2) 0.0073(18) 0.0219(17) 0.0343(19) C12 0.075(2) 0.0430(15) 0.066(2) 0.0045(14) 0.0324(18) 0.0113(15) C13 0.053(2) 0.073(2) 0.088(3) 0.0057(19) 0.0432(19) 0.0131(17) C14 0.114(3) 0.139(4) 0.054(2) 0.005(2) 0.006(2) 0.100(3) C15 0.0352(13) 0.0331(11) 0.0283(12) 0.0127(9) 0.0106(10) 0.0029(10) C16 0.0358(13) 0.0273(11) 0.0339(13) 0.0110(9) 0.0110(10) 0.0049(9) C17 0.0371(13) 0.0293(11) 0.0276(12) 0.0042(9) 0.0094(10) 0.0005(10) C18 0.0297(12) 0.0346(12) 0.0309(12) 0.0101(10) 0.0025(10) -0.0020(10) C19 0.0255(12) 0.0406(13) 0.0426(15) 0.0136(11) 0.0009(10) 0.0028(10) C20 0.0249(12) 0.0413(13) 0.0541(17) 0.0091(12) 0.0164(11) 0.0092(10) C21 0.0321(13) 0.0435(13) 0.0411(15) 0.0053(11) 0.0195(11) 0.0059(11) C22 0.0370(13) 0.0390(12) 0.0289(12) 0.0094(10) 0.0129(10) 0.0024(11) C23 0.109(3) 0.112(3) 0.069(3) 0.049(2) 0.039(2) 0.074(3) C24 0.086(3) 0.087(3) 0.064(2) 0.049(2) 0.022(2) 0.009(2) C25 0.076(3) 0.073(2) 0.072(2) 0.0236(19) -0.020(2) 0.0078(19) C26 0.100(3) 0.166(5) 0.045(2) 0.036(3) 0.029(2) 0.026(3) C27 0.201(6) 0.094(3) 0.064(3) 0.046(2) 0.013(3) 0.056(3) C28 0.166(5) 0.117(4) 0.045(2) 0.016(2) -0.021(3) -0.075(3) Li1 0.042(2) 0.036(2) 0.043(3) 0.0076(18) 0.012(2) 0.0007(18) O1 0.0496(12) 0.0510(11) 0.0472(11) -0.0072(9) 0.0175(9) -0.0028(9) O2 0.0429(11) 0.0466(11) 0.0593(13) 0.0021(9) 0.0083(10) 0.0094(9) O3 0.0593(14) 0.0519(12) 0.0686(15) 0.0226(10) 0.0163(11) -0.0036(10) O4 0.0613(14) 0.0422(10) 0.0600(13) -0.0026(9) 0.0175(11) -0.0069(10) O5 0.0444(12) 0.0586(12) 0.0622(13) 0.0096(10) 0.0256(10) 0.0089(10) O6 0.0632(14) 0.0547(12) 0.0477(12) 0.0208(10) 0.0139(10) 0.0030(10) C29 0.0526(19) 0.0610(18) 0.057(2) -0.0048(15) 0.0120(15) -0.0105(15) C30 0.063(2) 0.0491(16) 0.0570(19) -0.0064(14) 0.0261(16) 0.0026(15) C31 0.063(2) 0.0497(16) 0.064(2) 0.0067(15) 0.0242(17) 0.0169(15) C32 0.0433(18) 0.077(2) 0.066(2) 0.0056(17) 0.0050(16) 0.0079(16) C33 0.115(4) 0.091(3) 0.064(3) 0.032(2) 0.014(2) -0.010(3) C34 0.076(3) 0.057(2) 0.097(3) 0.037(2) 0.013(2) -0.0117(18) C35 0.081(3) 0.0321(15) 0.108(3) 0.0056(17) 0.016(2) -0.0008(16) C36 0.087(3) 0.080(2) 0.065(2) -0.0273(19) 0.018(2) -0.015(2) C37 0.071(3) 0.133(4) 0.135(4) 0.043(3) 0.050(3) 0.054(3) C38 0.054(2) 0.093(3) 0.058(2) 0.0031(19) 0.0303(17) -0.0147(19) C39 0.087(3) 0.066(2) 0.052(2) 0.0149(16) 0.0238(18) -0.028(2) C40 0.136(4) 0.119(4) 0.080(3) 0.062(3) 0.037(3) 0.066(3) _geom_special_details ; All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. ; 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 Ce1 C2 2.755(2) . ? Ce1 C17 2.765(2) . ? Ce1 C5 2.765(2) . ? Ce1 C8 2.766(2) . ? Ce1 C22 2.766(2) . ? Ce1 C19 2.769(3) . ? Ce1 C3 2.770(2) . ? Ce1 C16 2.776(2) . ? Ce1 C1 2.778(2) . ? Ce1 C18 2.778(2) . ? Ce1 C21 2.781(2) . ? Ce1 C7 2.781(2) . ? Si1 C9 1.873(3) . ? Si1 C1 1.875(2) . ? Si1 C11 1.877(3) . ? Si1 C10 1.877(3) . ? Si2 C13 1.877(3) . ? Si2 C14 1.877(4) . ? Si2 C12 1.878(3) . ? Si2 C4 1.881(3) . ? Si3 C25 1.863(4) . ? Si3 C24 1.867(3) . ? Si3 C23 1.873(4) . ? Si3 C15 1.882(3) . ? Si4 C27 1.853(4) . ? Si4 C28 1.857(4) . ? Si4 C18 1.875(3) . ? Si4 C26 1.882(4) . ? C1 C2 1.426(3) . ? C1 C8 1.431(3) . ? C2 C3 1.419(3) . ? C3 C4 1.424(3) . ? C4 C5 1.430(3) . ? C5 C6 1.406(4) . ? C6 C7 1.418(4) . ? C7 C8 1.410(4) . ? C15 C22 1.429(3) . ? C15 C16 1.431(3) . ? C16 C17 1.421(3) . ? C17 C18 1.434(3) . ? C18 C19 1.423(4) . ? C19 C20 1.417(4) . ? C20 C21 1.413(4) . ? C21 C22 1.406(4) . ? Li1 O4 2.073(4) . ? Li1 O5 2.084(5) . ? Li1 O6 2.149(5) . ? Li1 O1 2.159(5) . ? Li1 O3 2.212(5) . ? Li1 O2 2.232(5) . ? O1 C30 1.416(3) . ? O1 C29 1.438(4) . ? O2 C31 1.428(3) . ? O2 C32 1.430(3) . ? O3 C33 1.411(4) . ? O3 C34 1.420(4) . ? O4 C36 1.425(4) . ? O4 C35 1.426(4) . ? O5 C37 1.409(4) . ? O5 C38 1.417(4) . ? O6 C39 1.427(4) . ? O6 C40 1.427(4) . ? C30 C31 1.497(4) . ? C34 C35 1.465(5) . ? C38 C39 1.492(5) . ? 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 C2 Ce1 C17 149.33(7) . . ? C2 Ce1 C5 75.86(7) . . ? C17 Ce1 C5 97.92(7) . . ? C2 Ce1 C8 56.10(7) . . ? C17 Ce1 C8 152.66(7) . . ? C5 Ce1 C8 76.60(7) . . ? C2 Ce1 C22 98.29(7) . . ? C17 Ce1 C22 76.12(7) . . ? C5 Ce1 C22 157.95(8) . . ? C8 Ce1 C22 118.18(7) . . ? C2 Ce1 C19 152.97(8) . . ? C17 Ce1 C19 56.02(8) . . ? C5 Ce1 C19 118.08(8) . . ? C8 Ce1 C19 102.47(7) . . ? C22 Ce1 C19 76.56(8) . . ? C2 Ce1 C3 29.77(7) . . ? C17 Ce1 C3 123.15(7) . . ? C5 Ce1 C3 55.91(7) . . ? C8 Ce1 C3 76.29(7) . . ? C22 Ce1 C3 109.28(7) . . ? C19 Ce1 C3 173.97(7) . . ? C2 Ce1 C16 123.53(7) . . ? C17 Ce1 C16 29.72(7) . . ? C5 Ce1 C16 109.22(7) . . ? C8 Ce1 C16 174.09(7) . . ? C22 Ce1 C16 55.96(7) . . ? C19 Ce1 C16 75.93(7) . . ? C3 Ce1 C16 105.91(7) . . ? C2 Ce1 C1 29.87(7) . . ? C17 Ce1 C1 176.47(7) . . ? C5 Ce1 C1 85.13(7) . . ? C8 Ce1 C1 29.91(7) . . ? C22 Ce1 C1 100.39(7) . . ? C19 Ce1 C1 124.02(7) . . ? C3 Ce1 C1 57.25(7) . . ? C16 Ce1 C1 147.31(7) . . ? C2 Ce1 C18 176.00(7) . . ? C17 Ce1 C18 29.99(7) . . ? C5 Ce1 C18 100.15(7) . . ? C8 Ce1 C18 123.66(7) . . ? C22 Ce1 C18 85.30(7) . . ? C19 Ce1 C18 29.73(8) . . ? C3 Ce1 C18 147.03(7) . . ? C16 Ce1 C18 57.20(7) . . ? C1 Ce1 C18 151.27(7) . . ? C2 Ce1 C21 107.19(8) . . ? C17 Ce1 C21 82.85(7) . . ? C5 Ce1 C21 172.57(7) . . ? C8 Ce1 C21 99.31(7) . . ? C22 Ce1 C21 29.35(7) . . ? C19 Ce1 C21 56.34(8) . . ? C3 Ce1 C21 129.60(8) . . ? C16 Ce1 C21 75.02(7) . . ? C1 Ce1 C21 94.36(7) . . ? C18 Ce1 C21 76.80(8) . . ? C2 Ce1 C7 75.13(7) . . ? C17 Ce1 C7 126.71(7) . . ? C5 Ce1 C7 56.27(8) . . ? C8 Ce1 C7 29.45(7) . . ? C22 Ce1 C7 143.59(8) . . ? C19 Ce1 C7 93.17(7) . . ? C3 Ce1 C7 82.90(7) . . ? C16 Ce1 C7 155.35(7) . . ? C1 Ce1 C7 56.55(7) . . ? C18 Ce1 C7 103.03(7) . . ? C21 Ce1 C7 117.47(8) . . ? C9 Si1 C1 111.09(12) . . ? C9 Si1 C11 106.63(16) . . ? C1 Si1 C11 112.22(13) . . ? C9 Si1 C10 109.28(16) . . ? C1 Si1 C10 109.64(13) . . ? C11 Si1 C10 107.86(17) . . ? C13 Si2 C14 107.2(2) . . ? C13 Si2 C12 105.63(15) . . ? C14 Si2 C12 109.45(19) . . ? C13 Si2 C4 110.67(13) . . ? C14 Si2 C4 111.34(14) . . ? C12 Si2 C4 112.25(13) . . ? C25 Si3 C24 107.38(18) . . ? C25 Si3 C23 108.0(2) . . ? C24 Si3 C23 106.32(19) . . ? C25 Si3 C15 111.84(14) . . ? C24 Si3 C15 110.34(15) . . ? C23 Si3 C15 112.63(14) . . ? C27 Si4 C28 108.4(3) . . ? C27 Si4 C18 112.67(17) . . ? C28 Si4 C18 111.65(15) . . ? C27 Si4 C26 106.4(2) . . ? C28 Si4 C26 106.2(3) . . ? C18 Si4 C26 111.21(15) . . ? C2 C1 C8 130.7(2) . . ? C2 C1 Si1 113.98(17) . . ? C8 C1 Si1 115.31(18) . . ? C2 C1 Ce1 74.18(12) . . ? C8 C1 Ce1 74.57(13) . . ? Si1 C1 Ce1 132.47(10) . . ? C3 C2 C1 138.1(2) . . ? C3 C2 Ce1 75.68(13) . . ? C1 C2 Ce1 75.95(13) . . ? C2 C3 C4 136.7(2) . . ? C2 C3 Ce1 74.55(13) . . ? C4 C3 Ce1 76.37(13) . . ? C3 C4 C5 130.8(2) . . ? C3 C4 Si2 116.12(18) . . ? C5 C4 Si2 113.12(17) . . ? C3 C4 Ce1 74.01(13) . . ? C5 C4 Ce1 73.75(13) . . ? Si2 C4 Ce1 131.95(10) . . ? C6 C5 C4 136.5(2) . . ? C6 C5 Ce1 76.00(14) . . ? C4 C5 Ce1 76.47(13) . . ? C5 C6 C7 135.7(2) . . ? C5 C6 Ce1 74.63(13) . . ? C7 C6 Ce1 75.19(13) . . ? C8 C7 C6 135.4(2) . . ? C8 C7 Ce1 74.66(13) . . ? C6 C7 Ce1 75.28(13) . . ? C7 C8 C1 136.0(2) . . ? C7 C8 Ce1 75.89(13) . . ? C1 C8 Ce1 75.52(12) . . ? C22 C15 C16 130.7(2) . . ? C22 C15 Si3 112.52(17) . . ? C16 C15 Si3 116.75(18) . . ? C22 C15 Ce1 74.12(13) . . ? C16 C15 Ce1 74.51(12) . . ? Si3 C15 Ce1 130.60(11) . . ? C17 C16 C15 137.2(2) . . ? C17 C16 Ce1 74.70(12) . . ? C15 C16 Ce1 75.70(13) . . ? C16 C17 C18 137.2(2) . . ? C16 C17 Ce1 75.58(13) . . ? C18 C17 Ce1 75.53(13) . . ? C19 C18 C17 130.8(2) . . ? C19 C18 Si4 115.55(18) . . ? C17 C18 Si4 113.63(18) . . ? C19 C18 Ce1 74.76(13) . . ? C17 C18 Ce1 74.48(13) . . ? Si4 C18 Ce1 129.00(10) . . ? C20 C19 C18 136.2(2) . . ? C20 C19 Ce1 75.74(14) . . ? C18 C19 Ce1 75.50(14) . . ? C21 C20 C19 135.6(3) . . ? C21 C20 Ce1 75.25(14) . . ? C19 C20 Ce1 74.68(14) . . ? C22 C21 C20 135.6(2) . . ? C22 C21 Ce1 74.73(14) . . ? C20 C21 Ce1 75.33(14) . . ? C21 C22 C15 136.4(2) . . ? C21 C22 Ce1 75.92(14) . . ? C15 C22 Ce1 76.07(13) . . ? O4 Li1 O5 103.1(2) . . ? O4 Li1 O6 93.4(2) . . ? O5 Li1 O6 78.25(17) . . ? O4 Li1 O1 164.9(3) . . ? O5 Li1 O1 91.22(18) . . ? O6 Li1 O1 94.02(18) . . ? O4 Li1 O3 78.23(16) . . ? O5 Li1 O3 92.8(2) . . ? O6 Li1 O3 166.2(3) . . ? O1 Li1 O3 96.7(2) . . ? O4 Li1 O2 91.24(18) . . ? O5 Li1 O2 165.6(2) . . ? O6 Li1 O2 99.8(2) . . ? O1 Li1 O2 74.58(16) . . ? O3 Li1 O2 91.42(18) . . ? C30 O1 C29 113.1(2) . . ? C30 O1 Li1 115.5(2) . . ? C29 O1 Li1 123.0(2) . . ? C31 O2 C32 113.5(2) . . ? C31 O2 Li1 111.5(2) . . ? C32 O2 Li1 125.9(2) . . ? C33 O3 C34 112.4(3) . . ? C33 O3 Li1 127.7(2) . . ? C34 O3 Li1 105.0(2) . . ? C36 O4 C35 111.9(3) . . ? C36 O4 Li1 124.6(2) . . ? C35 O4 Li1 113.3(2) . . ? C37 O5 C38 112.3(3) . . ? C37 O5 Li1 127.5(3) . . ? C38 O5 Li1 113.6(2) . . ? C39 O6 C40 112.4(3) . . ? C39 O6 Li1 108.4(2) . . ? C40 O6 Li1 125.1(3) . . ? O1 C30 C31 108.2(2) . . ? O2 C31 C30 108.2(3) . . ? O3 C34 C35 108.9(3) . . ? O4 C35 C34 109.9(3) . . ? O5 C38 C39 108.0(3) . . ? O6 C39 C38 108.6(2) . . ? 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 C9 Si1 C1 C2 35.1(2) . . . . ? C11 Si1 C1 C2 154.38(19) . . . . ? C10 Si1 C1 C2 -85.8(2) . . . . ? C9 Si1 C1 C8 -146.98(19) . . . . ? C11 Si1 C1 C8 -27.7(2) . . . . ? C10 Si1 C1 C8 92.1(2) . . . . ? C9 Si1 C1 Ce1 -55.0(2) . . . . ? C11 Si1 C1 Ce1 64.2(2) . . . . ? C10 Si1 C1 Ce1 -175.94(16) . . . . ? C8 C1 C2 C3 3.9(4) . . . . ? Si1 C1 C2 C3 -178.6(2) . . . . ? Ce1 C1 C2 C3 -48.6(3) . . . . ? C8 C1 C2 Ce1 52.6(2) . . . . ? Si1 C1 C2 Ce1 -129.95(13) . . . . ? C1 C2 C3 C4 -0.7(5) . . . . ? Ce1 C2 C3 C4 -49.4(3) . . . . ? C1 C2 C3 Ce1 48.7(3) . . . . ? C2 C3 C4 C5 -2.0(4) . . . . ? Ce1 C3 C4 C5 -50.9(2) . . . . ? C2 C3 C4 Si2 178.2(2) . . . . ? Ce1 C3 C4 Si2 129.34(13) . . . . ? C2 C3 C4 Ce1 48.9(3) . . . . ? C13 Si2 C4 C3 125.2(2) . . . . ? C14 Si2 C4 C3 6.1(3) . . . . ? C12 Si2 C4 C3 -117.02(19) . . . . ? C13 Si2 C4 C5 -54.6(2) . . . . ? C14 Si2 C4 C5 -173.7(2) . . . . ? C12 Si2 C4 C5 63.2(2) . . . . ? C13 Si2 C4 Ce1 -143.14(17) . . . . ? C14 Si2 C4 Ce1 97.7(2) . . . . ? C12 Si2 C4 Ce1 -25.4(2) . . . . ? C3 C4 C5 C6 -1.1(4) . . . . ? Si2 C4 C5 C6 178.7(2) . . . . ? Ce1 C4 C5 C6 -52.0(3) . . . . ? C3 C4 C5 Ce1 51.0(2) . . . . ? Si2 C4 C5 Ce1 -129.24(13) . . . . ? C4 C5 C6 C7 3.5(5) . . . . ? Ce1 C5 C6 C7 -48.7(3) . . . . ? C4 C5 C6 Ce1 52.2(3) . . . . ? C5 C6 C7 C8 -0.5(5) . . . . ? Ce1 C6 C7 C8 -49.0(3) . . . . ? C5 C6 C7 Ce1 48.5(3) . . . . ? C6 C7 C8 C1 -1.7(5) . . . . ? Ce1 C7 C8 C1 -50.9(3) . . . . ? C6 C7 C8 Ce1 49.2(3) . . . . ? C2 C1 C8 C7 -1.4(4) . . . . ? Si1 C1 C8 C7 -178.9(2) . . . . ? Ce1 C1 C8 C7 51.0(3) . . . . ? C2 C1 C8 Ce1 -52.4(2) . . . . ? Si1 C1 C8 Ce1 130.11(13) . . . . ? C25 Si3 C15 C22 52.1(2) . . . . ? C24 Si3 C15 C22 -67.4(2) . . . . ? C23 Si3 C15 C22 174.0(2) . . . . ? C25 Si3 C15 C16 -128.1(2) . . . . ? C24 Si3 C15 C16 112.4(2) . . . . ? C23 Si3 C15 C16 -6.2(2) . . . . ? C25 Si3 C15 Ce1 -36.0(2) . . . . ? C24 Si3 C15 Ce1 -155.41(17) . . . . ? C23 Si3 C15 Ce1 86.0(2) . . . . ? C22 C15 C16 C17 -4.7(4) . . . . ? Si3 C15 C16 C17 175.5(2) . . . . ? Ce1 C15 C16 C17 47.5(3) . . . . ? C22 C15 C16 Ce1 -52.2(2) . . . . ? Si3 C15 C16 Ce1 128.06(14) . . . . ? C15 C16 C17 C18 1.1(5) . . . . ? Ce1 C16 C17 C18 48.8(3) . . . . ? C15 C16 C17 Ce1 -47.8(3) . . . . ? C16 C17 C18 C19 4.2(4) . . . . ? Ce1 C17 C18 C19 53.1(2) . . . . ? C16 C17 C18 Si4 -175.1(2) . . . . ? Ce1 C17 C18 Si4 -126.26(13) . . . . ? C16 C17 C18 Ce1 -48.9(3) . . . . ? C27 Si4 C18 C19 -19.8(3) . . . . ? C28 Si4 C18 C19 102.4(3) . . . . ? C26 Si4 C18 C19 -139.2(2) . . . . ? C27 Si4 C18 C17 159.6(2) . . . . ? C28 Si4 C18 C17 -78.1(3) . . . . ? C26 Si4 C18 C17 40.3(2) . . . . ? C27 Si4 C18 Ce1 70.9(3) . . . . ? C28 Si4 C18 Ce1 -166.9(2) . . . . ? C26 Si4 C18 Ce1 -48.5(2) . . . . ? C17 C18 C19 C20 -2.6(5) . . . . ? Si4 C18 C19 C20 176.8(2) . . . . ? Ce1 C18 C19 C20 50.4(3) . . . . ? C17 C18 C19 Ce1 -53.0(2) . . . . ? Si4 C18 C19 Ce1 126.35(14) . . . . ? C18 C19 C20 C21 -1.4(5) . . . . ? Ce1 C19 C20 C21 48.9(3) . . . . ? C18 C19 C20 Ce1 -50.4(3) . . . . ? C19 C20 C21 C22 0.2(5) . . . . ? Ce1 C20 C21 C22 49.0(3) . . . . ? C19 C20 C21 Ce1 -48.8(3) . . . . ? C20 C21 C22 C15 2.3(5) . . . . ? Ce1 C21 C22 C15 51.4(3) . . . . ? C20 C21 C22 Ce1 -49.2(3) . . . . ? C16 C15 C22 C21 0.9(4) . . . . ? Si3 C15 C22 C21 -179.3(2) . . . . ? Ce1 C15 C22 C21 -51.4(3) . . . . ? C16 C15 C22 Ce1 52.3(2) . . . . ? Si3 C15 C22 Ce1 -127.91(13) . . . . ? C29 O1 C30 C31 173.2(2) . . . . ? Li1 O1 C30 C31 -37.7(3) . . . . ? C32 O2 C31 C30 168.8(3) . . . . ? Li1 O2 C31 C30 -42.0(3) . . . . ? O1 C30 C31 O2 51.7(3) . . . . ? C33 O3 C34 C35 -168.6(3) . . . . ? Li1 O3 C34 C35 48.8(4) . . . . ? C36 O4 C35 C34 177.4(3) . . . . ? Li1 O4 C35 C34 30.5(4) . . . . ? O3 C34 C35 O4 -54.4(4) . . . . ? C37 O5 C38 C39 -170.9(3) . . . . ? Li1 O5 C38 C39 35.2(3) . . . . ? C40 O6 C39 C38 -172.9(3) . . . . ? Li1 O6 C39 C38 44.7(3) . . . . ? O5 C38 C39 O6 -53.0(3) . . . . ? _refine_diff_density_max 0.696 _refine_diff_density_min -0.539 _refine_diff_density_rms 0.082 _shelxl_version_number 2013-4 _shelx_res_file ; TITL mm148 in P-1 CELL 0.71073 11.74360 12.37590 18.53310 99.1499 102.1466 98.9223 ZERR 2.00 0.00380 0.00380 0.00640 0.0067 0.0065 0.0056 LATT 1 SFAC C H O SI LI CE UNIT 80 156 12 8 2 2 TEMP -73.15C SIZE 0.07 0.08 0.24 L.S. 80 LIST 0 ACTA CONF BOND FMAP 2 PLAN 5 OMIT 6 -16 9 OMIT -7 16 2 OMIT -7 15 3 OMIT -5 -9 24 OMIT 6 -15 14 OMIT 6 -15 12 OMIT -8 16 1 OMIT 6 -15 5 OMIT 6 -15 7 OMIT 6 -15 6 OMIT 4 -16 1 OMIT 7 -14 14 OMIT 5 -15 3 OMIT -7 14 3 OMIT -8 15 1 OMIT 7 -12 16 OMIT 6 -13 17 OMIT 6 -16 10 OMIT 6 -14 11 OMIT 6 -14 9 OMIT 9 -15 9 OMIT -4 -9 24 OMIT -3 -10 23 OMIT 6 -16 8 OMIT 7 -12 17 OMIT 7 -13 10 OMIT 7 -13 13 OMIT 6 -15 4 OMIT 6 -13 15 OMIT 7 -14 11 OMIT -5 -9 23 OMIT 6 -13 6 OMIT -2 -10 23 OMIT -5 -8 24 OMIT 6 -13 13 OMIT -1 -11 22 OMIT 0 -11 22 OMIT -4 -8 25 OMIT 6 -14 7 OMIT -4 -9 23 OMIT -3 -9 24 OMIT 6 -14 3 OMIT 7 -12 15 OMIT -4 13 1 OMIT 7 -13 12 OMIT 7 -13 11 OMIT 6 -14 5 OMIT -3 -10 22 OMIT 6 -13 7 OMIT 7 -14 12 WGHT 0.037400 0.601300 FVAR 0.14504 CE1 6 0.858890 0.634573 0.741799 11.00000 0.02386 0.02767 = 0.02880 0.00754 0.00702 0.00174 SI1 4 0.777276 0.364240 0.552577 11.00000 0.04090 0.03608 = 0.03558 0.00339 0.01192 0.01007 SI2 4 0.534919 0.714291 0.787472 11.00000 0.03734 0.04620 = 0.03730 0.00506 0.01146 0.01555 SI3 4 0.809527 0.889899 0.615304 11.00000 0.04913 0.04736 = 0.03415 0.02008 0.01335 0.01361 SI4 4 1.071965 0.768370 0.960894 11.00000 0.05515 0.04500 = 0.03132 0.01416 -0.00201 -0.00470 C1 1 0.751118 0.433531 0.643629 11.00000 0.02995 0.02667 = 0.03171 0.00458 0.00970 0.00477 C2 1 0.666589 0.504601 0.634859 11.00000 0.02758 0.03362 = 0.02745 0.00600 0.00512 0.00162 AFIX 43 H2A 2 0.635177 0.503886 0.583137 11.00000 -1.20000 AFIX 0 C3 1 0.616004 0.576101 0.681368 11.00000 0.02343 0.03354 = 0.03419 0.00815 0.00551 0.00312 AFIX 43 H3A 2 0.560940 0.610755 0.652456 11.00000 -1.20000 AFIX 0 C4 1 0.626094 0.609535 0.759951 11.00000 0.02601 0.03149 = 0.03188 0.00746 0.00923 0.00288 C5 1 0.694710 0.576492 0.823150 11.00000 0.03173 0.03505 = 0.03149 0.00878 0.01280 0.00388 AFIX 43 H5A 2 0.684495 0.614309 0.869442 11.00000 -1.20000 AFIX 0 C6 1 0.773379 0.502520 0.834510 11.00000 0.03524 0.04047 = 0.03021 0.01531 0.00769 0.00429 AFIX 43 H6A 2 0.799190 0.499584 0.886179 11.00000 -1.20000 AFIX 0 C7 1 0.823615 0.431255 0.787763 11.00000 0.03600 0.03479 = 0.03904 0.01868 0.00556 0.00763 AFIX 43 H7A 2 0.875359 0.392655 0.815738 11.00000 -1.20000 AFIX 0 C8 1 0.815324 0.403834 0.709776 11.00000 0.03418 0.02791 = 0.04053 0.00952 0.01022 0.01000 AFIX 43 H8A 2 0.864741 0.352889 0.698280 11.00000 -1.20000 AFIX 0 C9 1 0.768349 0.458564 0.482750 11.00000 0.08594 0.06047 = 0.04634 0.01569 0.03400 0.02527 AFIX 33 H9A 2 0.827492 0.527620 0.503700 11.00000 -1.50000 H9B 2 0.688772 0.476278 0.471841 11.00000 -1.50000 H9C 2 0.784113 0.421137 0.436181 11.00000 -1.50000 AFIX 0 C10 1 0.663487 0.232348 0.512289 11.00000 0.07901 0.04978 = 0.05302 -0.00689 0.01226 -0.00147 AFIX 33 H10A 2 0.668274 0.182633 0.548576 11.00000 -1.50000 H10B 2 0.678761 0.195195 0.465479 11.00000 -1.50000 H10C 2 0.584018 0.250358 0.501778 11.00000 -1.50000 AFIX 0 C11 1 0.928083 0.326678 0.565039 11.00000 0.06007 0.08848 = 0.05821 0.00725 0.02193 0.03426 AFIX 33 H11A 2 0.989272 0.394378 0.585702 11.00000 -1.50000 H11B 2 0.938158 0.291341 0.516180 11.00000 -1.50000 H11C 2 0.935554 0.274704 0.599742 11.00000 -1.50000 AFIX 0 C12 1 0.629723 0.849199 0.845243 11.00000 0.07481 0.04296 = 0.06612 0.00449 0.03238 0.01134 AFIX 33 H12A 2 0.682303 0.881555 0.816298 11.00000 -1.50000 H12B 2 0.677584 0.835124 0.891644 11.00000 -1.50000 H12C 2 0.578754 0.901318 0.857933 11.00000 -1.50000 AFIX 0 C13 1 0.438306 0.660912 0.848013 11.00000 0.05288 0.07317 = 0.08780 0.00569 0.04316 0.01315 AFIX 33 H13A 2 0.488069 0.644726 0.892972 11.00000 -1.50000 H13B 2 0.382857 0.592575 0.819537 11.00000 -1.50000 H13C 2 0.393537 0.717559 0.863146 11.00000 -1.50000 AFIX 0 C14 1 0.434300 0.742825 0.702549 11.00000 0.11355 0.13892 = 0.05422 0.00502 0.00566 0.10013 AFIX 33 H14A 2 0.481976 0.771389 0.669670 11.00000 -1.50000 H14B 2 0.388924 0.798391 0.718576 11.00000 -1.50000 H14C 2 0.379456 0.673598 0.675051 11.00000 -1.50000 AFIX 0 C15 1 0.907924 0.827048 0.684136 11.00000 0.03517 0.03313 = 0.02827 0.01273 0.01055 0.00289 C16 1 0.915290 0.865391 0.762314 11.00000 0.03580 0.02731 = 0.03391 0.01101 0.01104 0.00491 AFIX 43 H16A 2 0.872471 0.923730 0.769586 11.00000 -1.20000 AFIX 0 C17 1 0.969347 0.839785 0.832009 11.00000 0.03715 0.02934 = 0.02757 0.00425 0.00941 0.00053 AFIX 43 H17A 2 0.951672 0.884692 0.873208 11.00000 -1.20000 AFIX 0 C18 1 1.043368 0.764499 0.856998 11.00000 0.02971 0.03456 = 0.03093 0.01008 0.00249 -0.00199 C19 1 1.096908 0.687789 0.816183 11.00000 0.02545 0.04062 = 0.04261 0.01362 0.00087 0.00283 AFIX 43 H19A 2 1.144519 0.650948 0.848416 11.00000 -1.20000 AFIX 0 C20 1 1.097205 0.652429 0.739657 11.00000 0.02487 0.04127 = 0.05410 0.00914 0.01636 0.00925 AFIX 43 H20A 2 1.146399 0.599217 0.733459 11.00000 -1.20000 AFIX 0 C21 1 1.042228 0.676971 0.670340 11.00000 0.03208 0.04348 = 0.04107 0.00531 0.01948 0.00587 AFIX 43 H21A 2 1.063240 0.636028 0.628891 11.00000 -1.20000 AFIX 0 C22 1 0.964025 0.747179 0.647723 11.00000 0.03695 0.03904 = 0.02895 0.00940 0.01293 0.00242 AFIX 43 H22A 2 0.943045 0.739604 0.594532 11.00000 -1.20000 AFIX 0 C23 1 0.723617 0.983138 0.661923 11.00000 0.10854 0.11183 = 0.06916 0.04877 0.03928 0.07355 AFIX 33 H23A 2 0.673898 1.013589 0.623844 11.00000 -1.50000 H23B 2 0.778894 1.044471 0.698818 11.00000 -1.50000 H23C 2 0.673100 0.940150 0.687502 11.00000 -1.50000 AFIX 0 C24 1 0.900650 0.978139 0.567111 11.00000 0.08572 0.08714 = 0.06422 0.04913 0.02195 0.00895 AFIX 33 H24A 2 0.947166 0.932742 0.541417 11.00000 -1.50000 H24B 2 0.954450 1.039896 0.604461 11.00000 -1.50000 H24C 2 0.848166 1.008097 0.530157 11.00000 -1.50000 AFIX 0 C25 1 0.701730 0.780820 0.540905 11.00000 0.07645 0.07318 = 0.07237 0.02355 -0.02015 0.00775 AFIX 33 H25A 2 0.744795 0.730668 0.515894 11.00000 -1.50000 H25B 2 0.656908 0.816462 0.503812 11.00000 -1.50000 H25C 2 0.646771 0.737940 0.563865 11.00000 -1.50000 AFIX 0 C26 1 0.934158 0.779859 0.995844 11.00000 0.10004 0.16611 = 0.04488 0.03605 0.02922 0.02626 AFIX 33 H26A 2 0.951507 0.781360 1.050122 11.00000 -1.50000 H26B 2 0.871157 0.715505 0.969661 11.00000 -1.50000 H26C 2 0.908052 0.848695 0.985949 11.00000 -1.50000 AFIX 0 C27 1 1.119562 0.640984 0.986966 11.00000 0.20059 0.09438 = 0.06396 0.04553 0.01294 0.05562 AFIX 33 H27A 2 1.192035 0.631825 0.970394 11.00000 -1.50000 H27B 2 1.056568 0.575820 0.962554 11.00000 -1.50000 H27C 2 1.135257 0.647934 1.041739 11.00000 -1.50000 AFIX 0 C28 1 1.186481 0.891434 1.015258 11.00000 0.16590 0.11740 = 0.04492 0.01644 -0.02130 -0.07479 AFIX 33 H28A 2 1.260823 0.888943 0.999547 11.00000 -1.50000 H28B 2 1.199849 0.890345 1.069123 11.00000 -1.50000 H28C 2 1.159195 0.959948 1.005788 11.00000 -1.50000 AFIX 0 LI1 5 0.330335 0.201322 0.786071 11.00000 0.04234 0.03566 = 0.04341 0.00758 0.01201 0.00074 O1 3 0.387823 0.356611 0.867226 11.00000 0.04961 0.05103 = 0.04721 -0.00722 0.01745 -0.00281 O2 3 0.166254 0.241054 0.817849 11.00000 0.04293 0.04656 = 0.05935 0.00207 0.00826 0.00941 O3 3 0.352391 0.089741 0.867988 11.00000 0.05927 0.05188 = 0.06857 0.02256 0.01626 -0.00359 O4 3 0.237344 0.048813 0.720842 11.00000 0.06132 0.04223 = 0.06002 -0.00263 0.01751 -0.00694 O5 3 0.501886 0.205032 0.771249 11.00000 0.04442 0.05860 = 0.06218 0.00959 0.02556 0.00889 O6 3 0.325486 0.280533 0.690621 11.00000 0.06324 0.05468 = 0.04773 0.02075 0.01390 0.00296 C29 1 0.508283 0.395082 0.910733 11.00000 0.05259 0.06096 = 0.05745 -0.00483 0.01203 -0.01051 AFIX 33 H29A 2 0.514845 0.467123 0.943738 11.00000 -1.50000 H29B 2 0.561252 0.403723 0.876760 11.00000 -1.50000 H29C 2 0.530861 0.340624 0.941356 11.00000 -1.50000 AFIX 0 C30 1 0.303151 0.387587 0.906706 11.00000 0.06345 0.04911 = 0.05700 -0.00643 0.02607 0.00258 AFIX 23 H30A 2 0.322139 0.469055 0.926673 11.00000 -1.20000 H30B 2 0.304293 0.348843 0.949578 11.00000 -1.20000 AFIX 0 C31 1 0.183136 0.355550 0.853159 11.00000 0.06304 0.04971 = 0.06434 0.00674 0.02420 0.01686 AFIX 23 H31A 2 0.120796 0.366291 0.880703 11.00000 -1.20000 H31B 2 0.177967 0.402882 0.814713 11.00000 -1.20000 AFIX 0 C32 1 0.046905 0.194437 0.776273 11.00000 0.04332 0.07690 = 0.06633 0.00564 0.00499 0.00792 AFIX 33 H32A 2 -0.008339 0.226152 0.802411 11.00000 -1.50000 H32B 2 0.032135 0.113286 0.772117 11.00000 -1.50000 H32C 2 0.035116 0.211920 0.725793 11.00000 -1.50000 AFIX 0 C33 1 0.382902 0.119946 0.947328 11.00000 0.11470 0.09128 = 0.06379 0.03242 0.01423 -0.01039 AFIX 33 H33A 2 0.385742 0.052706 0.968805 11.00000 -1.50000 H33B 2 0.323243 0.158301 0.964080 11.00000 -1.50000 H33C 2 0.460906 0.169803 0.964186 11.00000 -1.50000 AFIX 0 C34 1 0.253409 -0.000087 0.840451 11.00000 0.07568 0.05709 = 0.09692 0.03733 0.01319 -0.01171 AFIX 23 H34A 2 0.180077 0.025525 0.847715 11.00000 -1.20000 H34B 2 0.264538 -0.060923 0.868479 11.00000 -1.20000 AFIX 0 C35 1 0.242672 -0.041008 0.760205 11.00000 0.08128 0.03213 = 0.10845 0.00557 0.01572 -0.00084 AFIX 23 H35A 2 0.311817 -0.074820 0.753636 11.00000 -1.20000 H35B 2 0.169894 -0.099190 0.739296 11.00000 -1.20000 AFIX 0 C36 1 0.232125 0.013692 0.642960 11.00000 0.08715 0.08028 = 0.06538 -0.02733 0.01792 -0.01479 AFIX 33 H36A 2 0.183012 -0.061286 0.624620 11.00000 -1.50000 H36B 2 0.312505 0.012448 0.636220 11.00000 -1.50000 H36C 2 0.197270 0.065763 0.614486 11.00000 -1.50000 AFIX 0 C37 1 0.581372 0.136782 0.796209 11.00000 0.07144 0.13252 = 0.13458 0.04260 0.04963 0.05403 AFIX 33 H37A 2 0.655652 0.157410 0.781130 11.00000 -1.50000 H37B 2 0.545916 0.058457 0.773658 11.00000 -1.50000 H37C 2 0.597824 0.147017 0.851196 11.00000 -1.50000 AFIX 0 C38 1 0.518170 0.238707 0.703919 11.00000 0.05418 0.09283 = 0.05821 0.00307 0.03032 -0.01469 AFIX 23 H38A 2 0.493263 0.173788 0.661430 11.00000 -1.20000 H38B 2 0.602970 0.270385 0.709292 11.00000 -1.20000 AFIX 0 C39 1 0.444576 0.324519 0.689262 11.00000 0.08688 0.06572 = 0.05159 0.01491 0.02381 -0.02797 AFIX 23 H39A 2 0.476456 0.393347 0.728291 11.00000 -1.20000 H39B 2 0.446584 0.343377 0.639538 11.00000 -1.20000 AFIX 0 C40 1 0.245705 0.351762 0.668177 11.00000 0.13649 0.11864 = 0.08004 0.06161 0.03655 0.06613 AFIX 33 H40A 2 0.261420 0.377584 0.623251 11.00000 -1.50000 H40B 2 0.257184 0.416185 0.709101 11.00000 -1.50000 H40C 2 0.163725 0.310429 0.656765 11.00000 -1.50000 AFIX 0 HKLF 4 REM mm148 in P-1 REM R1 = 0.0362 for 11104 Fo > 4sig(Fo) and 0.0530 for all 13751 data REM 469 parameters refined using 0 restraints END WGHT 0.0331 0.7611 REM Highest difference peak 0.696, deepest hole -0.539, 1-sigma level 0.082 Q1 1 0.8603 0.5609 0.7519 11.00000 0.05 0.70 Q2 1 0.8584 0.7123 0.7289 11.00000 0.05 0.67 Q3 1 0.8933 0.6449 0.7901 11.00000 0.05 0.61 Q4 1 0.8406 0.6925 0.7667 11.00000 0.05 0.60 Q5 1 0.9575 0.6156 0.7477 11.00000 0.05 0.58 ; _shelx_res_checksum 7600 _shelx_hkl_file ; 2 0 0 75.06 1.34 3 0 0 222.01 3.70 -4 0 0 83.81 2.22 4 0 0 85.54 1.73 4 0 0 83.92 1.67 -5 0 0 10.93 0.75 5 0 0 10.82 0.56 5 0 0 10.58 0.60 5 0 0 11.05 0.56 -6 0 0 18.92 1.07 6 0 0 19.04 0.79 6 0 0 19.41 0.81 6 0 0 20.25 0.84 -7 0 0 0.38 0.45 7 0 0 0.03 0.39 7 0 0 0.79 0.41 7 0 0 0.32 0.31 -8 0 0 7.97 1.01 8 0 0 6.59 0.81 8 0 0 8.05 0.85 -9 0 0 1.21 0.79 9 0 0 1.07 0.54 9 0 0 1.77 0.55 -10 0 0 32.28 1.97 10 0 0 32.44 1.30 10 0 0 32.78 1.51 -11 0 0 30.73 2.06 11 0 0 31.42 1.57 -12 0 0 3.52 1.09 12 0 0 2.91 0.82 -13 0 0 9.54 1.51 13 0 0 9.71 1.18 -14 0 0 5.66 1.39 -15 0 0 2.48 1.28 -16 0 0 -0.04 1.15 -16 1 0 6.50 1.65 -15 1 0 -0.46 0.90 -14 1 0 5.62 1.28 13 -1 0 26.40 1.62 -13 1 0 27.30 2.26 12 -1 0 2.57 0.79 -12 1 0 2.96 1.06 11 -1 0 24.80 1.40 -11 1 0 24.70 1.91 10 -1 0 18.76 1.22 -10 1 0 20.39 1.70 9 -1 0 51.75 1.75 9 -1 0 51.40 1.54 -9 1 0 50.48 2.25 8 -1 0 3.38 0.61 8 -1 0 3.60 0.52 -8 1 0 4.07 0.81 7 -1 0 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6 5 0 11.22 1.12 6 5 0 11.35 0.98 6 5 0 12.23 1.00 -7 -5 0 3.45 0.83 7 5 0 5.03 0.80 7 5 0 4.75 0.79 7 5 0 4.73 0.83 -8 -5 0 80.35 2.92 8 5 0 86.77 2.46 8 5 0 81.28 2.43 -9 -5 0 6.16 1.05 9 5 0 5.16 0.83 9 5 0 5.34 0.87 -10 -5 0 0.62 0.79 10 5 0 0.75 0.69 10 5 0 1.28 0.79 -11 -5 0 24.75 2.03 11 5 0 24.57 1.51 11 5 0 26.74 1.57 12 5 0 12.65 1.44 12 5 0 11.71 1.41 13 5 0 0.99 0.77 13 5 0 1.16 0.94 14 5 0 1.29 0.95 -16 6 0 -0.16 1.35 -15 6 0 2.67 1.48 -14 6 0 1.93 1.30 -13 6 0 5.67 1.31 12 -6 0 14.49 1.20 -12 6 0 13.72 1.66 11 -6 0 28.81 1.44 -11 6 0 26.17 2.01 10 -6 0 4.44 0.70 -10 6 0 3.72 0.92 9 -6 0 61.94 1.91 -9 6 0 61.88 2.72 8 -6 0 167.21 3.53 7 -6 0 2.56 0.48 6 -6 0 93.78 3.11 6 -6 0 93.21 1.87 6 -6 0 92.87 2.45 6 -6 0 91.61 2.18 5 -6 0 132.75 3.24 5 -6 0 134.69 2.77 5 -6 0 131.84 2.50 5 -6 0 130.36 3.73 4 -6 0 22.26 0.87 4 -6 0 22.38 0.76 4 -6 0 23.78 1.37 -4 6 0 22.85 0.73 3 -6 0 -0.10 0.25 3 -6 0 -0.02 0.31 3 -6 0 -0.01 0.26 3 -6 0 -0.10 0.95 -3 6 0 0.24 0.22 2 -6 0 71.95 2.16 2 -6 0 75.25 2.50 2 -6 0 73.03 1.73 2 -6 0 73.07 1.66 -2 6 0 73.56 1.60 1 -6 0 106.47 2.23 1 -6 0 97.41 2.18 1 -6 0 103.64 2.80 1 -6 0 100.09 2.82 -1 6 0 103.80 2.12 0 -6 0 3.41 0.42 0 -6 0 4.52 0.58 0 -6 0 3.59 0.56 0 -6 0 3.88 0.58 0 6 0 4.49 0.51 0 6 0 4.53 0.50 -1 -6 0 6.05 0.76 -1 -6 0 7.54 0.75 -1 -6 0 7.63 0.61 1 6 0 7.73 0.65 1 6 0 6.97 0.57 -2 -6 0 69.94 2.29 -2 -6 0 74.22 2.23 -2 -6 0 71.33 1.84 2 6 0 68.53 1.79 2 6 0 72.88 1.81 -3 -6 0 25.37 1.34 -3 -6 0 25.04 1.12 -3 -6 0 27.79 1.34 3 6 0 25.76 1.41 3 6 0 27.04 1.09 3 6 0 27.36 1.16 -4 -6 0 -0.11 0.46 -4 -6 0 0.66 0.47 4 6 0 -0.19 0.50 4 6 0 -0.21 0.36 4 6 0 0.30 0.54 -5 -6 0 56.73 2.15 -5 -6 0 59.25 2.26 5 6 0 60.69 1.82 5 6 0 59.73 1.88 5 6 0 58.56 2.30 -6 -6 0 18.96 1.37 6 6 0 17.50 1.39 6 6 0 18.13 1.20 6 6 0 19.14 1.23 -7 -6 0 29.60 1.70 7 6 0 30.51 1.50 7 6 0 29.33 1.71 7 6 0 30.39 1.50 -8 -6 0 15.30 1.40 8 6 0 16.83 1.39 8 6 0 16.07 1.23 8 6 0 16.76 1.24 -9 -6 0 8.46 1.28 9 6 0 8.81 1.11 9 6 0 8.31 0.99 -10 -6 0 18.37 1.66 10 6 0 19.06 1.39 10 6 0 16.82 1.42 11 6 0 -0.19 0.57 11 6 0 -0.70 0.75 12 6 0 8.58 1.24 12 6 0 6.91 1.17 13 6 0 10.38 1.36 13 6 0 8.94 1.34 -15 7 0 3.04 1.42 -14 7 0 22.03 2.56 -13 7 0 0.51 0.99 -12 7 0 2.74 1.13 11 -7 0 44.60 1.75 -11 7 0 39.86 2.41 10 -7 0 17.60 1.18 -10 7 0 18.06 1.67 9 -7 0 4.11 0.67 8 -7 0 52.43 1.71 7 -7 0 19.36 1.04 6 -7 0 4.52 0.92 6 -7 0 5.61 0.69 6 -7 0 6.21 0.64 5 -7 0 50.77 1.51 5 -7 0 49.43 1.25 5 -7 0 45.50 2.07 -5 7 0 49.59 1.22 4 -7 0 89.09 1.93 4 -7 0 90.12 2.12 4 -7 0 84.60 2.93 4 -7 0 88.60 2.56 -4 7 0 91.06 1.88 3 -7 0 51.29 1.83 3 -7 0 52.48 1.49 3 -7 0 53.26 1.38 3 -7 0 52.17 2.29 -3 7 0 52.57 1.30 2 -7 0 0.38 0.54 2 -7 0 -0.31 0.23 2 -7 0 0.06 0.34 2 -7 0 -0.15 0.36 -2 7 0 0.33 0.28 1 -7 0 152.22 3.13 1 -7 0 151.88 3.94 1 -7 0 157.22 3.17 1 -7 0 153.69 4.00 -1 7 0 157.52 3.03 -1 7 0 153.04 3.16 0 -7 0 151.46 3.22 0 -7 0 150.34 3.94 0 -7 0 154.69 3.93 0 -7 0 148.26 3.11 0 7 0 155.19 3.06 0 7 0 145.61 3.10 -1 -7 0 12.49 0.96 -1 -7 0 9.99 0.99 -1 -7 0 12.16 0.75 1 7 0 12.24 0.77 1 7 0 11.56 0.76 -2 -7 0 25.84 1.34 -2 -7 0 27.51 1.45 -2 -7 0 29.17 1.16 2 7 0 26.79 1.17 2 7 0 26.47 1.18 -3 -7 0 62.57 2.19 -3 -7 0 61.81 1.89 -3 -7 0 61.14 2.31 3 7 0 59.23 1.80 3 7 0 61.87 1.86 3 7 0 62.93 2.39 -4 -7 0 27.48 1.60 -4 -7 0 29.86 1.53 4 7 0 28.24 1.33 4 7 0 29.35 1.42 4 7 0 28.56 1.73 -5 -7 0 10.02 1.13 -5 -7 0 10.21 1.19 5 7 0 9.64 1.03 5 7 0 8.24 1.10 5 7 0 8.63 1.01 -6 -7 0 23.38 1.55 6 7 0 23.93 1.30 6 7 0 23.90 1.38 6 7 0 24.82 1.68 -7 -7 0 15.63 1.42 7 7 0 14.40 1.40 7 7 0 13.30 1.16 7 7 0 17.83 1.25 -8 -7 0 0.68 0.73 8 7 0 0.53 0.78 8 7 0 1.73 0.77 8 7 0 0.84 0.66 9 7 0 2.96 0.75 9 7 0 2.72 0.82 10 7 0 17.73 1.56 10 7 0 20.37 1.54 11 7 0 22.68 1.70 11 7 0 21.88 1.80 12 7 0 0.01 0.83 12 7 0 0.16 0.79 13 7 0 5.33 1.19 -15 8 0 -0.22 1.34 -14 8 0 21.36 2.51 -13 8 0 4.55 1.33 -12 8 0 0.74 0.99 11 -8 0 6.29 0.85 -11 8 0 5.83 1.20 10 -8 0 22.57 1.26 -10 8 0 21.13 1.81 9 -8 0 1.32 0.53 8 -8 0 5.40 0.67 7 -8 0 20.72 1.07 7 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102.39 3.44 -5 -8 0 38.89 1.90 -5 -8 0 40.48 2.06 5 8 0 38.34 1.67 5 8 0 37.76 2.10 5 8 0 37.96 1.66 -6 -8 0 -3.96 1.22 -6 -8 0 0.96 0.66 6 8 0 1.57 0.69 6 8 0 1.24 0.72 6 8 0 1.24 0.66 -7 -8 0 8.79 1.21 7 8 0 7.48 1.10 7 8 0 9.79 1.15 7 8 0 7.96 1.16 8 8 0 33.54 1.75 8 8 0 33.58 2.07 8 8 0 31.37 1.72 9 8 0 0.47 0.73 9 8 0 -0.28 0.60 10 8 0 4.28 0.90 10 8 0 3.70 1.06 11 8 0 18.69 1.56 11 8 0 20.46 1.84 12 8 0 3.57 1.09 -15 9 0 0.64 1.15 -14 9 0 0.21 1.19 -13 9 0 7.75 1.58 -12 9 0 0.39 0.79 11 -9 0 -0.22 0.50 -11 9 0 0.15 0.86 10 -9 0 5.79 0.81 9 -9 0 8.93 0.93 8 -9 0 14.85 1.04 7 -9 0 5.82 0.76 7 -9 0 6.84 1.19 6 -9 0 45.54 2.36 6 -9 0 46.73 1.66 5 -9 0 51.37 2.12 5 -9 0 54.28 1.75 5 -9 0 52.60 2.43 4 -9 0 3.55 0.62 4 -9 0 3.62 0.57 4 -9 0 4.21 0.84 4 -9 0 3.76 1.35 -4 9 0 4.31 0.53 3 -9 0 18.93 1.05 3 -9 0 14.80 1.28 3 -9 0 14.73 2.25 3 -9 0 16.45 1.00 -3 9 0 16.56 0.88 2 -9 0 81.64 2.20 2 -9 0 83.26 3.08 2 -9 0 79.50 2.17 2 -9 0 79.15 2.74 -2 9 0 84.87 2.06 -2 9 0 78.20 2.21 1 -9 0 50.11 1.81 1 -9 0 48.97 2.17 1 -9 0 51.04 1.67 1 -9 0 54.19 2.34 -1 9 0 52.49 1.63 -1 9 0 49.21 1.73 0 -9 0 0.10 0.43 0 -9 0 0.91 0.62 0 -9 0 0.44 0.59 0 9 0 -0.45 0.51 0 9 0 0.50 0.54 -1 -9 0 8.33 1.13 -1 -9 0 9.29 1.16 -1 -9 0 9.35 0.85 1 9 0 10.25 0.91 1 9 0 10.76 0.94 -2 -9 0 60.95 2.00 -2 -9 0 62.99 2.44 -2 -9 0 61.93 2.55 2 9 0 65.70 2.02 2 9 0 67.41 2.11 -3 -9 0 5.85 0.78 -3 -9 0 5.68 0.93 -3 -9 0 6.09 1.03 3 9 0 6.94 1.12 3 9 0 5.09 0.78 3 9 0 6.34 0.86 -4 -9 0 14.39 1.37 -4 -9 0 11.97 1.21 4 9 0 11.71 1.51 4 9 0 11.23 1.22 4 9 0 13.67 1.15 -5 -9 0 57.71 2.55 -5 -9 0 57.13 2.43 5 9 0 58.97 2.03 5 9 0 57.76 2.18 5 9 0 53.01 2.54 -6 -9 0 1.37 1.84 -6 -9 0 6.64 1.03 6 9 0 7.42 1.18 6 9 0 6.96 0.96 6 9 0 5.30 0.92 7 9 0 0.47 0.75 7 9 0 0.18 0.67 7 9 0 0.86 0.72 8 9 0 48.92 2.56 8 9 0 50.41 2.15 8 9 0 44.35 2.09 9 9 0 22.86 1.67 9 9 0 27.62 2.22 9 9 0 22.07 1.65 10 9 0 0.47 0.82 10 9 0 -0.11 0.83 11 9 0 5.97 1.20 -14 10 0 1.26 1.24 -13 10 0 -0.69 1.00 -12 10 0 7.92 1.56 -11 10 0 18.65 1.88 10 -10 0 2.79 0.69 9 -10 0 25.87 1.38 8 -10 0 26.51 2.15 8 -10 0 27.88 1.34 7 -10 0 23.10 1.26 7 -10 0 21.01 1.85 6 -10 0 35.22 1.49 6 -10 0 34.86 2.31 5 -10 0 11.53 1.49 5 -10 0 11.19 0.96 5 -10 0 11.33 1.37 4 -10 0 10.92 1.73 4 -10 0 11.09 1.34 4 -10 0 10.91 0.89 4 -10 0 12.44 1.07 3 -10 0 7.43 0.89 3 -10 0 10.12 1.74 3 -10 0 8.90 1.18 3 -10 0 7.83 0.87 -3 10 0 7.80 0.80 2 -10 0 20.55 1.33 2 -10 0 21.12 1.69 2 -10 0 21.49 1.16 2 -10 0 19.53 1.93 -2 10 0 22.29 1.24 -2 10 0 22.17 1.15 1 -10 0 92.66 3.35 1 -10 0 95.76 2.57 1 -10 0 92.08 3.25 -1 10 0 95.22 2.46 -1 10 0 95.53 2.61 0 -10 0 16.82 1.47 0 -10 0 18.27 1.52 0 -10 0 17.27 1.10 0 10 0 18.44 1.17 0 10 0 16.58 1.20 -1 -10 0 0.24 0.54 -1 -10 0 -0.16 0.60 -1 -10 0 0.28 0.65 1 10 0 -0.04 0.58 1 10 0 -0.28 0.62 -2 -10 0 33.33 2.05 -2 -10 0 36.95 1.92 -2 -10 0 33.65 1.52 2 10 0 36.57 1.66 2 10 0 34.78 2.15 2 10 0 34.25 1.53 -3 -10 0 53.44 2.34 -3 -10 0 53.29 1.98 -3 -10 0 58.36 2.62 3 10 0 55.48 2.61 3 10 0 58.45 2.04 3 10 0 52.33 1.93 -4 -10 0 10.74 1.27 -4 -10 0 17.53 1.61 4 10 0 10.47 1.13 4 10 0 9.70 1.10 4 10 0 10.60 1.44 -5 -10 0 13.27 1.61 5 10 0 12.37 1.11 5 10 0 9.15 1.10 5 10 0 10.07 1.52 6 10 0 8.55 1.05 6 10 0 10.49 1.45 6 10 0 6.61 1.00 7 10 0 4.27 1.11 7 10 0 7.57 1.11 7 10 0 4.42 1.01 8 10 0 0.30 0.62 8 10 0 0.47 0.87 8 10 0 0.98 0.88 9 10 0 16.29 1.47 9 10 0 16.41 1.93 9 10 0 13.98 1.55 10 10 0 8.52 1.22 11 10 0 0.16 0.83 -14 11 0 3.10 1.39 -13 11 0 1.46 1.17 -12 11 0 2.65 1.26 10 -11 0 12.75 1.16 9 -11 0 0.75 0.55 8 -11 0 10.05 1.69 8 -11 0 11.30 1.06 7 -11 0 39.90 1.64 7 -11 0 39.80 2.44 6 -11 0 4.81 1.14 6 -11 0 2.88 0.61 6 -11 0 5.28 1.08 5 -11 0 -0.09 0.39 5 -11 0 0.08 0.79 4 -11 0 24.40 1.73 4 -11 0 24.18 2.54 4 -11 0 25.95 1.35 3 -11 0 36.84 1.60 3 -11 0 37.50 2.14 3 -11 0 37.82 1.61 3 -11 0 38.29 2.96 -3 11 0 36.27 1.61 -3 11 0 38.00 1.45 2 -11 0 1.98 1.22 2 -11 0 3.82 0.95 2 -11 0 2.89 0.68 -2 11 0 1.87 0.69 -2 11 0 1.95 0.61 1 -11 0 22.26 1.87 1 -11 0 23.79 1.82 1 -11 0 20.99 1.22 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3.73 0.98 4 -12 0 1.75 0.58 4 -12 0 2.04 1.36 4 -12 0 3.25 0.98 -4 12 0 2.58 0.71 3 -12 0 63.07 3.68 3 -12 0 68.19 2.30 3 -12 0 74.96 3.04 -3 12 0 66.94 2.28 2 -12 0 28.68 1.44 2 -12 0 30.64 2.03 2 -12 0 30.00 2.57 -2 12 0 30.77 1.62 -2 12 0 27.14 1.42 1 -12 0 3.20 0.73 1 -12 0 3.30 1.14 1 -12 0 5.26 1.24 -1 12 0 3.55 0.69 -1 12 0 3.94 0.81 0 -12 0 15.77 1.23 0 -12 0 18.54 1.87 0 -12 0 14.54 1.84 0 12 0 15.85 1.29 0 12 0 15.71 1.30 -1 -12 0 16.26 1.59 -1 -12 0 17.23 1.29 -1 -12 0 22.90 1.97 1 12 0 15.85 1.37 1 12 0 15.17 1.20 1 12 0 15.73 1.84 -2 -12 0 3.15 0.95 -2 -12 0 4.75 0.80 2 12 0 4.30 0.96 2 12 0 4.55 0.83 2 12 0 6.02 1.25 -3 -12 0 1.00 0.61 3 12 0 2.05 1.02 3 12 0 3.05 0.79 3 12 0 2.02 0.90 4 12 0 6.77 1.34 4 12 0 5.83 0.99 4 12 0 3.72 1.03 -5 -12 0 6.65 2.85 5 12 0 11.84 1.22 5 12 0 12.45 1.38 5 12 0 10.85 1.60 6 12 0 -0.66 0.85 6 12 0 -0.90 0.72 6 12 0 0.46 0.70 7 12 0 6.87 1.33 7 12 0 8.51 1.51 7 12 0 9.55 1.24 8 12 0 14.42 1.99 8 12 0 9.16 1.27 9 12 0 3.13 1.05 -12 13 0 5.00 1.49 9 -13 0 14.10 1.29 7 -13 0 0.63 0.60 6 -13 0 15.72 1.26 5 -13 0 22.22 1.65 4 -13 0 0.97 1.35 4 -13 0 0.49 0.58 -4 13 0 2.51 0.78 3 -13 0 3.43 2.06 3 -13 0 4.79 0.80 -3 13 0 6.04 0.90 2 -13 0 5.08 0.84 2 -13 0 2.86 1.76 2 -13 0 9.78 1.63 -2 13 0 5.49 0.89 -2 13 0 4.46 0.83 1 -13 0 2.39 1.36 1 -13 0 2.75 0.70 -1 13 0 3.37 0.79 -1 13 0 2.49 0.79 0 -13 0 -1.33 1.00 0 -13 0 3.22 1.18 0 -13 0 1.03 0.55 0 13 0 -0.23 0.59 0 13 0 -0.07 0.55 0 13 0 -0.56 0.81 -1 -13 0 13.05 1.26 1 13 0 11.30 1.70 1 13 0 12.66 1.32 1 13 0 11.36 1.37 -2 -13 0 26.82 1.66 2 13 0 24.64 1.65 2 13 0 28.56 2.23 2 13 0 24.02 1.58 -3 -13 0 14.97 1.32 3 13 0 13.45 1.83 3 13 0 12.91 1.26 3 13 0 13.60 1.57 5 13 0 18.52 1.67 5 13 0 20.51 2.09 5 13 0 21.09 1.60 6 13 0 10.54 1.70 6 13 0 14.26 1.47 7 13 0 1.00 1.01 7 13 0 -0.44 0.84 8 13 0 5.16 1.36 8 13 0 3.83 1.08 -12 14 0 1.32 1.06 9 -14 0 8.15 1.12 5 -14 0 47.70 2.21 5 -14 0 56.70 2.14 4 -14 0 13.08 1.24 -4 14 0 15.09 1.43 3 -14 0 0.60 0.67 3 -14 0 -1.78 1.80 -3 14 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2.10 7 -10 9 20.42 2.13 7 -10 9 12.65 1.69 7 -10 9 14.64 1.21 8 -10 9 3.64 1.49 8 -10 9 -0.26 0.54 10 -10 9 6.42 1.11 11 -10 9 0.61 0.83 -12 10 -9 3.76 1.36 12 -10 9 2.64 1.02 -12 -9 9 2.39 1.34 -11 -9 9 17.84 2.23 10 9 -9 13.88 1.46 -10 -9 9 14.18 2.00 9 9 -9 1.16 0.80 -9 -9 9 1.58 0.94 8 9 -9 18.22 1.38 8 9 -9 19.44 1.25 -8 -9 9 17.98 1.94 7 9 -9 23.71 1.56 7 9 -9 22.44 1.31 -7 -9 9 22.53 2.02 -7 -9 9 28.42 1.89 6 9 -9 0.66 0.71 6 9 -9 1.83 0.58 -6 -9 9 2.21 0.59 -6 -9 9 0.56 0.77 -6 -9 9 0.71 0.88 5 9 -9 12.85 1.19 5 9 -9 12.80 1.02 -5 -9 9 12.03 0.99 -5 -9 9 10.72 1.51 -5 -9 9 10.71 1.52 4 9 -9 105.22 2.78 4 9 -9 100.73 2.68 -4 -9 9 100.18 3.63 -4 -9 9 98.92 2.68 -4 -9 9 105.20 3.60 3 9 -9 25.58 1.28 3 9 -9 25.97 1.39 -3 -9 9 26.76 1.83 -3 -9 9 27.69 1.93 -3 -9 9 26.51 1.31 2 9 -9 1.70 0.64 2 9 -9 2.63 0.62 -2 -9 9 2.43 0.88 -2 -9 9 2.89 0.57 -2 -9 9 1.91 0.94 1 9 -9 58.03 1.74 -1 -9 9 54.29 1.81 -1 -9 9 56.37 2.55 -1 -9 9 54.68 2.51 0 9 -9 65.27 1.80 0 -9 9 66.78 2.06 0 -9 9 62.65 2.71 0 -9 9 63.53 2.66 1 -9 9 19.01 1.12 1 -9 9 21.19 1.64 1 -9 9 21.33 1.79 2 -9 9 5.20 1.11 2 -9 9 5.49 1.08 2 -9 9 6.34 0.80 3 -9 9 6.24 0.87 3 -9 9 6.66 1.42 3 -9 9 7.81 1.17 4 -9 9 1.58 0.63 4 -9 9 1.20 0.81 4 -9 9 -1.34 1.53 5 -9 9 4.58 1.84 5 -9 9 3.64 0.76 5 -9 9 3.10 0.91 6 -9 9 14.76 1.57 6 -9 9 7.87 1.23 6 -9 9 8.41 0.96 7 -9 9 20.94 1.35 7 -9 9 21.58 1.87 7 -9 9 23.27 2.17 8 -9 9 22.43 2.11 8 -9 9 19.15 1.38 9 -9 9 7.40 1.10 10 -9 9 17.50 1.57 11 -9 9 22.35 1.65 -12 9 -9 0.26 0.85 12 -9 9 0.17 0.81 -13 9 -9 1.65 1.23 13 -9 9 0.21 0.90 -13 -8 9 9.19 1.80 -12 -8 9 1.12 1.01 11 8 -9 2.89 0.82 -11 -8 9 1.45 1.02 10 8 -9 38.78 1.94 -10 -8 9 36.25 2.57 9 8 -9 17.72 1.33 -9 -8 9 17.13 1.79 8 8 -9 3.03 0.67 8 8 -9 2.41 0.82 -8 -8 9 1.07 0.86 7 8 -9 21.05 1.19 7 8 -9 20.45 1.42 -7 -8 9 21.05 1.61 -7 -8 9 23.67 1.92 6 8 -9 24.59 1.22 6 8 -9 24.51 1.35 -6 -8 9 24.09 1.22 -6 -8 9 24.07 1.89 -6 -8 9 21.44 1.64 5 8 -9 8.79 0.88 5 8 -9 8.36 0.97 -5 -8 9 6.92 0.82 -5 -8 9 6.37 1.08 -5 -8 9 7.42 1.11 4 8 -9 37.89 1.50 4 8 -9 38.69 1.64 -4 -8 9 37.40 2.05 -4 -8 9 40.44 2.13 -4 -8 9 37.19 1.47 3 8 -9 88.19 2.35 3 8 -9 89.20 2.34 -3 -8 9 84.99 3.13 -3 -8 9 80.82 2.25 -3 -8 9 87.22 3.05 2 8 -9 0.86 0.55 -2 -8 9 0.79 0.41 -2 -8 9 1.27 0.72 -2 -8 9 1.49 0.79 1 8 -9 6.20 0.67 -1 -8 9 6.94 0.78 -1 -8 9 4.76 0.97 -1 -8 9 5.37 0.98 0 8 -9 94.44 2.16 0 -8 9 94.40 3.24 0 -8 9 94.83 2.44 0 -8 9 93.76 3.19 1 -8 9 84.38 3.00 1 -8 9 89.65 3.13 1 -8 9 89.26 2.36 2 -8 9 13.23 1.49 2 -8 9 14.97 1.53 2 -8 9 14.00 0.98 3 -8 9 28.45 2.17 3 -8 9 29.62 1.83 3 -8 9 27.83 1.34 4 -8 9 17.63 2.25 4 -8 9 19.26 1.61 4 -8 9 19.23 1.19 5 -8 9 42.58 1.70 5 -8 9 45.53 2.25 5 -8 9 39.30 2.59 6 -8 9 0.13 0.73 6 -8 9 -0.59 0.54 7 -8 9 14.07 1.66 7 -8 9 13.49 1.12 7 -8 9 10.53 1.44 8 -8 9 12.99 1.28 8 -8 9 16.85 1.95 9 -8 9 1.08 0.64 10 -8 9 1.50 0.71 -11 8 -9 8.58 1.50 11 -8 9 11.01 1.36 -12 8 -9 4.40 1.34 12 -8 9 4.05 1.01 -13 8 -9 -0.41 1.09 13 -8 9 -0.18 0.74 -14 -7 9 -0.14 1.18 -13 -7 9 11.89 1.90 12 7 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16.31 1.32 -3 -6 9 17.63 1.40 2 6 -9 20.42 0.95 -2 -6 9 21.00 1.36 -2 -6 9 18.44 1.29 -2 -6 9 21.00 0.92 1 6 -9 102.67 2.23 -1 -6 9 102.57 3.12 -1 -6 9 104.15 2.36 -1 -6 9 103.47 3.15 0 6 -9 113.13 2.29 0 -6 9 109.35 3.28 0 -6 9 111.17 2.51 0 -6 9 115.49 3.36 -1 6 -9 12.86 0.60 1 -6 9 11.83 1.06 1 -6 9 11.31 1.21 1 -6 9 11.50 0.82 2 -6 9 28.57 1.62 2 -6 9 28.80 1.19 2 -6 9 32.77 1.73 3 -6 9 79.30 2.74 3 -6 9 80.79 3.04 3 -6 9 79.36 2.18 4 -6 9 4.00 1.46 4 -6 9 1.04 0.49 4 -6 9 1.34 0.71 5 -6 9 0.76 0.53 5 -6 9 0.65 0.74 5 -6 9 0.56 0.71 6 -6 9 37.76 1.62 6 -6 9 37.04 1.98 6 -6 9 41.78 2.29 7 -6 9 16.30 1.45 7 -6 9 16.79 1.26 7 -6 9 16.21 1.88 8 -6 9 0.39 0.69 8 -6 9 0.28 0.54 9 -6 9 40.76 1.92 -10 6 -9 21.49 1.93 10 -6 9 22.49 1.60 -11 6 -9 2.49 1.02 11 -6 9 1.88 0.88 -12 6 -9 6.96 1.60 12 -6 9 7.08 1.15 13 -6 9 9.16 1.37 -15 -5 9 5.30 1.60 -14 -5 9 5.28 1.43 13 5 -9 5.90 1.06 -13 -5 9 6.47 1.42 12 5 -9 4.77 0.95 -12 -5 9 4.01 1.30 11 5 -9 7.87 0.99 -11 -5 9 5.72 1.24 10 5 -9 40.31 1.82 -10 -5 9 40.19 2.38 9 5 -9 0.67 0.61 -9 -5 9 0.59 0.72 8 5 -9 12.26 1.04 -8 -5 9 13.89 1.47 7 5 -9 147.65 3.08 7 5 -9 145.24 3.41 -7 -5 9 149.37 4.47 -7 -5 9 150.27 3.92 6 5 -9 56.98 1.56 6 5 -9 55.27 1.80 -6 -5 9 55.64 2.47 -6 -5 9 54.07 2.03 -6 -5 9 55.03 1.55 5 5 -9 5.50 0.56 5 5 -9 4.95 0.67 -5 -5 9 5.46 0.55 -5 -5 9 6.37 1.01 -5 -5 9 6.16 0.94 4 5 -9 61.17 1.73 -4 -5 9 63.16 2.20 -4 -5 9 61.32 1.59 -4 -5 9 61.05 2.38 3 5 -9 15.21 0.87 -3 -5 9 14.56 0.71 -3 -5 9 14.25 1.13 -3 -5 9 14.48 1.15 2 5 -9 26.15 0.99 -2 -5 9 25.99 1.39 -2 -5 9 25.34 0.93 -2 -5 9 26.18 1.42 1 5 -9 43.59 1.22 -1 -5 9 44.20 1.29 -1 -5 9 43.98 1.79 -1 -5 9 45.15 1.81 0 5 -9 24.20 0.81 0 -5 9 24.02 1.37 0 -5 9 24.19 1.27 0 -5 9 23.64 0.93 -1 5 -9 1.53 0.27 1 -5 9 1.19 0.39 1 -5 9 1.23 0.48 1 -5 9 1.37 0.57 -2 5 -9 1.36 0.27 2 -5 9 1.16 0.59 2 -5 9 2.28 0.67 2 -5 9 1.62 0.42 3 -5 9 98.31 3.04 3 -5 9 97.97 2.48 3 -5 9 101.32 3.29 4 -5 9 102.22 3.13 4 -5 9 101.46 2.53 4 -5 9 91.51 3.35 5 -5 9 36.49 1.87 5 -5 9 37.30 1.99 5 -5 9 36.99 1.50 6 -5 9 0.24 0.55 6 -5 9 1.11 0.86 6 -5 9 0.76 0.75 7 -5 9 53.16 1.95 7 -5 9 53.03 2.29 8 -5 9 29.92 1.60 8 -5 9 29.79 1.84 -9 5 -9 2.96 0.89 9 -5 9 2.01 0.79 -10 5 -9 26.83 2.00 10 -5 9 27.37 1.73 11 -5 9 13.19 1.35 12 -5 9 0.36 0.79 13 -5 9 4.63 1.17 14 -5 9 6.40 1.34 -15 -4 9 -0.99 1.13 14 4 -9 2.52 0.83 -14 -4 9 1.35 1.31 13 4 -9 11.77 1.30 -13 -4 9 9.02 1.53 12 4 -9 6.76 1.00 -12 -4 9 5.84 1.35 11 4 -9 1.50 0.61 -11 -4 9 2.70 1.10 10 4 -9 11.54 1.05 -10 -4 9 13.04 1.68 9 4 -9 44.64 1.77 -9 -4 9 43.04 2.30 8 4 -9 0.22 0.62 -8 -4 9 0.07 0.85 7 4 -9 70.72 2.10 -7 -4 9 72.70 2.31 -7 -4 9 78.28 2.88 6 4 -9 181.92 3.84 6 4 -9 186.80 3.45 -6 -4 9 184.75 4.49 -6 -4 9 187.91 5.04 5 4 -9 0.55 0.31 5 4 -9 0.53 0.49 -5 -4 9 1.59 0.34 -5 -4 9 1.64 0.71 -5 -4 9 0.67 0.49 4 4 -9 2.15 0.36 4 4 -9 2.30 0.47 -4 -4 9 2.16 0.35 -4 -4 9 1.88 0.58 -4 -4 9 1.80 0.55 3 4 -9 109.05 2.39 -3 -4 9 110.79 2.21 -3 -4 9 109.63 3.13 -3 -4 9 108.41 3.02 2 4 -9 55.00 1.45 -2 -4 9 54.88 1.95 -2 -4 9 55.86 1.97 -2 -4 9 53.98 1.36 1 4 -9 0.88 0.29 -1 -4 9 1.27 0.48 -1 -4 9 1.16 0.31 -1 -4 9 1.04 0.51 0 4 -9 7.91 0.48 0 -4 9 7.46 0.57 0 -4 9 6.56 0.89 0 -4 9 7.50 0.80 -1 4 -9 34.11 0.94 1 -4 9 32.42 1.52 1 -4 9 35.50 1.47 1 -4 9 32.22 1.12 -2 4 -9 50.53 1.19 2 -4 9 50.68 1.52 2 -4 9 48.35 1.87 2 -4 9 49.46 1.93 3 -4 9 2.58 0.55 3 -4 9 0.74 1.03 3 -4 9 2.34 0.68 4 -4 9 64.38 2.40 4 -4 9 66.26 2.34 4 -4 9 63.58 1.88 5 -4 9 24.52 1.25 5 -4 9 23.18 1.58 5 -4 9 24.83 1.57 6 -4 9 3.76 0.92 6 -4 9 2.02 0.65 7 -4 9 38.40 1.67 7 -4 9 35.73 1.95 -8 4 -9 18.45 1.49 8 -4 9 17.64 1.27 8 -4 9 18.12 1.57 -9 4 -9 17.97 1.56 9 -4 9 14.03 1.26 10 -4 9 -0.03 0.75 11 -4 9 6.87 1.14 12 -4 9 13.14 1.47 13 -4 9 4.00 1.12 14 -4 9 -1.36 0.85 -15 -3 9 8.29 1.83 14 3 -9 0.35 0.59 -14 -3 9 -0.76 1.08 13 3 -9 10.35 1.10 -13 -3 9 8.41 1.61 12 3 -9 52.08 2.08 -12 -3 9 52.99 2.97 11 3 -9 3.28 0.70 -11 -3 9 3.31 1.03 10 3 -9 12.31 1.11 -10 -3 9 11.29 1.59 9 3 -9 57.75 1.97 -9 -3 9 54.25 2.64 8 3 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-3 10 170.06 4.11 1 -3 10 164.85 3.32 -2 3 -10 11.43 0.61 2 -3 10 10.90 1.17 2 -3 10 12.95 1.16 2 -3 10 12.75 0.77 -3 3 -10 39.68 1.11 3 -3 10 40.50 1.41 3 -3 10 38.64 1.92 3 -3 10 40.54 1.87 4 -3 10 23.50 1.38 4 -3 10 24.43 1.64 4 -3 10 24.06 1.19 5 -3 10 3.04 0.65 5 -3 10 2.82 0.82 5 -3 10 2.54 0.87 6 -3 10 10.62 1.06 6 -3 10 11.23 1.49 7 -3 10 46.43 1.85 7 -3 10 45.27 2.25 8 -3 10 0.30 0.75 8 -3 10 0.72 0.61 9 -3 10 -0.08 0.72 10 -3 10 22.14 1.71 11 -3 10 14.29 1.46 12 -3 10 1.94 1.05 13 -3 10 -0.10 1.00 15 2 -10 2.68 0.83 -15 -2 10 0.28 1.12 14 2 -10 15.73 1.29 -14 -2 10 15.09 2.17 13 2 -10 13.69 1.28 -13 -2 10 15.88 2.04 12 2 -10 5.32 0.86 -12 -2 10 3.49 1.22 11 2 -10 6.56 0.92 -11 -2 10 6.40 1.20 10 2 -10 4.82 0.79 -10 -2 10 4.54 1.12 9 2 -10 27.48 1.33 -9 -2 10 25.11 1.89 8 2 -10 4.47 0.74 -8 -2 10 4.10 1.04 7 2 -10 11.05 0.97 -7 -2 10 12.71 1.41 6 2 -10 25.67 1.18 -6 -2 10 24.22 1.20 -6 -2 10 25.43 1.60 5 2 -10 87.87 2.19 -5 -2 10 90.96 2.84 -5 -2 10 90.93 2.54 4 2 -10 -0.39 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