data_mo_molan465_0m_a _audit_creation_method 'SHELXL-2014/7' _shelx_SHELXL_version_number '2014/7' _chemical_name_systematic ? _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'C12 H14 O8' _chemical_formula_weight 286.23 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' _space_group_crystal_system monoclinic _space_group_IT_number 13 _space_group_name_H-M_alt 'P 2/n' _space_group_name_Hall '-P 2yac' _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+1/2, y, -z+1/2' '-x, -y, -z' 'x-1/2, -y, z-1/2' _cell_length_a 3.8541(4) _cell_length_b 6.0625(5) _cell_length_c 24.554(2) _cell_angle_alpha 90 _cell_angle_beta 94.163(4) _cell_angle_gamma 90 _cell_volume 572.21(9) _cell_formula_units_Z 2 _cell_measurement_temperature 100(2) _cell_measurement_reflns_used 5785 _cell_measurement_theta_min 3.33 _cell_measurement_theta_max 27.12 _exptl_crystal_description 'needle' _exptl_crystal_colour 'dark brown' _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _exptl_crystal_density_diffrn 1.661 _exptl_crystal_F_000 300 _exptl_transmission_factor_min ? _exptl_transmission_factor_max ? _exptl_crystal_size_max 0.71 _exptl_crystal_size_mid 0.14 _exptl_crystal_size_min 0.03 _exptl_absorpt_coefficient_mu 0.142 _shelx_estimated_absorpt_T_min ? _shelx_estimated_absorpt_T_max ? _exptl_absorpt_correction_type 'multi-scan' _exptl_absorpt_correction_T_min 0.6364 _exptl_absorpt_correction_T_max 0.7455 _exptl_absorpt_process_details 'SADABS' _exptl_absorpt_special_details ? _diffrn_ambient_temperature 100(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 9007 _diffrn_reflns_av_unetI/netI 0.0183 _diffrn_reflns_av_R_equivalents 0.0282 _diffrn_reflns_limit_h_min -4 _diffrn_reflns_limit_h_max 4 _diffrn_reflns_limit_k_min -7 _diffrn_reflns_limit_k_max 7 _diffrn_reflns_limit_l_min -30 _diffrn_reflns_limit_l_max 30 _diffrn_reflns_theta_min 3.328 _diffrn_reflns_theta_max 26.372 _diffrn_reflns_theta_full 25.242 _diffrn_measured_fraction_theta_max 0.997 _diffrn_measured_fraction_theta_full 0.997 _diffrn_reflns_Laue_measured_fraction_max 0.997 _diffrn_reflns_Laue_measured_fraction_full 0.997 _diffrn_reflns_point_group_measured_fraction_max 0.997 _diffrn_reflns_point_group_measured_fraction_full 0.997 _reflns_number_total 1168 _reflns_number_gt 1076 _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 ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution ? _computing_structure_refinement 'SHELXL-2014/7 (Sheldrick, 2014)' _computing_molecular_graphics ? _computing_publication_material ? _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^)+(0.0640P)^2^+2.9567P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary ? _atom_sites_solution_secondary ? _atom_sites_solution_hydrogens mixed _refine_ls_hydrogen_treatment mixed _refine_ls_extinction_method none _refine_ls_extinction_coef . _refine_ls_number_reflns 1168 _refine_ls_number_parameters 110 _refine_ls_number_restraints 7 _refine_ls_R_factor_all 0.0712 _refine_ls_R_factor_gt 0.0668 _refine_ls_wR_factor_ref 0.1729 _refine_ls_wR_factor_gt 0.1704 _refine_ls_goodness_of_fit_ref 1.039 _refine_ls_restrained_S_all 1.037 _refine_ls_shift/su_max 0.006 _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 O1 O 1.0322(6) 0.9278(4) 0.29659(9) 0.0124(5) Uani 1 1 d D . . . . H1' H 1.157(17) 0.892(13) 0.271(2) 0.019 Uiso 0.5 1 d D U P . . H1" H 1.11(2) 0.999(12) 0.324(2) 0.019 Uiso 0.5 1 d D U P . . O2 O 0.5841(6) 0.5330(4) 0.44628(9) 0.0144(5) Uani 1 1 d . . . . . H2 H 0.6750 0.6393 0.4640 0.022 Uiso 1 1 calc R U . . . O3 O 0.3684(6) 0.2040(4) 0.37881(9) 0.0140(5) Uani 1 1 d D . . . . H3' H 0.30(2) 0.222(14) 0.4099(15) 0.021 Uiso 0.5 1 d D U P . . H3" H 0.32(2) 0.122(11) 0.352(2) 0.021 Uiso 0.5 1 d D U P . . C1 C 0.7271(7) 0.5838(5) 0.27975(11) 0.0090(6) Uani 1 1 d . . . . . C2 C 0.8519(7) 0.7500(5) 0.31542(12) 0.0090(6) Uani 1 1 d . . . . . C3 C 0.8054(7) 0.7375(5) 0.37116(12) 0.0100(6) Uani 1 1 d . . . . . H3 H 0.8874 0.8532 0.3948 0.012 Uiso 1 1 calc R U . . . C4 C 0.6400(8) 0.5568(5) 0.39211(12) 0.0099(6) Uani 1 1 d . . . . . C5 C 0.5244(7) 0.3852(5) 0.35739(12) 0.0095(6) Uani 1 1 d . . . . . C6 C 0.5715(7) 0.4003(5) 0.30253(12) 0.0088(6) Uani 1 1 d . . . . . H6 H 0.4957 0.2819 0.2793 0.011 Uiso 1 1 calc R U . . . O1W O 0.9304(6) 0.8007(4) 0.52055(9) 0.0193(6) Uani 1 1 d D . . . . H1W H 0.745(7) 0.883(6) 0.5149(15) 0.029 Uiso 1 1 d D U . . . H2W H 0.966(10) 0.710(6) 0.4944(12) 0.029 Uiso 1 1 d D 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 O1 0.0137(11) 0.0117(11) 0.0123(11) -0.0013(9) 0.0037(8) -0.0054(9) O2 0.0198(12) 0.0162(12) 0.0077(10) -0.0006(9) 0.0029(8) -0.0058(10) O3 0.0179(11) 0.0124(12) 0.0122(11) 0.0003(9) 0.0044(9) -0.0053(10) C1 0.0061(13) 0.0113(15) 0.0094(15) 0.0007(11) 0.0002(10) 0.0011(11) C2 0.0059(13) 0.0078(14) 0.0133(14) 0.0009(11) 0.0004(10) 0.0008(11) C3 0.0086(14) 0.0093(15) 0.0119(14) -0.0009(11) -0.0005(11) 0.0001(11) C4 0.0098(14) 0.0110(15) 0.0090(14) 0.0002(11) 0.0018(10) 0.0023(12) C5 0.0073(13) 0.0083(14) 0.0128(14) 0.0011(11) 0.0005(11) -0.0007(11) C6 0.0072(13) 0.0076(14) 0.0114(14) -0.0021(11) -0.0009(10) -0.0014(11) O1W 0.0224(13) 0.0198(13) 0.0161(11) -0.0010(10) 0.0042(9) -0.0030(10) _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 O1 C2 1.380(4) . ? O1 H1' 0.841(10) . ? O1 H1" 0.837(11) . ? O2 C4 1.371(4) . ? O2 H2 0.8400 . ? O3 C5 1.375(4) . ? O3 H3' 0.840(10) . ? O3 H3" 0.838(10) . ? C1 C2 1.397(4) . ? C1 C6 1.400(4) . ? C1 C1 1.484(5) 2_655 ? C2 C3 1.395(4) . ? C3 C4 1.385(4) . ? C3 H3 0.9500 . ? C4 C5 1.397(4) . ? C5 C6 1.375(4) . ? C6 H6 0.9500 . ? O1W H1W 0.874(10) . ? O1W H2W 0.866(10) . ? 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 O1 H1' 112(6) . . ? C2 O1 H1" 107(6) . . ? H1' O1 H1" 122(8) . . ? C4 O2 H2 109.5 . . ? C5 O3 H3' 115(6) . . ? C5 O3 H3" 104(6) . . ? H3' O3 H3" 137(8) . . ? C2 C1 C6 117.4(3) . . ? C2 C1 C1 123.8(2) . 2_655 ? C6 C1 C1 118.6(2) . 2_655 ? O1 C2 C3 118.3(3) . . ? O1 C2 C1 120.8(3) . . ? C3 C2 C1 120.9(3) . . ? C4 C3 C2 120.2(3) . . ? C4 C3 H3 119.9 . . ? C2 C3 H3 119.9 . . ? O2 C4 C3 123.6(3) . . ? O2 C4 C5 116.6(3) . . ? C3 C4 C5 119.8(3) . . ? C6 C5 O3 121.3(3) . . ? C6 C5 C4 119.3(3) . . ? O3 C5 C4 119.4(3) . . ? C5 C6 C1 122.3(3) . . ? C5 C6 H6 118.8 . . ? C1 C6 H6 118.8 . . ? H1W O1W H2W 114.7(18) . . ? _refine_diff_density_max 0.529 _refine_diff_density_min -0.666 _refine_diff_density_rms 0.094 _shelx_res_file ; mo_molan465_0m_a.res created by SHELXL-2014/7 TITL mo_molan465_0m_a.res in P2/n REM Old TITL mo_molan465_0m in P2/n REM SHELXT solution in P2/n REM R1 0.106, Rweak 0.007, Alpha 0.025, Orientation as input REM Formula found by SHELXT: C6 O4 CELL 0.71073 3.8541 6.0625 24.5543 90.000 94.163 90.000 ZERR 2.000 0.0004 0.0005 0.0024 0.000 0.004 0.000 LATT 1 SYMM 1/2-X, Y, 1/2-Z SFAC C H O UNIT 24 28 16 TEMP -173.160 L.S. 10 shel 10 0.80 BOND $H acta LIST 4 FMAP 2 PLAN 5 DFIX 0.86 0.01 O1w H1w O1w H2w DFIX 1.47 0.01 H1W H2W DFIX 0.84 0.01 O1 H1' O1 H1" O3 H3' O3 H3" omit -1 1 1 WGHT 0.064000 2.956700 FVAR 1.06890 O1 3 1.032202 0.927799 0.296591 11.00000 0.01367 0.01166 = 0.01232 -0.00128 0.00371 -0.00536 H1' 2 1.156909 0.891620 0.271312 10.50000 -1.50000 H1" 2 1.111198 0.999016 0.323971 10.50000 -1.50000 O2 3 0.584107 0.532979 0.446285 11.00000 0.01975 0.01619 = 0.00768 -0.00060 0.00293 -0.00576 AFIX 147 H2 2 0.674995 0.639289 0.464021 11.00000 -1.50000 AFIX 0 O3 3 0.368410 0.203976 0.378810 11.00000 0.01792 0.01239 = 0.01219 0.00029 0.00440 -0.00533 H3' 2 0.295921 0.221728 0.409943 10.50000 -1.50000 H3" 2 0.322955 0.121566 0.351820 10.50000 -1.50000 C1 1 0.727135 0.583776 0.279754 11.00000 0.00609 0.01132 = 0.00945 0.00067 0.00017 0.00105 C2 1 0.851938 0.749989 0.315423 11.00000 0.00586 0.00784 = 0.01331 0.00094 0.00037 0.00084 C3 1 0.805390 0.737516 0.371157 11.00000 0.00862 0.00931 = 0.01189 -0.00089 -0.00051 0.00009 AFIX 43 H3 2 0.887363 0.853243 0.394802 11.00000 -1.20000 AFIX 0 C4 1 0.639952 0.556821 0.392107 11.00000 0.00975 0.01104 = 0.00899 0.00025 0.00181 0.00228 C5 1 0.524449 0.385205 0.357391 11.00000 0.00732 0.00826 = 0.01280 0.00113 0.00051 -0.00065 C6 1 0.571517 0.400273 0.302527 11.00000 0.00718 0.00756 = 0.01144 -0.00211 -0.00089 -0.00139 AFIX 43 H6 2 0.495697 0.281905 0.279260 11.00000 -1.20000 AFIX 0 O1W 3 0.930402 0.800743 0.520554 11.00000 0.02240 0.01979 = 0.01614 -0.00098 0.00416 -0.00299 H1W 2 0.744736 0.882833 0.514925 11.00000 -1.50000 H2W 2 0.966196 0.709565 0.494391 11.00000 -1.50000 HKLF 4 REM mo_molan465_0m_a.res in P2/n REM R1 = 0.0668 for 1076 Fo > 4sig(Fo) and 0.0712 for all 1168 data REM 110 parameters refined using 7 restraints END WGHT 0.0495 2.5924 REM Highest difference peak 0.529, deepest hole -0.666, 1-sigma level 0.094 Q1 1 1.1426 0.7181 0.5283 11.00000 0.05 0.53 Q2 1 0.7500 0.5840 0.2500 10.50000 0.05 0.36 Q3 1 -0.0143 0.2276 0.3990 11.00000 0.05 0.33 Q4 1 0.9896 0.9717 0.5023 11.00000 0.05 0.32 Q5 1 0.6998 1.0476 0.5244 11.00000 0.05 0.31 ; _shelx_res_checksum 90867 _shelx_hkl_file ; 1 0 0 -0.80 1.30 1 0 0 -2.20 1.30 1 0 0 -3.00 1.20 -1 0 0 -2.50 1.20 -1 0 0 -2.00 1.20 -1 0 0 -0.40 1.30 2 0 0 766.82 26.10 -2 0 0 754.82 26.10 -2 0 0 737.43 26.70 2 0 0 761.52 25.90 -2 0 0 747.63 25.90 2 0 0 763.62 26.10 3 0 0 -1.90 2.90 -3 0 0 2.80 3.10 -3 0 0 -3.90 3.00 3 0 0 3.50 2.80 3 0 0 0.30 3.20 4 0 0 52.09 8.10 4 0 0 52.39 7.10 -4 0 0 60.89 7.40 4 0 0 59.19 7.00 0 -1 0 2653.83 85.59 0 -1 0 2461.85 85.39 0 1 0 2688.33 85.59 0 1 0 2602.04 85.49 0 1 0 2615.24 85.59 1 -1 0 5228.48 170.68 -1 -1 0 5263.47 170.38 1 -1 0 5120.59 170.68 -1 -1 0 5262.17 170.38 -1 -1 0 5207.38 170.68 1 -1 0 5134.69 170.18 1 1 0 5190.08 170.38 -1 1 0 5205.08 170.68 1 1 0 5188.38 170.28 1 1 0 5177.68 170.68 -1 1 0 5097.79 170.58 2 -1 0 65.89 4.00 -2 -1 0 74.49 4.70 2 -1 0 74.49 4.70 2 -1 0 71.99 4.70 -2 -1 0 71.79 4.40 -2 1 0 71.29 5.30 2 1 0 73.29 4.30 2 1 0 74.09 4.80 2 1 0 83.89 4.20 -2 1 0 76.39 4.60 -3 -1 0 23.70 3.80 3 -1 0 20.90 4.20 3 -1 0 20.10 3.70 -3 -1 0 25.80 4.00 -3 -1 0 23.40 3.60 3 -1 0 24.40 3.40 -3 1 0 18.10 4.20 3 1 0 26.70 4.10 3 1 0 26.60 3.60 3 1 0 28.30 4.40 -3 1 0 32.00 4.70 4 -1 0 18.80 5.80 4 -1 0 5.40 5.10 4 -1 0 10.40 4.90 -4 -1 0 18.50 5.40 4 1 0 13.00 4.70 4 1 0 10.50 5.20 4 1 0 7.90 5.60 -4 1 0 14.30 5.10 0 -2 0 133.89 4.80 0 -2 0 133.59 5.30 0 -2 0 130.39 4.80 0 2 0 139.89 4.70 0 2 0 132.59 4.90 0 2 0 132.29 5.10 1 -2 0 35.70 2.90 1 -2 0 34.20 3.20 -1 -2 0 43.90 3.50 -1 2 0 43.40 2.80 -1 2 0 37.40 3.10 1 2 0 44.00 2.30 1 2 0 47.20 3.40 -2 -2 0 366.46 12.50 2 -2 0 336.77 12.00 2 -2 0 335.67 13.30 -2 -2 0 340.27 12.70 2 -2 0 340.77 13.20 -2 -2 0 359.16 13.40 2 2 0 353.46 13.30 -2 2 0 337.07 13.00 -2 2 0 330.67 14.10 2 2 0 359.06 12.60 2 2 0 345.57 12.30 3 -2 0 222.28 8.80 -3 -2 0 221.08 10.30 3 -2 0 206.08 10.40 -3 -2 0 214.28 9.50 3 -2 0 211.38 10.00 -3 -2 0 216.98 9.80 -3 2 0 202.08 10.40 3 2 0 210.78 9.30 -3 2 0 214.58 9.80 3 2 0 211.28 9.10 3 2 0 206.08 10.60 4 -2 0 85.49 8.90 4 -2 0 80.29 7.50 -4 -2 0 61.39 9.00 -4 -2 0 63.79 8.90 -4 2 0 74.49 8.60 4 2 0 74.39 8.00 4 2 0 91.89 7.50 0 -3 0 1135.19 37.70 0 -3 0 1108.69 37.20 0 -3 0 1146.99 37.30 0 3 0 1049.09 36.90 0 3 0 1116.69 37.10 0 3 0 1143.79 37.40 0 3 0 1151.08 37.60 -1 -3 0 315.87 10.50 -1 -3 0 322.97 12.10 1 -3 0 305.37 11.70 1 -3 0 282.07 10.90 1 -3 0 311.57 11.40 -1 3 0 305.07 11.10 -1 3 0 310.77 11.60 1 3 0 317.47 10.70 1 3 0 322.27 10.50 2 -3 0 15.30 2.20 2 -3 0 14.00 3.10 -2 -3 0 19.80 2.50 -2 -3 0 15.80 3.30 2 -3 0 6.50 3.20 -2 -3 0 14.70 2.70 -2 3 0 10.50 2.50 2 3 0 13.50 3.40 2 3 0 18.10 1.90 2 3 0 13.50 2.30 -3 -3 0 335.47 13.40 3 -3 0 336.47 13.90 -3 -3 0 313.17 14.40 3 -3 0 323.57 14.50 3 -3 0 309.37 12.60 -3 -3 0 316.17 12.50 -3 3 0 336.97 14.30 -3 3 0 331.77 13.60 3 3 0 326.57 12.70 3 3 0 299.47 12.10 -4 -3 0 166.88 13.10 -4 -3 0 174.38 12.00 4 -3 0 186.58 12.10 4 3 0 169.58 10.10 -4 3 0 185.78 11.60 0 -4 0 183.28 6.60 0 -4 0 177.48 7.80 0 -4 0 180.78 7.60 0 4 0 184.28 7.10 0 4 0 185.28 6.40 1 -4 0 900.21 30.30 1 -4 0 895.71 29.40 -1 -4 0 874.61 30.60 -1 -4 0 834.42 29.30 1 -4 0 867.81 29.90 -1 4 0 853.91 29.60 1 4 0 869.31 29.10 1 4 0 869.01 29.10 1 4 0 879.71 30.40 -1 4 0 900.61 30.20 -2 -4 0 165.38 6.10 2 -4 0 161.38 8.20 -2 -4 0 148.69 8.80 2 -4 0 146.99 8.60 2 -4 0 149.69 5.70 -2 -4 0 137.89 7.10 -2 4 0 167.38 8.50 2 4 0 162.08 5.70 2 4 0 153.48 6.50 2 4 0 143.99 9.00 -2 4 0 153.88 7.40 -3 -4 0 168.28 8.50 3 -4 0 217.18 12.20 -3 -4 0 191.08 10.00 -3 -4 0 209.38 12.20 3 -4 0 198.28 8.70 3 4 0 204.08 9.70 -3 4 0 225.88 10.40 -3 4 0 217.58 11.60 3 4 0 195.28 7.80 4 -4 0 189.68 13.60 -4 -4 0 168.38 14.80 4 4 0 141.29 9.70 -4 4 0 201.48 12.20 0 -5 0 816.42 27.90 0 -5 0 775.32 26.50 0 -5 0 813.32 27.30 0 5 0 749.82 26.30 0 5 0 790.82 27.00 -1 -5 0 487.55 16.80 -1 -5 0 480.35 16.90 1 -5 0 519.65 17.50 -1 -5 0 503.25 18.90 1 -5 0 525.05 18.60 1 -5 0 476.35 17.60 1 5 0 440.56 17.10 1 5 0 474.15 18.40 -1 5 0 481.75 17.10 -1 5 0 506.25 18.10 -2 -5 0 13.30 5.40 -2 -5 0 9.80 1.90 2 -5 0 8.70 4.20 -2 -5 0 8.40 3.70 2 5 0 14.20 5.80 -2 5 0 10.20 4.80 -2 5 0 13.00 3.20 3 -5 0 2.80 2.70 -3 -5 0 27.10 8.10 3 -5 0 14.90 6.00 -3 5 0 11.40 6.70 -3 5 0 10.50 4.90 3 5 0 10.50 3.90 0 -6 0 871.01 30.90 0 -6 0 897.21 31.70 0 -6 0 880.91 29.70 0 6 0 889.71 30.10 0 6 0 865.41 29.50 -1 -6 0 48.00 4.10 1 -6 0 41.70 4.60 1 -6 0 36.90 4.90 -1 -6 0 49.60 7.10 -1 -6 0 42.50 5.40 -1 6 0 41.60 6.30 1 6 0 43.10 4.30 -1 6 0 46.80 3.50 -2 -6 0 11.50 7.70 2 -6 0 9.60 5.10 -2 -6 0 10.50 3.40 2 6 0 12.40 5.40 -2 6 0 13.40 6.00 -2 6 0 7.10 3.60 -3 -6 0 21.70 9.70 3 -6 0 22.90 7.40 -3 6 0 20.20 5.50 0 -7 0 47.30 8.40 0 7 0 35.40 3.30 -1 -7 0 13.90 9.60 -1 7 0 32.40 3.50 -2 -7 0 181.78 17.10 -2 7 0 168.98 9.00 4 0 -1 14.70 4.60 4 0 -1 17.60 5.50 -4 0 1 23.20 5.40 4 0 -1 22.80 6.00 -3 0 1 5.20 3.20 3 0 -1 4.10 2.80 3 0 -1 4.30 3.20 -3 0 1 2.10 3.10 3 0 -1 2.40 3.10 2 0 -1 -1.60 1.90 2 0 -1 1.70 1.90 -2 0 1 0.90 2.00 -2 0 1 -0.20 2.40 2 0 -1 -2.70 1.90 -2 0 1 -1.90 1.70 -1 0 1 746.53 26.80 1 0 -1 790.72 26.50 -1 0 1 784.32 26.50 1 0 -1 812.82 26.60 -1 0 1 809.42 26.60 1 0 -1 811.52 26.60 -1 0 -1 4465.95 146.09 1 0 1 4485.85 145.99 -1 0 -1 4350.76 146.09 -1 0 -1 4481.55 145.99 1 0 1 4495.65 146.09 1 0 1 4372.76 146.09 2 0 1 -2.60 1.90 2 0 1 -1.80 1.90 2 0 1 -1.80 1.90 -2 0 -1 1.00 1.70 -2 0 -1 -1.60 1.90 3 0 1 63.49 5.30 -3 0 -1 71.59 5.70 -3 0 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