#============================================================================= data_global loop_ _journal_name_full 'European Journal of Chemistry' _journal_coden_ASTM EJCUA9 _journal_volume 14 _journal_issue 1 _journal_year 2023 _journal_page_first 90 _journal_page_last 98 #============================================================================= data_jammu-a10 _audit_creation_date 2022-12-30 _audit_creation_method ; Olex2 1.5 (compiled 2021.08.20 svn.r13c46975 for OlexSys, GUI svn.r6396) ; _shelx_SHELXL_version_number '2018/3' _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. C71, 3-8. ; _chemical_name_common ? _chemical_name_systematic ? _chemical_formula_moiety 'C16 H17 N O2' _chemical_formula_sum 'C16 H17 N O2' _chemical_formula_weight 255.30 _chemical_melting_point ? _chemical_oxdiff_formula 'C H N O' 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' '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' _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 14 _space_group_name_H-M_alt 'P 1 21/n 1' _space_group_name_Hall '-P 2yn' loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' _cell_length_a 6.4478(3) _cell_length_b 9.2477(4) _cell_length_c 23.4572(9) _cell_angle_alpha 90 _cell_angle_beta 95.114(4) _cell_angle_gamma 90 _cell_volume 1393.11(10) _cell_formula_units_Z 4 _cell_measurement_reflns_used 5012 _cell_measurement_temperature 293(2) _cell_measurement_theta_max 24.2550 _cell_measurement_theta_min 3.3620 _shelx_estimated_absorpt_T_max ? _shelx_estimated_absorpt_T_min ? _exptl_absorpt_coefficient_mu 0.080 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.97699 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.39.31d (Rigaku Oxford Diffraction, 2017) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_absorpt_special_details ? _exptl_crystal_colour yellow _exptl_crystal_density_diffrn 1.217 _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _exptl_crystal_description block _exptl_crystal_F_000 544 _exptl_crystal_size_max 0.35 _exptl_crystal_size_mid 0.10 _exptl_crystal_size_min 0.10 _exptl_transmission_factor_max ? _exptl_transmission_factor_min ? _diffrn_reflns_av_R_equivalents 0.0328 _diffrn_reflns_av_unetI/netI 0.0317 _diffrn_reflns_Laue_measured_fraction_full 0.974 _diffrn_reflns_Laue_measured_fraction_max 0.966 _diffrn_reflns_limit_h_max 8 _diffrn_reflns_limit_h_min -7 _diffrn_reflns_limit_k_max 11 _diffrn_reflns_limit_k_min -11 _diffrn_reflns_limit_l_max 28 _diffrn_reflns_limit_l_min -29 _diffrn_reflns_number 12104 _diffrn_reflns_point_group_measured_fraction_full 0.974 _diffrn_reflns_point_group_measured_fraction_max 0.966 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 26.367 _diffrn_reflns_theta_min 3.214 _diffrn_ambient_temperature 293(2) _diffrn_detector 'CCD plate' _diffrn_detector_area_resol_mean ? _diffrn_detector_type HyPix3000 _diffrn_measured_fraction_theta_full 0.974 _diffrn_measured_fraction_theta_max 0.966 _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 -77.00 -52.00 0.50 15.00 -- -9.79 163.00 95.00 50 2 \w -53.00 -28.00 0.50 15.00 -- -9.79 117.00 -53.00 50 3 \w 28.00 53.00 0.50 15.00 -- 10.07-163.00 69.00 50 4 \w 0.00 25.00 0.50 15.00 -- 10.07-117.00-141.00 50 5 \w 11.00 44.00 0.50 15.00 -- -9.79 38.00-120.00 66 6 \w -17.00 29.00 0.50 15.00 -- -9.79 38.00-150.00 92 7 \w -7.00 24.00 0.50 15.00 -- 10.07 -38.00 -30.00 62 8 \w -60.00 20.00 0.50 15.00 -- 10.07 -19.00-120.00 160 9 \w -54.00 -28.00 0.50 15.00 -- 10.07 -77.00-120.00 52 10 \w -6.00 36.00 0.50 15.00 -- 10.07 -77.00-120.00 84 11 \w -19.00 33.00 0.50 15.00 -- 10.07 -99.00 150.00 104 12 \w -27.00 1.00 0.50 15.00 -- 10.07 114.00 158.43 56 13 \w -53.00 -27.00 0.50 15.00 -- 10.07 -38.00 -30.00 52 14 \w 36.00 61.00 0.50 15.00 -- 10.07 57.00 120.00 50 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'SuperNova, Single source at offset/far, HyPix3000' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 -0.0005055000 _diffrn_orient_matrix_UB_12 0.0100958000 _diffrn_orient_matrix_UB_13 0.0299525000 _diffrn_orient_matrix_UB_21 0.0176100000 _diffrn_orient_matrix_UB_22 0.0750818000 _diffrn_orient_matrix_UB_23 -0.0034863000 _diffrn_orient_matrix_UB_31 -0.1090391000 _diffrn_orient_matrix_UB_32 0.0120952000 _diffrn_orient_matrix_UB_33 -0.0034430000 _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 'SuperNova (Mo) X-ray Source' _reflns_Friedel_coverage 0.000 _reflns_Friedel_fraction_full . _reflns_Friedel_fraction_max . _reflns_number_gt 1605 _reflns_number_total 2744 _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 1.171.39.31d (Rigaku OD, 2017)' _computing_data_collection 'CrysAlisPro 1.171.39.31d (Rigaku OD, 2017)' _computing_data_reduction 'CrysAlisPro 1.171.39.31d (Rigaku OD, 2017)' _computing_molecular_graphics 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.5 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2018/3 (Sheldrick, 2015)' _computing_structure_solution 'ShelXT (Sheldrick, 2015)' _refine_diff_density_max 0.283 _refine_diff_density_min -0.166 _refine_diff_density_rms 0.032 _refine_ls_extinction_coef 0.009(3) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_extinction_method 'SHELXL-2018/3 (Sheldrick 2018)' _refine_ls_goodness_of_fit_ref 1.066 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 176 _refine_ls_number_reflns 2744 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0919 _refine_ls_R_factor_gt 0.0542 _refine_ls_restrained_S_all 1.066 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0804P)^2^+0.1320P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1489 _refine_ls_wR_factor_ref 0.1739 _refine_special_details ? _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H) groups At 1.5 times of: All C(H,H,H) groups 2.a Aromatic/amide H refined with riding coordinates: C12(H12), C9(H9), C8(H8), C11(H11), C5(H5), C2(H2), C3(H3), C6(H6) 2.b Idealised Me refined as rotating group: C14(H14A,H14B,H14C), C16(H16A,H16B,H16C), C15(H15A,H15B,H15C) ; _atom_sites_solution_hydrogens geom _atom_sites_solution_primary ? _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 C1 C 0.0837(3) 0.2201(2) 0.04017(8) 0.0623(5) Uani 1 1 d . . . . . N1 N -0.5000(3) 0.4189(2) -0.14042(9) 0.0799(6) Uani 1 1 d . . . . . C10 C -0.3508(3) 0.3649(2) -0.09423(9) 0.0669(6) Uani 1 1 d . . . . . C7 C -0.0699(3) 0.2695(2) -0.00678(8) 0.0623(5) Uani 1 1 d . . . . . C4 C 0.3777(3) 0.1276(2) 0.12993(8) 0.0651(6) Uani 1 1 d . . . . . C12 C -0.0176(3) 0.2756(2) -0.06298(9) 0.0757(6) Uani 1 1 d . . . . . H12 H 0.114683 0.246576 -0.071145 0.091 Uiso 1 1 calc R U . . . O1 O -0.4459(3) 0.4232(2) -0.18870(7) 0.1057(6) Uani 1 1 d . . . . . C9 C -0.4099(3) 0.3582(2) -0.03969(9) 0.0715(6) Uani 1 1 d . . . . . H9 H -0.543647 0.385095 -0.032109 0.086 Uiso 1 1 calc R U . . . O2 O -0.6718(3) 0.4574(2) -0.12837(8) 0.1092(7) Uani 1 1 d . . . . . C8 C -0.2690(3) 0.3112(2) 0.00369(8) 0.0699(6) Uani 1 1 d . . . . . H8 H -0.308189 0.307249 0.040861 0.084 Uiso 1 1 calc R U . . . C11 C -0.1563(3) 0.3234(3) -0.10664(9) 0.0773(7) Uani 1 1 d . . . . . H11 H -0.118717 0.327595 -0.143975 0.093 Uiso 1 1 calc R U . . . C5 C 0.3667(3) 0.0656(2) 0.07618(9) 0.0755(6) Uani 1 1 d . . . . . H5 H 0.458636 -0.008580 0.069273 0.091 Uiso 1 1 calc R U . . . C2 C 0.0924(3) 0.2825(2) 0.09392(9) 0.0757(6) Uani 1 1 d . . . . . H2 H -0.000065 0.356169 0.100974 0.091 Uiso 1 1 calc R U . . . C3 C 0.2363(3) 0.2368(3) 0.13719(9) 0.0789(7) Uani 1 1 d . . . . . H3 H 0.238250 0.281487 0.172754 0.095 Uiso 1 1 calc R U . . . C13 C 0.5315(3) 0.0775(2) 0.17936(9) 0.0763(7) Uani 1 1 d . . . A 2 C6 C 0.2235(3) 0.1101(2) 0.03235(9) 0.0722(6) Uani 1 1 d . . . . . H6 H 0.221244 0.065080 -0.003154 0.087 Uiso 1 1 calc R U . . . C14 C 0.4177(5) -0.0188(4) 0.21891(12) 0.1258(11) Uani 1 1 d . . . . . H14A H 0.305054 0.034188 0.233090 0.189 Uiso 1 1 calc R U . A 2 H14B H 0.512626 -0.049407 0.250455 0.189 Uiso 1 1 calc R U . A 2 H14C H 0.363524 -0.102072 0.198129 0.189 Uiso 1 1 calc R U . A 2 C16 C 0.7094(4) -0.0146(3) 0.15864(12) 0.1116(9) Uani 1 1 d . . . . . H16A H 0.652421 -0.099773 0.139788 0.167 Uiso 1 1 calc R U . A 2 H16B H 0.803315 -0.042226 0.190867 0.167 Uiso 1 1 calc R U . A 2 H16C H 0.783293 0.040759 0.132359 0.167 Uiso 1 1 calc R U . A 2 C15 C 0.6270(6) 0.2062(3) 0.21161(15) 0.1547(16) Uani 1 1 d . . . . . H15A H 0.688708 0.269451 0.185436 0.232 Uiso 1 1 calc R U . A 2 H15B H 0.732031 0.173481 0.240296 0.232 Uiso 1 1 calc R U . A 2 H15C H 0.520810 0.257298 0.229597 0.232 Uiso 1 1 calc R U . A 2 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 C1 0.0644(12) 0.0609(12) 0.0622(12) -0.0034(9) 0.0081(9) -0.0066(10) N1 0.0810(14) 0.0777(13) 0.0795(13) 0.0093(10) -0.0012(11) -0.0070(10) C10 0.0658(13) 0.0650(13) 0.0686(13) 0.0027(10) -0.0005(10) -0.0075(10) C7 0.0664(13) 0.0585(12) 0.0620(12) -0.0038(9) 0.0052(10) -0.0069(9) C4 0.0698(13) 0.0600(12) 0.0654(12) 0.0006(10) 0.0045(10) -0.0049(11) C12 0.0631(13) 0.0944(16) 0.0700(14) 0.0031(11) 0.0088(10) -0.0010(11) O1 0.1102(14) 0.1348(17) 0.0710(11) 0.0174(10) 0.0025(9) 0.0062(10) C9 0.0664(13) 0.0743(14) 0.0737(14) -0.0056(11) 0.0064(11) 0.0002(11) O2 0.0809(12) 0.1390(17) 0.1066(13) 0.0243(11) 0.0027(10) 0.0176(11) C8 0.0698(14) 0.0785(15) 0.0618(12) -0.0050(10) 0.0084(10) 0.0001(11) C11 0.0771(16) 0.0937(17) 0.0618(13) 0.0069(11) 0.0099(11) -0.0054(12) C5 0.0834(15) 0.0694(15) 0.0738(14) -0.0041(11) 0.0071(11) 0.0105(11) C2 0.0788(14) 0.0750(14) 0.0721(13) -0.0157(11) -0.0007(11) 0.0110(11) C3 0.0854(15) 0.0821(16) 0.0674(13) -0.0163(11) -0.0029(11) 0.0024(13) C13 0.0853(15) 0.0709(15) 0.0712(13) 0.0036(11) -0.0012(11) 0.0037(12) C6 0.0803(14) 0.0736(14) 0.0625(12) -0.0105(10) 0.0052(10) 0.0039(12) C14 0.132(2) 0.145(3) 0.103(2) 0.0466(19) 0.0197(18) 0.012(2) C16 0.0982(19) 0.130(2) 0.105(2) 0.0170(17) -0.0011(15) 0.0213(17) C15 0.188(3) 0.095(2) 0.159(3) -0.0175(19) -0.106(3) 0.013(2) _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 C1 C7 1.486(3) . ? C1 C2 1.383(3) . ? C1 C6 1.382(3) . ? N1 C10 1.471(3) . ? N1 O1 1.215(2) . ? N1 O2 1.221(2) . ? C10 C9 1.368(3) . ? C10 C11 1.368(3) . ? C7 C12 1.391(3) . ? C7 C8 1.383(3) . ? C4 C5 1.381(3) . ? C4 C3 1.381(3) . ? C4 C13 1.529(3) . ? C12 H12 0.9300 . ? C12 C11 1.372(3) . ? C9 H9 0.9300 . ? C9 C8 1.373(3) . ? C8 H8 0.9300 . ? C11 H11 0.9300 . ? C5 H5 0.9300 . ? C5 C6 1.382(3) . ? C2 H2 0.9300 . ? C2 C3 1.379(3) . ? C3 H3 0.9300 . ? C13 C14 1.521(3) . ? C13 C16 1.542(3) . ? C13 C15 1.511(3) . ? C6 H6 0.9300 . ? C14 H14A 0.9600 . ? C14 H14B 0.9600 . ? C14 H14C 0.9600 . ? C16 H16A 0.9600 . ? C16 H16B 0.9600 . ? C16 H16C 0.9600 . ? C15 H15A 0.9600 . ? C15 H15B 0.9600 . ? C15 H15C 0.9600 . ? 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 C1 C7 121.16(19) . . ? C6 C1 C7 121.85(18) . . ? C6 C1 C2 116.99(18) . . ? O1 N1 C10 118.3(2) . . ? O1 N1 O2 123.2(2) . . ? O2 N1 C10 118.4(2) . . ? C9 C10 N1 119.1(2) . . ? C11 C10 N1 119.4(2) . . ? C11 C10 C9 121.55(19) . . ? C12 C7 C1 120.86(19) . . ? C8 C7 C1 121.46(18) . . ? C8 C7 C12 117.68(18) . . ? C5 C4 C13 122.89(19) . . ? C3 C4 C5 115.82(18) . . ? C3 C4 C13 121.27(19) . . ? C7 C12 H12 119.2 . . ? C11 C12 C7 121.6(2) . . ? C11 C12 H12 119.2 . . ? C10 C9 H9 120.5 . . ? C10 C9 C8 119.1(2) . . ? C8 C9 H9 120.5 . . ? C7 C8 H8 119.3 . . ? C9 C8 C7 121.3(2) . . ? C9 C8 H8 119.3 . . ? C10 C11 C12 118.7(2) . . ? C10 C11 H11 120.6 . . ? C12 C11 H11 120.6 . . ? C4 C5 H5 118.9 . . ? C4 C5 C6 122.1(2) . . ? C6 C5 H5 118.9 . . ? C1 C2 H2 119.6 . . ? C3 C2 C1 120.9(2) . . ? C3 C2 H2 119.6 . . ? C4 C3 H3 118.6 . . ? C2 C3 C4 122.8(2) . . ? C2 C3 H3 118.6 . . ? C4 C13 C16 112.28(19) . . ? C14 C13 C4 108.92(19) . . ? C14 C13 C16 106.4(2) . . ? C15 C13 C4 110.39(19) . . ? C15 C13 C14 110.7(3) . . ? C15 C13 C16 108.2(2) . . ? C1 C6 H6 119.3 . . ? C5 C6 C1 121.40(19) . . ? C5 C6 H6 119.3 . . ? C13 C14 H14A 109.5 . . ? C13 C14 H14B 109.5 . . ? C13 C14 H14C 109.5 . . ? H14A C14 H14B 109.5 . . ? H14A C14 H14C 109.5 . . ? H14B C14 H14C 109.5 . . ? C13 C16 H16A 109.5 . . ? C13 C16 H16B 109.5 . . ? C13 C16 H16C 109.5 . . ? H16A C16 H16B 109.5 . . ? H16A C16 H16C 109.5 . . ? H16B C16 H16C 109.5 . . ? C13 C15 H15A 109.5 . . ? C13 C15 H15B 109.5 . . ? C13 C15 H15C 109.5 . . ? H15A C15 H15B 109.5 . . ? H15A C15 H15C 109.5 . . ? H15B C15 H15C 109.5 . . ? 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 C1 C7 C12 C11 -178.8(2) . . . . ? C1 C7 C8 C9 179.33(18) . . . . ? C1 C2 C3 C4 -0.3(4) . . . . ? N1 C10 C9 C8 -178.37(18) . . . . ? N1 C10 C11 C12 178.87(18) . . . . ? C10 C9 C8 C7 -0.5(3) . . . . ? C7 C1 C2 C3 -179.52(19) . . . . ? C7 C1 C6 C5 179.56(19) . . . . ? C7 C12 C11 C10 -0.5(3) . . . . ? C4 C5 C6 C1 0.2(3) . . . . ? C12 C7 C8 C9 -0.5(3) . . . . ? O1 N1 C10 C9 -179.5(2) . . . . ? O1 N1 C10 C11 1.0(3) . . . . ? C9 C10 C11 C12 -0.7(3) . . . . ? O2 N1 C10 C9 0.7(3) . . . . ? O2 N1 C10 C11 -178.9(2) . . . . ? C8 C7 C12 C11 1.1(3) . . . . ? C11 C10 C9 C8 1.2(3) . . . . ? C5 C4 C3 C2 -0.1(3) . . . . ? C5 C4 C13 C14 -100.8(3) . . . . ? C5 C4 C13 C16 16.7(3) . . . . ? C5 C4 C13 C15 137.5(3) . . . . ? C2 C1 C7 C12 143.2(2) . . . . ? C2 C1 C7 C8 -36.7(3) . . . . ? C2 C1 C6 C5 -0.6(3) . . . . ? C3 C4 C5 C6 0.1(3) . . . . ? C3 C4 C13 C14 77.5(3) . . . . ? C3 C4 C13 C16 -165.0(2) . . . . ? C3 C4 C13 C15 -44.2(3) . . . . ? C13 C4 C5 C6 178.52(19) . . . . ? C13 C4 C3 C2 -178.5(2) . . . . ? C6 C1 C7 C12 -37.0(3) . . . . ? C6 C1 C7 C8 143.2(2) . . . . ? C6 C1 C2 C3 0.6(3) . . . . ? _shelx_res_file ; TITL Jammu-A10 in P21/n #14 jammu-a10.res created by SHELXL-2018/3 at 12:09:39 on 30-Dec-2022 REM reset to P21/n #14 CELL 0.71073 6.447763 9.247664 23.457212 90 95.1144 90 ZERR 4 0.000274 0.000417 0.000933 0 0.0038 0 LATT 1 SYMM 0.5-X,0.5+Y,0.5-Z SFAC C H N O UNIT 64 68 4 8 L.S. 10 PLAN 2 CONF BOND MORE -1 BOND $H fmap 2 acta OMIT 0 1 3 REM REM REM WGHT 0.080400 0.132000 EXTI 0.008727 FVAR 0.86185 C1 1 0.083684 0.220065 0.040166 11.00000 0.06439 0.06087 = 0.06222 -0.00336 0.00814 -0.00661 N1 3 -0.500001 0.418917 -0.140417 11.00000 0.08104 0.07774 = 0.07949 0.00929 -0.00119 -0.00697 C10 1 -0.350823 0.364850 -0.094233 11.00000 0.06584 0.06500 = 0.06858 0.00268 -0.00049 -0.00752 C7 1 -0.069906 0.269482 -0.006778 11.00000 0.06637 0.05848 = 0.06201 -0.00385 0.00520 -0.00693 C4 1 0.377680 0.127619 0.129933 11.00000 0.06978 0.05997 = 0.06542 0.00064 0.00450 -0.00488 C12 1 -0.017554 0.275604 -0.062977 11.00000 0.06311 0.09437 = 0.07003 0.00312 0.00884 -0.00100 AFIX 43 H12 2 0.114683 0.246576 -0.071145 11.00000 -1.20000 AFIX 0 O1 4 -0.445879 0.423204 -0.188705 11.00000 0.11019 0.13482 = 0.07099 0.01743 0.00247 0.00616 C9 1 -0.409882 0.358162 -0.039691 11.00000 0.06641 0.07434 = 0.07375 -0.00565 0.00645 0.00021 AFIX 43 H9 2 -0.543647 0.385095 -0.032109 11.00000 -1.20000 AFIX 0 O2 4 -0.671822 0.457448 -0.128371 11.00000 0.08090 0.13899 = 0.10657 0.02432 0.00268 0.01763 C8 1 -0.268971 0.311150 0.003688 11.00000 0.06979 0.07853 = 0.06182 -0.00496 0.00844 0.00011 AFIX 43 H8 2 -0.308189 0.307249 0.040861 11.00000 -1.20000 AFIX 0 C11 1 -0.156260 0.323422 -0.106639 11.00000 0.07713 0.09373 = 0.06181 0.00688 0.00986 -0.00536 AFIX 43 H11 2 -0.118717 0.327595 -0.143975 11.00000 -1.20000 AFIX 0 C5 1 0.366700 0.065562 0.076184 11.00000 0.08338 0.06940 = 0.07383 -0.00410 0.00710 0.01051 AFIX 43 H5 2 0.458636 -0.008580 0.069273 11.00000 -1.20000 AFIX 0 C2 1 0.092386 0.282461 0.093921 11.00000 0.07884 0.07497 = 0.07209 -0.01575 -0.00071 0.01100 AFIX 43 H2 2 -0.000065 0.356169 0.100974 11.00000 -1.20000 AFIX 0 C3 1 0.236296 0.236836 0.137185 11.00000 0.08535 0.08215 = 0.06744 -0.01628 -0.00294 0.00240 AFIX 43 H3 2 0.238250 0.281487 0.172754 11.00000 -1.20000 AFIX 0 PART 2 C13 1 0.531525 0.077478 0.179357 11.00000 0.08535 0.07087 = 0.07119 0.00361 -0.00117 0.00365 PART 0 C6 1 0.223548 0.110074 0.032354 11.00000 0.08033 0.07355 = 0.06252 -0.01048 0.00524 0.00391 AFIX 43 H6 2 0.221244 0.065080 -0.003154 11.00000 -1.20000 AFIX 0 C14 1 0.417682 -0.018837 0.218905 11.00000 0.13151 0.14467 = 0.10300 0.04659 0.01971 0.01190 AFIX 137 H14A 2 0.305054 0.034188 0.233090 11.00000 -1.50000 H14B 2 0.512626 -0.049407 0.250455 11.00000 -1.50000 H14C 2 0.363524 -0.102072 0.198129 11.00000 -1.50000 AFIX 0 C16 1 0.709418 -0.014628 0.158639 11.00000 0.09824 0.12980 = 0.10500 0.01702 -0.00112 0.02132 AFIX 137 H16A 2 0.652421 -0.099773 0.139788 11.00000 -1.50000 H16B 2 0.803315 -0.042226 0.190867 11.00000 -1.50000 H16C 2 0.783293 0.040759 0.132359 11.00000 -1.50000 AFIX 0 C15 1 0.626975 0.206165 0.211614 11.00000 0.18828 0.09542 = 0.15866 -0.01750 -0.10619 0.01274 AFIX 137 H15A 2 0.688708 0.269451 0.185436 11.00000 -1.50000 H15B 2 0.732031 0.173481 0.240296 11.00000 -1.50000 H15C 2 0.520810 0.257298 0.229597 11.00000 -1.50000 AFIX 0 HKLF 4 REM Jammu-A10 in P21/n #14 REM wR2 = 0.1739, GooF = S = 1.066, Restrained GooF = 1.066 for all data REM R1 = 0.0542 for 1605 Fo > 4sig(Fo) and 0.0919 for all 2744 data REM 176 parameters refined using 0 restraints END WGHT 0.0804 0.1320 REM Highest difference peak 0.283, deepest hole -0.166, 1-sigma level 0.032 Q1 1 0.7400 0.1232 0.1659 11.00000 0.05 0.28 Q2 1 0.4560 0.2002 0.2398 11.00000 0.05 0.24 ; _shelx_res_checksum 88683 _shelx_hkl_file ; 0 0 -4 1812.39 62.8240 13 0 0 4 1890.18 62.8928 13 0 0 -4 1874.49 62.8237 6 0 0 -5-0.19073 0.34907 11 0 0 -5 0.12251 0.41344 6 0 0 5 0.12922 0.36638 13 0 0 -6 815.867 29.4720 11 0 0 -6 778.474 29.7596 6 0 0 6 799.486 29.8205 13 0 0 7-0.18230 0.42215 13 0 0 -7 0.17427 0.34954 6 0 0 8 208.147 8.81083 13 0 0 -8 187.213 8.55147 6 0 0 -8 188.427 8.19697 11 0 0 -9-0.22766 0.49300 6 0 0 9 0.71546 0.55211 13 0 0 -9-0.17380 0.37637 11 0 0 -10 67.0791 4.28073 6 0 0 10 70.7499 4.45983 13 0 0 -10 77.3739 4.12727 11 0 0 -11-0.21043 0.48718 11 0 0 -11 0.56294 0.65164 6 0 0 11 0.29842 0.54620 13 0 0 -12 182.605 8.58995 11 0 0 12 205.697 9.52579 13 0 0 -12 183.210 9.17530 6 0 0 13-0.55039 0.71240 5 0 0 13-0.34817 0.75407 13 0 0 -13-0.49071 0.49208 11 0 0 -13 0.34022 0.68222 6 0 0 -14 18.5728 2.40936 6 0 0 14 23.2303 2.65057 13 0 0 -14 18.1025 2.02156 11 0 0 14 24.4761 2.42814 5 0 0 15-0.31420 0.77153 5 0 0 15 1.20324 0.98486 13 0 0 -15 0.40256 0.80710 6 0 0 -16 29.7550 2.79702 11 0 0 16 34.2354 3.45099 13 0 0 16 35.9213 3.20182 5 0 0 -16 32.9763 3.42062 6 0 0 -17-1.86459 0.93506 6 0 0 17-0.45819 1.06115 13 0 0 17-0.35122 0.81365 5 0 0 -17-0.31500 0.72986 11 0 0 -18 51.3552 4.80689 6 0 0 18 63.5293 4.63173 5 0 0 18 64.0289 5.18263 13 0 0 -19-1.06414 1.23203 6 0 0 19-0.52192 1.13051 13 0 0 19-0.38721 1.00253 5 0 0 -20 6.80051 1.98242 6 0 0 20 6.68992 2.10469 13 0 0 21-2.34218 1.85718 13 0 0 -21 1.80819 1.97426 6 0 0 -22 178.053 10.9568 6 0 0 -23 0.67447 1.46078 6 0 0 -24 2.85295 1.75426 6 0 0 -25-1.50591 1.63142 6 0 0 -26-0.78163 1.69288 6 0 0 -27 0.80967 1.75359 6 0 0 -28 21.7856 4.07287 6 0 0 -29 1.72844 2.12296 6 0 1 -3 13.6048 1.15744 14 0 -1 3 12.1869 1.13831 8 0 1 -3 13.0754 1.17337 8 0 1 -3 14.8302 0.90868 12 0 1 -3 10.7186 1.10443 6 0 -1 3 16.1172 1.26261 6 0 -1 -3 14.6007 1.11472 5 0 1 3 12.4805 1.11468 7 0 -1 -4 272.875 10.8134 5 0 1 4 275.686 10.7968 5 0 1 -4 272.534 11.0331 8 0 1 -4 272.722 10.9855 14 0 -1 4 276.872 11.0869 8 0 -1 4 281.343 11.0465 6 0 1 -4 283.435 11.1323 6 0 1 -5 1117.44 40.7171 6 0 -1 5 1128.15 40.6140 6 0 -1 5 1122.76 40.6876 8 0 1 5 1098.38 40.3138 5 0 -1 -5 1104.79 40.3832 5 0 1 5 1087.15 39.6764 11 0 1 -5 1097.42 40.6632 8 0 1 6 67.3012 3.22034 11 0 -1 6 72.7383 3.92507 6 0 1 6 79.4777 3.89946 5 0 -1 -6 68.7180 3.74952 5 0 -1 6 79.6652 4.13443 8 0 1 -6 77.9036 4.14081 8 0 -1 -6 79.1761 3.99420 13 0 1 -6 77.9440 4.15514 6 0 1 7 634.368 22.3167 11 0 -1 -7 622.851 23.1544 13 0 -1 -7 595.732 23.0186 5 0 1 -7 622.860 23.4578 8 0 -1 7 598.128 23.1407 6 0 -1 -7 641.348 22.3014 11 0 1 7 618.855 23.0138 5 0 -1 -8 54.6565 3.20370 13 0 -1 -8 48.4335 2.40870 11 0 -1 8 40.9148 2.82709 6 0 1 -8 46.7252 3.19623 6 0 1 -8 48.7375 3.09203 11 0 1 -8 44.7452 3.11625 8 0 1 8 48.7602 2.94140 5 0 1 -9 284.720 12.0558 8 0 1 9 261.823 11.4539 5 0 1 9 266.909 10.7705 11 0 -1 9 285.758 11.7199 6 0 -1 -9 269.773 11.6802 13 0 1 -9 276.074 12.0603 6 0 -1 -9 276.137 10.8176 11 0 1 -9 271.257 11.7368 11 0 -1 10 204.805 9.25663 6 0 1 10 190.788 9.02555 5 0 1 -10 190.104 9.55573 6 0 1 -10 211.061 9.35440 11 0 -1 -10 210.209 9.36852 13 0 -1 -10 201.950 8.42246 11 0 1 10 208.163 8.44849 11 0 1 -10 201.608 9.58805 8 0 1 -11 42.7231 3.48516 8 0 1 11 49.2644 3.33906 5 0 1 -11 45.4269 3.60117 6 0 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1.66963 1.02596 6 0 -1 16 0.88470 1.02509 13 0 1 -16 1.81996 0.94324 11 0 1 -16 0.48060 1.04177 6 0 1 -17-0.46080 0.99789 8 0 1 -17 0.76031 0.98398 11 0 -1 17 1.41483 1.15805 13 0 -1 -17 0.89157 0.96538 6 0 1 -17-0.51144 1.10757 6 0 1 17 0.71203 1.00945 5 0 1 -18 3.25211 1.47480 6 0 -1 18 5.53336 1.74970 13 0 -1 -18 3.33383 1.40908 6 0 1 -18 3.39224 1.48751 8 0 1 18 1.49690 1.06579 5 0 1 -18 2.38019 1.08156 11 0 1 19 1.17550 0.96580 5 0 -1 19 2.69906 1.53286 13 0 1 -19 3.57244 1.56522 8 0 -1 -19 2.02273 1.43625 6 0 1 -19 5.15941 1.81921 6 0 1 -20 62.7735 5.74241 6 0 -1 -20 57.8622 5.32132 6 0 -1 20 79.4807 6.12432 13 0 1 -21 115.062 8.16973 6 0 -1 -21 110.726 7.81795 6 0 -1 21 103.482 7.59125 13 0 -1 22 53.4860 5.30032 13 0 -1 -22 53.9693 5.28989 6 0 1 -22 66.0049 6.04540 6 0 -1 23 1.26634 1.37130 13 0 1 -23-0.69672 1.50892 6 0 -1 -23 3.01636 1.63779 9 0 -1 -23 0.63849 1.38281 6 0 -1 24 0.66238 1.32822 13 0 -1 -24 0.67660 1.46540 6 0 1 -24 0.72987 1.19504 6 0 -1 -25 1.41850 1.53810 6 0 1 -25 3.04813 1.76605 6 0 -1 25 2.79671 1.81155 13 0 -1 26 1.46919 1.90147 13 0 -1 -26 3.71807 2.35735 6 0 1 -26-0.79400 1.29993 6 0 -1 -27 2.33414 1.80186 6 0 1 -27 0.82179 1.64830 6 0 -1 -28 0.81089 1.87748 6 0 1 -28 0.85279 1.84697 6 0 -1 -29-0.85558 1.85279 6 0 1 -29 1.76154 2.03903 6 0 -2 0 578.047 21.7362 9 0 2 0 588.618 21.6734 9 0 -2 0 584.232 22.3072 8 0 -2 1 7266.40 259.146 8 0 2 -1 7879.59 259.215 8 0 -2 -1 7746.33 258.770 9 0 2 1 7908.28 258.746 9 0 -2 -2 4660.92 168.162 7 0 -2 -2 4805.29 168.042 9 0 2 -2 4647.74 168.252 8 0 -2 2 4704.34 167.417 10 0 -2 2 4723.60 168.356 8 0 -2 2 4645.65 168.202 14 0 2 -3 3809.36 135.827 14 0 2 3 3743.83 135.828 7 0 -2 -3 3529.02 135.646 9 0 -2 3 3837.78 135.795 14 0 -2 3 3811.61 135.935 8 0 2 -3 3844.79 135.936 8 0 -2 -3 3831.59 135.714 7 0 -2 3 3831.27 134.891 10 0 -2 -4 1017.83 37.6012 9 0 2 4 995.064 37.5508 7 0 -2 4 993.899 37.6248 8 0 2 -4 1004.97 37.6243 8 0 -2 -4 1011.98 37.4044 7 0 -2 4 1011.88 37.5417 14 0 2 -4 1015.27 37.5527 14 0 -2 4 994.315 36.4350 12 0 2 -4 1028.94 36.5351 10 0 -2 5 4.76398 0.93354 8 0 2 5 9.82228 1.23907 7 0 2 -5 6.36170 1.12238 8 0 -2 -5 6.37787 0.97493 5 0 2 -5 7.21883 0.73412 10 0 2 -5 6.57446 1.14213 14 0 2 -5 6.28513 0.72550 12 0 -2 -5 6.47163 1.03079 7 0 -2 5 6.65545 1.08854 6 0 -2 6 214.953 9.32752 8 0 2 -6 197.309 9.16379 8 0 -2 6 214.280 9.22867 6 0 2 -6 205.655 9.10044 14 0 2 -6 196.126 8.17566 12 0 -2 -6 202.504 8.85142 5 0 2 -6 203.531 8.16628 10 0 2 6 204.053 9.10499 7 0 2 -7 308.058 11.6221 12 0 -2 7 307.197 12.5994 6 0 2 -7 288.743 12.7335 6 0 2 -7 295.250 12.6028 8 0 2 7 320.371 11.1838 11 0 -2 -7 306.920 12.3182 5 0 2 7 297.295 12.5361 7 0 2 -7 299.366 12.5417 14 0 -2 8 172.278 8.29896 8 0 2 -8 159.896 8.24140 6 0 2 -8 175.588 7.30018 12 0 2 -8 171.643 8.11047 14 0 2 8 164.529 6.74102 11 0 2 8 186.390 8.31777 7 0 2 -8 152.231 8.03155 8 0 -2 -8 171.371 7.87564 5 0 2 8 161.472 7.72437 5 0 -2 8 171.547 8.12832 6 0 2 9 287.143 12.2265 7 0 -2 9 279.185 12.0645 6 0 2 9 267.243 11.6869 5 0 -2 -9 279.831 11.8430 5 0 -2 9 265.985 12.1627 8 0 2 -9 255.123 12.0725 8 0 2 -9 238.296 11.0065 12 0 2 -9 292.409 12.4472 6 0 2 9 282.959 10.5599 11 0 2 -9 283.707 12.1005 14 0 2 -10 138.514 7.19243 14 0 -2 10 138.538 7.16025 6 0 2 10 133.943 6.83860 5 0 -2 -10 146.259 7.17046 13 0 2 10 138.195 5.81195 11 0 2 -10 127.763 7.18175 8 0 -2 -10 126.275 6.82395 5 0 2 -10 139.780 6.53181 12 0 2 -10 144.390 7.61146 6 0 -2 11 200.649 9.30912 6 0 2 11 190.767 9.03015 5 0 -2 -11 187.602 9.10984 5 0 2 11 187.645 7.83106 11 0 -2 -11 209.159 9.37244 13 0 2 -11 195.288 9.60960 8 0 2 -11 205.664 9.94983 6 0 2 -11 202.136 9.63626 11 0 2 -11 162.461 9.05470 14 0 -2 12 4.87883 1.17876 6 0 2 -12 2.90532 1.08061 8 0 2 -12 4.34137 1.31814 14 0 -2 -12 3.68315 1.07475 13 0 2 12 4.78298 1.18233 5 0 2 -12 5.59483 1.31883 11 0 2 -12 3.15805 1.17314 6 0 2 12 3.21689 0.65537 11 0 -2 -12 4.88272 1.23144 5 0 2 13 9.24947 1.54898 5 0 2 -13 13.1017 2.16338 6 0 2 -13 10.8414 1.93615 8 0 -2 -13 6.25462 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55.9063 4.57243 5 0 -2 -19 54.6034 4.72784 13 0 2 -19 53.0428 5.30069 6 0 2 -19 54.4337 5.03300 8 0 2 -19 59.4819 4.98378 11 0 -2 20 107.636 7.85478 13 0 2 -20 120.069 7.68761 11 0 2 -20 112.746 8.27454 6 0 -2 -20 122.498 7.95454 6 0 2 -21 74.3756 6.55325 6 0 -2 -21 79.7874 6.49554 9 0 -2 -21 75.1710 6.14162 6 0 -2 21 68.0818 6.06747 13 0 -2 22 5.08303 1.88923 13 0 2 -22 5.57047 2.14491 6 0 -2 -22 8.87509 2.27345 9 0 -2 -22 7.15451 2.08320 6 0 -2 23 2.00184 1.44593 13 0 2 -23 0.72638 1.68239 6 0 -2 -23 0.62351 1.35121 6 0 -2 -23 3.29496 1.70645 9 0 -2 -24 0.68423 1.37196 9 0 -2 -24 1.96372 1.60742 6 0 2 -24 0.75845 1.75598 6 0 -2 24-0.68967 1.38286 13 0 -2 -25 4.81072 2.10766 6 0 2 -25 2.36210 1.82620 6 0 -2 -25 3.50114 1.81583 9 0 -2 25 2.13513 2.02102 13 0 2 -26 1.63724 1.64252 6 0 -2 -26 0.72571 1.57287 6 0 -2 26 3.66806 1.89991 13 0 -2 27 3.00914 1.85320 13 0 -2 -27 3.77834 2.05675 6 0 2 -27 6.76863 2.40353 6 0 -2 28-0.77909 1.68717 13 0 2 -28-0.87856 1.90259 6 0 -2 -28 0.78526 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18.7495 11 2 -1 3 472.335 18.9523 4 2 1 3 483.222 19.0361 4 2 -1 3 491.756 18.3330 6 -2 -1 -3 470.635 18.9726 10 2 -1 3 462.744 18.0569 10 -2 1 -3 486.803 19.4601 1 -2 -1 -3 463.094 19.3668 1 -2 1 -3 485.651 18.9250 11 -2 1 -3 488.140 18.5311 6 2 1 4 314.789 12.8647 4 2 1 4 296.606 11.9533 5 2 1 4 261.859 12.3873 12 2 -1 4 273.325 12.4594 11 -2 1 -4 284.177 11.9109 10 -2 -1 -4 278.460 12.4889 12 -2 -1 -4 284.422 11.9649 5 2 -1 4 304.588 12.2134 6 -2 1 -4 311.600 13.4292 1 -2 -1 -4 321.691 13.4709 1 -2 -1 -4 301.710 12.8490 10 -2 1 -4 291.564 12.7220 11 -2 1 -4 286.307 12.3585 6 2 -1 4 284.793 12.7571 12 2 -1 4 286.472 12.6689 4 -2 -1 -5 169.602 8.61995 4 2 1 5 174.206 8.35204 4 -2 1 -5 177.344 6.75053 8 2 1 5 184.122 7.83723 5 2 -1 5 174.091 8.33374 4 2 -1 5 176.443 8.49757 12 2 -1 5 164.835 8.17279 11 2 1 5 159.356 6.49178 7 -2 1 -5 174.602 8.66116 4 -2 -1 -5 161.750 8.11254 12 2 -1 5 161.141 7.64617 14 -2 1 -5 175.513 9.02508 1 -2 -1 -5 191.505 9.22078 1 -2 1 -5 165.718 7.60460 10 2 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80.0789 9 -2 -1 -8 2263.92 82.1742 4 -2 1 -8 2136.14 79.9131 8 -2 -1 -8 2217.45 81.4382 12 2 1 8 2203.24 80.8563 5 -2 1 -8 2123.01 81.5074 6 -2 1 -8 2160.75 81.5010 12 -2 -1 -8 2258.84 79.5310 14 2 -1 8 2263.26 80.5829 14 2 1 8 2191.62 81.0889 11 -2 1 -8 2209.94 81.7247 11 -2 1 -8 2280.94 82.1568 4 -2 -1 -8 2195.60 80.9651 6 2 -1 8 2202.70 80.9233 6 2 1 8 2203.48 81.0276 9 2 -1 8 2235.11 81.6435 12 2 -1 8 2203.26 81.4340 11 2 -1 9 387.909 14.9621 9 -2 1 -9 369.085 14.8782 8 2 1 9 375.813 15.6482 5 -2 1 -9 370.963 16.2055 12 -2 -1 -9 360.902 14.3929 14 -2 -1 -9 352.930 15.9867 12 -2 1 -9 378.350 16.4240 11 2 -1 9 310.396 15.7016 11 -2 1 -9 412.331 17.0123 4 -2 -1 -9 356.510 16.5813 4 -2 1 -9 397.193 16.4252 6 2 1 9 365.276 15.7774 11 2 1 9 382.464 15.7538 9 2 -1 9 375.911 15.7016 6 -2 -1 -9 386.549 15.9168 6 -2 1 -10 8.11333 1.60505 11 2 1 10 7.98674 1.53362 9 -2 1 -10 5.90489 1.50213 6 -2 1 -10 6.81730 1.55078 12 -2 1 -10 7.57978 1.24618 8 -2 -1 -10 8.80552 1.14103 14 -2 1 -10 7.51699 1.38240 14 2 1 10 7.36137 1.41175 5 2 1 10 6.60919 1.41442 11 2 -1 10 8.21231 1.65043 11 -2 1 -10 10.5065 1.94922 4 -2 -1 -10 6.96735 1.73149 4 2 -1 10 7.17906 1.45407 6 -2 -1 -10 9.56920 1.83251 12 -2 -1 -10 9.09317 1.61859 6 -2 -1 -11 77.8167 5.19481 12 -2 1 -11 63.3588 5.22275 4 -2 1 -11 71.4342 4.30567 8 -2 -1 -11 67.0074 5.30128 4 2 1 11 70.2880 4.69642 5 -2 1 -11 73.6460 5.29877 11 2 -1 11 74.8654 5.08493 11 2 1 11 74.4391 4.85543 11 -2 1 -11 66.2418 5.12580 6 2 -1 11 65.6143 4.60794 6 -2 -1 -11 74.5666 3.97005 14 -2 -1 -11 72.7256 4.94734 6 -2 1 -11 69.4835 4.52045 14 -2 1 -11 71.9524 5.08260 12 -2 -1 -12 5.72073 1.46950 6 -2 -1 -12 2.00376 0.70700 14 2 1 12 5.40607 1.33220 11 -2 1 -12 3.61787 1.34046 6 -2 1 -12 3.76486 1.06300 8 -2 -1 -12 2.77456 1.08325 12 -2 1 -12 5.72128 1.31017 14 2 1 12 5.32568 1.31256 5 -2 1 -12 2.34477 1.11509 12 2 -1 12 3.42032 1.17058 11 -2 1 -12 2.96074 1.15500 11 2 -1 12 4.71020 1.23787 6 -2 1 -12 2.95162 1.27942 4 -2 -1 -12 3.92022 1.39503 4 -2 1 -13 120.075 6.60565 8 -2 -1 -13 126.473 7.44977 12 2 1 13 130.456 7.15288 5 -2 1 -13 114.205 7.19962 12 2 -1 13 115.693 6.63854 13 2 -1 13 121.828 7.27316 11 -2 -1 -13 126.435 7.39984 6 -2 1 -13 138.615 8.33262 4 -2 -1 -13 135.585 8.21527 4 -2 1 -13 113.423 7.34569 11 2 1 13 119.607 6.92975 11 -2 1 -13 120.236 7.69154 6 -2 1 -13 122.695 6.80729 14 -2 1 -14 17.0756 2.74682 4 -2 -1 -14 21.9838 2.77187 6 -2 -1 -14 19.7883 2.98868 4 -2 1 -14 22.3714 2.40167 8 -2 1 -14 15.3388 2.66194 6 2 -1 14 19.1741 2.33112 13 -2 1 -14 14.9188 2.09929 14 -2 -1 -14 19.6120 2.70226 12 -2 1 -14 17.9130 2.63288 11 -2 1 -14 21.1475 2.73888 12 2 1 14 19.2629 2.45737 5 2 1 14 17.4504 2.34047 11 2 -1 14 16.7384 2.47495 11 -2 -1 -14 18.8608 2.56625 9 -2 -1 -15 17.4876 2.67513 6 -2 1 -15 19.1915 3.04279 4 -2 -1 -15 20.9323 3.11580 4 -2 1 -15 19.5232 2.80449 11 -2 -1 -15 18.8870 2.65710 9 -2 1 -15 19.5178 2.98152 6 2 -1 15 17.6579 2.37527 13 -2 1 -15 16.3047 2.27568 14 -2 1 -15 15.8110 2.52314 12 2 1 15 18.8474 2.53357 11 -2 -1 -15 22.3785 2.94384 12 2 1 15 18.2652 2.56783 5 2 -1 15 16.9305 2.55792 11 -2 -1 -16 470.277 20.5233 9 -2 1 -16 454.872 20.3645 12 2 1 16 471.918 20.1023 5 -2 -1 -16 472.222 21.6942 4 2 -1 16 447.820 19.6258 13 -2 1 -16 449.438 20.5305 11 2 -1 16 448.673 20.1030 11 -2 1 -16 473.744 21.7059 4 -2 -1 -16 488.927 20.7476 12 -2 -1 -16 458.874 20.6568 6 -2 1 -16 447.617 21.0909 6 -2 -1 -17 179.990 10.1726 9 -2 1 -17 194.779 11.2691 4 -2 1 -17 180.326 10.2787 11 -2 -1 -17 201.539 10.8469 6 -2 1 -17 180.745 10.1049 12 2 -1 17 173.595 9.49274 13 2 -1 17 176.855 9.88101 11 -2 1 -17 169.512 10.6221 6 -2 -1 -17 167.652 10.7483 4 -2 -1 -18 71.3143 5.76822 9 2 -1 18 71.2488 5.32454 13 -2 -1 -18 72.6125 6.06431 6 -2 1 -18 63.8153 5.55870 11 -2 1 -18 86.4148 6.90234 4 -2 -1 -18 59.4145 5.95255 4 -2 1 -18 69.0037 6.17358 6 -2 -1 -19 33.2955 4.25238 6 -2 1 -19 63.6249 5.29351 11 -2 1 -19 53.0917 5.57317 4 -2 -1 -19 44.8437 4.51956 9 -2 -1 -19 48.0998 5.32314 4 -2 1 -19 54.9358 5.41492 6 -2 1 -20 5.18299 2.11821 4 -2 -1 -20 7.67381 2.41509 6 -2 -1 -20 10.3481 2.65210 4 -2 1 -20 10.5633 2.65638 6 -2 1 -20 7.77228 2.10131 11 -2 1 -21 6.18643 2.28689 4 -2 -1 -21 3.09158 1.90357 4 -2 -1 -21 2.69368 1.66016 6 -2 1 -21 6.61633 2.33511 6 -2 -1 -22 2.41634 1.86704 4 -2 -1 -22 2.84028 2.09763 6 -2 1 -22 3.07644 2.08999 6 -2 1 -22 2.41569 1.97948 4 -2 1 -23 2.51209 1.93911 4 -2 -1 -23 0.83690 1.67856 4 -2 -1 -23 1.49311 1.72894 6 -2 1 -23 0.79980 1.60419 6 -2 -1 -24 2.34755 1.69566 6 -2 1 -24 0.83332 1.67182 6 -2 1 -24 2.60699 1.88282 4 -2 1 -25 3.60017 2.21011 4 -2 -1 -25 0.89963 1.80376 4 -2 -1 -25-0.81883 1.77329 6 -2 1 -25 0.86213 1.57798 6 -2 1 -26 0.93472 2.02431 4 -2 -1 -26 0.93509 1.71157 4 -2 -1 -26 1.71510 1.71946 6 -2 1 -26-0.89305 1.79064 6 -2 1 -27 0.96367 1.93229 4 -2 -1 -27 0.96405 1.93305 4 -2 -1 -27-1.79512 2.20415 6 -2 1 -27 0.92468 1.51399 6 -2 -2 28-0.87282 1.89036 13 -2 -2 27 0.84903 1.55419 13 -2 -2 26 2.40929 2.08041 13 -2 -2 25 2.31825 1.67543 13 -2 -2 24 5.93772 2.11494 13 2 -2 -23 33.2552 4.05497 6 -2 -2 23 36.5490 4.63309 13 -2 -2 22 6.22331 2.12694 13 2 -2 -22 5.17180 1.75659 6 -2 -2 21 11.9804 2.80935 13 2 -2 -21 11.7509 2.34011 6 2 2 -20 1.05374 1.14251 6 -2 -2 20 2.56067 1.57304 13 2 -2 -20 1.86296 1.20694 6 -2 -2 19 14.7537 2.80218 13 2 2 -19 13.9258 2.59228 6 2 2 -18 1.87160 1.15119 6 -2 -2 18 2.32360 1.50528 13 2 2 -17 6.55996 1.85708 8 2 -2 -17 6.50886 1.79750 13 2 2 -17 6.13752 1.57849 6 -2 -2 17 4.93060 1.69123 13 2 2 -16 6.17919 1.56441 6 2 2 -16 9.45806 2.12111 8 2 -2 -16 5.37392 1.57427 13 -2 -2 16 8.28921 1.95857 13 2 2 -15 3.84131 1.26838 6 2 2 -15 5.02494 1.54770 8 -2 -2 15 5.38302 1.61062 13 2 -2 -15 4.79279 1.52197 13 2 2 -14 7.48811 1.57916 6 2 2 -14 8.65212 2.07073 8 2 -2 -14 13.6640 2.19497 13 -2 -2 14 9.22862 1.98998 13 2 2 -13-0.32971 0.71401 6 2 2 -13 1.37547 1.18671 8 2 -2 -13-0.39157 1.01349 13 -2 -2 13 0.43522 1.00755 13 2 2 -12 44.4770 4.09610 8 2 -2 -12 43.3149 3.78896 13 -2 -2 12 45.6527 3.96953 13 -2 -2 12 45.2202 3.12306 6 2 2 -12 44.6439 3.47591 6 -2 2 11-0.40461 0.74053 3 2 2 -11-0.27489 0.71152 6 -2 -2 11 1.30181 0.93972 8 2 2 -11 0.41429 0.95911 8 2 -2 -11 0.23932 0.20784 11 -2 -2 11-0.81851 0.66996 6 -2 -2 11-0.38099 0.76386 13 2 -2 -11 1.17431 0.64080 5 -2 2 11-0.42496 0.85201 7 2 -2 -11 0.35885 0.92884 13 -2 -2 10 63.0105 4.59841 8 2 2 -10 53.0725 4.26878 8 -2 2 10 56.1718 4.34355 3 -2 -2 10 50.7114 4.11683 3 2 -2 -10 49.6033 3.07444 5 2 -2 -10 53.6754 2.44623 11 -2 2 10 49.9514 4.16262 7 2 2 -10 52.5819 4.09518 10 -2 -2 10 46.3101 3.08708 6 -2 -2 10 42.7661 3.74498 13 -2 -2 9 49.7076 4.08431 8 2 2 -9 48.2666 3.99640 8 -2 2 9 46.9081 3.89507 3 2 -2 -9 49.6417 2.94700 5 -2 -2 9 43.6911 3.62015 13 -2 -2 9 50.1625 4.00445 3 2 -2 -9 51.6132 2.48733 11 -2 -2 9 52.5087 3.08778 6 2 2 -9 47.3189 3.85784 10 -2 2 9 54.8902 4.18662 7 -2 -2 8 493.411 20.1741 8 2 2 -8 475.474 19.8921 8 -2 2 8 452.137 19.6835 3 -2 -2 8 457.951 19.6323 3 -2 2 8 470.365 19.8766 7 2 -2 -8 453.846 18.0807 5 2 -2 -8 488.186 17.6767 11 2 2 -8 483.261 19.7633 10 -2 -2 8 465.792 18.2277 6 -2 -2 7 210.407 10.5140 8 -2 2 7 211.210 10.2894 3 -2 -2 7 225.740 10.4100 3 2 2 -7 222.978 10.5204 8 2 -2 -7 219.085 8.91498 5 2 2 -7 226.476 10.4375 10 -2 2 7 213.627 10.4054 7 2 -2 -7 206.672 8.65870 11 -2 -2 7 222.598 9.09210 6 -2 2 6 142.672 7.35675 3 -2 -2 6 129.955 7.14326 3 -2 2 6 133.817 7.28829 7 2 2 -6 130.679 7.23538 8 -2 -2 6 136.279 6.07725 6 2 -2 -6 146.302 6.05998 11 -2 -2 6 136.169 7.44158 8 2 2 -6 138.379 7.32097 10 -2 2 5 587.099 23.6972 3 -2 -2 5 574.919 23.6151 3 -2 -2 5 608.847 23.9694 8 2 2 -5 609.588 23.8430 8 2 -2 -5 606.833 22.4260 11 2 -2 -5 613.614 23.4507 3 2 2 -5 596.654 23.3321 3 -2 2 5 606.073 23.7819 7 2 2 -5 609.555 23.8785 10 -2 -2 5 558.858 22.2028 6 -2 -2 4 203.933 9.91653 8 2 -2 -4 217.451 9.66625 3 2 2 -4 211.349 9.89825 8 2 2 -4 215.063 9.62539 3 2 -2 -4 208.247 8.91422 11 -2 2 4 214.598 9.93285 7 2 -2 -4 221.379 9.71671 7 -2 -2 4 218.968 10.3010 10 2 2 -4 202.802 9.89970 10 -2 -2 3 72.2390 4.49890 2 2 -2 -3 79.4740 4.57714 3 2 2 -3 72.8282 4.40184 3 -2 -2 3 70.6437 4.58132 8 2 2 -3 75.3911 4.67711 8 2 2 -3 75.6129 4.73548 10 2 2 -3 79.9743 3.97788 12 2 -2 -3 78.9324 4.49198 7 -2 2 3 78.6222 4.69859 7 2 -2 -3 77.0750 4.10127 11 -2 2 3 75.3130 4.57967 2 -2 -2 3 77.5660 4.95674 10 2 -2 -2 1915.23 70.4705 3 2 2 -2 1913.50 70.4241 3 -2 -2 2 1930.04 70.6818 8 2 2 -2 1965.03 70.6465 8 2 2 -2 1934.57 69.6505 12 -2 2 2 1922.96 70.0320 11 2 -2 -2 1939.78 70.2826 7 2 -2 -2 1905.85 69.9521 11 2 2 -2 1918.24 70.7993 10 -2 2 2 1985.54 70.6514 2 -2 -2 2 1883.85 70.4686 2 -2 -2 2 1834.44 71.0736 10 -2 -2 1 933.573 34.9702 8 2 2 -1 939.533 34.8181 8 -2 -2 1 957.457 35.5746 10 2 2 -1 897.598 34.0895 12 -2 2 1 946.686 34.6324 11 2 -2 -1 973.148 34.5933 11 -2 2 1 960.024 34.9972 2 2 2 -1 923.999 35.1648 10 -2 -2 1 909.869 34.8673 2 2 -2 -1 969.741 34.7267 7 -2 2 0-0.23369 0.42770 11 2 -2 0-0.23178 0.56912 2 2 2 0 2.07977 0.68196 2 2 -2 0-0.22093 0.54250 11 2 2 0 0.35666 0.43789 12 -2 -2 0-0.19093 0.41346 12 -2 -2 0-0.25253 0.65362 8 2 2 0 1.33073 0.65352 1 2 2 0 0.23489 0.57676 8 -2 -2 0-0.31171 0.72163 10 2 -2 0-0.87963 0.67347 7 2 -2 0 1.33202 0.53412 1 2 -2 1 3.06113 0.91767 1 -2 -2 -1 2.21737 0.81404 8 2 -2 1 3.59654 0.98735 2 2 2 1 1.90359 0.76222 2 -2 -2 -1 2.60175 0.64429 5 2 2 1 3.84749 0.47981 14 -2 -2 -1 4.72035 0.97119 12 -2 2 -1 2.78615 0.86177 11 2 2 1 4.12253 0.98665 1 2 -2 1 2.92027 0.68315 10 2 -2 1 2.72627 0.52798 8 2 -2 1 3.10242 0.90181 11 -2 -2 -1 3.11776 0.99439 10 -2 2 -2 26.7722 2.58941 1 -2 -2 -2 27.0731 2.58941 1 2 -2 2 27.6178 1.62492 8 -2 -2 -2 31.6081 2.56704 8 -2 -2 -2 28.8583 2.22381 5 2 2 2 29.6807 2.50480 2 -2 2 -2 20.9871 2.27517 11 2 -2 2 28.4226 2.45605 4 2 -2 2 30.6878 2.54292 11 2 -2 2 26.3586 2.62317 1 2 2 2 28.7763 2.65689 1 2 2 2 25.6508 2.38383 4 2 -2 2 30.3037 2.07735 10 -2 -2 -2 24.2487 2.52682 10 2 -2 2 23.9818 2.32798 2 2 -2 2 28.0683 2.38842 6 -2 -2 -2 27.5246 2.27991 12 2 2 3 36.7850 2.90709 4 2 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270.221 11.5683 12 2 3 4 258.995 11.5367 4 -2 -3 -4 263.353 9.81437 14 -2 -3 -4 245.784 10.5584 7 2 -3 4 251.296 11.4958 4 -2 3 -4 287.946 12.4536 11 2 -3 4 264.890 11.9967 11 2 -3 4 258.594 10.1843 10 -2 3 -4 279.758 12.2799 1 -2 -3 -4 267.146 12.1005 1 2 -3 4 263.567 12.0420 6 2 3 5 219.916 10.6256 9 2 -3 5 227.632 9.38630 8 -2 3 -5 211.751 9.30788 8 -2 -3 -5 225.941 10.1766 5 -2 -3 -5 221.099 8.24598 14 -2 -3 -5 198.047 9.89895 12 2 -3 5 214.435 9.99295 4 -2 -3 -5 209.592 9.04044 7 -2 3 -5 211.626 10.6527 11 2 -3 5 211.017 10.3851 11 -2 3 -5 244.969 11.0572 1 -2 -3 -5 210.931 10.5682 1 2 3 5 211.133 9.97626 4 2 -3 5 211.712 10.4365 6 2 3 6 17.5345 2.34223 9 2 -3 6 21.1099 1.86511 8 2 -3 6 18.9635 2.37480 6 -2 3 -6 18.9390 1.79305 8 -2 -3 -6 21.4990 2.30951 5 -2 3 -6 18.0506 2.45152 11 2 -3 6 21.0712 2.42866 12 -2 3 -6 24.6842 2.84291 1 -2 -3 -6 20.7438 2.85252 1 -2 -3 -6 17.9777 2.27321 4 2 -3 6 23.3252 2.59510 11 2 -3 6 23.5672 2.62364 14 2 -3 6 21.7698 1.18958 9 2 3 7 2.50767 1.06282 9 2 -3 7 1.78899 0.97740 6 2 -3 7 4.34346 0.94886 8 -2 3 -7 3.89337 0.94314 8 -2 -3 -7 2.22959 0.94628 5 2 -3 7 4.18204 1.18116 12 -2 3 -7 2.89064 1.12630 11 2 -3 7 3.33055 1.21647 11 -2 3 -7 2.19180 1.08355 4 -2 -3 -7 2.54095 1.07678 4 2 -3 7 4.34934 1.19164 14 2 3 8 72.1601 5.10400 9 2 -3 8 64.6172 4.16385 8 -2 3 -8 78.3490 4.48357 8 -2 -3 -8 73.5441 4.95745 5 2 -3 8 71.6160 5.04246 12 -2 3 -8 89.6822 5.68441 4 2 -3 8 81.8910 5.36247 14 -2 3 -8 72.8372 5.46679 11 2 -3 8 82.8760 5.50030 11 -2 -3 -8 84.5313 5.52477 4 2 -3 8 86.6215 5.47994 6 2 -3 9 3.76611 1.35020 14 2 -3 9 2.70353 1.19024 6 -2 3 -9 3.50322 0.96980 8 -2 3 -9 7.27438 1.71047 11 -2 -3 -9 3.76861 0.89908 13 2 -3 9 4.99444 1.27969 12 2 3 9 4.98123 1.33721 9 -2 -3 -9 2.49605 1.06066 5 2 3 9 2.38779 0.90542 7 -2 -3 -9 4.95167 1.39887 4 -2 3 -9 4.99363 1.56649 4 2 -3 10 13.3768 2.19261 6 2 3 10 12.8059 2.11558 9 -2 3 -10 15.2045 2.40420 11 2 3 10 11.8352 1.59204 7 2 -3 10 12.8430 1.97043 12 -2 -3 -10 14.8904 2.27936 4 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-15 8.63574 2.17206 9 -2 3 -15 7.01164 2.22584 6 -2 3 -15 7.52343 2.07797 11 -2 3 -15 4.64465 1.72929 4 -2 -3 -15 6.35876 1.96483 4 -2 -3 -16 6.70855 1.96462 4 -2 -3 -16 13.1526 2.65821 9 -2 3 -16 9.31781 2.46115 6 -2 3 -16 9.58610 2.32650 11 -2 3 -16 13.4290 2.66672 4 -2 -3 -17 32.6309 4.23436 4 -2 -3 -17 30.9784 4.01447 9 -2 3 -17 28.9071 3.55226 14 -2 3 -17 37.5879 4.61792 6 -2 3 -17 29.0580 3.94216 11 -2 3 -17 28.9095 4.05064 4 -2 -3 -18 88.4832 7.23355 9 -2 3 -18 89.5034 7.37541 4 -2 3 -18 112.847 7.86977 11 -2 -3 -18 92.8020 7.47327 4 -2 -3 -18 94.6308 6.98904 6 -2 3 -18 85.7933 7.59985 6 -2 -3 -19 38.7551 4.79715 4 -2 -3 -19 33.7966 4.36826 9 -2 3 -19 35.5707 4.73765 6 -2 3 -19 39.3256 4.67650 11 -2 -3 -19 35.3675 4.18961 6 -2 3 -19 40.9096 4.93842 4 -2 -3 -20 55.3922 5.62410 9 -2 3 -20 47.2473 5.62867 6 -2 -3 -20 53.6928 5.85148 4 2 -3 20 54.8419 5.12854 13 -2 3 -20 50.1560 5.61228 4 -2 3 -20 55.8229 5.59584 11 -2 -3 -20 48.9792 5.15848 6 -2 3 -21 30.0143 4.36934 4 -2 -3 -21 24.5581 4.12507 4 -2 -3 -21 24.6680 3.80566 9 -2 3 -21 22.0796 3.89553 6 -2 3 -21 28.1788 4.08185 11 -2 -3 -21 26.5691 3.89702 6 -2 -3 -22 3.38252 1.83673 6 -2 3 -22 0.80099 1.46631 4 -2 -3 -22-0.80048 1.46538 4 -2 -3 -22 0.72528 1.45446 9 -2 3 -22 0.84836 1.70117 6 -2 3 -22 4.91072 2.36770 11 -2 -3 -23 7.48496 2.54883 4 -2 -3 -23 0.74483 1.49644 9 -2 3 -23 3.51098 2.03433 6 -2 -3 -23 1.41515 1.53533 6 -2 3 -23 4.16098 2.15615 4 -2 3 -23 3.57481 1.94328 11 -2 3 -24 0.86328 1.86970 4 -2 -3 -24 0.86204 1.57798 4 -2 -3 -24 0.73529 1.47448 6 -2 3 -24 0.90657 1.65948 6 -2 3 -25 2.67929 2.06864 4 -2 -3 -25 6.24260 2.63266 4 -2 -3 -25-0.76754 1.66348 6 -2 3 -25 4.67693 2.29779 6 -2 3 -26 0.92438 2.00183 4 -2 -3 -26-0.92088 1.84632 4 -2 -3 -26 1.61345 2.28738 6 -2 3 -26 0.96282 1.76221 6 -2 -4 27 0.88302 1.91228 13 -2 4 27-0.91121 2.10957 7 -2 -4 26 7.66574 2.70678 13 -2 4 26 3.55566 2.42060 7 -2 -4 25-0.82106 2.01633 13 -2 4 25-0.86408 1.58173 7 -2 4 24 2.51910 1.82249 7 -2 -4 24 4.72471 2.14113 13 -2 -4 23 0.76176 1.87051 13 -2 4 23-0.81710 1.63823 7 -2 -4 22 2.94497 2.08750 13 -2 4 22-0.79161 1.71426 7 -2 4 21 6.13041 2.35132 7 -2 -4 21 2.85256 1.85155 13 -2 -4 20 8.95051 2.40193 13 -2 4 20 4.44528 2.19852 7 -2 -4 19 4.63791 2.03121 13 -2 4 19 1.43258 1.55392 7 -2 -4 18 1.90655 1.37750 13 -2 4 18 1.38105 1.49652 7 -2 -4 17 7.91189 2.24831 13 -2 4 17 9.33077 2.45839 7 -2 -4 16 2.59432 1.76482 8 2 -4 -16 3.61604 1.36171 5 -2 4 16 3.85058 1.66549 7 -2 -4 15 0.62596 1.02469 8 2 -4 -15-0.69045 0.84770 5 -2 4 15 1.85805 1.60307 7 -2 4 14 13.7523 2.67439 7 -2 -4 14 25.0753 3.49622 8 2 4 -14 14.5979 2.48237 14 2 4 -14 25.8202 3.47205 8 2 -4 -14 19.5135 2.34576 5 -2 4 14 20.7122 2.86668 3 -2 -4 13 12.5232 2.51795 8 2 -4 -13 9.81012 1.66200 5 2 4 -13 8.16661 2.21622 8 2 4 -13 8.29803 1.92968 14 -2 4 13 12.8145 2.27975 3 -2 -4 13 10.8913 2.13555 3 -2 4 13 18.4474 2.93360 7 -2 4 12 39.5670 4.24238 7 -2 -4 12 48.8278 4.84393 8 2 4 -12 42.0880 4.30150 8 -2 4 12 42.4264 3.98391 3 -2 -4 12 35.6666 3.68329 3 2 -4 -12 43.9197 3.42351 5 2 4 -12 48.0215 3.97276 10 -2 -4 12 42.1051 3.52434 6 2 4 -12 36.2846 3.67272 14 -2 -4 11 1.90867 0.97982 6 2 4 -11 2.03655 1.32194 8 -2 -4 11 3.91145 1.71446 8 -2 -4 11 3.64806 1.20077 3 2 4 -11 6.35330 1.56219 14 2 -4 -11 4.63687 1.11748 5 -2 4 11 3.66918 1.25292 3 -2 4 11 2.71666 1.47865 7 2 4 -11 1.14872 0.89260 10 -2 -4 10 101.530 7.28840 8 -2 4 10 112.537 6.76250 3 2 4 -10 105.706 7.20246 8 -2 -4 10 113.178 6.76495 3 2 -4 -10 114.006 6.15720 5 -2 4 10 119.114 7.69168 7 2 4 -10 114.479 6.78196 10 2 4 -10 108.628 6.66319 14 -2 -4 10 112.616 6.31722 6 -2 -4 9 87.4594 6.44915 8 -2 4 9 97.1620 5.93138 3 -2 -4 9 84.3152 5.61888 3 2 4 -9 96.1340 6.59546 8 2 4 -9 94.1319 5.88476 10 -2 4 9 98.1777 6.78897 7 -2 -4 9 92.7163 5.50227 6 2 4 -9 86.8031 5.71026 14 -2 -4 8 0.58844 0.68115 6 -2 -4 8 0.50039 1.00325 8 -2 4 8-0.34194 0.74050 3 2 4 -8-0.93586 1.01333 8 -2 4 8 0.61036 0.43554 11 -2 4 8-0.98809 1.21313 7 2 -4 -8 0.40274 0.87217 7 2 4 -8-0.33717 0.67600 14 -2 -4 8-0.33801 0.82998 3 2 4 -8 0.35534 0.71243 10 -2 -4 7 43.5071 3.51321 3 -2 -4 7 42.7836 4.14687 8 2 4 -7 58.7462 4.67935 8 2 4 -7 45.8987 3.71617 10 2 4 -7 45.4246 3.59831 14 -2 4 7 46.3123 4.24816 7 -2 4 7 35.7287 2.53230 11 2 -4 -7 56.3770 4.26390 7 -2 -4 7 46.1296 3.95057 10 -2 4 7 48.2226 3.69150 3 -2 4 6 241.404 12.2771 3 -2 -4 6 297.940 12.7058 3 -2 -4 6 278.563 13.8286 8 2 4 -6 277.949 13.5672 8 2 4 -6 282.297 12.5633 14 -2 4 6 292.640 11.6390 11 2 -4 -6 286.297 13.2458 7 -2 -4 6 298.982 13.4898 10 2 4 -6 272.792 12.7677 10 -2 -4 5 348.390 16.0454 8 2 4 -5 350.933 15.7272 8 2 4 -5 344.146 14.5701 14 -2 4 5 324.864 13.8602 11 -2 -4 5 327.710 15.3757 10 2 -4 -5 351.357 15.3699 7 2 4 -5 346.408 15.0713 10 2 -4 -4 849.796 34.0704 7 -2 -4 4 790.816 34.5572 8 2 4 -4 851.285 34.3989 8 2 4 -4 897.739 33.3005 14 -2 4 4 889.066 32.9478 11 -2 4 4 862.937 33.2074 2 -2 -4 4 867.448 33.0626 2 -2 -4 4 899.287 34.5365 10 -2 4 3 21.1281 2.26889 2 2 -4 -3 21.6919 2.14784 3 2 4 -3 20.4926 2.05473 3 2 -4 -3 21.3706 2.64157 7 -2 4 3 24.6813 2.28046 11 -2 -4 3 20.5759 2.18460 2 -2 -4 3 28.0602 3.03700 10 -2 -4 3 20.8216 2.75315 8 2 4 -3 21.8367 2.80030 8 2 4 -3 22.6794 2.27226 14 2 -4 -2 1947.72 69.8018 3 2 4 -2 1771.07 70.1265 1 2 4 -2 1895.96 69.6723 3 -2 -4 2 1959.74 71.8279 8 -2 4 2 1914.91 70.0018 2 2 4 -2 1919.63 71.3291 8 2 -4 -2 1908.25 71.1391 7 2 -4 -2 1971.69 70.2288 1 -2 4 2 1905.61 70.1907 11 -2 -4 2 1837.24 71.3040 10 -2 -4 2 1885.29 69.8098 2 2 4 -2 1923.21 69.8821 14 -2 -4 2 1931.69 69.0434 12 2 -4 -1 340.229 13.8915 3 2 4 -1 326.255 13.7299 3 -2 -4 1 334.775 15.4421 8 2 4 -1 299.324 14.8028 8 2 -4 -1 345.930 15.0231 7 -2 4 1 341.970 14.4148 11 -2 -4 1 330.684 13.2862 12 -2 -4 1 339.009 15.2458 10 2 -4 -1 334.646 14.0327 1 2 4 -1 320.246 13.9264 1 2 -4 0 2.13537 0.69187 1 -2 -4 0 1.30601 1.06960 8 2 -4 0 0.84010 0.72576 8 -2 -4 0 0.37040 0.50412 12 2 4 0 1.04150 0.70779 1 -2 4 0 1.27073 0.82310 11 -2 -4 0 1.21729 0.87947 10 -2 -4 -1 64.8496 4.94100 8 2 -4 1 71.3467 4.32356 8 -2 -4 -1 59.4200 3.71956 12 2 -4 1 59.1423 3.86745 2 -2 4 -1 66.6228 4.58058 11 2 -4 1 62.7587 3.93897 4 2 4 1 58.8469 3.85254 4 2 4 1 63.3209 3.94478 2 -2 -4 -1 74.0363 5.13263 10 2 -4 2 56.2453 3.77619 8 -2 -4 -2 51.8919 4.42738 8 -2 -4 -2 49.5150 4.35086 10 -2 -4 -2 56.5359 3.64428 12 -2 4 -2 62.4875 4.43693 11 2 4 2 50.1083 3.48946 4 2 -4 2 48.3026 3.50549 2 2 -4 2 67.8863 3.89708 4 2 4 2 53.3293 3.59957 2 -2 -4 -2 50.8200 3.07969 14 2 4 2 56.4335 4.24973 9 2 4 3 21.4459 2.55829 9 -2 4 -3 21.1602 2.34979 1 -2 -4 -3 26.4284 2.53378 1 2 -4 3 20.2738 2.13048 8 -2 -4 -3 23.7725 1.76146 14 -2 -4 -3 18.3551 2.61934 8 -2 4 -3 22.9815 2.69715 11 2 -4 3 24.6101 2.25724 4 2 4 3 25.0184 2.26435 4 2 4 3 20.2234 2.12837 2 2 -4 3 15.7774 1.97191 2 2 4 4 70.4223 4.99746 9 2 -4 4 61.5524 4.12459 8 -2 -4 -4 61.4136 4.98131 8 -2 -4 -4 69.1941 3.52901 14 -2 -4 -4 69.6527 4.16401 7 2 -4 4 70.9087 3.31599 10 2 -4 4 79.7781 4.49690 4 2 4 4 63.1018 4.12662 4 -2 4 -4 70.6742 4.67382 1 -2 -4 -4 65.2088 4.53734 1 -2 4 -4 63.8630 4.92325 11 2 4 5 514.183 22.3754 9 2 -4 5 526.385 21.4215 8 -2 -4 -5 534.025 22.0855 5 -2 4 -5 540.363 21.4068 8 -2 -4 -5 561.993 23.1896 8 -2 -4 -5 539.351 21.1615 7 -2 4 -5 536.588 22.8728 11 -2 -4 -5 527.389 20.2983 14 -2 4 -5 553.281 22.3202 1 -2 -4 -5 554.500 22.2517 1 2 -4 5 553.263 22.7636 6 2 4 6 74.5055 5.27841 9 2 -4 6 79.1892 4.69913 8 -2 4 -6 72.1896 4.58050 8 -2 -4 -6 77.6333 5.14364 5 2 -4 6 75.8794 5.23171 12 -2 -4 -6 74.0995 4.35896 7 -2 4 -6 77.3128 5.59939 11 -2 4 -6 76.8079 5.28612 1 2 -4 6 74.2145 5.51319 14 -2 -4 -6 82.8644 5.41657 1 2 -4 6 74.5696 5.40373 6 2 4 7 61.2726 4.64392 9 2 -4 7 53.1335 3.80535 8 -2 4 -7 60.1457 4.00599 8 -2 -4 -7 68.7548 4.67173 5 2 -4 7 60.2170 4.81843 14 -2 -4 -7 53.2150 3.58498 7 -2 -4 -7 48.7763 4.07213 4 -2 4 -7 65.9062 5.11160 11 -2 4 -7 56.1547 4.68698 1 -2 -4 -7 50.7913 4.47794 1 2 -4 7 63.4278 4.57696 12 2 -4 7 62.5840 4.79054 6 2 4 8 26.8143 2.94804 9 2 -4 8 23.3615 2.39285 8 -2 4 -8 22.4517 2.32764 8 -2 4 -8 27.8814 2.94053 4 2 -4 8 22.2200 2.62035 12 2 -4 8 27.3509 3.13632 14 -2 -4 -8 23.4353 2.69007 4 -2 -4 -8 19.2580 2.52491 5 -2 4 -8 26.3969 3.18674 11 2 -4 8 23.0448 2.83387 6 2 4 9 25.7443 2.96656 9 2 -4 9 25.4703 2.49074 8 2 -4 9 20.6111 2.73654 6 2 -4 9 30.1706 3.27307 14 2 -4 9 24.1098 2.70122 12 -2 -4 -9 17.1877 2.45196 5 -2 4 -9 19.8910 2.85548 11 -2 4 -9 22.7938 2.79182 4 -2 -4 -9 23.8931 2.87707 4 2 4 10 1.77258 1.14700 9 2 -4 10-0.45006 0.97462 6 2 -4 10 1.37601 1.18718 14 2 -4 10 0.31521 0.63197 8 -2 -4 -10-0.41819 0.90562 5 2 -4 10 0.75213 0.75398 12 -2 4 -10-1.05946 1.14715 11 -2 4 -10 0.44162 0.95634 4 -2 -4 -10 0.43787 0.80141 4 -2 -4 -11 8.72433 1.88387 5 2 -4 11 5.55204 1.59531 6 2 -4 11 10.3997 2.07334 14 2 -4 11 13.4009 1.90106 8 2 -4 11 9.59855 1.83467 12 -2 4 -11 11.5675 2.32209 11 -2 4 -11 5.61052 1.69986 4 -2 -4 -11 13.8890 2.23365 4 -2 4 -12 2.28010 1.47567 11 2 -4 12 0.47891 1.17630 6 2 -4 12 0.97757 1.05885 14 -2 -4 -12 0.45538 0.91343 5 -2 4 -12 0.98744 1.06953 4 -2 -4 -12 0.48993 0.89711 4 2 -4 13 2.41426 1.31395 6 -2 -4 -13 2.37447 1.29240 5 -2 4 -13 4.13443 1.74543 11 -2 4 -13 3.64170 1.59588 4 -2 -4 -13 1.55645 1.20456 4 -2 -4 -14 0.49535 1.28213 5 -2 4 -14-0.60936 1.11526 11 -2 4 -14 0.54954 1.00577 4 -2 -4 -14-0.54822 1.00336 4 -2 -4 -15 7.75837 2.04029 5 -2 4 -15 4.41061 1.94018 11 -2 4 -15 6.35994 1.90366 4 -2 -4 -15 4.61867 1.77957 4 -2 4 -16 14.9693 2.84613 11 -2 4 -16 12.1948 2.57496 4 -2 -4 -16 7.86737 2.24985 4 -2 -4 -17-0.68206 1.24841 9 -2 4 -17-1.34178 1.73653 11 -2 4 -17 0.63798 1.38165 4 -2 -4 -17 0.63631 1.27582 4 -2 -4 -18 29.5605 4.15592 9 -2 4 -18 24.8817 3.88480 11 -2 4 -18 31.4885 4.15313 4 -2 -4 -18 28.0490 4.10444 4 -2 -4 -19 17.4117 3.42423 9 -2 4 -19 21.3198 3.64676 11 -2 4 -19 14.7205 3.26291 4 -2 -4 -19 23.0897 3.77052 4 -2 -4 -20 12.6969 2.87923 9 -2 4 -20 6.55296 2.24514 11 -2 4 -20 5.85856 2.17695 4 -2 -4 -20 6.56496 2.32709 4 -2 -4 -21-0.76753 1.53884 9 -2 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17-0.71699 1.31242 8 -2 5 17 2.24182 1.52159 3 -2 5 17 0.73548 1.34625 7 -2 -5 16 31.0092 4.25008 8 -2 5 16 23.9686 3.31310 3 -2 -5 16 32.3703 3.78143 3 -2 5 16 34.5209 4.56557 7 -2 5 15 3.54676 1.60802 3 -2 -5 15 3.47440 1.97172 8 2 -5 -15 2.75843 1.29243 5 -2 -5 15 2.02569 1.24588 3 -2 5 15 0.69572 1.14148 7 -2 5 14 42.8522 4.10511 3 -2 -5 14 31.5745 3.64478 3 -2 -5 14 40.9885 4.81707 8 2 -5 -14 34.0631 3.39752 5 -2 5 14 34.3848 4.35771 7 -2 -5 13 140.924 9.40399 8 -2 5 13 156.373 9.74710 7 -2 5 13 135.631 8.20375 3 -2 -5 13 138.705 8.21548 3 2 -5 -13 131.828 7.58116 5 2 5 -13 125.004 8.10213 14 -2 -5 12 93.9475 7.28621 8 -2 5 12 97.1258 6.31760 3 -2 -5 12 83.9731 5.96383 3 2 5 -12 95.9314 7.15350 8 2 -5 -12 93.7588 5.85811 5 2 5 -12 87.4547 6.26745 14 -2 5 12 85.3686 7.01803 7 -2 -5 11 72.9261 6.43884 8 -2 5 11 65.6349 5.20490 3 -2 -5 11 93.7451 5.81150 3 2 5 -11 93.8013 6.84513 8 2 -5 -11 80.0074 5.26139 5 2 5 -11 81.6516 5.78176 14 -2 5 11 73.1900 6.37305 7 2 5 -10-0.41923 0.84071 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3.37427 10 -3 -3 -1 43.7565 4.13535 10 3 -3 2 13.8045 1.17759 8 3 -3 2 15.5998 2.13291 2 3 -3 2 10.9898 2.25338 1 3 -3 2 12.9690 1.84661 6 3 3 2 9.82543 1.72487 2 3 3 2 10.7751 2.07668 1 -3 -3 -2 9.80725 1.44920 5 -3 -3 -2 15.7750 2.12552 8 -3 -3 -2 12.5522 1.80860 12 -3 3 -2 9.41015 1.80559 11 3 -3 2 10.8033 1.86325 11 3 -3 2 7.88532 1.63287 4 3 3 2 10.2888 1.79057 4 3 -3 2 12.3076 1.55990 10 -3 -3 -2 12.9993 2.30107 10 3 -3 3 13.1487 1.09570 8 3 -3 3 14.1304 2.01946 6 3 -3 3 12.7761 2.01230 2 3 3 3 13.7956 2.08825 2 -3 -3 -3 12.9542 1.73975 5 -3 -3 -3 9.77911 1.71325 8 -3 -3 -3 14.1897 1.96430 12 -3 -3 -3 11.7283 1.08105 7 -3 3 -3 8.64658 1.77871 11 3 -3 3 13.8943 2.13461 11 3 -3 3 17.0376 1.75290 10 3 -3 3 14.9922 2.10260 4 3 3 3 12.6727 1.97474 4 -3 -3 -3 18.9830 2.71169 10 3 -3 4 14.1886 1.11569 8 3 -3 4 9.66337 1.71477 6 -3 -3 -4 14.5658 2.38744 1 -3 -3 -4 11.0234 1.72127 5 3 -3 4 15.0667 2.14468 2 3 3 4 14.2157 2.13078 2 -3 -3 -4 14.7908 2.02765 12 -3 3 -4 11.6678 2.08710 11 3 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3.03667 1.76080 12 6 -1 10 0.77782 1.55968 12 6 -1 11 15.2583 3.33135 12 -6 1 -11 17.8109 4.05891 1 -6 -1 -11 13.6055 3.57367 1 -6 1 -12-1.05159 1.92499 1 -6 -1 -12-1.05554 2.11657 1 -6 1 -13 1.06857 2.31432 1 -6 -1 -13 1.06704 1.51318 1 -6 1 -14-1.08606 2.17777 1 -6 1 -15-1.10936 2.22424 1 -6 -1 -15 1.10848 2.22246 1 -6 -1 -16 6.79335 3.07501 1 -6 1 -16 1.13332 1.85760 1 -6 2 18 11.9682 3.30514 2 -6 -2 18 9.08697 2.99774 2 -6 2 17-0.90204 1.65093 2 -6 -2 17 0.89052 1.78541 2 -6 2 16 1.77516 2.05527 2 -6 -2 16 0.87869 1.76224 2 -6 2 15 0.87638 1.60534 2 -6 -2 15 3.46039 2.00386 2 -6 2 14 4.31317 2.23461 2 -6 -2 14 1.70855 1.56614 2 -6 2 13 0.85784 1.72014 2 -6 -2 13 0.84653 1.69748 2 -6 2 12 1.69278 1.69797 2 -6 -2 12 1.67175 1.93601 2 -6 -2 11-0.82475 1.35042 2 -6 2 10 2.46173 1.90165 2 -6 -2 10 2.42516 1.98686 2 -6 2 9-0.80865 1.75117 2 -6 -2 9 4.00633 2.27187 2 -6 2 8 6.41257 2.29437 2 -6 -2 8 13.4697 3.12606 2 -6 2 7 26.2127 4.22634 2 -6 -2 7 29.0307 4.41736 2 -6 2 6 8.66267 2.67037 2 -6 -2 6 6.21101 2.47485 2 -6 2 5 0.77467 1.55337 2 6 2 -3 6.40216 2.03379 12 6 2 -2 14.6124 2.79662 12 6 2 -1-0.59126 1.45197 12 6 2 0 36.5231 4.29720 12 -6 -2 0 30.2838 4.48728 10 6 2 1 52.2046 5.09220 12 6 -2 1 40.9962 5.15062 12 -6 -2 -1 39.8112 5.16602 10 6 2 2 10.4481 2.47657 12 6 -2 2 9.28537 2.84296 12 -6 -2 -2 3.18912 2.07813 10 6 2 3 2.49908 1.69611 12 6 -2 3 4.63513 2.27987 12 -6 -2 -3-0.79912 1.60223 10 6 2 4-1.29307 1.40049 12 6 -2 4-0.77293 1.55000 12 -6 -2 -4-0.79884 1.84964 10 6 2 5 45.9861 5.07182 12 6 -2 5 37.8695 4.99210 12 -6 -2 -5 52.6445 5.83562 10 6 -2 6 13.1257 3.01285 12 -6 -2 -6 18.3821 3.68193 10 6 -2 7 33.2286 4.56674 12 -6 -2 -7 20.8131 3.93046 10 6 -2 8 31.1383 4.52305 12 -6 -2 -8 24.9163 4.22491 10 6 -2 9 10.9445 2.86874 12 -6 -2 -9 3.23353 1.99536 10 6 -2 10-0.78506 1.57396 12 -6 -2 -10 0.81117 1.32788 10 6 -2 11 0.80080 1.60567 12 -6 2 -11-1.04207 2.08937 1 -6 -2 -11 3.15980 2.28099 1 -6 2 -12 1.05135 2.27676 1 -6 -2 -12 1.04954 2.10424 1 6 -2 12-0.82121 1.64647 12 -6 2 -13 1.06701 1.95287 1 -6 -2 -13-1.06480 1.94883 1 -6 2 -14-1.08429 2.51048 1 -6 -2 -14-1.08192 2.16946 1 -6 2 -15 2.20711 2.55598 1 -6 2 -16-2.25474 2.76917 1 -6 -2 -16-1.12243 1.83881 1 -6 3 19-0.85205 1.84542 7 -6 -3 19-0.91414 1.83302 2 -6 3 18-0.91424 2.24490 2 -6 -3 18 1.79339 1.94182 2 -6 -3 17-0.88410 1.77280 2 -6 3 17-0.89964 1.47304 2 -6 3 16 13.2669 3.50933 2 -6 -3 16 15.6656 3.59829 2 -6 3 15 0.87384 1.75279 2 -6 -3 15 2.57159 2.21935 2 -6 3 14 0.86054 1.72667 2 -6 -3 14 4.25799 2.51412 2 -6 3 13 0.85400 1.39857 2 -6 -3 13 1.68089 1.94609 2 -6 3 12-0.84452 1.54648 2 -6 -3 12-1.65633 1.91791 2 -6 -3 11 0.81318 1.48856 2 -6 3 10 0.81586 1.63616 2 -6 -3 10 1.60121 1.85384 2 -6 3 9 9.69773 2.89307 2 -6 -3 9 4.76022 2.35342 2 -6 3 8 5.58972 2.26893 2 -6 -3 8 3.13773 1.93181 2 -6 3 7 2.37217 1.83188 2 -6 -3 7 1.55355 1.79961 2 -6 3 6 6.25136 2.31514 2 -6 -3 6 5.35954 2.18052 2 -6 -3 2 1.69350 1.83464 10 -6 -3 1 2.53924 1.96155 10 -6 -3 0 20.3622 3.87142 10 6 3 1 2.31241 1.57011 12 -6 -3 -1 0.84894 1.20454 10 6 3 2 3.00174 1.47730 12 6 -3 2 2.42989 1.87759 12 -6 -3 -2 2.55049 1.97054 10 6 -3 3 1.61659 1.98476 12 -6 -3 -3-0.84976 1.55524 10 6 -3 4 13.7543 3.26857 12 -6 -3 -4 9.37431 2.81840 10 6 -3 5 15.3005 3.33542 12 -6 -3 -5 13.6587 3.39012 10 6 -3 6 20.0770 3.75493 12 -6 -3 -6 11.1478 3.10378 10 6 -3 7 10.4103 2.96315 12 -6 -3 -7 14.6638 3.41356 10 6 -3 8 16.8826 3.50747 12 -6 -3 -8 8.65605 2.86536 10 6 -3 9 0.80355 1.47067 12 -6 -3 -9-0.87011 1.74448 10 6 -3 10 4.83165 2.18951 12 -6 -3 -10 2.61863 1.75437 10 6 -3 11 3.22744 2.09181 12 -6 -3 -11 3.50896 2.03437 10 -6 -3 -12 1.06246 1.73926 1 6 -3 12 0.82059 1.77704 12 -6 -3 -12-0.88465 2.28976 10 -6 3 -12 1.05304 1.72383 1 -6 -3 -13 1.05872 1.94123 1 6 -3 13 5.03800 2.38363 12 -6 3 -13 5.31300 2.61183 1 -6 -3 -14 2.14852 2.32692 1 -6 3 -14 1.07753 1.76467 1 -6 3 -15 3.27281 2.53113 1 -6 -3 -15 6.54613 2.82886 1 -6 3 -16-1.11321 2.03750 1 -6 -3 -16 2.21533 2.02735 1 -6 4 18-0.90601 1.81674 2 -6 -4 18-0.88379 1.77219 2 -6 4 18-0.88775 1.78013 7 -6 4 17 0.89428 1.79321 2 -6 -4 17 0.87102 1.74658 2 -6 4 16-0.88066 1.76591 2 -6 -4 16 5.16158 2.22686 2 -6 4 15 0.86706 1.41940 2 -6 -4 15-0.85203 1.70825 2 -6 4 14-0.86053 1.72553 2 -6 -4 14-0.84021 1.68481 2 -6 4 13 6.80457 2.61286 2 -6 -4 13 4.96910 2.25744 2 -6 4 12 10.0302 2.84594 2 -6 -4 12 11.3776 3.07153 2 -6 4 11 2.45492 2.00986 2 -6 -4 11 0.79913 1.60282 2 -6 4 10 11.3389 3.14353 2 -6 -4 10 15.0332 3.39667 2 -6 4 9 3.99677 2.27602 2 -6 -4 9 8.58083 2.71689 2 -6 4 8 4.74974 2.24461 2 -6 -4 8-0.77200 1.78733 2 -6 4 7 3.90605 1.92404 2 -6 -4 7 4.55774 2.06749 2 -6 -4 3-0.89115 1.78694 10 -6 -4 2 2.67660 1.93441 10 -6 -4 1 0.89510 1.63853 10 -6 -4 0 4.49656 2.33314 10 -6 -4 -1 2.69799 2.08419 10 -6 -4 -2 4.49906 2.33444 10 6 -4 3-0.84333 1.82626 12 -6 -4 -3 0.90376 1.47945 10 6 -4 4 4.20176 1.95040 12 -6 -4 -4 3.62001 1.96471 10 6 -4 5-0.83987 1.68413 12 -6 -4 -5-0.91108 1.82688 10 6 -4 6 0.83376 1.80579 12 -6 -4 -6 0.91581 1.67640 10 6 -4 7 5.81421 2.45944 12 -6 -4 -7 5.52499 2.50780 10 6 -4 8 10.7489 2.88916 12 -6 -4 -8 7.41491 2.85666 10 6 -4 9 18.1205 3.63121 12 -6 -4 -9 20.4170 4.07624 10 6 -4 10 0.82557 1.65518 12 -6 -4 -10-0.93577 1.71266 10 6 -4 11 0.82484 1.51036 12 -6 -4 -11-1.88781 2.18569 10 6 -4 12-0.82289 2.02081 12 6 -4 13 3.34813 2.05721 12 -6 4 -13 2.11514 2.44992 1 -6 -4 -13 1.89779 2.05675 10 -6 4 -14-1.06679 2.13881 1 6 -4 14 1.70640 2.09503 12 -6 -4 -14 2.14645 2.32411 1 -6 -4 -14-0.95580 1.91628 10 -6 5 16 5.39429 2.66008 7 -6 -5 4 2.80142 2.29509 10 -6 -5 3-0.93667 1.71462 10 -6 -5 2 1.87864 1.88441 10 -6 -5 1 1.88989 1.73074 10 -6 -5 0 1.89210 1.89791 10 -6 -5 -1 0.94752 1.55143 10 -6 -5 -2 6.66771 2.59655 10 -6 -5 -3-0.95458 1.74740 10 6 -5 4 1.73888 2.01283 12 -6 -5 -4-0.96103 1.92680 10 6 -5 5 0.86528 1.87443 12 -6 -5 -5 1.93285 1.93820 10 6 -5 6-0.86265 1.72983 12 -6 -5 -6-0.97237 1.59209 10 6 -5 7 12.7989 3.25453 12 -6 -5 -7 24.4009 4.55763 10 6 -5 8 26.2758 4.35611 12 -6 -5 -8 20.6019 4.25382 10 6 -5 9 3.37391 2.29448 12 -6 -5 -9 4.94769 2.29557 10 6 -5 10 1.67597 1.94107 12 -6 -5 -10 1.99679 2.00273 10 6 -5 11 11.7234 3.16466 12 -6 -5 -11 9.99879 3.39647 10 6 -5 12 7.50997 2.75411 12 -6 -5 -12 14.0540 3.69106 10 -6 -6 5 0.96985 1.94476 10 -6 -6 4 3.89524 2.25864 10 -6 -6 3 1.95939 1.79439 10 -6 -6 2 0.98670 1.97854 10 -6 -6 1 2.96669 1.98542 10 -6 -6 0-0.99183 1.81560 10 -6 -6 -1-0.99748 1.82595 10 -6 -6 -2 3.00097 2.16884 10 -6 -6 -3 2.01533 1.84562 10 6 -6 4-0.89570 2.07361 12 -6 -6 -4 1.01393 2.03283 10 6 -6 5-0.88909 1.78285 12 -6 -6 -5-1.02049 1.67088 10 6 -6 6-0.88458 2.17207 12 -6 -6 -6 1.02810 2.06123 10 6 -6 7 2.62176 2.26425 12 -6 -6 -7 3.09597 2.23711 10 6 -6 8 2.59830 2.24473 12 -6 -6 -8 4.15483 2.55317 10 6 -6 9 3.42847 2.32772 12 -6 -6 -9 1.04840 1.71752 10 6 -6 10 0.84930 1.84008 12 -6 -6 -10 3.15030 2.57914 10 -6 -7 6-0.99888 2.00295 10 -6 -7 5 1.00507 1.83984 10 -6 -7 4-1.01304 2.03136 10 -6 -7 3 1.02085 1.86872 10 -6 -7 2-1.02715 1.68183 10 -6 -7 1-1.03139 1.88802 10 -6 -7 0 1.03591 1.69617 10 -6 -7 -1 3.12570 2.41459 10 -6 -7 -2 1.04712 1.91681 10 -6 -7 -3 1.05771 2.12093 10 6 -7 4 0.91705 1.83865 12 -6 -7 -4-1.06366 2.13258 10 6 -7 5 1.82058 2.10851 12 -6 -7 -5 2.14392 2.32241 10 6 -7 6 0.89904 2.08162 12 -6 -7 -6 1.07585 2.33004 10 -7 0 16-2.01341 2.33166 2 -7 0 15-0.99543 1.99605 2 -7 0 13 2.89565 2.37229 2 -7 0 12-0.95766 1.92031 2 -7 0 11-0.94910 2.05558 2 -7 0 10 2.81723 2.03605 2 -7 0 9 14.9051 3.61518 2 -7 0 8 0.92105 1.99483 2 -7 0 7 1.81715 1.82274 2 7 0 -5 8.59615 2.80467 12 7 0 -4-0.78178 1.56764 12 7 0 -3 7.03930 2.40830 12 7 0 -2 0.78314 1.69615 12 7 0 -1 29.7687 4.47500 12 7 0 0-0.78208 1.56823 12 7 0 1 0.78729 1.70513 12 7 0 2-0.78795 1.57999 12 7 0 3 0.79164 1.58740 12 7 0 4-1.59466 1.95864 12 7 0 5 0.80059 1.60535 12 7 0 6-0.80373 1.74074 12 7 0 7 0.81470 1.63364 12 7 0 8-0.83652 1.81176 12 7 0 9-0.85842 1.57138 12 -7 1 16 2.01500 2.18359 2 -7 -1 16 3.00306 2.16957 2 -7 1 15 4.98530 2.45459 2 -7 -1 15 4.95432 2.57070 2 -7 1 14-0.98090 2.12421 2 -7 -1 14 0.97569 1.95620 2 -7 1 13 2.89778 2.23783 2 -7 -1 13 1.92012 2.35899 2 -7 1 12 0.95916 1.92306 2 -7 -1 12-0.95333 1.74482 2 -7 1 11 0.94974 2.05696 2 -7 -1 11 0.94392 1.89276 2 -7 1 10 1.87939 2.17589 2 -7 -1 10 0.93498 1.53118 2 -7 1 9 0.93216 1.86917 2 -7 -1 9 0.92761 1.69805 2 -7 1 8 0.92158 1.68700 2 -7 -1 8 0.91712 1.50166 2 -7 1 7 11.8269 3.18690 2 7 1 -4-0.72962 1.88865 12 7 1 -3 14.6162 3.09682 12 7 -1 -3 15.8175 3.58101 12 7 1 -2 4.38032 2.16632 12 7 -1 -2 9.99057 2.89992 12 7 1 -1 2.19071 1.98289 12 7 -1 -1 0.83132 1.52222 12 7 1 0 0.73412 1.59028 12 7 -1 0 1.66498 1.80324 12 7 1 1 28.8142 4.27111 12 7 -1 1 19.1408 3.82209 12 7 1 2 0.74425 1.72320 12 7 -1 2 0.82985 1.51905 12 7 1 3 0.75297 1.51046 12 7 -1 3 2.48217 1.91610 12 7 1 4 9.09254 2.65423 12 7 -1 4 10.7884 2.98126 12 7 1 5 0.76966 1.89010 12 7 -1 5 0.83306 1.52494 12 7 1 6-0.79133 1.58658 12 7 -1 6 1.67383 1.67798 12 7 1 7 0.81358 1.76184 12 7 -1 7-0.83866 1.68144 12 7 -1 8-0.84370 1.82731 12 7 -1 9-0.86089 1.86454 12 7 -1 10 0.88038 1.76534 12 -7 2 15 0.99327 1.99171 2 -7 -2 15 0.98170 1.96851 2 -7 2 14 1.95701 2.26581 2 -7 -2 14 0.96356 1.93246 2 -7 2 13 0.96503 2.09044 2 -7 -2 13 2.86171 2.34286 2 -7 2 12 2.86807 2.07052 2 -7 -2 12-1.89421 2.19281 2 -7 2 11-0.94642 1.73215 2 -7 -2 11 0.93585 2.02661 2 -7 2 10 2.81392 2.17528 2 -7 -2 10 4.63861 2.40468 2 -7 2 9 1.85986 2.01381 2 -7 -2 9-0.91980 1.68344 2 -7 2 8 0.91637 1.83751 2 -7 -2 8 0.90666 1.65970 2 7 -2 -1-0.87719 1.89983 12 7 -2 0 3.49810 2.02836 12 7 2 1 2.08998 1.97528 12 7 -2 1-0.87420 1.75268 12 7 2 2 11.9891 2.90495 12 7 -2 2 6.98701 2.69497 12 7 2 3 0.72363 1.32438 12 7 -2 3-1.74248 1.88670 12 -7 -2 -3 0.89967 1.94826 10 7 2 4 0.74488 1.49342 12 7 -2 4-0.86748 1.73921 12 -7 -2 -4-0.89951 1.94792 10 7 -2 5 2.59650 2.00587 12 -7 -2 -5 2.69681 1.94894 10 7 -2 6 1.73502 1.73977 12 -7 -2 -6 0.89952 1.64685 10 7 -2 7 2.61036 1.88477 12 -7 -2 -7-1.80106 2.21165 10 7 -2 8 2.61186 2.01765 12 7 -2 9 0.87114 1.74681 12 7 -2 10 0.87970 1.61034 12 7 -2 11 0.89997 2.08371 12 -7 3 14-0.96792 1.94058 2 -7 -3 14 1.90519 2.33909 2 -7 3 13 0.96055 1.92691 2 -7 -3 13 2.83034 2.04411 2 -7 3 12 11.4155 3.12713 2 -7 -3 12 5.60195 2.55003 2 -7 3 11-0.94054 2.03677 2 -7 -3 11 2.77346 2.14024 2 -7 3 10 0.93222 1.70647 2 -7 -3 10 0.91621 1.67717 2 -7 3 9 0.92054 1.68509 2 -7 -3 9 0.90503 1.96014 2 -7 3 8 3.63149 2.23298 2 7 -3 0 10.9734 3.11044 12 7 -3 1 0.91038 1.66919 12 -7 -3 -1 9.53336 3.12280 10 7 -3 2 0.90887 1.82222 12 -7 -3 -2-0.95456 2.06716 10 7 -3 3 6.34770 2.57411 12 -7 -3 -3 1.91091 1.91958 10 7 -3 4 0.90255 1.65219 12 -7 -3 -4 0.95648 1.75087 10 7 -3 5 4.49048 2.20924 12 -7 -3 -5 2.87972 2.36075 10 7 -3 6 13.4206 3.36404 12 -7 -3 -6 2.87994 2.49575 10 7 -3 7 0.89461 1.79405 12 -7 -3 -7-1.91763 2.22007 10 7 -3 8 0.89580 1.79629 12 -7 -3 -8 0.95954 1.92405 10 7 -3 9-0.89408 1.79253 12 -7 -3 -9 0.96098 1.57312 10 7 -3 10 10.7172 3.29112 12 -7 4 12 5.63219 2.54837 2 -7 -4 12-0.91674 1.83816 2 -7 4 11 2.79072 2.01689 2 -7 4 10 0.92078 1.84607 2 -7 -4 10-0.89669 1.79777 2 -7 -4 1 1.00091 2.00702 10 -7 -4 0 3.00845 2.46470 10 7 -4 1 0.94854 1.90176 12 -7 -4 -1-1.00563 1.84054 10 7 -4 2 5.65960 2.67985 12 -7 -4 -2 4.02942 2.47934 10 7 -4 3 2.81924 2.30987 12 -7 -4 -3 3.03020 2.18980 10 7 -4 4 0.93643 1.87776 12 -7 -4 -4 1.01210 1.85267 10 7 -4 5 6.51541 2.76137 12 -7 -4 -5 10.1234 3.32645 10 7 -4 6 2.77221 2.26993 12 -7 -4 -6 1.01315 2.03226 10 7 -4 7 0.91844 1.99021 12 -7 -4 -7-3.04747 2.35278 10 7 -4 8-0.91686 1.83852 12 -7 -4 -8-1.01645 2.03816 10 -7 -5 2 1.04423 1.91152 10 -7 -5 1 1.04616 1.71296 10 -7 -5 0-1.05041 1.92282 10 -7 -5 -1 2.10645 1.92906 10 7 -5 2 2.93229 2.26534 12 -7 -5 -2 3.17721 2.87699 10 7 -5 3 2.91278 2.25171 12 -7 -5 -3 5.30288 3.01006 10 7 -5 4 0.96606 2.37278 12 -7 -5 -4 2.12356 2.29998 10 8 0 -3-0.86389 1.73228 12 8 0 -2-0.86059 1.99254 12 8 0 -1-0.85643 1.85487 12 8 0 0 1.72413 2.11766 12 8 -1 -5-0.91500 1.98173 12 8 -1 -4-0.91610 2.12107 12 8 -1 -3 2.74520 2.24904 12 8 -1 -2 5.47606 2.70040 12 8 -1 -1 0.91458 1.98082 12 0 0 0 0.00 0.00 0 TITL Jammu-A10 in P2(1)/n REM P2(1)/n (#14 in standard setting) CELL 0.71073 6.447763 9.247664 23.457212 90.0000 95.1144 90.0000 ZERR 26.00 0.000274 0.000417 0.000933 0.0000 0.0038 0.0000 LATT 1 SYMM -x+1/2, y+1/2,-z+1/2 SFAC C H N O UNIT 26.00 26.00 26.00 26.00 TREF HKLF 4 END ; _shelx_hkl_checksum 68969 _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 1.269 _oxdiff_exptl_absorpt_empirical_full_min 0.769