data_rkjk6_abs _audit_creation_date 2022-04-09 _audit_creation_method ; Olex2 1.3-ac4 (compiled 2020.11.27 svn.r5f609507 for Rigaku Oxford Diffraction, GUI svn.r6214) ; _shelx_SHELXL_version_number '2016/6' _audit_contact_author_address ? _audit_contact_author_email ? _audit_contact_author_name '' _audit_contact_author_phone ? _publ_contact_author_id_orcid ? _publ_section_references ; Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H. (2009), J. Appl. Cryst. 42, 339-341. Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8. Sheldrick, G.M. (2015). Acta Cryst. C71, 3-8. ; _chemical_name_common ? _chemical_name_systematic ? _chemical_formula_moiety 'C30 H36 La N4 O9, 2(F3 P0.5), 7(H O0.5)' _chemical_formula_sum 'C30 H43 F6 La N4 O12.50 P' _chemical_formula_weight 943.56 _chemical_melting_point ? _chemical_oxdiff_formula C30H43F6LaN4O12.5P _chemical_oxdiff_usercomment 'Crystallized from water/acetone.' 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' 'F' 'F' 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'La' 'La' -0.2871 2.4523 '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' 'P' 'P' 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _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. ; _space_group_crystal_system 'monoclinic' _space_group_IT_number 15 _space_group_name_H-M_alt 'C 1 2/c 1' _space_group_name_Hall '-C 2yc' loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y, -z+1/2' 'x+1/2, y+1/2, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y, z-1/2' '-x+1/2, -y+1/2, -z' 'x+1/2, -y+1/2, z-1/2' _cell_length_a 22.1824(4) _cell_length_b 17.0833(3) _cell_length_c 20.0078(4) _cell_angle_alpha 90 _cell_angle_beta 106.384(2) _cell_angle_gamma 90 _cell_volume 7274.0(2) _cell_formula_units_Z 8 _cell_measurement_reflns_used 31427 _cell_measurement_temperature 100.0(7) _cell_measurement_theta_max 31.5310 _cell_measurement_theta_min 3.0180 _shelx_estimated_absorpt_T_max 0.873 _shelx_estimated_absorpt_T_min 0.821 _exptl_absorpt_coefficient_mu 1.317 _exptl_absorpt_correction_T_max 1.000 _exptl_absorpt_correction_T_min 0.731 _exptl_absorpt_correction_type gaussian _exptl_absorpt_process_details ; CrysAlisPro 1.171.41.112a (Rigaku Oxford Diffraction, 2021) Numerical absorption correction based on gaussian integration over a multifaceted crystal model Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_absorpt_special_details ? _exptl_crystal_colour 'clear colourless' _exptl_crystal_density_diffrn 1.723 _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _exptl_crystal_description block _exptl_crystal_F_000 3816 loop_ _exptl_crystal_face_index_h _exptl_crystal_face_index_k _exptl_crystal_face_index_l _exptl_crystal_face_perp_dist 25 -2 10 0.0702 13 13 -23 0.0664 29 8 -9 0.0613 11 -9 20 0.0717 11 -21 -11 0.0415 14 20 6 0.0530 -1 20 -14 0.0565 -4 11 25 0.0550 -16 20 0 0.0498 -21 5 25 0.0437 -12 1 28 0.0452 -26 12 1 0.0526 -18 -8 25 0.0420 -27 -6 -5 0.0533 -22 -16 14 0.0421 _exptl_crystal_size_max 0.156 _exptl_crystal_size_mid 0.118 _exptl_crystal_size_min 0.106 loop_ _exptl_oxdiff_crystal_face_indexfrac_h _exptl_oxdiff_crystal_face_indexfrac_k _exptl_oxdiff_crystal_face_indexfrac_l _exptl_oxdiff_crystal_face_x _exptl_oxdiff_crystal_face_y _exptl_oxdiff_crystal_face_z 25.1032 -1.5551 9.7066 0.5468 -0.1310 0.8270 12.7563 13.2815 -22.9187 0.7194 -0.1726 -0.6728 29.3247 8.3182 -8.7202 0.9568 -0.2294 0.1788 11.4244 -8.7368 20.3087 -0.0031 0.0009 1.0000 10.8260 -21.3297 -11.0912 -0.2292 -0.9560 0.1831 13.6248 19.9852 5.9640 0.8136 0.5595 0.1582 -1.3085 20.4600 -13.8882 0.5230 0.3596 -0.7727 -3.6484 11.2252 24.6480 0.1096 0.8347 0.5397 -16.3497 20.1791 -0.1060 0.1012 0.7703 -0.6296 -20.6078 5.2633 24.6983 -0.4561 0.8394 0.2954 -11.9723 0.7436 28.0149 -0.3673 0.6758 0.6390 -26.2648 11.9360 0.6061 -0.3503 0.6448 -0.6793 -17.6003 -7.6580 25.1055 -0.7055 0.4320 0.5618 -27.2036 -6.1855 -4.5337 -0.8082 0.0210 -0.5885 -21.6942 -15.6921 13.8053 -0.9695 0.0251 0.2437 _exptl_transmission_factor_max ? _exptl_transmission_factor_min ? _diffrn_reflns_av_R_equivalents 0.0486 _diffrn_reflns_av_unetI/netI 0.0295 _diffrn_reflns_Laue_measured_fraction_full 0.998 _diffrn_reflns_Laue_measured_fraction_max 0.999 _diffrn_reflns_limit_h_max 28 _diffrn_reflns_limit_h_min -28 _diffrn_reflns_limit_k_max 21 _diffrn_reflns_limit_k_min -21 _diffrn_reflns_limit_l_max 25 _diffrn_reflns_limit_l_min -25 _diffrn_reflns_number 41597 _diffrn_reflns_point_group_measured_fraction_full 0.998 _diffrn_reflns_point_group_measured_fraction_max 0.999 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.102 _diffrn_reflns_theta_min 2.610 _diffrn_ambient_environment N~2~ _diffrn_ambient_temperature 100.0(7) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_detector_type HyPix _diffrn_measured_fraction_theta_full 0.998 _diffrn_measured_fraction_theta_max 0.999 _diffrn_measurement_details ; List of Runs (angles in degrees, time in seconds): # Type Start End Width t~exp~ \w \q \k \f Frames -------------------------------------------------------------------------- 1 \w -31.00 8.00 0.50 6.70 -- 5.48 -95.00 -5.00 78 2 \w -28.00 -3.00 0.50 6.70 -- -5.95 -95.00 -5.00 50 3 \w 15.00 73.00 0.50 6.70 -- 5.48 19.00 90.00 116 4 \w 20.00 46.00 0.50 6.70 -- 5.48-135.00 -80.58 52 5 \w -23.00 32.00 0.50 6.70 -- 5.48 -99.00 150.00 110 6 \w -36.00 7.00 0.50 6.70 -- -5.95 95.00-126.90 86 7 \w -6.00 26.00 0.50 6.70 -- -5.95 -99.00 -90.00 64 8 \w -23.00 2.00 0.50 6.70 -- -5.95 -99.00-150.00 50 9 \w -22.00 26.00 0.50 6.70 -- -5.95 -99.00 120.00 96 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'XtaLAB Synergy, Dualflex, HyPix' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 0.0245869000 _diffrn_orient_matrix_UB_12 0.0249211000 _diffrn_orient_matrix_UB_13 -0.0032644000 _diffrn_orient_matrix_UB_21 -0.0106447000 _diffrn_orient_matrix_UB_22 0.0296480000 _diffrn_orient_matrix_UB_23 0.0187877000 _diffrn_orient_matrix_UB_31 0.0197718000 _diffrn_orient_matrix_UB_32 -0.0150134000 _diffrn_orient_matrix_UB_33 0.0316587000 _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength 0.71073 _diffrn_source 'micro-focus sealed X-ray tube' _diffrn_source_type 'PhotonJet (Mo) X-ray Source' _reflns_Friedel_coverage 0.000 _reflns_Friedel_fraction_full . _reflns_Friedel_fraction_max . _reflns_number_gt 7398 _reflns_number_total 8016 _reflns_odcompleteness_completeness 99.82 _reflns_odcompleteness_iscentric 1 _reflns_odcompleteness_theta 27.04 _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. ; _reflns_threshold_expression 'I > 2\s(I)' _computing_cell_refinement 'CrysAlisPro 1.171.41.112a (Rigaku OD, 2021)' _computing_data_collection 'CrysAlisPro 1.171.41.112a (Rigaku OD, 2021)' _computing_data_reduction 'CrysAlisPro 1.171.41.112a (Rigaku OD, 2021)' _computing_molecular_graphics 'Olex2 1.3-ac4 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.3-ac4 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2016/6 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' _refine_diff_density_max 0.966 _refine_diff_density_min -0.554 _refine_diff_density_rms 0.090 _refine_ls_extinction_coef . _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.066 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 521 _refine_ls_number_reflns 8016 _refine_ls_number_restraints 9 _refine_ls_R_factor_all 0.0267 _refine_ls_R_factor_gt 0.0235 _refine_ls_restrained_S_all 1.066 _refine_ls_shift/su_max 0.004 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0288P)^2^+8.5241P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0570 _refine_ls_wR_factor_ref 0.0585 _refine_special_details ? _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H) groups, All C(H,H) groups, All O(H) groups, All O(H,H) groups 2. Restrained distances O3S-H3SB = O3S-H3SA = O4S-H4SB = O4S-H4SA = O2S-H2SB = O2S-H2SA = O9-H9A = O9- H9B 0.84 with sigma of 0.02 O1S-H1S 0.84 with sigma of 0.02 3.a Secondary CH2 refined with riding coordinates: C1(H1A,H1B), C2(H2A,H2B), C9(H9C,H9D), C10(H10A,H10B), C11(H11A,H11B), C12(H12A,H12B), C13(H13A,H13B), C14(H14A,H14B), C15(H15A,H15B), C16(H16A,H16B), C17(H17A,H17B), C24(H24A,H24B) 3.b Aromatic/amide H refined with riding coordinates: C4(H4), C5(H5), C6(H6), C7(H7), C19(H19), C20(H20), C21(H21), C26(H26), C27(H27), C28(H28) ; _atom_sites_solution_hydrogens mixed _atom_sites_solution_primary dual _atom_sites_solution_secondary ? 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 La La 0.76077(2) 0.52022(2) 0.34761(2) 0.01040(4) Uani 1 1 d . . . . . O1 O 0.82594(6) 0.63396(7) 0.46347(6) 0.0150(2) Uani 1 1 d . . . . . O2 O 0.70689(6) 0.62932(7) 0.41583(6) 0.0161(3) Uani 1 1 d . . . . . O3 O 0.69178(6) 0.55783(7) 0.21125(6) 0.0163(3) Uani 1 1 d . . . . . O4 O 0.82006(6) 0.54017(8) 0.24728(7) 0.0201(3) Uani 1 1 d . . . . . O5 O 0.71839(6) 0.40489(7) 0.27506(6) 0.0151(2) Uani 1 1 d . . . . . O6 O 0.70557(6) 0.27573(7) 0.26162(6) 0.0163(3) Uani 1 1 d . . . . . O7 O 0.80485(6) 0.48041(7) 0.46949(7) 0.0155(3) Uani 1 1 d . . . . . O8 O 0.82622(6) 0.37901(8) 0.54389(7) 0.0207(3) Uani 1 1 d . . . . . O9 O 0.77269(7) 0.66413(8) 0.32087(7) 0.0199(3) Uani 1 1 d D . . . . H9A H 0.7741(11) 0.6903(13) 0.3559(10) 0.024 Uiso 1 1 d D U . . . H9B H 0.7769(11) 0.6931(13) 0.2890(10) 0.024 Uiso 1 1 d D U . . . N1 N 0.89485(7) 0.52913(9) 0.38969(8) 0.0152(3) Uani 1 1 d . . . . . N2 N 0.62234(7) 0.53237(8) 0.31120(8) 0.0146(3) Uani 1 1 d . . . . . N3 N 0.83241(7) 0.38991(8) 0.36030(7) 0.0128(3) Uani 1 1 d . . . . . N4 N 0.69171(7) 0.42931(8) 0.40817(8) 0.0137(3) Uani 1 1 d . . . . . C1 C 0.91767(8) 0.60306(11) 0.42798(10) 0.0174(4) Uani 1 1 d . . . . . H1A H 0.906276 0.647274 0.394813 0.021 Uiso 1 1 calc R U . . . H1B H 0.964106 0.601052 0.444940 0.021 Uiso 1 1 calc R U . . . C2 C 0.89240(8) 0.61977(11) 0.48925(10) 0.0176(4) Uani 1 1 d . . . . . H2A H 0.900374 0.574534 0.521482 0.021 Uiso 1 1 calc R U . . . H2B H 0.913687 0.666197 0.515004 0.021 Uiso 1 1 calc R U . . . C3 C 0.79430(9) 0.64214(10) 0.51325(9) 0.0150(3) Uani 1 1 d . . . . . C4 C 0.82213(9) 0.65176(10) 0.58420(9) 0.0175(4) Uani 1 1 d . . . . . H4 H 0.866583 0.651592 0.602483 0.021 Uiso 1 1 calc R U . . . C5 C 0.78381(9) 0.66170(11) 0.62831(9) 0.0200(4) Uani 1 1 d . . . . . H5 H 0.802492 0.668960 0.676832 0.024 Uiso 1 1 calc R U . . . C6 C 0.71926(9) 0.66109(11) 0.60233(10) 0.0196(4) Uani 1 1 d . . . . . H6 H 0.693879 0.668298 0.632969 0.024 Uiso 1 1 calc R U . . . C7 C 0.69103(9) 0.64997(10) 0.53136(10) 0.0172(4) Uani 1 1 d . . . . . H7 H 0.646555 0.648552 0.513507 0.021 Uiso 1 1 calc R U . . . C8 C 0.72878(9) 0.64100(10) 0.48713(9) 0.0143(3) Uani 1 1 d . . . . . C9 C 0.64319(8) 0.65349(10) 0.38047(10) 0.0171(4) Uani 1 1 d . . . . . H9C H 0.642461 0.682535 0.337428 0.020 Uiso 1 1 calc R U . . . H9D H 0.627096 0.688407 0.411021 0.020 Uiso 1 1 calc R U . . . C10 C 0.60250(8) 0.58144(10) 0.36265(10) 0.0169(4) Uani 1 1 d . . . . . H10A H 0.605869 0.550654 0.405475 0.020 Uiso 1 1 calc R U . . . H10B H 0.558046 0.597167 0.343044 0.020 Uiso 1 1 calc R U . . . C11 C 0.59532(9) 0.56540(11) 0.24065(9) 0.0180(4) Uani 1 1 d . . . . . H11A H 0.599578 0.623102 0.242935 0.022 Uiso 1 1 calc R U . . . H11B H 0.549955 0.552789 0.224573 0.022 Uiso 1 1 calc R U . . . C12 C 0.62687(9) 0.53428(11) 0.18887(10) 0.0192(4) Uani 1 1 d . . . . . H12A H 0.623728 0.476476 0.186605 0.023 Uiso 1 1 calc R U . . . H12B H 0.606336 0.555626 0.141960 0.023 Uiso 1 1 calc R U . . . C13 C 0.72237(10) 0.53580(12) 0.15974(10) 0.0218(4) Uani 1 1 d . . . . . H13A H 0.698329 0.555961 0.113517 0.026 Uiso 1 1 calc R U . . . H13B H 0.724367 0.478046 0.156901 0.026 Uiso 1 1 calc R U . . . C14 C 0.78700(10) 0.56905(12) 0.17951(10) 0.0231(4) Uani 1 1 d . . . . . H14A H 0.809191 0.553274 0.145094 0.028 Uiso 1 1 calc R U . . . H14B H 0.785040 0.626922 0.180264 0.028 Uiso 1 1 calc R U . . . C15 C 0.88276(9) 0.57206(12) 0.26780(11) 0.0232(4) Uani 1 1 d . . . . . H15A H 0.881687 0.627728 0.281186 0.028 Uiso 1 1 calc R U . . . H15B H 0.901786 0.568731 0.228692 0.028 Uiso 1 1 calc R U . . . C16 C 0.92029(9) 0.52531(11) 0.32827(10) 0.0206(4) Uani 1 1 d . . . . . H16A H 0.921087 0.469996 0.313780 0.025 Uiso 1 1 calc R U . . . H16B H 0.964099 0.544792 0.342071 0.025 Uiso 1 1 calc R U . . . C17 C 0.92144(8) 0.46094(11) 0.43368(10) 0.0172(4) Uani 1 1 d . . . . . H17A H 0.914242 0.467021 0.480035 0.021 Uiso 1 1 calc R U . . . H17B H 0.967364 0.458770 0.440354 0.021 Uiso 1 1 calc R U . . . C18 C 0.89180(8) 0.38565(10) 0.40080(9) 0.0148(3) Uani 1 1 d . . . . . C19 C 0.92477(9) 0.31533(11) 0.41271(9) 0.0180(4) Uani 1 1 d . . . . . H19 H 0.966968 0.313941 0.441364 0.022 Uiso 1 1 calc R U . . . C20 C 0.89545(9) 0.24751(11) 0.38238(10) 0.0191(4) Uani 1 1 d . . . . . H20 H 0.917247 0.198984 0.389786 0.023 Uiso 1 1 calc R U . . . C21 C 0.83362(9) 0.25130(10) 0.34091(9) 0.0161(3) Uani 1 1 d . . . . . H21 H 0.812171 0.205511 0.319882 0.019 Uiso 1 1 calc R U . . . C22 C 0.80401(8) 0.32371(10) 0.33100(8) 0.0124(3) Uani 1 1 d . . . . . C23 C 0.73745(8) 0.33530(10) 0.28579(8) 0.0122(3) Uani 1 1 d . . . . . C24 C 0.59728(8) 0.45240(10) 0.31303(10) 0.0170(4) Uani 1 1 d . . . . . H24A H 0.600527 0.423139 0.271479 0.020 Uiso 1 1 calc R U . . . H24B H 0.552262 0.455679 0.311098 0.020 Uiso 1 1 calc R U . . . C25 C 0.63211(8) 0.40843(10) 0.37776(9) 0.0156(3) Uani 1 1 d . . . . . C26 C 0.60316(9) 0.34755(11) 0.40326(10) 0.0210(4) Uani 1 1 d . . . . . H26 H 0.560751 0.333914 0.380841 0.025 Uiso 1 1 calc R U . . . C27 C 0.63713(10) 0.30722(11) 0.46177(10) 0.0223(4) Uani 1 1 d . . . . . H27 H 0.618468 0.265013 0.479631 0.027 Uiso 1 1 calc R U . . . C28 C 0.69856(9) 0.32900(11) 0.49400(10) 0.0187(4) Uani 1 1 d . . . . . H28 H 0.722589 0.302690 0.534629 0.022 Uiso 1 1 calc R U . . . C29 C 0.72413(8) 0.39010(10) 0.46556(9) 0.0149(3) Uani 1 1 d . . . . . C30 C 0.79090(8) 0.41793(10) 0.49641(9) 0.0143(3) Uani 1 1 d . . . . . P1 P 0.500000 0.19381(5) 0.750000 0.02322(15) Uani 1 2 d S T P . . F1 F 0.51071(9) 0.13152(13) 0.80949(12) 0.0811(7) Uani 1 1 d . . . . . F2 F 0.48926(10) 0.25986(14) 0.69174(12) 0.0844(7) Uani 1 1 d . . . . . F3 F 0.42682(6) 0.19404(11) 0.74439(8) 0.0472(4) Uani 1 1 d . . . . . P2 P 0.500000 0.500000 0.500000 0.01817(13) Uani 1 2 d S . P . . F4 F 0.57418(6) 0.50865(9) 0.51493(7) 0.0372(3) Uani 1 1 d . . . . . F5 F 0.50941(7) 0.41228(7) 0.53073(7) 0.0371(3) Uani 1 1 d . . . . . F6 F 0.50516(6) 0.53253(8) 0.57642(6) 0.0305(3) Uani 1 1 d . . . . . O1S O 0.500000 0.20708(15) 0.250000 0.0323(5) Uani 1 2 d DS T P . . H1S H 0.5159(13) 0.1857(16) 0.2869(10) 0.039 Uiso 1 1 d D U . . . O2S O 0.57872(7) 0.29943(10) 0.19570(9) 0.0324(3) Uani 1 1 d D . . . . H2SA H 0.6173(9) 0.2938(16) 0.2147(13) 0.039 Uiso 1 1 d D U . . . H2SB H 0.5604(12) 0.2730(15) 0.2182(13) 0.039 Uiso 1 1 d D U . . . O3S O 0.95119(8) 0.34813(11) 0.61295(10) 0.0373(4) Uani 1 1 d D . . . . H3SA H 0.9122(9) 0.3593(17) 0.5939(14) 0.045 Uiso 1 1 d D U . . . H3SB H 0.9616(14) 0.3134(15) 0.5901(14) 0.045 Uiso 1 1 d D U . . . O4S O 0.52339(7) 0.26968(9) 0.05629(8) 0.0288(3) Uani 1 1 d D . . . . H4SA H 0.5127(12) 0.3131(12) 0.0352(13) 0.035 Uiso 1 1 d D U . . . H4SB H 0.5454(12) 0.2834(15) 0.0968(10) 0.035 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 La 0.01156(6) 0.00825(6) 0.01040(6) 0.00017(3) 0.00148(4) -0.00097(3) O1 0.0133(6) 0.0165(6) 0.0140(6) -0.0019(5) 0.0021(5) -0.0010(5) O2 0.0132(6) 0.0192(6) 0.0139(6) -0.0026(5) 0.0005(5) 0.0003(5) O3 0.0204(6) 0.0150(6) 0.0117(6) -0.0002(5) 0.0017(5) 0.0000(5) O4 0.0215(7) 0.0238(7) 0.0158(6) 0.0030(5) 0.0065(5) -0.0013(6) O5 0.0156(6) 0.0118(6) 0.0152(6) -0.0008(5) 0.0001(5) 0.0001(5) O6 0.0166(6) 0.0127(6) 0.0180(6) -0.0044(5) 0.0022(5) -0.0028(5) O7 0.0164(6) 0.0150(6) 0.0135(6) 0.0001(5) 0.0014(5) -0.0015(5) O8 0.0205(7) 0.0238(7) 0.0153(6) 0.0049(5) 0.0008(5) 0.0039(5) O9 0.0351(8) 0.0108(6) 0.0144(6) 0.0002(5) 0.0080(6) -0.0041(5) N1 0.0139(7) 0.0141(7) 0.0176(7) -0.0033(6) 0.0044(6) -0.0031(6) N2 0.0150(7) 0.0112(7) 0.0153(7) 0.0009(6) 0.0006(6) -0.0002(6) N3 0.0143(7) 0.0122(7) 0.0118(7) -0.0001(5) 0.0035(5) 0.0000(5) N4 0.0146(7) 0.0122(7) 0.0142(7) -0.0001(5) 0.0037(6) 0.0003(6) C1 0.0135(8) 0.0158(8) 0.0221(9) -0.0044(7) 0.0037(7) -0.0054(7) C2 0.0129(8) 0.0174(8) 0.0199(9) -0.0041(7) 0.0004(7) -0.0025(7) C3 0.0197(9) 0.0089(7) 0.0162(8) -0.0012(6) 0.0050(7) -0.0017(6) C4 0.0183(9) 0.0145(8) 0.0172(9) -0.0029(7) 0.0008(7) -0.0033(7) C5 0.0299(10) 0.0159(8) 0.0130(8) -0.0024(7) 0.0043(7) -0.0038(7) C6 0.0281(10) 0.0140(8) 0.0195(9) -0.0017(7) 0.0113(8) -0.0020(7) C7 0.0177(9) 0.0137(8) 0.0204(9) -0.0013(7) 0.0057(7) -0.0017(7) C8 0.0187(9) 0.0096(8) 0.0134(8) -0.0006(6) 0.0026(7) -0.0009(6) C9 0.0141(8) 0.0152(8) 0.0191(9) 0.0006(7) 0.0001(7) 0.0031(7) C10 0.0127(8) 0.0160(8) 0.0209(9) -0.0004(7) 0.0031(7) 0.0012(7) C11 0.0148(8) 0.0170(8) 0.0171(9) 0.0021(7) -0.0037(7) 0.0004(7) C12 0.0215(10) 0.0163(8) 0.0139(8) 0.0009(7) -0.0046(7) -0.0026(7) C13 0.0309(11) 0.0215(9) 0.0125(8) -0.0002(7) 0.0052(8) 0.0049(8) C14 0.0313(11) 0.0242(10) 0.0152(9) 0.0045(7) 0.0087(8) 0.0028(8) C15 0.0255(10) 0.0210(9) 0.0264(10) 0.0001(8) 0.0128(8) -0.0063(8) C16 0.0180(9) 0.0232(10) 0.0236(10) -0.0051(7) 0.0105(8) -0.0055(7) C17 0.0121(8) 0.0169(8) 0.0197(9) -0.0016(7) -0.0003(7) -0.0001(7) C18 0.0132(8) 0.0168(8) 0.0146(8) -0.0001(7) 0.0040(6) -0.0006(7) C19 0.0148(9) 0.0199(9) 0.0175(9) 0.0007(7) 0.0014(7) 0.0023(7) C20 0.0206(9) 0.0157(8) 0.0199(9) 0.0021(7) 0.0039(7) 0.0045(7) C21 0.0194(9) 0.0131(8) 0.0152(8) -0.0013(7) 0.0039(7) -0.0010(7) C22 0.0138(8) 0.0132(8) 0.0105(7) -0.0001(6) 0.0041(6) -0.0011(6) C23 0.0153(8) 0.0121(8) 0.0097(7) -0.0006(6) 0.0045(6) -0.0007(6) C24 0.0133(8) 0.0130(8) 0.0214(9) 0.0000(7) -0.0004(7) -0.0025(7) C25 0.0151(8) 0.0124(8) 0.0193(9) -0.0013(7) 0.0049(7) -0.0007(6) C26 0.0177(9) 0.0192(9) 0.0264(10) 0.0009(8) 0.0069(7) -0.0035(7) C27 0.0265(10) 0.0166(9) 0.0266(10) 0.0034(8) 0.0121(8) -0.0046(7) C28 0.0250(10) 0.0143(8) 0.0177(9) 0.0031(7) 0.0076(7) 0.0013(7) C29 0.0181(9) 0.0144(8) 0.0130(8) -0.0002(6) 0.0055(7) 0.0015(7) C30 0.0171(9) 0.0156(8) 0.0102(8) -0.0022(6) 0.0039(6) 0.0022(7) P1 0.0183(3) 0.0275(4) 0.0230(3) 0.000 0.0045(3) 0.000 F1 0.0461(10) 0.0984(15) 0.1050(16) 0.0735(14) 0.0314(10) 0.0138(10) F2 0.0787(14) 0.0987(16) 0.0912(15) 0.0649(13) 0.0489(12) 0.0530(12) F3 0.0193(6) 0.0836(12) 0.0383(8) -0.0177(8) 0.0076(6) 0.0015(7) P2 0.0181(3) 0.0192(3) 0.0152(3) 0.0016(3) 0.0014(3) 0.0004(3) F4 0.0193(7) 0.0624(9) 0.0268(7) 0.0061(6) 0.0016(5) -0.0038(6) F5 0.0536(9) 0.0210(6) 0.0278(7) 0.0054(5) -0.0033(6) 0.0002(6) F6 0.0340(7) 0.0364(7) 0.0184(6) -0.0029(5) 0.0030(5) 0.0076(5) O1S 0.0213(11) 0.0464(14) 0.0271(11) 0.000 0.0035(9) 0.000 O2S 0.0193(8) 0.0366(9) 0.0358(9) 0.0028(7) -0.0015(6) -0.0035(7) O3S 0.0187(8) 0.0399(10) 0.0486(11) 0.0077(8) 0.0016(7) -0.0059(7) O4S 0.0327(8) 0.0210(7) 0.0284(8) -0.0016(6) 0.0018(6) 0.0058(6) _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 La O2 2.7723(12) . ? La O3 2.8006(12) . ? La O4 2.7139(13) . ? La O5 2.4703(12) . ? La O7 2.4535(13) . ? La O9 2.5457(13) . ? La N1 2.8575(16) . ? La N2 2.9567(16) . ? La N3 2.7051(14) . ? La N4 2.6970(15) . ? O1 C2 1.438(2) . ? O1 C3 1.378(2) . ? O2 C8 1.386(2) . ? O2 C9 1.450(2) . ? O3 C12 1.439(2) . ? O3 C13 1.435(2) . ? O4 C14 1.435(2) . ? O4 C15 1.441(2) . ? O5 C23 1.260(2) . ? O6 C23 1.256(2) . ? O7 C30 1.273(2) . ? O8 C30 1.240(2) . ? O9 H9A 0.824(16) . ? O9 H9B 0.833(16) . ? N1 C1 1.490(2) . ? N1 C16 1.491(2) . ? N1 C17 1.479(2) . ? N2 C10 1.487(2) . ? N2 C11 1.481(2) . ? N2 C24 1.479(2) . ? N3 C18 1.340(2) . ? N3 C22 1.346(2) . ? N4 C25 1.338(2) . ? N4 C29 1.349(2) . ? C1 H1A 0.9900 . ? C1 H1B 0.9900 . ? C1 C2 1.512(3) . ? C2 H2A 0.9900 . ? C2 H2B 0.9900 . ? C3 C4 1.389(3) . ? C3 C8 1.399(3) . ? C4 H4 0.9500 . ? C4 C5 1.398(3) . ? C5 H5 0.9500 . ? C5 C6 1.379(3) . ? C6 H6 0.9500 . ? C6 C7 1.394(3) . ? C7 H7 0.9500 . ? C7 C8 1.388(3) . ? C9 H9C 0.9900 . ? C9 H9D 0.9900 . ? C9 C10 1.508(2) . ? C10 H10A 0.9900 . ? C10 H10B 0.9900 . ? C11 H11A 0.9900 . ? C11 H11B 0.9900 . ? C11 C12 1.502(3) . ? C12 H12A 0.9900 . ? C12 H12B 0.9900 . ? C13 H13A 0.9900 . ? C13 H13B 0.9900 . ? C13 C14 1.488(3) . ? C14 H14A 0.9900 . ? C14 H14B 0.9900 . ? C15 H15A 0.9900 . ? C15 H15B 0.9900 . ? C15 C16 1.492(3) . ? C16 H16A 0.9900 . ? C16 H16B 0.9900 . ? C17 H17A 0.9900 . ? C17 H17B 0.9900 . ? C17 C18 1.508(2) . ? C18 C19 1.392(3) . ? C19 H19 0.9500 . ? C19 C20 1.382(3) . ? C20 H20 0.9500 . ? C20 C21 1.390(3) . ? C21 H21 0.9500 . ? C21 C22 1.388(2) . ? C22 C23 1.511(2) . ? C24 H24A 0.9900 . ? C24 H24B 0.9900 . ? C24 C25 1.508(2) . ? C25 C26 1.393(3) . ? C26 H26 0.9500 . ? C26 C27 1.384(3) . ? C27 H27 0.9500 . ? C27 C28 1.384(3) . ? C28 H28 0.9500 . ? C28 C29 1.385(3) . ? C29 C30 1.512(2) . ? P1 F1 1.5641(17) . ? P1 F1 1.5641(17) 2_656 ? P1 F2 1.5911(18) 2_656 ? P1 F2 1.5912(18) . ? P1 F3 1.5953(13) . ? P1 F3 1.5953(13) 2_656 ? P2 F4 1.5943(13) . ? P2 F4 1.5943(13) 5_666 ? P2 F5 1.6109(12) 5_666 ? P2 F5 1.6108(12) . ? P2 F6 1.6002(12) 5_666 ? P2 F6 1.6003(12) . ? O1S H1S 0.811(16) 2_655 ? O1S H1S 0.811(16) . ? O2S H2SA 0.839(17) . ? O2S H2SB 0.821(17) . ? O3S H3SA 0.863(17) . ? O3S H3SB 0.820(17) . ? O4S H4SA 0.853(17) . ? O4S H4SB 0.852(17) . ? loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle_publ_flag O2 La O3 97.61(4) . . ? O2 La N1 112.13(4) . . ? O2 La N2 60.79(4) . . ? O3 La N1 120.81(4) . . ? O3 La N2 59.98(4) . . ? O4 La O2 130.24(4) . . ? O4 La O3 59.75(4) . . ? O4 La N1 61.96(4) . . ? O4 La N2 119.68(4) . . ? O5 La O2 132.84(4) . . ? O5 La O3 66.28(4) . . ? O5 La O4 81.31(4) . . ? O5 La O9 133.76(4) . . ? O5 La N1 114.05(4) . . ? O5 La N2 73.42(4) . . ? O5 La N3 60.98(4) . . ? O5 La N4 68.57(4) . . ? O7 La O2 78.66(4) . . ? O7 La O3 170.72(4) . . ? O7 La O4 129.02(4) . . ? O7 La O5 109.99(4) . . ? O7 La O9 116.15(4) . . ? O7 La N1 68.41(4) . . ? O7 La N2 111.06(4) . . ? O7 La N3 67.65(4) . . ? O7 La N4 60.76(4) . . ? O9 La O2 62.54(4) . . ? O9 La O3 68.55(4) . . ? O9 La O4 67.82(4) . . ? O9 La N1 81.33(4) . . ? O9 La N2 92.44(4) . . ? O9 La N3 136.17(5) . . ? O9 La N4 139.14(5) . . ? N1 La N2 172.41(4) . . ? N3 La O2 146.15(4) . . ? N3 La O3 115.17(4) . . ? N3 La O4 77.20(4) . . ? N3 La N1 58.75(4) . . ? N3 La N2 128.51(4) . . ? N4 La O2 77.73(4) . . ? N4 La O3 110.25(4) . . ? N4 La O4 149.30(4) . . ? N4 La N1 125.05(4) . . ? N4 La N2 57.93(4) . . ? N4 La N3 82.94(4) . . ? C3 O1 C2 115.93(14) . . ? C8 O2 La 121.94(10) . . ? C8 O2 C9 118.14(14) . . ? C9 O2 La 116.56(10) . . ? C12 O3 La 117.57(10) . . ? C13 O3 La 113.60(10) . . ? C13 O3 C12 109.73(14) . . ? C14 O4 La 121.14(11) . . ? C14 O4 C15 109.52(14) . . ? C15 O4 La 117.82(11) . . ? C23 O5 La 126.78(11) . . ? C30 O7 La 125.23(11) . . ? La O9 H9A 109.0(17) . . ? La O9 H9B 140.8(16) . . ? H9A O9 H9B 110(2) . . ? C1 N1 La 111.78(11) . . ? C1 N1 C16 107.95(14) . . ? C16 N1 La 111.05(11) . . ? C17 N1 La 109.92(10) . . ? C17 N1 C1 109.94(14) . . ? C17 N1 C16 106.01(14) . . ? C10 N2 La 111.02(10) . . ? C11 N2 La 111.99(11) . . ? C11 N2 C10 109.02(14) . . ? C24 N2 La 107.48(10) . . ? C24 N2 C10 108.46(14) . . ? C24 N2 C11 108.77(14) . . ? C18 N3 La 123.55(11) . . ? C18 N3 C22 118.52(15) . . ? C22 N3 La 117.41(11) . . ? C25 N4 La 124.24(11) . . ? C25 N4 C29 118.41(15) . . ? C29 N4 La 115.75(11) . . ? N1 C1 H1A 108.5 . . ? N1 C1 H1B 108.5 . . ? N1 C1 C2 115.29(15) . . ? H1A C1 H1B 107.5 . . ? C2 C1 H1A 108.5 . . ? C2 C1 H1B 108.5 . . ? O1 C2 C1 108.53(14) . . ? O1 C2 H2A 110.0 . . ? O1 C2 H2B 110.0 . . ? C1 C2 H2A 110.0 . . ? C1 C2 H2B 110.0 . . ? H2A C2 H2B 108.4 . . ? O1 C3 C4 125.49(17) . . ? O1 C3 C8 114.58(15) . . ? C4 C3 C8 119.93(17) . . ? C3 C4 H4 120.5 . . ? C3 C4 C5 119.05(17) . . ? C5 C4 H4 120.5 . . ? C4 C5 H5 119.6 . . ? C6 C5 C4 120.86(17) . . ? C6 C5 H5 119.6 . . ? C5 C6 H6 119.8 . . ? C5 C6 C7 120.36(17) . . ? C7 C6 H6 119.8 . . ? C6 C7 H7 120.5 . . ? C8 C7 C6 119.08(17) . . ? C8 C7 H7 120.5 . . ? O2 C8 C3 114.34(15) . . ? O2 C8 C7 124.96(17) . . ? C7 C8 C3 120.69(16) . . ? O2 C9 H9C 110.0 . . ? O2 C9 H9D 110.0 . . ? O2 C9 C10 108.58(14) . . ? H9C C9 H9D 108.4 . . ? C10 C9 H9C 110.0 . . ? C10 C9 H9D 110.0 . . ? N2 C10 C9 110.44(15) . . ? N2 C10 H10A 109.6 . . ? N2 C10 H10B 109.6 . . ? C9 C10 H10A 109.6 . . ? C9 C10 H10B 109.6 . . ? H10A C10 H10B 108.1 . . ? N2 C11 H11A 109.1 . . ? N2 C11 H11B 109.1 . . ? N2 C11 C12 112.38(15) . . ? H11A C11 H11B 107.9 . . ? C12 C11 H11A 109.1 . . ? C12 C11 H11B 109.1 . . ? O3 C12 C11 107.84(14) . . ? O3 C12 H12A 110.1 . . ? O3 C12 H12B 110.1 . . ? C11 C12 H12A 110.1 . . ? C11 C12 H12B 110.1 . . ? H12A C12 H12B 108.5 . . ? O3 C13 H13A 109.9 . . ? O3 C13 H13B 109.9 . . ? O3 C13 C14 108.93(15) . . ? H13A C13 H13B 108.3 . . ? C14 C13 H13A 109.9 . . ? C14 C13 H13B 109.9 . . ? O4 C14 C13 108.49(15) . . ? O4 C14 H14A 110.0 . . ? O4 C14 H14B 110.0 . . ? C13 C14 H14A 110.0 . . ? C13 C14 H14B 110.0 . . ? H14A C14 H14B 108.4 . . ? O4 C15 H15A 110.2 . . ? O4 C15 H15B 110.2 . . ? O4 C15 C16 107.55(15) . . ? H15A C15 H15B 108.5 . . ? C16 C15 H15A 110.2 . . ? C16 C15 H15B 110.2 . . ? N1 C16 C15 112.98(16) . . ? N1 C16 H16A 109.0 . . ? N1 C16 H16B 109.0 . . ? C15 C16 H16A 109.0 . . ? C15 C16 H16B 109.0 . . ? H16A C16 H16B 107.8 . . ? N1 C17 H17A 109.4 . . ? N1 C17 H17B 109.4 . . ? N1 C17 C18 111.13(14) . . ? H17A C17 H17B 108.0 . . ? C18 C17 H17A 109.4 . . ? C18 C17 H17B 109.4 . . ? N3 C18 C17 116.79(15) . . ? N3 C18 C19 122.01(16) . . ? C19 C18 C17 121.20(16) . . ? C18 C19 H19 120.4 . . ? C20 C19 C18 119.26(16) . . ? C20 C19 H19 120.4 . . ? C19 C20 H20 120.5 . . ? C19 C20 C21 119.07(17) . . ? C21 C20 H20 120.5 . . ? C20 C21 H21 120.8 . . ? C22 C21 C20 118.32(16) . . ? C22 C21 H21 120.8 . . ? N3 C22 C21 122.82(16) . . ? N3 C22 C23 114.14(14) . . ? C21 C22 C23 123.04(15) . . ? O5 C23 C22 116.73(15) . . ? O6 C23 O5 125.01(16) . . ? O6 C23 C22 118.25(15) . . ? N2 C24 H24A 109.2 . . ? N2 C24 H24B 109.2 . . ? N2 C24 C25 112.11(14) . . ? H24A C24 H24B 107.9 . . ? C25 C24 H24A 109.2 . . ? C25 C24 H24B 109.2 . . ? N4 C25 C24 117.31(15) . . ? N4 C25 C26 122.07(17) . . ? C26 C25 C24 120.61(16) . . ? C25 C26 H26 120.5 . . ? C27 C26 C25 118.97(18) . . ? C27 C26 H26 120.5 . . ? C26 C27 H27 120.3 . . ? C26 C27 C28 119.33(17) . . ? C28 C27 H27 120.3 . . ? C27 C28 H28 120.8 . . ? C27 C28 C29 118.35(17) . . ? C29 C28 H28 120.8 . . ? N4 C29 C28 122.85(17) . . ? N4 C29 C30 114.66(15) . . ? C28 C29 C30 122.48(16) . . ? O7 C30 C29 114.72(15) . . ? O8 C30 O7 126.67(17) . . ? O8 C30 C29 118.61(16) . . ? F1 P1 F1 94.3(2) . 2_656 ? F1 P1 F2 88.04(14) . 2_656 ? F1 P1 F2 177.70(15) . . ? F1 P1 F2 177.70(15) 2_656 2_656 ? F1 P1 F2 88.03(14) 2_656 . ? F1 P1 F3 89.33(9) . . ? F1 P1 F3 89.33(9) 2_656 2_656 ? F1 P1 F3 90.86(9) . 2_656 ? F1 P1 F3 90.86(9) 2_656 . ? F2 P1 F2 89.7(2) 2_656 . ? F2 P1 F3 90.43(10) . . ? F2 P1 F3 90.43(10) 2_656 2_656 ? F2 P1 F3 89.37(9) 2_656 . ? F2 P1 F3 89.36(10) . 2_656 ? F3 P1 F3 179.71(14) . 2_656 ? F4 P2 F4 180.0 . 5_666 ? F4 P2 F5 89.94(8) . . ? F4 P2 F5 89.94(8) 5_666 5_666 ? F4 P2 F5 90.06(8) 5_666 . ? F4 P2 F5 90.06(8) . 5_666 ? F4 P2 F6 90.17(7) . 5_666 ? F4 P2 F6 89.83(7) 5_666 5_666 ? F4 P2 F6 89.83(7) . . ? F4 P2 F6 90.17(7) 5_666 . ? F5 P2 F5 180.0 . 5_666 ? F6 P2 F5 90.47(7) 5_666 . ? F6 P2 F5 89.53(7) . . ? F6 P2 F5 89.53(7) 5_666 5_666 ? F6 P2 F5 90.47(7) . 5_666 ? F6 P2 F6 180.0 5_666 . ? H1S O1S H1S 126(4) . 2_655 ? H2SA O2S H2SB 107(3) . . ? H3SA O3S H3SB 109(3) . . ? H4SA O4S H4SB 104(3) . . ? loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_site_symmetry_A O9 H9B O6 0.833(16) 1.842(17) 2.6533(18) 164(2) 4_655 O1S H1S O3S 0.811(16) 2.014(17) 2.812(2) 168(3) 7_656 O2S H2SA O6 0.839(17) 1.942(18) 2.780(2) 177(3) . O2S H2SB O1S 0.821(17) 1.988(18) 2.791(2) 166(3) . O3S H3SA O8 0.863(17) 1.916(18) 2.777(2) 175(3) . O4S H4SB O2S 0.852(17) 1.927(18) 2.759(2) 165(3) . 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 La O2 C8 C3 42.34(18) . . . . ? La O2 C8 C7 -136.75(15) . . . . ? La O2 C9 C10 54.27(16) . . . . ? La O3 C12 C11 53.69(16) . . . . ? La O3 C13 C14 -52.97(17) . . . . ? La O4 C14 C13 -37.16(19) . . . . ? La O4 C15 C16 50.91(18) . . . . ? La O5 C23 O6 158.12(13) . . . . ? La O5 C23 C22 -22.2(2) . . . . ? La O7 C30 O8 147.70(14) . . . . ? La O7 C30 C29 -31.9(2) . . . . ? La N1 C1 C2 53.22(17) . . . . ? La N1 C16 C15 41.16(17) . . . . ? La N1 C17 C18 48.05(16) . . . . ? La N2 C10 C9 43.27(16) . . . . ? La N2 C11 C12 40.58(17) . . . . ? La N2 C24 C25 46.83(16) . . . . ? La N3 C18 C17 -7.4(2) . . . . ? La N3 C18 C19 172.10(13) . . . . ? La N3 C22 C21 -172.05(13) . . . . ? La N3 C22 C23 8.61(18) . . . . ? La N4 C25 C24 -14.1(2) . . . . ? La N4 C25 C26 164.48(13) . . . . ? La N4 C29 C28 -165.79(14) . . . . ? La N4 C29 C30 14.00(18) . . . . ? O1 C3 C4 C5 178.10(16) . . . . ? O1 C3 C8 O2 1.9(2) . . . . ? O1 C3 C8 C7 -178.91(15) . . . . ? O2 C9 C10 N2 -65.25(18) . . . . ? O3 C13 C14 O4 58.2(2) . . . . ? O4 C15 C16 N1 -61.0(2) . . . . ? N1 C1 C2 O1 -66.45(19) . . . . ? N1 C17 C18 N3 -29.6(2) . . . . ? N1 C17 C18 C19 150.93(17) . . . . ? N2 C11 C12 O3 -62.46(19) . . . . ? N2 C24 C25 N4 -26.4(2) . . . . ? N2 C24 C25 C26 154.97(17) . . . . ? N3 C18 C19 C20 -0.5(3) . . . . ? N3 C22 C23 O5 6.7(2) . . . . ? N3 C22 C23 O6 -173.59(15) . . . . ? N4 C25 C26 C27 -0.2(3) . . . . ? N4 C29 C30 O7 8.4(2) . . . . ? N4 C29 C30 O8 -171.25(15) . . . . ? C1 N1 C16 C15 -81.71(19) . . . . ? C1 N1 C17 C18 171.51(15) . . . . ? C2 O1 C3 C4 12.2(2) . . . . ? C2 O1 C3 C8 -168.47(14) . . . . ? C3 O1 C2 C1 173.48(14) . . . . ? C3 C4 C5 C6 0.8(3) . . . . ? C4 C3 C8 O2 -178.66(15) . . . . ? C4 C3 C8 C7 0.5(3) . . . . ? C4 C5 C6 C7 0.4(3) . . . . ? C5 C6 C7 C8 -1.2(3) . . . . ? C6 C7 C8 O2 179.78(16) . . . . ? C6 C7 C8 C3 0.7(3) . . . . ? C8 O2 C9 C10 -105.48(17) . . . . ? C8 C3 C4 C5 -1.2(3) . . . . ? C9 O2 C8 C3 -159.05(15) . . . . ? C9 O2 C8 C7 21.9(2) . . . . ? C10 N2 C11 C12 163.83(15) . . . . ? C10 N2 C24 C25 -73.27(18) . . . . ? C11 N2 C10 C9 -80.56(17) . . . . ? C11 N2 C24 C25 168.27(15) . . . . ? C12 O3 C13 C14 173.15(15) . . . . ? C13 O3 C12 C11 -174.48(14) . . . . ? C14 O4 C15 C16 -165.25(15) . . . . ? C15 O4 C14 C13 -179.60(16) . . . . ? C16 N1 C1 C2 175.65(16) . . . . ? C16 N1 C17 C18 -72.05(18) . . . . ? C17 N1 C1 C2 -69.1(2) . . . . ? C17 N1 C16 C15 160.51(15) . . . . ? C17 C18 C19 C20 179.01(17) . . . . ? C18 N3 C22 C21 0.0(2) . . . . ? C18 N3 C22 C23 -179.37(15) . . . . ? C18 C19 C20 C21 -0.2(3) . . . . ? C19 C20 C21 C22 0.7(3) . . . . ? C20 C21 C22 N3 -0.6(3) . . . . ? C20 C21 C22 C23 178.63(16) . . . . ? C21 C22 C23 O5 -172.59(16) . . . . ? C21 C22 C23 O6 7.1(2) . . . . ? C22 N3 C18 C17 -178.91(15) . . . . ? C22 N3 C18 C19 0.6(3) . . . . ? C24 N2 C10 C9 161.15(14) . . . . ? C24 N2 C11 C12 -78.07(19) . . . . ? C24 C25 C26 C27 178.36(17) . . . . ? C25 N4 C29 C28 0.4(3) . . . . ? C25 N4 C29 C30 -179.80(15) . . . . ? C25 C26 C27 C28 0.9(3) . . . . ? C26 C27 C28 C29 -0.9(3) . . . . ? C27 C28 C29 N4 0.3(3) . . . . ? C27 C28 C29 C30 -179.48(17) . . . . ? C28 C29 C30 O7 -171.81(16) . . . . ? C28 C29 C30 O8 8.5(3) . . . . ? C29 N4 C25 C24 -179.06(15) . . . . ? C29 N4 C25 C26 -0.5(3) . . . . ? _shelx_res_file ; TITL rkjk6_abs_a.res in C2/c rkjk6_abs.res created by SHELXL-2016/6 at 12:46:51 on 09-Apr-2022 REM Old TITL Rkjk6_abs in C2/c REM SHELXT solution in C2/c REM R1 0.081, Rweak 0.003, Alpha 0.037, Orientation as input REM Formula found by SHELXT: C60 N15 O14 F16 P2 La2 CELL 0.71073 22.1824 17.0833 20.0078 90 106.384 90 ZERR 8 0.0004 0.0003 0.0004 0 0.002 0 LATT 7 SYMM -X,+Y,0.5-Z SFAC C H F La N O P UNIT 240 344 48 8 32 100 8 EQIV $1 1.5-X,0.5+Y,0.5-Z EQIV $2 1.5-X,0.5-Y,1-Z DFIX 0.84 O3S H3Sb O3S H3Sa O4S H4Sb O4S H4Sa O2S H2Sb O2S H2Sa O9 H9a O9 H9b DFIX 0.84 O1S H1S L.S. 10 PLAN 20 SIZE 0.106 0.118 0.156 TEMP -173 CONF HTAB O9 O6_$1 HTAB O1S O3S_$2 HTAB O2S O6 HTAB O2S O1S HTAB O3S O8 HTAB O4S O2S BOND $H list 4 MORE -1 fmap 2 53 acta OMIT 10 0 2 REM REM REM WGHT 0.028800 8.524100 FVAR 0.14002 LA 4 0.760773 0.520219 0.347614 11.00000 0.01156 0.00825 = 0.01040 0.00017 0.00148 -0.00097 O1 6 0.825945 0.633957 0.463465 11.00000 0.01334 0.01654 = 0.01402 -0.00186 0.00211 -0.00099 O2 6 0.706887 0.629321 0.415830 11.00000 0.01318 0.01924 = 0.01389 -0.00255 0.00047 0.00035 O3 6 0.691780 0.557827 0.211248 11.00000 0.02043 0.01503 = 0.01171 -0.00020 0.00172 0.00001 O4 6 0.820058 0.540170 0.247275 11.00000 0.02150 0.02376 = 0.01579 0.00304 0.00652 -0.00133 O5 6 0.718394 0.404895 0.275057 11.00000 0.01559 0.01182 = 0.01524 -0.00081 0.00015 0.00007 O6 6 0.705574 0.275728 0.261621 11.00000 0.01659 0.01270 = 0.01804 -0.00445 0.00221 -0.00278 O7 6 0.804852 0.480408 0.469488 11.00000 0.01642 0.01504 = 0.01347 0.00014 0.00144 -0.00154 O8 6 0.826225 0.379015 0.543887 11.00000 0.02054 0.02375 = 0.01530 0.00492 0.00078 0.00386 O9 6 0.772691 0.664134 0.320874 11.00000 0.03509 0.01084 = 0.01437 0.00016 0.00798 -0.00405 H9A 2 0.774141 0.690282 0.355901 11.00000 -1.20000 H9B 2 0.776906 0.693077 0.288982 11.00000 -1.20000 N1 5 0.894852 0.529129 0.389687 11.00000 0.01388 0.01415 = 0.01759 -0.00332 0.00442 -0.00307 N2 5 0.622336 0.532375 0.311199 11.00000 0.01496 0.01120 = 0.01527 0.00091 0.00062 -0.00021 N3 5 0.832406 0.389907 0.360301 11.00000 0.01426 0.01219 = 0.01182 -0.00011 0.00351 0.00000 N4 5 0.691710 0.429314 0.408170 11.00000 0.01457 0.01216 = 0.01421 -0.00010 0.00375 0.00034 C1 1 0.917671 0.603064 0.427983 11.00000 0.01354 0.01577 = 0.02211 -0.00436 0.00368 -0.00538 AFIX 23 H1A 2 0.906276 0.647274 0.394813 11.00000 -1.20000 H1B 2 0.964106 0.601052 0.444940 11.00000 -1.20000 AFIX 0 C2 1 0.892402 0.619774 0.489250 11.00000 0.01286 0.01737 = 0.01987 -0.00407 0.00045 -0.00255 AFIX 23 H2A 2 0.900374 0.574534 0.521482 11.00000 -1.20000 H2B 2 0.913687 0.666197 0.515004 11.00000 -1.20000 AFIX 0 C3 1 0.794301 0.642142 0.513247 11.00000 0.01975 0.00894 = 0.01615 -0.00119 0.00497 -0.00174 C4 1 0.822135 0.651762 0.584197 11.00000 0.01833 0.01449 = 0.01724 -0.00287 0.00084 -0.00334 AFIX 43 H4 2 0.866583 0.651592 0.602483 11.00000 -1.20000 AFIX 0 C5 1 0.783813 0.661697 0.628314 11.00000 0.02989 0.01592 = 0.01298 -0.00238 0.00426 -0.00385 AFIX 43 H5 2 0.802492 0.668960 0.676832 11.00000 -1.20000 AFIX 0 C6 1 0.719258 0.661094 0.602333 11.00000 0.02809 0.01404 = 0.01954 -0.00173 0.01127 -0.00200 AFIX 43 H6 2 0.693879 0.668298 0.632969 11.00000 -1.20000 AFIX 0 C7 1 0.691026 0.649970 0.531355 11.00000 0.01772 0.01372 = 0.02040 -0.00131 0.00573 -0.00170 AFIX 43 H7 2 0.646555 0.648552 0.513507 11.00000 -1.20000 AFIX 0 C8 1 0.728781 0.640996 0.487128 11.00000 0.01874 0.00963 = 0.01339 -0.00064 0.00256 -0.00090 C9 1 0.643188 0.653490 0.380465 11.00000 0.01414 0.01519 = 0.01905 0.00058 0.00005 0.00313 AFIX 23 H9C 2 0.642461 0.682535 0.337428 11.00000 -1.20000 H9D 2 0.627096 0.688407 0.411021 11.00000 -1.20000 AFIX 0 C10 1 0.602496 0.581437 0.362651 11.00000 0.01270 0.01600 = 0.02089 -0.00043 0.00307 0.00120 AFIX 23 H10A 2 0.605869 0.550654 0.405475 11.00000 -1.20000 H10B 2 0.558046 0.597167 0.343044 11.00000 -1.20000 AFIX 0 C11 1 0.595324 0.565404 0.240647 11.00000 0.01476 0.01701 = 0.01710 0.00206 -0.00368 0.00044 AFIX 23 H11A 2 0.599578 0.623102 0.242935 11.00000 -1.20000 H11B 2 0.549955 0.552789 0.224573 11.00000 -1.20000 AFIX 0 C12 1 0.626868 0.534276 0.188866 11.00000 0.02145 0.01628 = 0.01387 0.00089 -0.00458 -0.00258 AFIX 23 H12A 2 0.623728 0.476476 0.186605 11.00000 -1.20000 H12B 2 0.606336 0.555626 0.141960 11.00000 -1.20000 AFIX 0 C13 1 0.722375 0.535802 0.159740 11.00000 0.03091 0.02148 = 0.01253 -0.00017 0.00523 0.00491 AFIX 23 H13A 2 0.698329 0.555961 0.113517 11.00000 -1.20000 H13B 2 0.724367 0.478046 0.156901 11.00000 -1.20000 AFIX 0 C14 1 0.787005 0.569045 0.179509 11.00000 0.03132 0.02418 = 0.01520 0.00449 0.00868 0.00284 AFIX 23 H14A 2 0.809191 0.553274 0.145094 11.00000 -1.20000 H14B 2 0.785040 0.626922 0.180264 11.00000 -1.20000 AFIX 0 C15 1 0.882757 0.572064 0.267802 11.00000 0.02546 0.02098 = 0.02640 0.00007 0.01281 -0.00634 AFIX 23 H15A 2 0.881687 0.627728 0.281186 11.00000 -1.20000 H15B 2 0.901786 0.568731 0.228692 11.00000 -1.20000 AFIX 0 C16 1 0.920289 0.525306 0.328274 11.00000 0.01796 0.02321 = 0.02363 -0.00513 0.01054 -0.00552 AFIX 23 H16A 2 0.921087 0.469996 0.313780 11.00000 -1.20000 H16B 2 0.964099 0.544792 0.342071 11.00000 -1.20000 AFIX 0 C17 1 0.921443 0.460940 0.433679 11.00000 0.01208 0.01692 = 0.01971 -0.00161 -0.00026 -0.00009 AFIX 23 H17A 2 0.914242 0.467021 0.480035 11.00000 -1.20000 H17B 2 0.967364 0.458770 0.440354 11.00000 -1.20000 AFIX 0 C18 1 0.891799 0.385653 0.400804 11.00000 0.01320 0.01676 = 0.01455 -0.00013 0.00400 -0.00058 C19 1 0.924774 0.315325 0.412712 11.00000 0.01478 0.01991 = 0.01746 0.00074 0.00140 0.00228 AFIX 43 H19 2 0.966968 0.313941 0.441364 11.00000 -1.20000 AFIX 0 C20 1 0.895446 0.247506 0.382383 11.00000 0.02057 0.01566 = 0.01991 0.00215 0.00393 0.00450 AFIX 43 H20 2 0.917247 0.198984 0.389786 11.00000 -1.20000 AFIX 0 C21 1 0.833625 0.251302 0.340913 11.00000 0.01942 0.01306 = 0.01522 -0.00128 0.00390 -0.00101 AFIX 43 H21 2 0.812171 0.205511 0.319882 11.00000 -1.20000 AFIX 0 C22 1 0.804011 0.323714 0.330998 11.00000 0.01384 0.01316 = 0.01051 -0.00010 0.00412 -0.00108 C23 1 0.737454 0.335298 0.285788 11.00000 0.01532 0.01214 = 0.00965 -0.00061 0.00451 -0.00072 C24 1 0.597282 0.452400 0.313035 11.00000 0.01333 0.01300 = 0.02144 0.00004 -0.00036 -0.00246 AFIX 23 H24A 2 0.600527 0.423139 0.271479 11.00000 -1.20000 H24B 2 0.552262 0.455679 0.311098 11.00000 -1.20000 AFIX 0 C25 1 0.632113 0.408428 0.377757 11.00000 0.01511 0.01245 = 0.01929 -0.00132 0.00488 -0.00071 C26 1 0.603163 0.347550 0.403261 11.00000 0.01767 0.01925 = 0.02642 0.00087 0.00690 -0.00353 AFIX 43 H26 2 0.560751 0.333914 0.380841 11.00000 -1.20000 AFIX 0 C27 1 0.637129 0.307223 0.461769 11.00000 0.02653 0.01663 = 0.02660 0.00344 0.01208 -0.00455 AFIX 43 H27 2 0.618468 0.265013 0.479631 11.00000 -1.20000 AFIX 0 C28 1 0.698564 0.329005 0.494000 11.00000 0.02503 0.01434 = 0.01774 0.00310 0.00758 0.00134 AFIX 43 H28 2 0.722589 0.302690 0.534629 11.00000 -1.20000 AFIX 0 C29 1 0.724134 0.390098 0.465558 11.00000 0.01809 0.01440 = 0.01296 -0.00023 0.00549 0.00148 C30 1 0.790903 0.417925 0.496410 11.00000 0.01714 0.01557 = 0.01022 -0.00216 0.00387 0.00225 P1 7 0.500000 0.193810 0.750000 10.50000 0.01835 0.02749 = 0.02300 0.00000 0.00450 0.00000 F1 3 0.510710 0.131518 0.809495 11.00000 0.04612 0.09840 = 0.10497 0.07352 0.03145 0.01381 F2 3 0.489261 0.259859 0.691744 11.00000 0.07865 0.09870 = 0.09121 0.06487 0.04888 0.05300 F3 3 0.426821 0.194045 0.744387 11.00000 0.01934 0.08365 = 0.03830 -0.01765 0.00757 0.00154 P2 7 0.500000 0.500000 0.500000 10.50000 0.01805 0.01921 = 0.01522 0.00159 0.00138 0.00042 F4 3 0.574183 0.508652 0.514927 11.00000 0.01931 0.06236 = 0.02679 0.00610 0.00161 -0.00384 F5 3 0.509411 0.412281 0.530730 11.00000 0.05360 0.02099 = 0.02775 0.00541 -0.00334 0.00025 F6 3 0.505159 0.532531 0.576417 11.00000 0.03399 0.03637 = 0.01839 -0.00289 0.00304 0.00755 O1S 6 0.500000 0.207083 0.250000 10.50000 0.02134 0.04636 = 0.02708 0.00000 0.00352 0.00000 H1S 2 0.515914 0.185683 0.286926 11.00000 -1.20000 O2S 6 0.578722 0.299433 0.195696 11.00000 0.01927 0.03657 = 0.03579 0.00280 -0.00148 -0.00354 H2SA 2 0.617326 0.293844 0.214729 11.00000 -1.20000 H2SB 2 0.560441 0.272986 0.218191 11.00000 -1.20000 O3S 6 0.951193 0.348135 0.612950 11.00000 0.01867 0.03988 = 0.04864 0.00772 0.00158 -0.00590 H3SA 2 0.912166 0.359329 0.593896 11.00000 -1.20000 H3SB 2 0.961638 0.313439 0.590141 11.00000 -1.20000 O4S 6 0.523393 0.269681 0.056290 11.00000 0.03268 0.02101 = 0.02844 -0.00163 0.00185 0.00576 H4SA 2 0.512746 0.313097 0.035225 11.00000 -1.20000 H4SB 2 0.545415 0.283397 0.096786 11.00000 -1.20000 HKLF 4 REM rkjk6_abs_a.res in C2/c REM R1 = 0.0235 for 7398 Fo > 4sig(Fo) and 0.0267 for all 8016 data REM 521 parameters refined using 9 restraints END WGHT 0.0288 8.5183 REM Highest difference peak 0.966, deepest hole -0.554, 1-sigma level 0.090 Q1 1 0.4795 0.2021 0.6749 11.00000 0.05 0.97 Q2 1 0.4871 0.2763 0.7408 11.00000 0.05 0.60 Q3 1 0.5139 0.0975 0.7669 11.00000 0.05 0.51 Q4 1 0.5000 0.1353 0.7500 10.50000 0.05 0.42 Q5 1 0.9055 0.5587 0.3031 11.00000 0.05 0.42 Q6 1 0.7580 0.4018 0.4857 11.00000 0.05 0.41 Q7 1 0.6204 0.6168 0.3768 11.00000 0.05 0.39 Q8 1 0.8143 0.4968 0.2404 11.00000 0.05 0.38 Q9 1 0.7176 0.5235 0.3181 11.00000 0.05 0.37 Q10 1 0.7602 0.6398 0.5000 11.00000 0.05 0.37 Q11 1 0.8213 0.3580 0.3425 11.00000 0.05 0.35 Q12 1 0.6205 0.3747 0.3840 11.00000 0.05 0.35 Q13 1 0.8184 0.2861 0.3422 11.00000 0.05 0.34 Q14 1 0.5589 0.5451 0.5249 11.00000 0.05 0.34 Q15 1 0.8061 0.4253 0.3377 11.00000 0.05 0.34 Q16 1 0.4801 0.2763 0.6869 11.00000 0.05 0.33 Q17 1 0.6182 0.6250 0.2421 11.00000 0.05 0.32 Q18 1 0.6243 0.3199 0.4245 11.00000 0.05 0.31 Q19 1 0.8043 0.6593 0.5456 11.00000 0.05 0.31 Q20 1 0.9308 0.4784 0.6174 11.00000 0.05 0.31 ; _shelx_res_checksum 12319 _shelx_hkl_file ; 0 0 -3 0.21 0.61 0 0 3 -0.10 0.83 0 0 4 7.36 1.34 0 0 -4 6.82 1.21 0 0 5 0.93 0.91 0 0 -5 0.15 1.01 0 0 6 1880.29 70.34 0 0 -6 1802.81 70.80 0 0 -7 -0.41 1.18 0 0 -7 -0.23 1.13 0 0 -8 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2425.97 28.93 0 -8 5 2459.53 19.97 0 -8 5 2467.97 25.46 0 -8 -6 1674.88 12.21 0 -8 -6 1489.79 23.12 0 -8 6 1511.66 14.72 0 -8 6 1475.61 20.16 0 8 -6 -0.33 1.19 0 -8 6 1501.33 20.86 0 8 6 0.45 1.08 0 -8 7 2.22 2.04 0 -8 7 2.71 1.24 0 -8 -7 3.48 2.28 0 -8 -7 1.55 0.77 0 8 -7 1.65 1.31 0 -8 7 1.64 2.00 0 8 -7 -0.36 1.57 0 -8 8 21.21 1.89 0 -8 8 24.99 3.50 0 -8 8 22.33 3.17 0 8 -8 21.76 3.10 0 -8 -9 761.53 32.91 0 -8 9 732.04 28.53 0 8 -9 782.03 32.30 0 -8 9 758.88 31.73 0 8 9 727.34 30.40 0 8 10 123.18 8.23 0 8 -10 151.69 9.29 0 -8 -10 158.83 9.96 0 8 10 138.50 9.30 0 8 10 129.81 7.64 0 8 11 865.23 35.64 0 8 -11 828.90 36.22 0 -8 -11 861.05 37.09 0 8 -11 869.61 35.69 0 8 11 811.40 36.59 0 8 11 813.03 34.50 0 8 12 1.36 2.48 0 8 -12 4.29 2.50 0 -8 -12 6.17 3.10 0 8 -12 4.06 2.37 0 8 12 4.68 2.72 0 8 12 2.46 1.96 0 8 13 10.14 3.02 0 8 -13 5.05 2.53 0 -8 -13 5.76 2.99 0 8 -13 3.43 2.88 0 8 -13 3.30 2.09 0 8 13 3.62 2.81 0 8 13 7.49 2.41 0 8 14 280.27 14.96 0 8 -14 279.87 15.47 0 8 -14 277.06 15.53 0 8 -14 270.99 14.64 0 8 14 283.86 14.20 0 8 14 286.54 15.92 0 8 15 83.74 7.77 0 8 15 74.63 6.82 0 8 -15 105.27 7.97 0 8 -15 86.41 7.58 0 8 -15 85.14 6.99 0 8 -15 81.89 7.19 0 8 15 89.98 6.70 0 8 16 361.04 18.28 0 8 -16 360.86 18.76 0 8 -16 355.85 18.87 0 8 -16 338.50 18.32 0 8 -16 337.88 17.72 0 8 16 336.60 17.13 0 8 -16 347.67 18.28 0 8 16 377.32 19.23 0 8 17 307.26 17.43 0 8 17 305.58 17.02 0 8 -17 317.02 17.47 0 8 -17 321.32 17.86 0 8 -17 340.86 17.66 0 8 -17 325.85 16.80 0 8 17 311.99 16.12 0 8 -17 305.07 17.20 0 8 18 15.54 4.28 0 8 -18 15.63 4.33 0 8 -18 15.59 4.43 0 8 -18 20.67 4.25 0 8 18 20.13 3.95 0 8 18 18.00 4.56 0 8 -19 167.64 11.42 0 8 -19 178.44 12.29 0 8 19 187.88 11.50 0 8 19 183.93 12.47 0 8 -20 121.52 9.39 0 8 -20 120.79 9.82 0 8 20 118.70 8.94 0 8 20 110.40 9.70 0 8 -21 504.99 25.81 0 8 21 515.93 24.63 0 8 -21 477.32 26.00 0 8 -21 537.75 25.07 0 8 -22 24.01 4.91 0 8 -22 20.85 4.74 0 8 22 20.12 4.64 0 8 -22 29.46 6.34 0 -10 0 24.94 3.29 0 -10 0 17.50 3.05 0 10 0 24.17 3.25 0 10 0 27.93 2.96 0 -10 1 1517.54 57.02 0 -10 -1 1429.97 57.58 0 -10 1 1459.77 57.23 0 10 1 1441.66 57.33 0 10 -1 1431.33 56.87 0 10 -1 1310.36 56.37 0 -10 2 8.85 2.31 0 -10 2 14.00 2.66 0 -10 -2 10.23 2.68 0 10 -2 12.63 2.41 0 10 2 9.16 2.38 0 10 -3 245.12 12.22 0 -10 -3 221.31 12.79 0 -10 3 258.34 12.10 0 -10 3 221.11 12.03 0 10 3 229.64 12.74 0 10 -3 235.64 11.66 0 -10 -3 223.34 9.43 0 10 -3 248.01 9.46 0 -10 4 260.77 12.82 0 -10 4 239.08 12.60 0 -10 4 240.84 11.90 0 10 -4 243.99 12.61 0 10 -4 228.96 11.59 0 10 4 239.16 13.15 0 -10 5 1703.99 67.55 0 10 5 1802.65 69.78 0 -10 5 1728.54 68.81 0 -10 5 1715.00 68.74 0 -10 6 85.27 5.42 0 10 -6 86.87 6.37 0 -10 6 96.31 6.68 0 -10 6 84.14 6.41 0 10 -6 69.74 5.81 0 10 6 86.21 6.91 0 -10 7 69.17 5.75 0 -10 7 63.41 4.31 0 -10 -7 57.48 6.06 0 10 -7 64.03 5.68 0 -10 7 64.75 5.64 0 10 -7 59.26 5.21 0 10 7 57.87 5.77 0 -10 -8 258.48 14.28 0 -10 8 253.81 10.88 0 -10 8 227.30 12.64 0 10 -8 238.72 12.53 0 -10 9 359.33 15.23 0 -10 -9 360.44 19.11 0 10 -9 376.23 17.86 0 -10 9 364.78 18.33 0 -10 9 335.67 17.66 0 10 -9 418.59 18.79 0 -10 -10 494.65 23.49 0 10 10 467.36 20.38 0 10 -10 513.72 22.11 0 10 -10 465.53 22.19 0 10 11 635.20 27.79 0 10 -11 598.62 28.35 0 10 11 637.77 26.72 0 -10 -11 619.20 29.45 0 10 -11 620.11 28.01 0 10 11 607.00 28.91 0 10 12 23.28 3.94 0 10 -12 22.78 4.01 0 10 12 28.64 3.57 0 -10 -12 19.76 4.42 0 10 -12 29.85 4.50 0 10 12 19.70 4.38 0 10 -13 17.48 3.83 0 10 13 19.70 4.03 0 -10 -13 16.06 4.42 0 10 13 10.82 3.59 0 10 13 14.66 2.80 0 10 14 154.40 10.06 0 10 14 142.55 10.80 0 10 14 129.12 8.51 0 10 -14 160.41 10.60 0 10 15 682.08 30.48 0 10 15 682.54 31.65 0 10 15 646.91 28.96 0 10 -15 669.64 31.18 0 10 16 62.88 6.42 0 10 16 57.00 5.48 0 10 16 55.02 6.84 0 10 -16 62.23 6.79 0 10 17 235.25 14.77 0 10 17 248.62 13.99 0 10 17 292.37 16.49 0 10 -17 300.98 16.43 0 10 18 2.05 2.85 0 10 -18 5.25 3.43 0 10 19 241.14 13.54 0 10 -19 229.33 14.92 0 10 20 121.73 9.23 0 10 -20 133.81 10.85 0 10 21 561.44 26.19 0 10 -21 543.43 27.98 0 -12 0 6.84 2.61 0 -12 0 8.50 2.96 0 12 0 8.79 2.71 0 12 0 10.48 2.25 0 -12 1 325.84 15.17 0 -12 -1 282.31 15.51 0 -12 1 290.34 15.21 0 12 1 281.85 15.10 0 12 -1 293.97 14.96 0 12 -1 290.48 14.56 0 -12 2 98.41 7.10 0 -12 -2 98.30 7.74 0 -12 2 93.63 7.11 0 12 -2 101.40 6.95 0 12 2 99.05 7.45 0 12 -2 96.26 6.81 0 -12 3 320.55 16.43 0 -12 -3 303.86 17.19 0 -12 3 342.82 16.43 0 12 -3 339.88 16.09 0 12 3 322.49 17.03 0 12 -3 366.76 16.85 0 12 -4 96.38 6.88 0 -12 -4 88.52 7.34 0 -12 4 90.01 6.25 0 -12 4 82.22 6.46 0 -12 4 83.37 6.70 0 12 4 86.20 7.09 0 -12 -4 81.47 3.70 0 12 -4 76.02 3.60 0 12 -4 80.17 3.63 0 -12 -4 78.17 3.68 0 -12 5 1871.00 72.64 0 -12 5 1856.66 72.62 0 -12 5 1842.66 71.41 0 -12 5 1632.14 72.86 0 12 -5 1783.61 72.56 0 12 5 1878.83 73.58 0 12 -6 253.15 13.55 0 -12 6 246.90 12.23 0 -12 6 245.27 13.40 0 -12 6 240.46 13.38 0 12 -6 230.44 12.75 0 12 6 233.62 13.98 0 12 -7 320.39 16.88 0 -12 7 328.53 15.18 0 -12 7 323.90 16.82 0 -12 7 329.85 17.06 0 12 -7 313.54 16.14 0 12 7 345.37 17.91 0 -12 8 252.26 14.42 0 -12 -8 297.69 16.42 0 -12 8 284.46 12.88 0 12 -8 225.13 13.96 0 -12 8 277.16 15.07 0 12 -8 306.27 14.71 0 12 8 268.45 15.47 0 -12 9 159.89 10.32 0 -12 9 150.88 8.10 0 -12 -9 155.20 11.25 0 12 -9 159.09 10.10 0 -12 9 164.89 10.65 0 12 -9 169.19 10.15 0 12 9 178.73 11.61 0 12 -10 78.84 6.85 0 -12 -10 82.00 8.01 0 12 -10 71.32 6.59 0 -12 10 83.20 7.17 0 12 -11 1125.84 47.77 0 -12 11 1210.14 47.60 0 -12 -11 1147.21 49.08 0 12 -11 1108.19 46.84 0 12 -11 1141.99 47.04 0 12 11 1140.62 45.27 0 12 12 -0.76 2.30 0 12 -12 -1.34 2.66 0 12 12 -0.54 3.19 0 -12 -12 2.38 3.16 0 12 -12 -1.14 3.35 0 12 -12 -0.57 3.05 0 12 12 2.92 3.04 0 12 13 3.58 2.22 0 12 13 2.25 3.14 0 12 -13 6.94 3.54 0 -12 -13 4.92 3.62 0 12 -13 3.55 3.22 0 12 -13 4.22 3.03 0 12 13 3.75 3.61 0 12 14 55.10 6.26 0 12 -14 61.25 6.71 0 12 14 57.51 5.34 0 12 -14 63.89 6.54 0 12 -14 59.77 6.54 0 12 14 64.00 7.31 0 12 15 626.56 29.60 0 12 15 659.45 28.20 0 12 15 619.55 30.96 0 12 -15 649.58 30.75 0 12 16 6.87 2.97 0 12 -16 7.74 3.73 0 12 17 206.88 12.17 0 12 -17 230.54 14.67 0 12 18 175.48 10.97 0 12 -18 172.42 12.81 0 12 19 126.22 9.18 0 12 -19 140.71 11.37 0 12 20 19.02 4.24 0 12 -20 19.12 4.95 0 -14 0 171.17 10.93 0 14 0 200.69 11.58 0 -14 0 196.06 12.02 0 -14 -1 603.72 27.40 0 -14 1 562.61 27.18 0 -14 -1 634.56 28.59 0 -14 1 628.22 28.13 0 14 1 609.29 27.95 0 14 -1 627.24 27.70 0 -14 2 122.02 8.82 0 -14 -2 140.12 9.86 0 -14 2 138.63 9.19 0 14 -2 119.91 8.42 0 14 2 127.25 9.28 0 14 -2 121.20 8.54 0 -14 3 15.00 3.69 0 -14 -3 9.27 3.54 0 -14 3 11.67 3.39 0 14 -3 9.68 2.73 0 14 -3 11.92 3.04 0 14 3 11.50 3.62 0 -14 4 356.71 18.46 0 -14 4 339.15 18.37 0 -14 -4 341.61 19.30 0 -14 4 379.92 18.13 0 14 -4 388.37 18.61 0 14 4 378.35 19.33 0 -14 5 2000.26 80.27 0 -14 5 1997.87 80.25 0 -14 5 1967.86 79.10 0 -14 -5 2065.60 81.83 0 -14 5 1919.55 81.07 0 14 -5 2068.18 80.37 0 14 5 1984.11 81.04 0 14 6 40.45 5.78 0 14 -6 41.84 4.97 0 -14 6 30.12 4.14 0 -14 -6 43.44 6.22 0 -14 6 42.06 5.27 0 14 -6 37.12 4.59 0 -14 6 40.55 5.16 0 -14 -6 32.65 2.49 0 14 -6 41.77 2.59 0 14 7 249.49 15.20 0 14 -7 267.77 14.76 0 -14 7 270.29 13.14 0 -14 7 271.03 14.70 0 -14 7 265.09 14.75 0 14 -7 290.14 14.24 0 14 -7 225.02 10.89 0 -14 8 143.19 10.11 0 14 -8 135.76 10.10 0 14 -8 160.19 10.03 0 -14 8 146.01 10.39 0 14 8 141.64 10.80 0 -14 8 155.37 8.67 0 14 -9 248.51 14.67 0 -14 9 235.06 14.17 0 -14 9 254.18 14.76 0 14 -9 244.57 13.92 0 14 9 256.26 15.39 0 -14 10 172.92 11.70 0 -14 -10 165.16 12.47 0 -14 10 189.46 12.30 0 14 -10 184.84 11.48 0 14 10 175.27 12.52 0 14 -11 675.86 32.67 0 -14 -11 788.41 35.77 0 14 -11 753.99 33.18 0 -14 11 733.10 33.35 0 -14 12 0.65 3.36 0 -14 -12 1.77 3.60 0 14 -12 1.24 2.97 0 14 -12 3.09 3.07 0 14 12 3.55 2.27 0 -14 12 0.86 4.05 0 14 -13 -0.77 3.26 0 14 13 4.83 3.32 0 14 -14 2.38 3.37 0 14 14 0.43 2.40 0 14 -15 186.70 13.06 0 14 15 174.25 10.38 0 14 -16 14.34 4.63 0 14 16 18.73 3.79 0 14 -16 14.43 4.99 0 14 -17 51.19 7.09 0 14 17 47.06 5.29 0 14 -17 57.81 7.46 0 14 -18 1.78 4.15 0 14 -18 -1.70 4.63 0 14 18 -1.97 3.55 0 -16 0 437.37 22.45 0 16 0 480.85 23.06 0 -16 0 489.26 23.62 0 -16 -1 667.25 29.88 0 -16 1 680.00 30.14 0 16 1 645.08 30.21 0 16 -1 644.15 29.85 0 -16 1 660.51 30.36 0 -16 -1 625.83 30.56 0 -16 2 50.82 5.74 0 -16 -2 55.29 6.09 0 16 -2 56.81 6.02 0 16 2 61.84 6.68 0 -16 -2 53.23 6.55 0 -16 2 47.13 5.88 0 -16 3 148.73 10.61 0 -16 3 172.96 11.34 0 -16 -3 155.59 11.63 0 -16 3 152.98 10.59 0 16 3 173.84 11.57 0 -16 4 403.42 20.85 0 -16 4 436.83 21.28 0 -16 4 383.85 19.99 0 -16 -4 403.04 21.88 0 16 -4 431.05 20.83 0 16 4 386.08 21.13 0 -16 5 883.98 39.03 0 -16 5 885.53 39.11 0 -16 5 904.49 38.13 0 -16 5 836.06 39.94 0 -16 -5 903.54 40.57 0 16 -5 880.07 38.81 0 16 5 877.60 39.63 0 16 -6 54.01 6.21 0 -16 -6 64.77 7.45 0 -16 6 70.17 7.52 0 -16 6 70.79 5.96 0 -16 6 70.54 6.98 0 16 -6 48.50 5.38 0 -16 6 55.10 6.54 0 16 6 55.80 7.05 0 16 7 67.44 7.70 0 -16 -7 78.28 3.55 0 16 -7 108.33 8.36 0 -16 -7 108.32 9.44 0 -16 7 80.55 6.40 0 -16 7 67.60 7.06 0 -16 7 87.71 7.85 0 16 -7 87.35 7.21 0 -16 -7 69.29 3.50 0 16 8 -1.58 3.73 0 16 -8 1.00 1.37 0 16 -8 6.34 3.64 0 -16 8 -0.70 3.11 0 16 -8 0.57 3.02 0 16 -8 0.28 1.29 0 -16 8 0.67 3.18 0 -16 -9 463.71 18.47 0 16 -9 405.73 18.14 0 -16 9 464.90 22.65 0 16 -9 413.90 22.33 0 16 -9 470.00 21.97 0 -16 9 402.42 22.18 0 -16 -10 121.66 6.70 0 16 -10 99.99 6.29 0 16 -10 112.17 8.83 0 -16 10 118.32 9.77 0 16 -10 133.27 9.95 0 -16 10 101.67 9.17 0 -16 11 553.03 26.00 0 16 -11 484.71 25.68 0 -16 -11 491.75 26.93 0 -16 12 1.44 3.40 0 16 12 2.48 2.41 0 -16 12 -0.94 4.08 0 -16 13 70.77 8.41 0 16 13 49.89 5.33 0 16 14 22.13 3.69 0 16 -15 392.40 22.33 0 16 15 399.54 18.99 0 16 -16 33.54 6.27 0 16 -16 45.27 7.10 0 16 16 37.54 4.75 0 -18 0 547.82 27.42 0 18 0 564.65 27.01 0 -18 0 552.73 26.65 0 -18 -1 401.16 21.43 0 -18 1 384.13 20.90 0 18 1 387.02 20.79 0 -18 1 420.35 20.79 0 -18 -1 370.05 20.08 0 -18 2 11.03 3.98 0 -18 -2 6.40 4.03 0 18 2 6.46 3.56 0 -18 -2 5.09 3.60 0 -18 2 8.79 3.64 0 -18 -3 14.88 4.82 0 -18 3 24.41 4.91 0 18 3 14.06 4.42 0 -18 -3 29.96 5.10 0 -18 3 19.32 4.45 0 -18 4 238.75 14.47 0 -18 4 294.53 17.00 0 -18 -4 248.21 16.02 0 18 4 237.22 15.38 0 -18 4 242.25 14.94 0 -18 -4 242.66 14.47 0 -18 5 292.62 17.07 0 -18 5 293.68 17.96 0 -18 5 277.41 15.87 0 -18 -5 291.21 18.11 0 18 -5 317.25 16.23 0 -18 6 234.86 16.02 0 -18 -6 253.52 16.60 0 -18 6 246.42 15.34 0 18 -6 255.19 14.45 0 -18 -7 43.74 6.97 0 18 -7 52.74 6.50 0 -18 7 44.11 6.55 0 18 -7 43.17 5.63 0 -18 -8 5.74 5.15 0 18 -8 14.61 4.40 0 -18 8 11.68 4.45 0 -18 -9 168.02 13.43 0 -18 9 148.37 11.79 0 18 -9 152.41 11.88 0 -18 10 360.01 20.68 0 18 -10 371.18 20.82 0 -18 -11 213.94 9.76 0 18 -11 226.44 14.67 0 -18 -11 186.66 9.59 0 18 -12 64.29 8.06 0 -18 12 54.50 8.62 0 18 12 67.64 5.80 0 18 -13 41.08 6.60 0 18 13 36.57 4.50 0 -18 13 22.14 6.27 0 18 14 6.11 3.11 0 -20 0 409.39 21.66 0 -20 0 354.49 20.11 0 -20 -1 123.26 10.56 0 -20 -1 110.49 9.32 0 -20 1 97.72 9.26 0 -20 -2 49.17 7.20 0 -20 -2 49.69 6.81 0 -20 2 51.79 6.83 0 -20 -3 -0.70 3.87 0 -20 -3 3.62 5.27 0 -20 3 -0.76 3.78 0 -20 4 267.32 15.69 0 -20 -4 209.64 14.21 0 -20 -4 250.00 16.46 0 -20 4 230.13 16.11 0 20 -4 234.83 13.92 0 -20 -5 86.03 8.47 0 -20 5 79.32 9.42 0 -20 5 92.96 8.95 0 -20 -6 334.61 18.41 0 -20 6 340.72 19.30 0 -20 6 291.07 19.54 0 -20 7 27.47 5.86 0 -20 7 21.26 5.64 0 -20 8 4.24 4.21 0 -20 9 20.17 5.62 0 -20 10 411.09 23.23 1 1 -24 307.69 18.11 -1 1 24 311.74 17.79 -1 1 24 270.26 14.71 1 -1 -24 297.79 14.81 1 1 -24 270.28 15.20 1 1 -24 301.30 17.04 -1 1 23 64.36 7.04 -1 -1 23 54.20 6.91 -1 1 23 59.16 5.31 1 1 -23 49.14 6.83 1 1 -23 48.96 5.39 1 -1 -23 60.35 7.09 1 -1 -23 54.12 4.76 1 1 -22 131.17 9.44 -1 -1 22 159.41 10.17 -1 1 22 138.26 9.23 -1 1 22 140.03 7.32 1 -1 -22 125.66 9.38 1 -1 -22 139.39 7.00 1 1 -22 141.84 7.83 -1 -1 21 0.70 3.24 -1 1 21 0.67 3.37 -1 1 21 -4.42 2.70 -1 -1 21 0.99 1.35 1 1 -21 2.19 3.56 1 -1 -21 0.71 3.59 1 1 -21 3.41 2.45 1 -1 -21 4.88 2.26 -1 1 20 30.03 3.98 -1 -1 20 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1368.78 19.30 -8 -12 -5 0.71 1.59 8 -12 5 1026.83 23.67 -8 12 -5 1247.41 17.96 -8 -12 -5 1252.06 26.91 -8 -12 -6 8.36 3.79 -8 -12 -6 11.18 2.87 -8 12 -6 11.71 2.93 -8 12 -6 13.14 2.94 -8 -12 -6 11.52 2.76 -8 12 -6 14.89 2.66 -8 -12 -7 4.68 3.57 -8 12 -7 7.24 2.71 -8 -12 -7 3.71 2.30 -8 12 -7 0.73 1.65 -8 12 -7 5.88 2.51 -8 -12 -7 2.40 2.48 8 12 7 0.77 2.36 -8 -12 -8 5.61 3.79 -8 -12 -8 2.68 2.47 -8 12 -8 6.53 3.03 -8 12 -8 4.76 1.60 -8 12 -8 5.87 2.92 -8 -12 -8 8.17 2.93 8 12 8 6.95 2.63 8 12 9 768.32 35.31 -8 12 -9 866.12 36.13 -8 -12 -9 870.71 36.26 -8 -12 -9 830.29 35.85 -8 12 -9 898.66 36.15 -8 -12 -9 840.01 39.07 8 12 10 75.16 6.37 8 -12 10 76.24 7.73 -8 12 -10 58.04 6.60 -8 -12 -10 86.54 8.64 -8 12 -10 72.72 6.56 -8 -12 -10 78.48 6.79 -8 -12 -11 97.05 9.31 8 12 11 86.16 6.97 -8 12 -11 77.41 7.04 -8 -12 -11 95.67 7.71 -8 -12 -12 3.52 4.10 8 12 12 0.50 2.76 -8 -12 -12 1.15 3.35 -8 12 -12 1.11 3.10 -8 -12 -13 443.21 24.37 8 12 13 448.77 21.50 -8 12 -13 462.62 22.28 -8 -12 -13 427.78 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9.93 3.31 -10 12 9 11.38 4.29 10 12 -9 11.09 3.05 10 12 -9 7.03 2.53 -10 -12 9 10.16 3.00 -10 -12 8 55.94 5.91 -10 12 8 55.60 6.56 10 12 -8 50.64 4.70 -10 -12 8 64.19 6.16 10 12 -7 806.38 32.60 -10 -12 7 782.72 34.55 -10 12 7 759.68 35.40 10 -12 -7 746.62 34.30 10 12 -7 769.34 32.83 10 -12 -7 796.74 32.83 10 12 -7 799.95 32.65 -10 -12 7 792.76 34.73 -10 -12 6 231.59 12.60 -10 12 6 218.61 13.21 10 -12 -6 235.48 12.82 10 12 -6 232.95 11.05 10 -12 -6 206.69 10.68 10 12 -6 200.83 10.60 -10 -12 6 227.83 12.87 10 -12 -6 236.80 10.95 10 12 -5 343.09 14.53 -10 -12 5 294.83 16.17 -10 12 5 325.24 17.38 10 -12 -5 323.73 16.84 -10 -12 5 311.25 16.89 10 12 -5 308.02 14.72 10 -12 -5 332.40 14.80 10 -12 -5 313.53 14.81 10 12 -5 298.00 14.74 10 12 -4 36.65 3.75 10 -12 -4 31.93 3.49 10 12 -4 47.91 3.44 -10 -12 4 47.33 4.95 -10 12 4 26.60 4.59 10 -12 -4 34.58 4.50 10 -12 -4 37.79 4.94 -10 -12 4 37.56 3.71 10 -12 -4 36.92 3.60 -10 -12 4 30.96 4.71 10 12 -4 39.22 3.80 10 12 -3 402.01 18.00 10 -12 -3 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2.19 -10 12 -4 -0.39 2.27 10 12 5 503.71 21.64 -10 12 -5 495.09 21.77 -10 -12 -5 453.94 24.89 10 -12 5 467.42 23.84 -10 -12 -5 473.82 22.26 -10 12 -5 534.60 22.69 -10 12 -5 482.76 22.14 -10 -12 -5 506.89 22.30 10 12 6 41.31 4.09 -10 12 -6 43.81 4.89 -10 -12 -6 30.47 4.32 -10 12 -6 38.35 3.77 10 -12 6 35.53 5.14 -10 -12 -6 50.32 5.05 -10 12 -6 36.51 4.70 -10 -12 -6 36.21 5.90 10 12 7 13.22 2.90 -10 12 -7 14.03 3.45 -10 -12 -7 14.80 3.63 -10 12 -7 19.79 2.83 10 -12 7 11.58 3.80 -10 12 -7 19.21 3.63 -10 -12 -7 19.63 3.41 -10 -12 -7 13.22 4.69 10 12 8 25.30 3.59 -10 -12 -8 26.83 4.21 -10 12 -8 24.26 4.03 -10 -12 -8 21.12 5.05 10 -12 8 16.84 4.38 -10 12 -8 31.70 4.61 -10 -12 -8 18.73 4.08 -10 12 -8 22.42 2.69 10 12 9 561.94 23.81 -10 -12 -9 547.40 24.72 -10 12 -9 564.90 24.69 -10 -12 -9 531.67 27.26 10 -12 9 561.62 26.50 -10 -12 -9 513.10 24.54 -10 12 -9 594.84 25.15 -10 12 -9 486.48 20.78 10 12 10 33.99 4.24 -10 -12 -10 26.92 4.78 -10 12 -10 28.27 4.84 -10 -12 -10 31.69 5.85 10 -12 10 24.24 5.19 -10 -12 -10 34.15 4.95 -10 12 -10 30.87 4.99 -10 -12 -11 160.71 12.89 10 12 11 159.01 10.30 -10 12 -11 179.28 11.53 -10 -12 -11 176.35 11.64 -10 12 -11 201.22 11.84 -10 -12 -11 182.86 11.59 -10 12 -12 11.60 4.38 10 12 12 17.34 3.96 -10 -12 -12 18.29 5.00 -10 -12 -12 13.51 4.11 -10 12 -12 14.84 4.28 -10 12 -13 236.39 16.22 10 12 13 267.81 14.49 -10 -12 -13 276.13 17.37 -10 12 -13 243.08 14.99 -10 -12 -13 281.83 15.80 -10 12 -14 3.49 4.06 10 12 14 4.23 3.43 -10 -12 -14 0.95 4.71 -10 12 -14 7.31 4.58 -10 12 -15 451.36 25.86 -10 -12 -15 502.53 27.04 10 12 15 515.05 23.92 -10 12 -15 512.11 26.24 -10 12 -16 0.92 4.04 -10 12 -16 2.59 4.34 -10 -12 -16 0.98 5.17 10 14 -19 5.15 3.75 -10 14 19 0.74 3.82 -10 -14 19 1.07 2.36 10 14 -18 7.76 3.98 -10 14 18 4.34 3.94 -10 -14 18 8.70 2.96 10 14 -17 530.33 25.35 -10 -14 17 495.27 22.97 10 14 -16 19.31 4.54 -10 -14 16 27.89 4.10 -10 -14 16 27.44 5.39 10 14 -15 205.06 13.05 10 14 -15 215.53 12.97 -10 -14 15 218.33 12.00 -10 -14 15 219.31 12.28 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7.32 -10 -14 -13 194.11 14.83 10 14 13 182.74 11.64 -10 -14 -13 191.79 12.62 -10 14 -13 191.00 12.36 -10 14 -13 173.22 12.01 -10 -14 -13 198.50 12.60 -10 -14 -14 46.76 6.81 -10 14 -14 31.35 5.75 -10 -14 -14 49.78 8.21 10 16 -16 31.78 5.35 -10 -16 16 29.10 4.52 -10 -16 16 22.31 5.62 -10 -16 15 325.54 16.70 10 16 -15 327.59 17.84 -10 -16 15 289.30 18.65 -10 -16 15 311.74 16.72 10 16 -14 0.64 3.85 -10 -16 14 -1.06 3.70 -10 -16 14 1.65 2.92 -10 -16 14 -0.86 4.12 10 16 -13 79.75 7.55 -10 -16 13 81.01 7.30 -10 -16 13 76.46 8.66 10 16 -13 79.36 7.39 -10 -16 13 92.41 7.74 -10 -16 12 53.34 5.93 -10 -16 12 55.87 7.05 10 16 -12 58.11 6.00 -10 -16 12 57.67 6.39 10 16 -11 300.27 15.34 -10 -16 11 283.71 15.38 -10 -16 11 258.88 16.75 10 16 -11 288.18 14.24 -10 -16 11 282.02 15.96 10 16 -10 31.25 4.46 -10 -16 10 28.35 5.39 -10 -16 10 30.81 4.62 10 16 -10 27.74 3.69 10 -16 -10 23.52 3.40 10 16 -10 22.00 3.60 10 -16 -10 25.58 3.62 -10 -16 10 16.16 4.69 10 16 -9 27.55 4.06 -10 -16 9 30.59 4.71 10 -16 -9 27.75 3.59 10 -16 -9 28.54 3.53 10 16 -9 36.91 3.93 10 16 -9 35.43 3.89 -10 -16 9 24.02 4.97 -10 16 9 32.22 3.24 10 16 -8 13.79 3.16 10 -16 -8 8.56 2.43 10 16 -8 8.60 2.44 10 16 -8 10.63 2.52 10 -16 -8 8.94 2.47 -10 -16 8 15.80 4.49 10 16 -7 298.06 15.09 -10 16 7 317.64 15.10 -10 16 7 310.99 18.40 10 -16 -7 333.58 14.13 -10 -16 7 305.94 17.66 10 16 -7 299.12 14.02 10 16 -7 295.33 14.06 10 -16 -7 342.77 14.28 10 16 -6 118.91 6.82 10 -16 -6 135.41 6.89 10 16 -6 126.87 7.72 -10 -16 6 128.35 9.60 -10 16 6 119.28 7.88 -10 16 6 114.14 10.07 10 -16 -6 136.80 10.35 -10 -16 6 136.90 8.91 -10 -16 6 120.33 9.97 -10 -16 5 229.25 14.35 -10 16 5 251.95 13.21 -10 16 5 246.73 15.47 -10 -16 5 263.55 15.76 10 -16 -5 258.55 15.50 -10 -16 5 257.28 13.60 10 16 -5 250.42 12.24 10 16 -4 0.27 1.33 -10 16 4 0.46 2.30 -10 -16 4 3.04 3.22 -10 16 4 0.72 3.75 10 -16 -4 7.53 3.68 10 -16 -4 5.77 3.83 -10 -16 4 3.15 2.51 -10 -16 4 5.37 4.18 10 16 -3 55.66 4.07 -10 16 3 54.03 5.49 -10 -16 3 55.70 6.05 -10 16 3 53.15 6.62 10 -16 -3 56.25 6.75 10 -16 -3 55.41 6.70 10 -16 -3 58.99 6.98 -10 -16 3 54.87 5.20 -10 -16 3 52.69 6.83 -10 -16 2 233.79 14.20 -10 16 2 256.64 14.03 -10 16 2 237.79 14.92 -10 -16 2 247.58 15.76 10 -16 -2 260.49 15.48 10 -16 -2 281.38 15.77 -10 -16 2 252.77 13.21 10 16 -2 249.46 11.28 -10 -16 1 381.07 18.36 -10 -16 1 403.80 21.87 -10 16 1 377.79 20.26 -10 -16 1 391.95 19.80 10 -16 -1 416.01 21.40 -10 -16 0 176.22 9.84 -10 16 0 172.29 11.27 -10 -16 0 177.29 12.77 -10 -16 0 142.47 10.24 10 16 0 162.78 7.08 10 -16 0 181.48 12.43 -10 -16 -1 97.40 6.89 -10 16 -1 95.63 8.00 -10 -16 -1 96.49 9.29 -10 -16 -1 80.95 7.20 10 -16 1 104.08 9.33 -10 -16 -2 7.28 3.19 -10 -16 -2 2.67 3.63 -10 -16 -2 3.88 2.19 -10 16 -2 4.98 3.56 10 -16 2 12.25 4.17 -10 -16 -3 296.92 14.94 -10 -16 -3 283.01 18.46 -10 16 -3 341.71 16.61 -10 -16 -3 315.15 16.17 10 -16 3 291.02 18.19 -10 -16 -4 107.30 7.20 -10 16 -4 110.20 8.02 -10 -16 -4 95.32 7.68 10 -16 4 121.72 10.51 -10 -16 -5 171.42 11.00 -10 16 -5 210.79 11.38 10 -16 5 180.28 13.91 -10 -16 -5 198.03 10.68 -10 16 -6 32.56 4.08 -10 -16 -6 25.20 4.15 -10 -16 -7 5.94 4.68 -10 16 -7 2.34 2.90 -10 -16 -7 7.58 2.96 10 16 7 5.94 2.88 -10 -16 -7 2.26 2.74 -10 -16 -8 193.06 10.96 10 16 8 172.08 11.07 -10 -16 -8 188.21 10.96 -10 -16 -8 199.26 11.04 -10 16 -8 176.03 10.75 -10 -16 -9 474.24 21.69 -10 -16 -9 500.37 26.60 10 16 9 448.96 21.77 10 -16 9 498.53 25.36 -10 -16 -9 470.45 21.82 -10 16 -9 419.98 21.28 -10 -16 -10 79.99 7.18 10 16 10 76.05 7.06 10 -16 10 89.51 9.24 -10 -16 -10 89.33 7.52 -10 16 -10 80.42 7.17 10 16 11 16.82 4.02 -10 16 -11 22.37 5.48 -10 -16 -11 22.62 4.83 -10 -16 -11 22.46 4.83 -10 16 -11 24.08 4.73 -10 -16 -11 20.33 6.28 -10 -18 13 124.27 9.15 10 18 -13 112.89 9.27 10 -18 -13 103.36 7.11 -10 -18 13 122.54 11.11 -10 -18 12 433.64 22.45 -10 -18 12 447.88 22.83 10 -18 -12 442.96 20.01 -10 -18 12 477.81 25.35 10 18 -12 483.17 22.41 -10 -18 11 226.26 14.64 -10 -18 11 277.73 17.24 -10 -18 11 276.64 15.76 10 -18 -11 261.80 12.34 10 18 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167.30 10.69 10 -18 -1 188.27 13.07 -10 18 1 203.15 12.95 -10 -18 1 176.77 13.36 10 18 -1 184.31 8.45 10 -18 -1 176.72 13.02 -10 -18 1 186.29 11.94 -10 18 1 194.44 11.96 10 -18 0 103.84 9.97 -10 -18 0 118.58 8.29 -10 18 0 126.87 9.89 -10 -18 0 119.11 11.18 10 -18 0 131.99 11.13 -10 -18 0 121.64 9.18 -10 18 0 131.43 9.56 -10 18 -1 8.62 3.48 -10 -18 -1 7.43 3.29 -10 -18 -1 -0.94 4.25 10 -18 1 3.27 3.87 -10 -18 -1 5.02 2.69 10 -18 1 0.88 3.82 -10 18 -1 4.48 3.73 -10 18 -2 1.39 3.33 -10 -18 -2 -0.56 3.28 -10 -18 -2 1.93 4.71 10 -18 2 2.49 3.99 -10 -18 -2 2.26 2.63 10 -18 2 3.63 4.50 -10 18 -2 1.21 3.55 -10 18 -3 110.41 9.36 -10 -18 -3 108.91 8.35 -10 -18 -3 112.40 11.16 -10 -18 -3 98.56 7.44 10 -18 3 119.88 10.80 -10 18 -3 101.99 8.41 -10 -18 -4 171.64 10.24 -10 -18 -4 180.10 13.98 -10 18 -4 162.97 12.08 -10 -18 -4 161.03 10.64 10 -18 4 169.19 13.54 -10 -18 -5 135.23 8.84 -10 -18 -5 132.61 12.13 10 -18 5 132.96 12.05 -10 18 -5 141.71 10.98 -10 -18 -5 132.18 9.12 -10 -18 -6 27.16 4.33 -10 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362.50 20.52 -11 9 -12 375.46 19.60 -11 -9 -12 371.12 19.65 -11 9 -13 47.12 6.65 11 9 13 46.19 5.10 -11 9 -13 36.96 5.52 -11 -9 -13 44.22 6.59 -11 9 -13 47.55 6.55 -11 -9 -13 50.94 6.76 -11 9 -14 46.09 6.71 -11 -9 -14 46.58 6.55 -11 9 -14 38.29 5.82 11 9 14 52.31 5.42 -11 9 -15 124.86 10.97 -11 -9 -15 133.85 10.93 11 9 15 106.10 8.49 -11 9 -15 134.54 10.54 -11 9 -16 37.16 6.76 -11 -9 -16 37.86 6.43 11 9 16 26.32 4.96 -11 9 -17 743.83 34.99 -11 9 -17 683.80 33.32 -11 -9 -17 663.25 33.66 11 11 -21 99.46 8.99 -11 11 21 83.41 8.65 -11 -11 21 95.19 6.68 11 11 -20 1.40 3.77 -11 11 20 2.24 3.96 11 11 -19 670.14 31.03 -11 11 19 655.07 31.48 11 11 -18 25.59 4.79 -11 11 18 22.62 4.89 11 11 -17 61.42 6.53 -11 11 17 69.30 7.39 11 11 -17 65.37 6.89 11 11 -17 63.90 6.78 11 11 -16 7.45 3.56 11 11 -16 9.38 3.96 11 11 -16 6.20 3.29 -11 11 15 861.97 41.66 11 11 -15 1007.79 41.54 -11 -11 15 1017.29 42.56 11 11 -15 963.20 41.50 11 11 -15 994.36 41.47 -11 -11 14 44.70 4.24 -11 -11 14 51.10 6.13 11 11 -14 45.26 5.36 11 11 -14 47.60 5.29 11 11 -14 51.41 5.55 -11 -11 14 49.34 5.98 -11 -11 13 591.61 25.84 -11 11 13 617.01 30.10 11 11 -13 591.48 27.22 11 11 -13 617.08 27.30 11 11 -13 635.79 27.63 -11 -11 13 629.80 28.52 -11 11 12 27.03 1.90 -11 -11 12 27.51 4.64 -11 11 12 31.10 5.70 11 11 -12 24.24 3.90 11 11 -12 27.84 4.14 11 11 -12 22.21 3.66 -11 -11 12 28.07 3.37 -11 11 11 3.68 3.43 -11 -11 11 4.46 2.88 -11 -11 11 2.31 1.92 11 11 -11 7.49 2.74 11 11 -11 6.70 2.47 11 11 -11 0.43 2.42 -11 -11 10 34.20 4.76 -11 11 10 25.77 5.25 -11 -11 10 33.36 4.72 -11 -11 10 30.03 3.53 11 11 -10 33.29 4.10 11 11 -10 28.76 3.75 11 11 -10 30.55 3.91 -11 -11 9 1971.23 78.95 -11 11 9 1990.67 80.15 11 11 -9 1938.94 76.88 11 11 -9 2021.46 77.06 11 11 -9 1911.42 76.91 11 -11 -8 1.54 2.72 11 11 -8 0.67 2.06 -11 11 8 0.67 3.41 -11 -11 8 1.11 2.63 11 11 -8 1.02 1.99 -11 -11 7 238.05 10.22 -11 11 7 258.44 11.63 11 -11 -7 240.66 10.04 11 11 -7 234.72 8.89 11 -11 -7 240.80 8.96 -11 -11 7 264.92 10.97 11 11 -6 55.63 4.31 -11 -11 6 67.08 5.85 -11 11 6 52.79 6.07 11 -11 -6 53.83 5.64 11 -11 -6 49.67 4.72 11 11 -6 54.21 4.93 11 -11 -6 50.07 4.62 -11 -11 6 55.78 5.82 11 11 -6 51.48 4.74 11 11 -5 656.04 26.60 -11 -11 5 652.10 29.06 -11 11 5 650.20 29.83 11 -11 -5 614.91 28.28 11 -11 -5 648.04 29.25 11 -11 -5 651.12 27.64 -11 -11 5 645.95 29.70 11 11 -5 643.79 27.64 11 -11 -5 658.86 27.82 11 11 -5 657.34 27.87 -11 -11 4 5.02 2.83 11 -11 -4 4.33 2.84 11 -11 -4 6.64 2.43 -11 -11 4 3.61 2.80 11 11 -4 7.07 2.34 11 -11 -4 3.85 2.35 11 11 -4 2.14 2.15 -11 11 4 1.72 2.72 11 -11 -4 3.20 2.27 11 -11 -3 1165.67 43.78 11 11 -3 1065.31 43.53 11 -11 -3 1147.19 45.18 -11 11 3 1092.46 45.57 11 -11 -3 960.34 44.95 -11 -11 3 1063.82 42.69 -11 -11 3 1034.87 45.84 11 11 -3 1068.54 43.45 11 -11 -3 1066.35 43.38 11 11 -2 137.44 8.53 11 -11 -2 162.27 8.85 11 -11 -2 174.40 10.26 11 -11 -2 146.87 10.01 -11 -11 2 153.80 10.60 -11 -11 2 148.72 7.80 -11 11 2 153.62 9.92 11 -11 -1 29.33 3.48 11 11 -1 21.82 3.13 11 -11 -1 28.60 4.11 -11 11 1 24.20 3.97 11 -11 -1 26.05 4.34 11 -11 -1 24.06 3.86 -11 -11 1 17.83 2.31 -11 -11 1 18.15 4.35 -11 -11 0 104.58 5.76 11 -11 0 101.07 7.84 -11 11 0 101.01 7.55 11 -11 0 111.33 8.45 11 -11 0 105.08 8.05 -11 -11 -1 322.64 14.59 11 -11 1 334.17 17.49 -11 11 -1 354.42 16.98 11 -11 1 352.65 18.28 11 -11 1 373.92 18.25 11 -11 2 47.68 5.44 -11 -11 -2 60.86 3.86 -11 11 -2 46.52 4.91 11 -11 2 56.74 6.34 11 -11 2 58.74 6.14 11 -11 3 249.24 14.85 -11 11 -3 260.93 13.14 -11 -11 -3 250.48 11.44 11 -11 3 244.65 14.15 -11 -11 -3 287.46 16.00 -11 -11 -3 232.16 12.91 -11 11 -3 256.85 13.17 -11 -11 -4 11.16 3.92 11 11 4 9.00 2.30 -11 -11 -4 14.47 3.31 -11 11 -4 13.81 3.17 -11 -11 -4 15.47 3.55 -11 11 -4 12.57 3.07 11 -11 4 14.23 3.80 -11 11 -4 12.45 2.72 -11 11 -5 95.02 6.44 -11 -11 -5 87.55 7.06 -11 11 -5 91.53 7.07 11 -11 5 103.95 8.32 11 11 5 105.26 6.34 -11 -11 -5 110.55 7.65 -11 11 -5 101.08 7.45 -11 -11 -5 105.07 9.17 11 11 6 394.57 17.91 -11 -11 -6 409.01 19.37 -11 11 -6 381.91 19.12 -11 11 -6 415.10 18.00 -11 -11 -6 420.44 22.04 11 -11 6 396.44 20.51 -11 -11 -6 418.02 19.62 -11 11 -6 371.75 19.18 11 11 7 599.29 25.06 -11 11 -7 573.42 24.30 -11 -11 -7 588.99 29.13 -11 11 -7 552.11 26.18 -11 -11 -7 559.96 26.27 11 -11 7 626.06 28.10 -11 -11 -7 574.18 26.61 -11 11 -7 591.53 26.65 11 11 8 46.87 4.58 -11 11 -8 58.78 3.98 -11 -11 -8 57.69 5.92 -11 11 -8 45.72 5.63 -11 11 -8 56.62 6.73 11 -11 8 56.46 6.64 -11 -11 -8 51.35 5.75 -11 11 -8 55.07 5.84 -11 -11 -8 59.51 7.10 11 11 9 30.24 3.97 -11 -11 -9 38.01 6.26 -11 11 -9 30.82 2.62 -11 -11 -9 34.41 4.74 -11 11 -9 34.29 4.75 -11 11 -9 36.08 5.90 11 -11 9 49.71 6.07 -11 -11 -9 41.33 5.27 -11 11 -9 31.29 4.78 -11 -11 -10 7.74 4.32 11 11 10 2.45 2.40 -11 11 -10 3.16 3.61 -11 -11 -10 3.71 3.56 -11 11 -10 3.62 3.28 -11 -11 -10 1.17 3.58 -11 11 -10 -0.57 3.60 -11 -11 -11 710.30 33.56 11 11 11 661.94 29.34 -11 11 -11 704.33 33.01 -11 -11 -11 679.01 31.33 -11 11 -11 687.37 31.37 -11 -11 -11 684.12 31.07 -11 11 -11 636.64 30.69 -11 -11 -12 62.38 7.73 11 11 12 45.25 5.13 -11 11 -12 52.76 6.98 -11 -11 -12 47.96 6.48 -11 11 -12 52.75 6.37 -11 11 -12 61.12 7.04 -11 -11 -12 47.93 6.35 -11 11 -13 186.90 13.50 11 11 13 175.27 10.93 -11 -11 -13 172.12 13.42 -11 11 -13 188.87 12.56 -11 -11 -13 204.08 12.95 -11 11 -14 -0.88 3.75 -11 -11 -14 -0.92 4.07 11 11 14 3.52 3.26 -11 11 -14 -1.59 4.05 -11 11 -15 64.32 8.49 -11 -11 -15 69.28 8.45 11 11 15 63.26 6.58 -11 11 -15 76.06 8.28 -11 11 -16 -2.79 4.17 -11 11 -16 -0.84 4.29 -11 -11 -16 -0.95 4.34 11 13 -20 69.06 7.74 -11 13 20 61.27 7.69 -11 -13 20 68.93 5.73 11 13 -19 463.92 23.66 -11 13 19 501.99 24.50 -11 -13 19 441.28 21.02 11 13 -18 5.39 3.89 -11 13 18 7.36 3.96 -11 -13 18 10.95 3.24 -11 -13 17 -0.93 2.72 11 13 -17 -0.64 3.18 11 13 -16 1.22 3.27 -11 -13 16 -1.45 3.08 -11 -13 16 -1.50 3.92 11 13 -16 -1.18 3.63 11 13 -15 455.71 22.72 11 13 -15 486.83 23.07 -11 -13 15 479.73 22.38 11 13 -15 458.82 22.83 -11 -13 15 483.71 24.34 11 13 -14 260.72 14.01 11 13 -14 230.33 13.57 -11 -13 14 240.78 12.59 -11 -13 14 233.61 13.42 11 13 -14 244.40 13.89 -11 -13 14 230.02 14.64 11 13 -13 403.28 19.43 -11 -13 13 387.72 18.32 11 13 -13 383.35 19.11 -11 -13 13 382.57 19.51 11 13 -13 392.77 19.37 -11 -13 13 392.19 20.75 11 13 -12 196.68 11.00 -11 13 12 163.09 12.63 -11 -13 12 163.41 9.83 11 13 -12 179.20 10.72 -11 -13 12 174.94 11.12 -11 -13 12 153.02 11.44 11 13 -12 185.62 10.83 11 13 -11 26.82 3.89 -11 -13 11 17.57 4.42 -11 13 11 17.63 5.06 -11 -13 11 18.75 4.36 -11 -13 11 18.35 3.31 11 13 -11 21.21 3.72 11 13 -11 21.48 3.75 -11 -13 11 30.64 4.81 -11 13 10 5.06 1.70 -11 -13 10 4.44 3.15 -11 13 10 2.33 3.86 -11 -13 10 3.84 3.49 -11 -13 10 6.26 2.68 11 13 -10 0.43 2.56 11 13 -10 4.68 2.53 -11 -13 10 9.90 3.09 -11 -13 9 1195.25 51.60 -11 13 9 1202.73 52.87 11 13 -9 1259.40 49.74 -11 -13 9 1220.24 51.52 11 13 -8 58.08 4.88 -11 -13 8 48.78 5.86 -11 13 8 44.51 6.33 11 -13 -8 52.28 5.99 11 13 -8 54.46 5.04 11 -13 -8 58.94 5.11 11 -13 -8 59.20 5.10 11 13 -8 48.51 4.83 -11 -13 8 53.79 6.23 11 13 -7 132.36 7.59 -11 -13 7 101.46 8.67 -11 13 7 137.02 10.36 11 -13 -7 132.05 9.55 11 13 -7 116.81 7.77 11 -13 -7 125.02 7.85 11 -13 -7 138.17 7.95 -11 -13 7 127.06 9.38 11 13 -7 116.73 7.70 -11 -13 6 47.75 5.20 -11 13 6 39.53 5.75 11 -13 -6 37.94 5.06 11 -13 -6 29.16 3.47 11 13 -6 41.67 4.21 11 -13 -6 36.15 3.74 -11 -13 6 42.86 5.15 11 13 -6 40.98 3.84 11 13 -5 508.33 20.77 -11 -13 5 514.26 23.66 -11 13 5 503.12 24.37 11 -13 -5 523.45 23.40 11 -13 -5 465.52 23.53 11 13 -5 485.79 21.28 -11 -13 5 471.80 23.98 11 -13 -5 464.99 21.11 11 13 -5 479.52 21.44 11 -13 -5 466.64 21.23 11 -13 -4 164.90 9.06 11 13 -4 161.71 9.03 11 13 -4 175.60 8.34 -11 -13 4 165.84 10.62 -11 13 4 169.45 11.35 11 -13 -4 160.46 10.55 11 -13 -4 145.69 10.77 -11 -13 4 169.26 9.31 -11 -13 4 168.10 11.50 11 13 -3 419.24 19.33 11 -13 -3 457.22 19.49 11 13 -3 431.18 18.06 11 -13 -3 412.29 21.24 -11 -13 3 444.26 21.33 -11 13 3 447.71 21.92 11 -13 -3 467.22 22.34 -11 -13 3 450.52 19.43 -11 -13 3 408.98 22.08 -11 -13 2 1.58 2.64 11 -13 -2 6.57 3.32 -11 13 2 -2.92 3.10 11 -13 -2 -1.29 3.09 -11 -13 2 1.20 1.74 -11 -13 2 4.26 3.81 11 -13 -1 8.03 3.06 -11 -13 1 1.54 2.59 -11 13 1 6.71 3.43 11 -13 -1 5.87 3.64 -11 -13 1 5.99 2.19 -11 -13 1 11.65 4.20 -11 -13 0 522.81 24.98 11 -13 0 521.84 26.21 -11 13 0 574.05 25.70 -11 -13 0 568.56 23.24 11 -13 0 492.66 25.63 11 -13 0 554.02 26.32 -11 -13 0 583.09 27.57 11 -13 1 1748.47 65.72 -11 -13 -1 1516.46 61.57 -11 13 -1 1551.09 63.92 11 -13 1 1543.62 65.55 11 -13 1 1649.12 65.66 11 -13 2 3.85 2.98 -11 -13 -2 3.75 1.82 -11 13 -2 2.40 2.48 11 -13 2 4.93 2.99 11 -13 2 2.07 3.32 -11 -13 -3 6.99 2.05 11 -13 3 12.47 3.75 -11 13 -3 9.02 2.91 11 -13 3 7.97 3.81 11 -13 3 4.33 3.53 -11 -13 -4 55.86 7.06 11 -13 4 60.42 6.87 -11 -13 -4 52.09 4.21 -11 -13 -4 50.02 5.01 11 -13 4 47.00 5.91 -11 13 -4 50.74 5.25 11 -13 5 157.10 11.26 -11 13 -5 170.56 9.60 -11 -13 -5 176.29 12.72 11 13 5 161.39 9.23 -11 -13 -5 162.24 9.87 -11 13 -5 168.82 10.01 -11 13 -5 160.01 9.86 -11 -13 -5 175.70 10.20 -11 13 -6 8.31 3.10 -11 -13 -6 7.55 3.11 -11 13 -6 6.21 2.98 -11 -13 -6 4.97 3.10 11 13 6 8.91 2.60 -11 13 -6 4.87 2.41 11 -13 6 4.98 3.92 -11 -13 -6 9.60 4.13 -11 -13 -7 1212.98 49.03 -11 13 -7 1213.61 49.02 11 13 7 1178.03 47.94 -11 -13 -7 1198.33 52.73 -11 13 -7 1182.79 47.19 11 -13 7 1161.39 51.11 -11 -13 -7 1215.75 49.28 -11 13 -7 1121.14 48.81 -11 -13 -8 10.24 3.62 -11 13 -8 10.96 3.48 11 13 8 17.84 3.41 -11 -13 -8 20.03 5.44 11 -13 8 8.28 4.17 -11 -13 -8 19.68 4.17 -11 13 -8 11.94 3.67 -11 13 -8 14.87 2.39 -11 13 -9 42.05 5.44 -11 -13 -9 32.87 4.87 11 13 9 35.24 4.36 -11 -13 -9 35.28 6.33 11 -13 9 34.38 5.76 -11 -13 -9 32.23 4.96 -11 13 -9 34.02 4.89 -11 13 -9 29.62 2.59 -11 -13 -10 25.00 4.68 -11 13 -10 32.41 5.04 11 13 10 31.87 4.40 -11 -13 -10 27.40 6.21 11 -13 10 37.94 6.15 -11 -13 -10 30.46 5.04 -11 13 -10 25.38 4.68 -11 -13 -11 233.55 16.22 11 13 11 242.12 13.13 -11 -13 -11 277.80 14.86 -11 13 -11 230.85 13.95 -11 -13 -11 222.25 13.87 -11 13 -11 222.96 13.75 -11 -13 -12 16.61 5.59 11 13 12 11.67 3.42 -11 -13 -12 11.43 4.27 -11 13 -12 15.44 4.44 -11 -13 -12 19.11 4.90 -11 13 -12 17.68 4.52 -11 -13 -13 367.00 22.65 11 13 13 370.48 19.24 -11 -13 -13 421.86 21.41 -11 13 -13 387.06 20.71 -11 -13 -13 384.28 20.74 -11 13 -13 442.22 21.31 -11 -13 -14 2.25 4.48 -11 13 -14 8.56 4.46 11 13 14 9.02 3.76 11 15 -17 66.04 7.19 -11 -15 17 50.29 7.58 -11 -15 17 56.01 5.82 11 15 -16 3.23 3.80 -11 -15 16 6.66 3.34 -11 -15 16 2.50 4.13 11 15 -15 286.16 16.43 -11 -15 15 281.79 15.20 -11 -15 15 304.42 16.02 -11 -15 15 328.13 18.61 11 15 -14 8.32 3.87 11 15 -14 11.26 3.96 -11 -15 14 8.98 3.21 -11 -15 14 14.61 3.93 11 15 -14 13.11 4.15 -11 -15 14 8.00 4.15 11 15 -13 637.93 28.87 -11 -15 13 653.89 28.16 11 15 -13 581.12 28.33 -11 -15 13 635.86 28.99 11 15 -13 643.76 28.72 -11 -15 13 600.04 30.40 11 15 -12 110.52 8.36 -11 -15 12 100.44 9.16 11 15 -12 111.99 8.21 -11 -15 12 106.87 8.58 -11 -15 12 97.34 7.70 -11 -15 11 67.30 7.68 -11 -15 11 77.56 6.71 11 15 -11 74.59 6.43 -11 -15 11 77.27 7.40 11 15 -10 234.83 12.29 -11 15 10 211.11 10.13 -11 -15 10 238.93 14.53 -11 -15 10 213.13 12.29 11 15 -10 203.02 11.48 11 15 -10 220.07 11.74 11 -15 -10 218.68 11.71 -11 -15 10 202.87 13.19 11 15 -9 613.96 27.19 -11 15 9 613.45 25.83 11 -15 -9 617.50 29.42 11 15 -9 617.60 26.80 11 -15 -9 619.87 26.73 11 -15 -9 618.57 26.51 11 15 -9 638.98 26.75 -11 -15 9 629.56 29.48 11 15 -8 10.68 2.97 -11 15 8 0.32 1.36 -11 15 8 13.42 4.61 11 -15 -8 14.15 4.22 11 -15 -8 15.19 3.09 11 15 -8 17.12 3.18 11 -15 -8 11.48 2.76 -11 -15 8 6.77 3.83 11 15 -8 16.90 3.25 11 15 -7 80.37 5.89 -11 15 7 84.40 5.95 -11 -15 7 89.13 7.83 -11 15 7 68.09 7.93 11 -15 -7 74.02 7.57 11 -15 -7 80.70 5.58 11 15 -7 71.79 5.51 11 15 -7 75.51 5.50 11 -15 -7 75.82 5.49 -11 -15 7 81.99 7.90 11 15 -6 -0.63 1.86 -11 -15 6 0.62 2.90 -11 15 6 0.74 3.88 11 -15 -6 -0.68 3.01 11 15 -6 -0.30 2.06 11 -15 -6 -1.18 2.12 -11 -15 6 -1.43 3.09 11 15 -6 -0.58 2.27 11 -15 -6 -0.56 2.19 -11 -15 5 411.04 18.85 -11 15 5 428.63 20.05 11 -15 -5 437.98 19.40 11 -15 -5 407.92 19.54 -11 -15 5 425.36 20.18 11 15 -5 368.83 15.57 11 -15 -5 428.21 15.83 11 15 -4 7.57 1.98 -11 -15 4 14.25 3.82 -11 15 4 9.67 3.90 11 -15 -4 2.55 3.35 11 -15 -4 4.88 3.80 -11 -15 4 6.42 2.74 -11 -15 4 15.00 4.33 11 15 -3 366.56 16.03 -11 -15 3 376.88 19.37 -11 15 3 402.11 20.29 11 -15 -3 338.16 19.84 -11 -15 3 368.43 17.57 -11 -15 3 387.81 20.84 11 -15 -2 168.45 12.15 -11 -15 2 180.46 11.58 -11 15 2 179.94 12.33 11 -15 -2 216.84 13.39 -11 -15 2 184.89 10.22 -11 -15 2 217.54 13.66 -11 -15 1 3.93 2.83 11 -15 -1 6.41 3.63 -11 15 1 3.69 3.54 11 -15 -1 2.92 3.46 -11 -15 1 8.10 2.58 -11 -15 1 0.81 3.53 11 -15 0 9.47 4.12 -11 -15 0 8.23 3.59 -11 15 0 8.82 3.58 11 -15 0 5.18 3.89 -11 -15 0 7.16 2.54 -11 -15 0 14.22 4.88 -11 -15 -1 829.74 34.73 -11 15 -1 875.88 37.10 -11 -15 -1 902.84 39.87 11 -15 1 856.71 38.69 -11 -15 -1 759.09 36.21 11 -15 1 894.72 38.88 -11 -15 -2 75.10 5.39 -11 15 -2 72.35 6.84 -11 -15 -2 75.13 8.35 -11 -15 -2 73.73 6.71 11 -15 2 69.69 7.76 -11 -15 -3 93.14 6.31 -11 15 -3 87.35 7.32 11 -15 3 85.67 8.75 -11 -15 -4 14.43 3.57 -11 15 -4 10.80 3.49 -11 -15 -4 15.63 2.82 11 -15 4 10.51 4.26 11 -15 4 10.83 4.39 11 -15 5 191.27 12.99 -11 -15 -5 182.85 10.00 -11 15 -5 178.89 10.65 11 15 5 179.48 10.35 -11 -15 -5 201.33 11.35 -11 -15 -6 87.00 7.00 -11 -15 -6 95.83 6.87 -11 15 -6 71.11 6.31 -11 -15 -6 75.44 8.81 -11 15 -6 86.65 6.44 11 -15 6 82.81 8.46 11 15 6 72.03 6.16 11 15 7 573.35 25.08 -11 -15 -7 567.49 25.41 -11 -15 -7 541.87 25.16 -11 15 -7 524.20 24.98 -11 15 -7 572.45 25.32 -11 -15 -7 573.24 25.48 -11 -15 -7 560.18 29.42 11 -15 7 627.42 28.78 -11 15 -7 544.23 24.03 -11 -15 -8 23.50 3.99 -11 -15 -8 23.82 5.97 11 15 8 23.25 3.96 11 -15 8 23.21 5.48 -11 -15 -8 25.37 4.38 -11 -15 -8 22.80 4.23 -11 15 -8 25.86 4.28 -11 15 -8 23.18 4.18 -11 -15 -9 10.10 4.46 11 15 9 5.93 3.09 11 -15 9 4.29 3.93 -11 -15 -9 5.05 3.19 -11 15 -9 5.37 3.09 -11 -15 -9 6.90 3.44 -11 15 -9 8.76 3.61 -11 15 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12.55 -12 -2 16 520.62 23.38 -12 2 16 514.44 22.23 12 2 -16 476.95 23.41 -12 2 16 579.69 24.26 -12 -2 16 550.88 23.80 -12 2 16 479.69 24.34 -12 -2 16 515.08 24.53 12 -2 -16 505.95 21.27 12 2 -15 0.89 2.20 -12 -2 15 2.09 2.14 -12 2 15 0.62 1.79 -12 2 15 3.18 2.53 -12 -2 15 0.85 2.23 -12 2 15 -0.55 2.75 -12 -2 15 0.53 2.36 12 -2 -15 1.40 1.23 12 -2 -15 0.65 0.90 -12 -2 14 76.88 5.78 12 2 -14 60.31 5.52 -12 2 14 67.63 5.04 12 -2 -14 71.48 3.61 -12 -2 14 59.41 5.34 -12 2 14 59.50 5.45 -12 2 14 70.40 6.25 -12 -2 14 65.76 6.06 12 -2 -14 76.40 3.93 -12 -2 13 13.60 2.84 12 -2 -13 14.80 1.37 -12 2 13 16.12 2.96 -12 -2 13 17.71 3.14 -12 -2 13 16.42 3.54 -12 2 13 18.76 3.40 12 -2 -13 14.13 1.48 12 -2 -12 2018.20 74.15 -12 2 12 2142.97 78.08 -12 -2 12 2004.06 77.48 -12 2 12 1812.22 76.36 -12 -2 12 1775.21 75.99 12 -2 -11 314.41 12.51 -12 -2 11 312.72 15.03 -12 2 11 265.14 14.04 -12 -2 11 293.25 13.92 -12 -2 10 415.76 18.76 -12 2 10 384.94 17.97 -12 -2 10 413.35 17.72 -12 -2 9 41.95 3.96 -12 2 9 36.35 3.38 -12 -2 9 33.07 3.05 -12 2 8 550.77 22.37 -12 -2 8 523.78 20.90 -12 -2 8 519.66 22.86 -12 -2 8 525.00 21.71 -12 -2 7 358.35 14.61 -12 -2 7 364.22 15.15 -12 -2 7 363.98 16.37 -12 -2 6 1798.98 68.53 -12 -2 5 44.37 2.59 12 2 -5 37.23 4.50 -12 2 5 46.76 3.59 12 2 -4 13.62 2.86 12 2 -4 18.75 3.28 -12 -2 4 19.24 1.34 -12 2 4 16.80 1.67 -12 2 4 18.06 2.34 12 2 -3 1.59 2.21 12 2 -3 2.50 2.04 -12 2 3 5.30 1.77 12 2 -2 151.73 6.20 12 2 -2 155.77 9.11 12 2 -2 153.90 9.27 -12 2 2 160.39 8.67 12 -2 -1 94.17 5.30 12 2 -1 93.11 6.64 -12 2 1 89.96 6.24 12 2 -1 90.92 6.77 -12 2 0 712.88 30.12 -12 2 0 716.39 30.64 -12 2 0 780.79 30.92 12 2 0 739.51 30.58 12 -2 0 655.97 28.42 12 -2 1 -0.23 1.25 -12 -2 -1 0.34 0.61 12 2 1 2.67 2.45 -12 2 -1 2.55 2.28 -12 2 -1 -0.44 2.12 -12 2 -1 -0.42 1.33 -12 2 -2 1997.67 76.75 12 2 2 2006.31 77.00 -12 -2 -2 1949.50 73.35 12 -2 2 1871.21 74.67 -12 2 -2 1878.96 76.63 -12 2 -3 423.02 18.80 -12 -2 -3 366.24 15.31 -12 -2 -3 375.69 15.60 12 -2 3 403.76 16.89 -12 2 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2.71 3.98 -15 -11 -10 0.75 4.12 -15 11 -10 -0.73 4.20 -15 -11 -10 4.79 4.53 15 11 10 1.40 2.39 -15 11 -11 551.78 30.00 -15 -11 -11 606.43 31.09 -15 -11 -11 627.11 29.80 -15 11 -11 608.56 29.50 15 11 11 597.65 25.99 -15 -11 -12 0.82 4.40 -15 11 -12 1.59 4.06 -15 11 -12 -0.95 4.11 -15 -11 -12 0.98 5.40 -15 11 -13 103.96 10.18 -15 -11 -13 85.02 9.96 -15 -11 -13 101.22 9.93 -15 11 -13 94.07 9.26 -15 11 -13 90.95 9.14 15 13 -18 0.59 3.81 15 13 -17 -0.57 3.52 -15 -13 17 1.40 3.57 15 -13 -17 1.17 3.51 15 13 -17 1.12 3.37 15 13 -16 1.07 3.06 -15 -13 16 2.73 3.72 15 -13 -16 2.93 3.31 15 13 -16 3.17 3.44 -15 -13 15 283.75 13.44 15 13 -15 291.68 15.27 15 13 -15 300.77 15.29 -15 -13 15 318.25 16.92 15 13 -14 16.89 3.81 15 -13 -14 30.84 5.03 -15 -13 14 20.70 4.88 15 13 -14 29.02 4.28 -15 -13 14 20.49 3.09 15 13 -13 133.05 8.72 -15 -13 13 131.16 7.85 15 -13 -13 115.88 9.46 15 13 -13 127.91 8.46 -15 -13 13 141.99 10.28 15 -13 -12 16.87 4.45 -15 -13 12 10.28 2.82 15 13 -12 10.79 3.29 15 13 -12 9.51 3.01 -15 -13 12 17.94 4.78 -15 -13 12 3.78 3.19 15 -13 -12 13.29 3.05 15 -13 -11 196.55 11.10 -15 -13 11 191.28 12.34 15 13 -11 172.46 10.33 15 -13 -11 204.58 12.54 -15 -13 11 202.17 13.07 15 13 -11 203.81 12.18 15 -13 -11 205.86 12.17 15 -13 -10 0.45 2.56 15 13 -10 0.35 2.12 15 -13 -10 4.95 3.28 -15 -13 10 -2.14 3.69 15 13 -10 0.50 3.03 15 13 -10 2.17 2.95 15 -13 -10 -0.49 3.12 15 -13 -10 1.59 3.08 15 13 -9 405.83 20.47 15 -13 -9 377.46 20.02 -15 13 9 446.21 23.16 15 13 -9 411.10 18.79 15 -13 -9 431.73 21.59 15 -13 -9 442.47 20.43 -15 -13 9 469.27 22.71 15 13 -9 438.13 20.54 15 -13 -9 408.12 20.00 15 13 -8 1.81 1.07 -15 13 8 8.58 4.35 15 -13 -8 12.21 3.40 15 -13 -8 5.11 3.72 15 -13 -8 3.23 3.06 -15 -13 8 11.10 4.17 15 13 -8 4.28 3.31 15 13 -8 5.11 3.01 15 -13 -8 6.45 3.16 15 13 -7 1.48 2.85 15 -13 -7 -0.48 3.00 15 13 -7 0.28 1.53 -15 -13 7 3.25 3.31 -15 13 7 0.76 3.80 15 -13 -7 -0.65 3.40 15 13 -7 -0.93 3.15 15 -13 -7 -0.90 3.23 -15 -13 7 0.75 3.44 15 -13 -7 -0.51 2.54 15 13 -6 7.75 3.29 15 -13 -6 10.84 3.58 15 13 -6 12.61 2.29 -15 -13 6 17.15 4.20 -15 13 6 9.53 4.11 15 -13 -6 8.56 3.69 15 13 -6 10.39 3.22 15 -13 -6 16.23 3.62 -15 -13 6 17.59 4.61 15 -13 -6 9.96 3.27 15 -13 -5 446.82 23.60 15 -13 -5 516.24 25.10 -15 -13 5 525.37 24.82 -15 13 5 504.79 25.34 -15 -13 5 532.20 26.14 15 13 -5 503.92 23.16 15 -13 -5 545.05 23.32 15 13 -5 505.78 23.44 15 -13 -5 491.26 23.21 15 -13 -4 153.80 10.75 15 -13 -4 145.17 11.42 -15 -13 4 181.76 11.77 -15 13 4 170.30 11.91 15 -13 -4 201.20 12.32 -15 -13 4 206.60 13.26 15 13 -4 200.46 11.12 15 -13 -4 165.97 10.40 15 -13 -3 242.10 13.57 15 -13 -3 198.82 13.38 -15 13 3 192.49 13.03 15 -13 -3 218.49 13.46 15 13 -3 206.83 11.96 15 -13 -3 210.89 11.93 -15 -13 3 220.24 14.39 15 -13 -2 19.71 4.28 -15 13 2 7.04 3.88 -15 -13 2 16.49 4.40 15 -13 -2 13.01 4.10 15 -13 -1 163.71 10.89 -15 13 1 150.92 10.55 -15 -13 1 128.14 11.06 15 -13 -1 143.34 11.17 15 13 0 7.48 1.91 15 -13 0 7.57 3.59 15 -13 0 2.70 3.25 -15 13 0 4.14 3.22 15 -13 1 641.98 30.05 -15 13 -1 640.89 29.06 15 13 1 630.60 25.61 15 -13 2 6.97 3.70 -15 13 -2 4.87 3.05 15 13 2 4.72 1.78 15 13 3 138.55 6.94 15 -13 3 149.72 10.63 -15 -13 -3 121.50 5.99 -15 -13 -3 111.64 10.65 -15 13 -3 146.20 9.39 15 13 4 0.23 1.73 -15 13 -4 0.48 2.89 -15 -13 -4 0.75 1.23 15 -13 4 0.72 3.43 -15 -13 -4 -0.94 4.57 15 13 5 260.07 11.88 -15 13 -5 243.99 13.40 -15 -13 -5 260.75 14.53 -15 -13 -5 248.86 10.78 15 -13 5 237.93 15.12 -15 -13 -5 260.67 17.23 15 13 6 38.38 3.74 -15 13 -6 38.21 4.58 -15 -13 -6 31.14 5.16 -15 13 -6 33.95 5.45 -15 -13 -6 34.34 2.81 15 -13 6 35.91 5.92 -15 -13 -6 37.27 6.59 -15 -13 -7 305.79 16.99 -15 13 -7 293.87 16.73 -15 -13 -7 305.84 17.13 -15 13 -7 275.57 16.56 15 13 7 316.27 14.43 15 -13 7 342.81 18.71 -15 -13 -7 338.13 20.13 15 13 8 1.59 2.19 -15 -13 -8 1.87 3.67 -15 13 -8 -1.22 3.91 -15 -13 -8 3.32 3.74 -15 13 -8 1.29 3.56 15 -13 8 1.62 3.94 -15 -13 -8 1.01 5.08 -15 -13 -9 85.26 9.82 15 13 9 89.20 6.11 -15 -13 -9 84.76 8.10 -15 13 -9 67.94 7.35 15 -13 9 63.86 8.09 -15 -13 -9 79.37 8.05 -15 13 -9 85.84 8.10 -15 -13 -10 1.45 4.40 -15 13 -10 0.70 4.18 -15 -13 -10 4.16 4.67 -15 -13 -11 508.52 26.10 -15 13 -11 513.13 25.92 -15 -13 -11 525.73 28.56 15 15 -16 62.81 6.66 -15 -15 16 59.37 7.00 -15 -15 16 58.47 7.48 15 15 -15 435.52 20.74 15 15 -15 422.33 20.68 -15 -15 15 404.36 21.67 -15 -15 15 405.74 22.33 -15 -15 14 0.80 2.71 -15 -15 14 -0.70 3.83 15 15 -14 -1.02 3.10 15 -15 -13 267.42 15.53 15 15 -13 281.61 15.78 15 15 -13 289.33 15.04 -15 15 13 286.60 12.13 -15 -15 13 285.25 14.47 -15 -15 13 280.64 16.66 -15 -15 13 290.24 17.02 15 15 -12 14.93 3.45 -15 15 12 17.64 2.54 -15 -15 12 13.39 3.40 15 -15 -12 16.76 4.21 15 15 -12 15.30 4.00 15 15 -12 21.98 4.20 15 -15 -12 23.99 4.48 -15 -15 12 18.45 4.73 -15 -15 12 15.21 4.31 15 -15 -12 18.17 3.85 15 -15 -11 29.97 4.55 -15 -15 11 39.85 5.93 15 -15 -11 28.87 4.71 15 15 -11 30.74 4.92 15 -15 -11 31.80 5.06 15 15 -11 24.95 4.64 -15 -15 11 23.37 3.98 -15 -15 11 30.12 5.68 15 15 -11 26.54 4.09 15 15 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7 36.42 4.37 26 6 -7 34.83 7.09 26 -6 -7 41.07 6.84 26 -6 -7 32.85 4.60 -26 -6 6 2.48 2.39 26 6 -6 0.91 5.11 26 -6 -6 3.61 4.54 26 -6 -6 0.47 2.77 26 6 -5 28.39 6.09 26 -6 -5 19.16 5.66 26 -6 -5 23.48 3.96 26 6 -4 12.02 5.24 26 -6 -4 19.30 5.27 26 -6 -4 16.29 3.56 26 6 -3 163.23 13.18 26 -6 -3 156.47 13.01 -26 6 3 163.54 11.99 26 -6 -3 175.70 10.37 26 -6 -2 111.36 8.03 26 -6 -2 108.66 10.68 26 6 -2 94.05 10.10 -26 6 2 124.16 10.18 26 -6 -1 46.28 5.29 -26 6 1 54.36 7.00 26 -6 0 197.62 11.33 -26 6 0 168.42 12.91 26 8 -10 -0.92 5.26 26 -8 -10 -0.92 5.77 26 8 -9 42.26 7.75 26 -8 -9 53.70 8.10 26 -8 -9 42.54 5.88 26 8 -8 241.56 16.81 26 -8 -8 245.47 16.80 26 -8 -8 274.62 14.95 26 8 -7 269.10 17.50 26 -8 -7 285.10 17.72 26 -8 -7 251.68 14.73 26 8 -6 39.80 7.21 26 -8 -6 26.86 6.42 26 -8 -6 28.57 4.89 26 8 -5 304.79 19.26 26 -8 -5 316.54 19.32 26 -8 -5 307.87 16.66 26 8 -4 37.92 6.73 26 -8 -4 29.55 6.05 26 -8 -4 41.10 5.59 26 8 -3 126.85 11.98 26 -8 -3 138.40 12.17 26 -8 -3 154.27 10.24 -27 -1 14 124.21 9.89 -27 1 14 119.27 10.12 27 1 -14 119.56 12.15 -27 1 13 7.83 4.12 -27 -1 13 13.97 4.50 27 1 -13 11.20 5.81 -27 -1 12 159.53 11.22 27 1 -12 169.18 13.69 -27 -1 11 9.34 3.72 27 1 -11 13.12 6.07 -27 -1 10 122.95 9.36 27 1 -10 112.35 11.65 27 1 -10 131.42 6.72 -27 -1 9 7.24 2.60 27 1 -9 4.31 1.62 27 -1 -9 8.13 2.33 -27 -1 8 0.43 2.41 -27 1 8 -0.92 2.62 27 -1 -8 1.52 1.65 27 1 -8 -3.91 5.81 27 1 -8 0.53 1.06 -27 1 7 35.31 5.01 27 -1 -7 45.01 3.64 -27 -1 7 45.53 5.10 27 1 -7 37.72 7.42 27 -1 -6 616.19 25.10 -27 1 6 594.71 28.26 -27 -1 6 653.00 28.61 27 1 -6 635.58 32.12 -27 -1 5 21.30 4.32 -27 1 5 23.55 4.61 27 -1 -5 22.64 2.55 -27 1 4 91.01 8.02 -27 -1 4 85.73 7.97 -27 -1 4 79.35 6.30 27 1 -4 107.47 10.74 -27 1 3 1.34 3.42 -27 -1 3 -0.66 3.33 -27 1 3 0.78 2.52 27 1 -3 1.94 5.51 -27 1 2 3.53 3.75 -27 -1 2 9.89 4.62 -27 1 2 10.19 3.16 27 1 -2 2.92 5.23 -27 1 1 8.86 3.49 -27 1 1 14.10 4.56 -27 -1 1 7.45 4.11 -27 -1 0 363.35 21.71 -27 1 0 400.00 22.02 27 3 -13 -1.01 5.58 27 -3 -13 5.08 5.25 -27 -3 13 0.62 3.62 27 3 -12 381.14 21.99 27 -3 -12 328.74 20.86 -27 -3 12 318.91 17.80 27 3 -11 14.07 6.23 27 -3 -11 16.09 5.08 -27 -3 11 10.30 4.01 27 3 -10 376.04 17.93 27 -3 -10 365.39 17.40 -27 -3 10 394.69 13.43 27 -3 -9 4.94 2.65 -27 -3 9 6.89 2.62 27 3 -9 2.93 5.25 27 -3 -9 12.70 5.69 -27 -3 9 5.86 3.30 27 -3 -8 2.14 2.41 -27 -3 8 2.12 2.39 27 3 -8 2.92 5.16 27 -3 -8 4.86 4.82 -27 -3 8 4.58 3.03 27 -3 -7 42.62 4.44 -27 -3 7 49.38 5.25 -27 -3 7 38.77 5.01 27 3 -7 35.63 7.12 27 -3 -7 46.22 7.53 -27 3 6 213.12 12.33 27 -3 -6 182.76 10.00 -27 -3 6 186.82 11.62 -27 -3 6 192.17 11.23 27 3 -6 153.52 13.64 27 -3 -6 193.59 14.70 27 -3 -5 118.89 7.32 -27 3 5 132.99 9.70 -27 -3 5 113.92 9.14 27 3 -5 129.06 11.88 27 -3 -5 124.16 11.65 -27 3 4 52.70 6.27 -27 -3 4 60.07 6.62 27 -3 -4 54.24 4.63 27 3 -4 57.09 8.23 27 -3 -4 53.22 7.89 -27 3 3 6.19 3.56 -27 -3 3 2.67 4.06 27 -3 -3 6.77 2.41 27 3 -3 5.76 5.03 27 -3 -3 3.84 4.76 27 3 -2 120.07 11.50 27 -3 -2 110.42 11.35 -27 3 2 142.39 10.75 -27 -3 2 120.35 10.08 -27 3 1 6.08 3.76 -27 -3 1 2.25 3.66 -27 3 0 483.76 25.14 27 5 -12 119.58 11.94 27 -5 -12 97.40 10.95 -27 -5 12 97.34 8.05 27 5 -11 85.43 9.84 27 -5 -11 87.30 10.05 -27 -5 11 83.79 7.28 -27 -5 10 60.83 5.73 27 5 -10 69.24 8.57 27 -5 -10 77.01 8.72 27 -5 -9 51.16 5.53 -27 -5 9 49.33 4.67 -27 -5 9 40.90 5.22 27 5 -9 58.17 8.18 27 -5 -9 48.40 8.05 27 -5 -8 20.60 3.91 -27 -5 8 22.78 3.73 -27 -5 8 21.23 4.00 27 5 -8 25.95 6.38 27 -5 -8 24.95 7.06 27 -5 -7 132.74 8.93 -27 -5 7 138.13 9.44 -27 -5 7 143.76 9.13 27 5 -7 150.92 12.68 27 -5 -7 165.77 12.91 27 -5 -6 460.04 20.77 -27 -5 6 431.87 21.58 27 5 -6 432.82 24.77 27 -5 -6 443.33 24.85 27 5 -5 134.92 11.85 27 -5 -5 125.09 11.75 27 -5 -5 133.91 8.57 27 5 -4 91.28 10.46 27 -5 -4 120.88 11.24 27 -5 -4 103.46 7.42 -27 5 4 99.97 9.04 -27 5 3 5.03 4.00 27 5 -3 1.90 5.48 27 -5 -3 -0.95 5.70 27 -5 -3 3.28 2.63 -27 5 2 17.24 5.00 27 -5 -2 26.05 3.85 28 0 -11 -3.12 6.24 28 0 -10 43.92 8.02 28 0 -9 -7.11 6.05 28 0 -8 81.64 10.08 -28 0 8 100.08 7.59 28 0 -7 3.98 5.54 -28 0 7 -1.02 2.83 28 0 -6 1.99 5.22 -28 0 6 1.66 3.09 28 0 -5 1.00 5.58 -28 0 5 -0.60 3.14 28 0 -4 373.16 22.87 -28 0 4 390.70 20.13 -28 0 3 -1.36 3.89 -28 -2 10 70.46 7.10 28 2 -10 78.44 9.90 28 -2 -10 72.87 5.62 -28 -2 9 11.96 3.95 28 2 -9 6.08 5.59 -28 -2 9 15.28 3.16 28 -2 -9 9.48 2.74 -28 -2 8 203.98 12.49 28 2 -8 204.46 15.46 28 -2 -8 207.93 10.56 -28 -2 8 217.55 11.89 28 2 -7 134.14 12.02 -28 2 7 112.59 8.84 -28 -2 7 119.37 8.51 -28 2 6 92.28 8.07 28 2 -6 97.49 10.66 -28 -2 6 107.51 8.27 28 2 -5 5.00 4.96 -28 2 5 0.62 3.55 -28 -2 5 0.59 3.43 -28 2 4 283.71 16.63 -28 -2 4 305.63 16.81 28 2 -4 302.56 19.76 0 0 0 0.00 0.00 TITL Rkjk6_abs in C2/c REM C2/c (#15 in standard setting) CELL 0.71073 22.182415 17.083270 20.007825 90.0000 106.3845 90.0000 ZERR 4.00 0.000405 0.000264 0.000354 0.0000 0.0018 0.0000 LATT 7 SYMM -x, y,-z+1/2 SFAC C H N O F P La UNIT 120.00 172.00 16.00 50.00 24.00 4.00 4.00 REM CrysAlisPro recorded range (K): Min=99.5; max=100.4; aver:100.0 TEMP -173 SIZE 0.11 0.12 0.16 TREF HKLF 4 END _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' ; _shelx_hkl_checksum 60234 _olex2_submission_special_instructions 'No special instructions were received' _oxdiff_exptl_absorpt_empirical_details ; Empirical correction (ABSPACK) includes: - Absorption correction using spherical harmonics - Frame scaling ; _oxdiff_exptl_absorpt_empirical_full_max 1.230 _oxdiff_exptl_absorpt_empirical_full_min 0.847