#------------------------------------------------------------------------------ #$Date: 2025-08-19 20:21:09 +0100 (Tue, 19 Aug 2025) $ #$Revision: 301810 $ #$URL: svn://www.crystallography.net/cod/cif/3/50/00/3500031.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_3500031 loop_ _publ_author_name 'Thierry Maris' _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. (2008). Acta Cryst. A64, 112-122. Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8. ; _publ_section_title ; 2,6-Dibromoaniline ; _journal_name_full 'Personal communication to COD' _journal_year 2016 _chemical_absolute_configuration ad _chemical_formula_moiety 'C6 H5 Br2 N' _chemical_formula_sum 'C6 H5 Br2 N' _chemical_formula_weight 250.93 _chemical_name_common 2,6-Dibromoaniline _chemical_name_systematic 'benzenamine, 2,6-dibromo-' _space_group_crystal_system orthorhombic _space_group_IT_number 19 _space_group_name_Hall 'P 2ac 2ab' _space_group_name_H-M_alt 'P 21 21 21' _symmetry_space_group_name_Hall 'P 2ac 2ab' _symmetry_space_group_name_H-M 'P 21 21 21' _atom_sites_solution_hydrogens difmap _audit_creation_date 2016-01-16 _audit_creation_method ; Olex2 1.2 (compiled 2015.09.30 svn.r3233 for OlexSys, GUI svn.r5103) ; _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 4.3237(2) _cell_length_b 10.1666(4) _cell_length_c 16.3253(6) _cell_measurement_reflns_used 9300 _cell_measurement_temperature 100 _cell_measurement_theta_max 60.615 _cell_measurement_theta_min 2.356 _cell_volume 717.62(5) _computing_cell_refinement 'SAINT (2013) V8.34A; Integration Software for Single Crystal Data. Bruker AXS Inc., Madison, WI 53719-1173.' _computing_data_collection ; APEX 2 (2013) Bruker AXS Inc., Madison, WI 53719-1173. ; _computing_data_reduction 'SAINT (2013) V8.34A; Integration Software for Single Crystal Data. Bruker AXS Inc., Madison, WI 53719-1173.' _computing_molecular_graphics 'Olex2 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 (Dolomanov et al., 2009)' _computing_structure_refinement 'XL (Sheldrick, 2008)' _computing_structure_solution 'XT (Sheldrick, 2015)' _diffrn_ambient_temperature 100 _diffrn_detector 'CMOS Area detector' _diffrn_detector_area_resol_mean 10.24 _diffrn_detector_type 'Bruker Photon 100 CMOS Detector' _diffrn_measured_fraction_theta_full 0.956 _diffrn_measured_fraction_theta_max 0.964 _diffrn_measurement_device 'k-geometry diffractometer' _diffrn_measurement_device_type 'Bruker Venture Metaljet' _diffrn_measurement_method '\w and \f scans' _diffrn_radiation_collimation 'Focusing mirrors' _diffrn_radiation_monochromator 'Helios MX Mirror Optics' _diffrn_radiation_probe x-ray _diffrn_radiation_type GaK\a _diffrn_radiation_wavelength 1.34139 _diffrn_reflns_av_R_equivalents 0.0368 _diffrn_reflns_av_unetI/netI 0.0280 _diffrn_reflns_Laue_measured_fraction_full 0.956 _diffrn_reflns_Laue_measured_fraction_max 0.964 _diffrn_reflns_limit_h_max 5 _diffrn_reflns_limit_h_min -5 _diffrn_reflns_limit_k_max 13 _diffrn_reflns_limit_k_min -12 _diffrn_reflns_limit_l_max 21 _diffrn_reflns_limit_l_min -21 _diffrn_reflns_number 9122 _diffrn_reflns_point_group_measured_fraction_full 0.962 _diffrn_reflns_point_group_measured_fraction_max 0.969 _diffrn_reflns_theta_full 53.594 _diffrn_reflns_theta_max 60.585 _diffrn_reflns_theta_min 4.457 _diffrn_source 'Metal Jet' _diffrn_source_target Ga _diffrn_source_type 'Gallium Liquid Metal Jet Source' _exptl_absorpt_coefficient_mu 9.388 _exptl_absorpt_correction_T_max 0.3108 _exptl_absorpt_correction_T_min 0.1225 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; SADABS-2014/5 (Bruker,2014/5) was used for absorption correction. wR2(int) was 0.1243 before and 0.0565 after correction. The Ratio of minimum to maximum transmission is 0.3941. The \l/2 correction factor is 0.00150. ; _exptl_crystal_colour 'clear light colourless' _exptl_crystal_colour_lustre clear _exptl_crystal_colour_modifier light _exptl_crystal_colour_primary colourless _exptl_crystal_density_diffrn 2.323 _exptl_crystal_description Blco _exptl_crystal_F_000 472 _exptl_crystal_size_max 0.19 _exptl_crystal_size_mid 0.1 _exptl_crystal_size_min 0.08 _exptl_special_details ; X-ray crystallographic data for I were collected from a single crystal sample, which was mounted on a loop fiber. Data were collected using a Bruker Venture diffractometer equipped with a Photon 100 CMOS Detector, a Helios MX optics and a Kappa goniometer. The crystal-to-detector distance was 4.0 cm, and the data collection was carried out in 1024 x 1024 pixel mode. ; _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. ; _refine_diff_density_max 0.872 _refine_diff_density_min -0.470 _refine_diff_density_rms 0.105 _refine_ls_abs_structure_details ; Flack x determined using 633 quotients [(I+)-(I-)]/[(I+)+(I-)] (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). ; _refine_ls_abs_structure_Flack 0.02(2) _refine_ls_extinction_coef . _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.150 _refine_ls_hydrogen_treatment refall _refine_ls_matrix_type full _refine_ls_number_parameters 102 _refine_ls_number_reflns 1599 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.150 _refine_ls_R_factor_all 0.0228 _refine_ls_R_factor_gt 0.0227 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0387P)^2^+0.2339P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0587 _refine_ls_wR_factor_ref 0.0590 _reflns_Friedel_coverage 0.660 _reflns_Friedel_fraction_full 0.972 _reflns_Friedel_fraction_max 0.977 _reflns_number_gt 1595 _reflns_number_total 1599 _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)' _cod_data_source_file NBR2PH.cif _cod_data_source_block nbr2ph _cod_depositor_comments ; The following automatic conversions were performed: '_diffrn_radiation_probe' value 'X-ray' changed to 'x-ray' according to the built-in table from CIF Core dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29. Automatic conversion script Id: cif_fix_values 4287 2015-11-16 14:04:37Z antanas ; _cod_database_code 3500031 _cod_database_fobs_code 3500031 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_max 0.520 _shelx_estimated_absorpt_t_min 0.269 _olex2_refinement_description ; ; _shelx_res_file ; nbr2ph.res created by SHELXL-2014/7 TITL nbr2ph_a.res in P2(1)2(1)2(1) REM Old TITL NBR2PH in P212121 #19 REM SHELXT solution in P2(1)2(1)2(1) REM R1 0.082, Rweak 0.016, Alpha 0.005, Orientation as input REM Flack x = 0.105 ( 0.019 ) from Parsons' quotients REM Formula found by SHELXT: C6 N Br2 CELL 1.34139 4.3237 10.1666 16.3253 90 90 90 ZERR 4 0.0002 0.0004 0.0006 0 0 0 LATT -1 SYMM 0.5-X,-Y,0.5+Z SYMM -X,0.5+Y,0.5-Z SYMM 0.5+X,0.5-Y,-Z SFAC C H Br N DISP Br -0.934 1.041 8191.512 DISP C 0.014 0.007 57.748 DISP H -0 0 0.648 DISP N 0.025 0.014 110.512 UNIT 24 20 8 4 EQIV $1 0.5+X,0.5-Y,1-Z L.S. 50 PLAN 5 SIZE 0.08 0.1 0.19 TEMP -273.15 HTAB N1 Br2 HTAB N1 N1_$1 HTAB N1 Br1 HTAB N1 Br2_$1 BOND $H LIST 4 fmap 2 MORE -1 CONF HTAB ACTA OMIT 0 6 4 REM REM REM WGHT 0.038700 0.233900 FVAR 0.95876 BR1 3 0.482693 0.302563 0.737677 11.00000 0.02896 0.02829 = 0.01638 0.00556 -0.00067 0.00118 BR2 3 0.611738 0.494551 0.412232 11.00000 0.02548 0.02544 = 0.01470 0.00162 0.00136 -0.00301 N1 4 0.704710 0.305092 0.558256 11.00000 0.02148 0.02060 = 0.01684 -0.00025 0.00034 0.00339 C1 1 0.519772 0.411541 0.577039 11.00000 0.01558 0.01924 = 0.01702 -0.00195 -0.00355 -0.00297 C2 1 0.383286 0.426963 0.655071 11.00000 0.01991 0.02088 = 0.01745 0.00203 -0.00119 -0.00302 C3 1 0.186713 0.530608 0.674113 11.00000 0.02069 0.02174 = 0.02047 -0.00501 0.00034 -0.00210 C4 1 0.114628 0.623505 0.614162 11.00000 0.01984 0.01899 = 0.02766 -0.00550 0.00068 0.00101 C5 1 0.240843 0.611565 0.536571 11.00000 0.02131 0.01737 = 0.02196 0.00080 -0.00314 -0.00020 C6 1 0.438834 0.506930 0.519428 11.00000 0.01845 0.01998 = 0.01724 -0.00007 -0.00030 -0.00155 H1A 2 0.808559 0.318181 0.521814 11.00000 0.04630 H1B 2 0.759164 0.260995 0.600332 11.00000 0.02481 H4 2 -0.007263 0.691517 0.624919 11.00000 0.04202 H3 2 0.104385 0.533091 0.734232 11.00000 0.01951 H5 2 0.193787 0.675777 0.490057 11.00000 0.02982 HKLF 4 REM nbr2ph_a.res in P2(1)2(1)2(1) REM R1 = 0.0227 for 1595 Fo > 4sig(Fo) and 0.0228 for all 1599 data REM 102 parameters refined using 0 restraints END WGHT 0.0388 0.2351 REM Instructions for potential hydrogen bonds HTAB N1 Br2 HTAB N1 N1_$1 HTAB N1 Br1 HTAB N1 Br2_$1 EQIV $2 -x+1/2, -y+1, z+1/2 HTAB C3 Br2_$2 REM Highest difference peak 0.872, deepest hole -0.470, 1-sigma level 0.105 Q1 1 0.2938 0.2993 0.7379 11.00000 0.05 0.87 Q2 1 0.6859 0.3096 0.7370 11.00000 0.05 0.84 Q3 1 0.4305 0.4937 0.4132 11.00000 0.05 0.64 Q4 1 0.8131 0.4899 0.4128 11.00000 0.05 0.63 Q5 1 0.5422 0.6213 0.3818 11.00000 0.05 0.30 ; _shelx_res_checksum 34053 _shelx_hkl_file ; 1 0 0 18.10 1.10 1 0 0 17.40 1.10 3 0 0 1.40 8.10 4 0 0 8.50 2.10 4 0 0 9.00 1.70 4 0 0 5.50 8.10 4 0 0 6.40 2.10 0 1 0 2.50 1.50 0 -1 0 2.40 1.50 1 1 0 407.06 19.50 1 -1 0 390.76 19.20 1 1 0 354.36 19.20 1 1 0 403.86 19.30 1 -1 0 437.36 19.50 2 1 0 483.95 23.00 2 1 0 451.95 23.20 2 1 0 470.85 23.30 2 1 0 445.06 23.10 2 1 0 464.65 23.10 2 1 0 482.75 23.60 2 -1 0 504.35 23.60 2 -1 0 446.26 23.20 3 1 0 1565.14 72.89 3 -1 0 1422.86 72.49 3 -1 0 1547.65 72.89 3 1 0 1543.35 73.49 3 -1 0 1423.86 92.59 3 -1 0 1673.93 73.49 3 1 0 1545.35 72.99 3 -1 0 1535.05 73.09 3 1 0 1401.86 95.39 4 -1 0 368.76 39.50 4 1 0 358.16 18.50 4 1 0 373.86 19.30 4 1 0 356.56 41.80 4 1 0 366.66 18.50 4 -1 0 346.87 17.90 4 -1 0 371.96 18.60 4 -1 0 352.36 18.70 5 1 0 213.08 12.40 5 1 0 217.08 12.70 5 1 0 232.58 43.20 2 2 0 1102.19 52.89 2 2 0 1130.29 52.49 2 -2 0 1064.99 52.59 2 -2 0 1087.49 52.39 2 2 0 1115.89 52.39 2 2 0 941.01 52.09 2 2 0 1163.08 52.49 2 2 0 1123.59 52.19 3 -2 0 485.75 41.90 3 2 0 540.75 25.40 3 2 0 457.65 45.90 3 2 0 564.34 26.30 3 -2 0 513.35 25.40 3 2 0 536.65 25.50 3 -2 0 534.05 25.10 3 2 0 509.85 25.40 3 -2 0 502.05 25.70 4 -2 0 5456.55 256.97 4 2 0 5369.26 292.87 4 2 0 5402.56 256.97 4 -2 0 5215.88 256.37 4 -2 0 5361.36 257.37 4 2 0 5546.94 256.97 5 -2 0 248.18 28.80 5 2 0 209.28 12.40 5 -2 0 227.88 13.30 5 2 0 240.68 34.00 5 -2 0 224.18 11.80 0 -3 0 3.30 0.80 0 3 0 2.20 0.70 -1 3 0 2567.04 119.69 1 3 0 2461.05 120.39 2 -3 0 16.60 1.80 2 3 0 18.50 1.80 2 3 0 17.00 2.50 2 3 0 20.30 1.80 3 -3 0 3871.41 189.48 3 3 0 4126.69 189.68 3 3 0 3695.03 217.38 3 -3 0 4097.49 210.78 3 -3 0 4112.29 190.08 3 3 0 3876.71 189.98 3 3 0 4112.69 193.68 4 -3 0 256.77 12.50 4 -3 0 240.38 13.20 4 -3 0 246.08 13.50 4 3 0 242.58 35.60 4 3 0 237.58 12.90 4 -3 0 253.57 29.70 4 3 0 251.37 13.00 4 3 0 231.48 14.00 5 3 0 5.00 2.60 5 -3 0 7.10 3.20 5 -3 0 5.40 7.00 5 3 0 9.80 11.30 -1 4 0 3516.95 163.98 1 4 0 3375.16 165.28 2 4 0 893.71 43.70 2 4 0 952.40 44.10 -2 4 0 862.21 43.80 2 4 0 939.01 43.90 2 -4 0 934.11 43.90 2 4 0 893.01 43.80 2 4 0 922.81 44.90 2 -4 0 850.41 43.60 3 4 0 2730.23 129.69 3 4 0 2406.26 156.88 3 4 0 2677.43 131.19 3 4 0 2658.13 130.19 3 4 0 2755.82 129.99 3 4 0 2749.72 129.99 3 -4 0 2793.42 130.69 3 -4 0 2891.91 150.18 3 -4 0 2805.12 130.19 3 4 0 2719.43 130.09 4 -4 0 874.41 42.70 4 4 0 858.31 72.19 4 -4 0 899.61 44.00 4 4 0 841.62 44.50 4 4 0 841.92 43.10 4 -4 0 992.60 63.99 4 4 0 877.21 43.10 5 -4 0 679.63 33.10 5 -4 0 722.53 49.20 5 4 0 617.14 33.50 5 4 0 729.23 57.99 5 -4 0 664.23 34.30 0 5 0 -5.20 1.30 0 5 0 -5.40 1.70 1 5 0 3489.65 168.28 2 5 0 73.69 4.40 2 5 0 72.79 4.40 2 5 0 73.19 4.70 2 -5 0 72.39 4.50 2 -5 0 70.09 4.20 2 5 0 68.09 6.10 3 -5 0 405.86 35.10 3 5 0 357.46 20.40 3 5 0 372.66 18.70 3 5 0 422.96 19.20 3 5 0 371.46 19.20 3 5 0 362.66 19.20 3 5 0 341.07 43.10 3 5 0 346.17 18.60 3 -5 0 368.76 19.00 3 -5 0 368.36 18.40 4 5 0 32.90 4.40 4 5 0 42.50 19.80 4 5 0 35.30 3.40 4 -5 0 36.90 13.80 4 -5 0 30.60 4.50 5 -5 0 581.24 41.40 5 5 0 555.84 29.60 5 -5 0 594.84 30.70 5 5 0 673.03 50.59 5 -5 0 597.84 29.10 1 -6 0 5414.16 240.78 1 6 0 4717.23 243.38 -2 6 0 766.82 38.30 2 6 0 807.02 38.50 2 -6 0 809.12 38.20 2 6 0 821.12 38.60 -2 -6 0 769.72 38.30 2 6 0 817.12 38.90 2 6 0 710.33 40.50 2 -6 0 835.32 38.70 3 -6 0 657.13 46.90 3 -6 0 619.54 31.40 3 -6 0 620.54 30.00 3 6 0 626.14 31.20 3 -6 0 647.74 30.80 3 6 0 589.64 32.50 3 6 0 646.74 30.40 3 6 0 539.95 53.39 3 6 0 595.14 30.80 3 6 0 614.84 30.50 4 6 0 360.56 20.70 4 6 0 462.95 26.50 4 6 0 384.56 20.00 4 6 0 383.16 41.80 4 -6 0 384.06 19.60 4 -6 0 400.96 21.30 4 -6 0 410.16 34.60 1 7 0 1088.09 58.69 1 -7 0 1176.38 56.09 1 7 0 1242.98 56.29 -1 7 0 1142.59 55.99 1 7 0 1162.38 56.09 -1 7 0 1117.39 55.99 1 7 0 1154.38 56.29 -1 -7 0 1154.38 55.89 1 -7 0 1236.88 55.89 2 7 0 76.49 8.80 2 -7 0 85.89 5.00 -2 -7 0 79.19 5.10 2 7 0 85.89 5.80 -2 7 0 81.29 5.30 2 7 0 100.49 5.40 2 -7 0 87.39 5.50 2 7 0 93.89 5.60 -3 -7 0 1971.40 98.59 3 7 0 1847.92 122.19 3 -7 0 2098.99 100.09 3 7 0 1989.50 101.49 3 7 0 2105.89 99.99 3 7 0 2106.29 99.19 3 7 0 2148.19 99.49 3 7 0 2076.19 98.89 3 -7 0 2205.68 98.49 4 7 0 41.40 3.60 4 -7 0 46.80 5.30 4 7 0 36.80 17.70 4 7 0 54.09 5.60 4 7 0 49.00 8.40 4 -7 0 38.70 3.20 0 8 0 77.99 7.70 0 8 0 80.99 4.80 0 -8 0 71.29 4.50 0 8 0 68.09 4.90 1 -8 0 512.55 25.30 -1 8 0 483.55 25.20 -1 -8 0 506.55 25.10 -1 8 0 493.65 25.20 1 8 0 501.15 25.60 1 8 0 516.95 28.30 1 8 0 526.65 25.40 1 -8 0 514.15 25.30 1 8 0 554.24 25.50 2 8 0 769.32 38.40 2 -8 0 775.52 38.10 2 8 0 829.22 38.10 2 8 0 697.13 40.80 2 -8 0 798.12 37.60 -2 8 0 766.02 37.90 2 8 0 804.92 38.10 3 8 0 787.72 38.40 3 8 0 806.72 39.30 3 8 0 783.32 41.00 3 8 0 773.52 38.10 3 -8 0 745.53 39.10 3 -8 0 777.92 37.60 3 8 0 765.72 38.50 4 -8 0 2106.19 100.49 4 8 0 2074.49 101.49 4 8 0 2111.09 100.89 4 -8 0 2132.19 101.99 0 9 0 17.60 2.60 -1 9 0 444.36 22.30 1 9 0 457.45 25.30 1 -9 0 432.86 22.20 -1 -9 0 445.86 22.10 1 9 0 438.96 22.60 1 -9 0 468.75 22.00 1 9 0 489.65 22.50 -1 9 0 398.56 22.30 2 9 0 252.77 13.80 2 9 0 262.87 16.90 -2 -9 0 248.28 13.10 2 -9 0 263.87 13.50 2 9 0 249.18 13.50 -2 9 0 245.58 13.30 2 -9 0 261.07 12.90 2 9 0 253.37 13.30 3 -9 0 631.14 32.70 3 -9 0 704.13 32.10 3 9 0 636.64 32.10 3 9 0 631.14 32.00 3 9 0 645.14 31.70 3 9 0 625.64 34.40 3 9 0 633.54 32.70 4 -9 0 241.58 13.20 4 -9 0 233.38 11.70 4 9 0 232.68 12.20 0 10 0 8556.04 408.96 1 -10 0 2.90 1.90 -1 10 0 3.80 4.90 -1 -10 0 2.40 1.90 -1 10 0 0.30 1.30 2 10 0 1483.75 74.59 2 -10 0 1527.75 73.79 2 10 0 1532.05 74.39 2 -10 0 1444.06 74.19 2 10 0 1725.43 80.29 3 10 0 264.37 14.00 3 10 0 246.88 17.00 3 -10 0 265.67 14.30 3 -10 0 264.57 13.00 3 10 0 258.87 13.40 0 11 0 7.90 5.60 1 -11 0 475.05 24.20 1 11 0 506.25 24.40 -1 11 0 482.55 24.30 -1 11 0 450.15 26.80 1 11 0 506.05 24.70 1 11 0 509.55 27.00 2 -11 0 35.30 3.50 -2 11 0 27.10 7.00 2 11 0 46.10 9.50 3 -11 0 207.88 11.50 3 11 0 207.68 11.30 0 12 0 65.99 9.90 1 12 0 676.63 35.90 -1 12 0 691.83 33.40 1 12 0 730.33 33.50 1 12 0 717.23 33.80 -1 12 0 617.24 35.90 1 -12 0 666.03 33.30 2 -12 0 2.60 2.10 2 12 0 5.00 2.60 2 12 0 4.00 1.90 0 13 0 0.70 1.40 0 0 -1 3.60 0.90 3 0 1 5595.84 275.37 3 0 -1 5868.71 301.67 3 0 -1 5926.31 275.47 4 0 1 4.60 2.10 4 0 -1 1.80 1.40 4 0 1 3.50 1.90 4 0 1 1.20 2.00 4 0 -1 3.80 1.80 4 0 -1 1.30 7.60 5 0 -1 1288.27 67.29 5 0 1 1456.55 66.89 0 1 -1 654.23 33.40 0 -1 1 653.13 33.40 0 -1 -1 653.93 33.10 2 1 -1 1800.12 88.89 2 -1 1 2060.89 89.39 2 -1 1 1729.93 88.89 2 1 -1 1866.71 89.39 2 1 1 1746.43 85.59 2 -1 -1 1843.52 85.69 3 -1 1 725.33 32.40 3 1 -1 665.13 32.50 3 1 -1 708.73 32.10 3 -1 1 647.94 31.80 3 -1 1 673.93 32.10 3 1 -1 613.24 53.69 3 -1 1 594.34 31.50 3 1 -1 706.03 31.90 3 1 -1 567.24 31.50 3 -1 1 623.64 49.70 3 1 1 624.64 33.70 3 1 1 620.14 52.99 3 1 1 715.23 33.90 3 1 1 708.43 34.00 3 -1 -1 763.42 34.50 3 -1 -1 728.13 34.20 3 1 1 738.23 34.50 3 -1 -1 665.43 33.60 3 -1 -1 746.33 34.00 3 -1 -1 657.03 52.69 4 1 -1 324.87 40.60 4 1 -1 353.86 17.10 4 -1 1 326.87 17.10 4 -1 1 315.47 17.10 4 1 -1 336.47 17.70 4 1 -1 281.57 17.20 4 1 -1 335.67 17.00 4 -1 1 330.97 16.40 4 -1 1 345.47 37.40 4 1 1 336.07 17.50 4 1 1 332.47 39.40 4 -1 -1 337.67 16.90 4 1 1 315.07 16.70 4 1 1 320.37 16.60 4 -1 -1 330.07 17.00 4 -1 -1 310.97 16.20 4 -1 -1 313.27 37.10 5 -1 1 679.93 35.40 5 -1 1 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380.66 20.10 5 -3 2 363.56 18.80 5 3 -2 353.96 19.40 5 -3 2 424.06 36.20 5 3 -2 394.66 45.30 5 -3 -2 360.66 20.30 5 -3 -2 371.76 19.30 5 -3 -2 409.26 35.50 5 3 2 421.76 41.20 0 4 2 115.49 6.90 0 4 -2 129.89 7.00 0 4 -2 121.79 6.90 0 -4 -2 132.09 6.80 0 -4 2 129.79 7.00 0 4 2 136.19 7.00 -1 4 2 8223.18 378.26 1 -4 2 7161.08 375.06 1 -4 -2 7245.38 379.56 -1 4 -2 8338.27 383.06 2 4 -2 412.96 20.20 2 -4 2 382.26 19.70 2 4 -2 412.16 20.00 2 4 -2 403.26 19.90 2 4 -2 420.96 21.40 2 -4 2 407.66 20.10 2 4 -2 398.26 20.10 2 -4 -2 493.65 21.40 2 -4 -2 410.56 21.10 2 4 2 428.56 21.30 2 4 2 412.76 21.20 2 4 2 431.46 21.60 -2 4 -2 435.26 21.10 2 4 2 434.56 22.10 2 4 2 421.86 21.20 3 4 -2 4892.01 226.08 3 4 -2 4899.61 225.58 3 4 -2 4227.48 259.07 3 4 -2 4774.72 227.38 3 -4 2 4949.00 225.88 3 -4 2 4693.93 225.88 3 -4 -2 4841.12 236.28 3 4 2 4502.15 214.88 3 4 2 4721.83 216.28 3 4 2 4299.87 215.38 3 -4 -2 4927.91 215.68 3 4 2 4506.05 215.28 3 -4 -2 4369.16 214.78 3 4 2 4113.59 239.08 3 4 2 4355.56 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238.88 12.20 2 -5 -2 238.18 12.00 2 5 2 240.88 12.60 2 5 2 237.18 13.30 3 5 -2 428.46 21.90 3 -5 2 487.35 49.90 3 5 -2 436.66 21.70 3 -5 2 436.26 21.40 3 5 -2 429.36 23.90 3 5 -2 393.06 50.59 3 5 -2 439.06 22.30 3 -5 2 442.36 22.50 3 5 2 425.16 21.10 3 5 2 395.66 41.30 3 5 2 420.36 21.60 3 -5 -2 434.76 21.90 3 5 2 438.86 21.50 3 5 2 422.66 22.40 3 -5 -2 395.46 22.90 3 -5 -2 474.65 38.10 3 5 2 393.36 21.70 3 -5 -2 424.16 20.80 4 5 -2 1382.86 103.49 4 5 -2 1323.57 68.59 4 -5 2 1591.94 89.59 4 -5 2 1413.36 68.09 4 5 -2 1432.76 68.69 4 5 -2 1361.96 70.69 4 -5 2 1438.56 69.79 4 5 2 1386.16 67.49 4 -5 -2 1446.46 68.09 4 -5 -2 1577.44 86.99 4 5 2 1211.08 67.79 4 -5 -2 1381.96 68.39 4 5 2 1390.76 92.69 4 -5 -2 1414.06 67.09 4 5 2 1377.66 68.89 5 -5 2 74.39 4.50 5 -5 2 81.59 8.10 5 5 -2 68.79 5.20 5 5 -2 86.69 20.80 5 -5 2 70.89 13.40 5 5 2 76.29 16.70 5 -5 -2 63.29 13.00 5 -5 -2 66.19 4.10 5 -5 -2 61.99 6.10 0 6 -2 94.39 5.10 0 -6 -2 90.99 4.90 0 -6 2 89.69 5.00 0 6 2 80.99 5.30 0 6 2 84.49 5.00 0 6 -2 84.19 5.10 1 6 -2 4373.26 235.58 1 -6 2 5274.97 232.88 -1 6 2 5040.80 233.18 1 6 2 4708.03 226.98 1 -6 -2 4909.41 224.88 -1 6 -2 4694.53 224.98 1 6 2 4608.14 225.18 2 -6 2 337.37 31.70 2 6 -2 325.47 23.60 2 6 -2 350.96 17.30 2 6 -2 376.56 17.60 2 -6 2 370.36 17.50 2 -6 2 354.06 16.90 -2 -6 -2 329.27 16.90 2 6 -2 326.37 17.20 -2 6 2 336.37 17.00 -2 6 2 314.87 17.20 2 -6 -2 346.07 16.60 -2 6 -2 326.97 16.30 2 6 2 309.37 16.40 2 6 2 322.57 18.10 2 -6 -2 326.37 16.20 2 6 2 326.87 16.90 -2 -6 2 329.17 16.40 2 6 2 328.17 16.50 3 -6 2 2754.32 139.29 3 6 -2 2689.33 140.69 3 -6 2 2909.81 138.59 3 -6 2 3072.39 158.38 3 6 -2 2913.61 138.69 3 6 -2 2880.81 138.09 3 -6 2 2860.31 137.69 3 6 -2 2996.40 138.19 3 6 -2 2913.61 138.49 3 -6 -2 2818.32 132.29 3 6 2 2828.32 132.69 3 6 2 2558.14 154.78 3 6 2 2717.23 132.79 3 -6 -2 2893.41 133.69 3 6 2 2696.03 133.49 3 6 2 2837.12 134.29 3 6 2 2841.52 133.19 4 6 -2 870.81 73.09 4 -6 2 896.71 46.30 4 -6 2 909.81 44.40 4 -6 2 925.91 61.69 4 6 -2 892.91 44.90 4 6 -2 1037.20 52.09 4 6 2 796.02 42.90 4 -6 -2 911.21 57.89 4 6 2 901.21 63.49 4 6 2 846.92 42.20 -4 -6 2 808.92 42.10 4 -6 -2 911.61 41.80 4 -6 -2 869.91 43.20 4 -6 -2 896.71 44.00 4 6 2 843.62 43.80 0 7 -2 4632.84 220.18 0 7 2 4526.65 219.88 1 7 -2 92.69 5.30 -1 7 2 74.79 5.00 1 -7 2 91.19 5.30 1 7 -2 85.19 5.10 -1 7 2 78.89 5.40 1 7 -2 82.09 5.40 1 7 -2 104.49 9.50 1 -7 -2 100.79 5.50 1 7 2 93.69 5.90 -1 7 -2 89.19 5.50 1 7 2 101.99 5.70 -1 7 -2 98.49 5.60 1 7 2 90.49 8.40 1 -7 -2 94.39 5.40 -1 -7 2 94.99 5.50 1 7 2 96.59 5.70 2 7 -2 496.85 32.10 2 7 -2 619.54 30.10 2 -7 2 611.94 28.60 2 7 -2 580.74 29.00 -2 7 2 582.24 28.80 2 -7 2 600.04 29.90 2 7 -2 617.34 29.00 -2 7 -2 564.24 28.70 2 7 2 573.64 30.90 2 7 2 577.04 28.90 -2 -7 2 576.94 28.70 2 -7 -2 596.74 28.90 2 7 2 580.94 28.90 2 7 2 616.84 29.70 2 -7 -2 604.44 28.50 3 7 -2 28.90 7.80 3 -7 2 28.10 2.70 3 -7 2 26.30 3.70 3 7 -2 19.80 21.10 3 7 -2 29.90 3.00 3 7 -2 31.20 4.40 3 7 -2 27.00 3.80 3 7 -2 23.60 3.60 3 7 2 29.20 6.00 3 -7 -2 30.20 3.70 3 -7 -2 20.00 2.40 -3 -7 2 24.90 3.10 3 7 2 23.60 4.60 3 7 2 27.90 5.50 3 7 2 22.00 3.70 3 7 2 21.70 2.60 4 -7 2 408.06 20.20 4 -7 2 422.56 22.30 4 -7 2 364.86 34.10 4 7 -2 425.36 42.60 4 7 -2 411.36 24.20 4 7 -2 426.66 20.70 4 -7 -2 429.66 21.60 4 7 2 421.26 22.00 4 -7 -2 434.06 23.00 4 7 2 423.16 24.20 4 7 2 491.15 24.90 0 8 -2 5949.60 285.37 -1 8 2 1759.72 87.69 1 8 -2 1817.82 88.09 -1 -8 -2 1700.03 87.39 1 8 -2 1797.92 87.79 -1 8 2 1773.62 87.89 1 -8 2 1967.50 87.59 1 8 -2 1798.22 90.59 1 8 -2 1949.70 87.89 1 -8 2 1905.61 87.89 1 -8 -2 1760.22 89.69 1 8 2 1916.51 89.99 1 8 2 1817.52 90.19 1 8 2 1826.72 91.99 1 -8 -2 2024.60 89.49 -1 8 -2 1791.42 89.69 -1 -8 2 1903.01 89.69 1 8 2 1941.01 89.99 2 8 -2 2230.48 104.29 -2 8 2 2083.49 104.09 2 -8 2 2223.58 104.39 2 8 -2 2219.18 104.29 2 8 -2 2145.29 104.49 2 8 -2 2116.09 107.69 2 -8 2 2195.48 103.79 2 8 2 2159.98 102.89 2 8 2 2209.28 103.39 -2 -8 2 2098.89 102.59 2 -8 -2 2073.89 102.89 2 -8 -2 2189.58 102.49 2 8 2 2094.99 104.89 2 8 2 2193.88 102.99 3 8 -2 797.32 37.10 3 8 -2 771.82 37.00 3 8 -2 779.02 37.40 3 -8 2 745.63 38.30 3 8 -2 642.94 58.39 3 8 -2 726.63 40.40 3 8 -2 814.62 37.90 3 -8 2 757.82 37.40 3 -8 2 744.43 36.50 3 -8 -2 789.02 36.50 3 8 2 758.12 37.10 3 8 2 771.12 37.50 3 -8 -2 760.72 37.80 -3 -8 2 731.63 36.60 3 8 2 750.92 38.90 3 8 2 739.13 38.30 3 8 2 747.53 36.80 3 8 2 719.03 37.30 4 8 -2 78.09 4.90 4 -8 2 70.29 4.40 4 8 -2 65.99 10.50 4 -8 2 77.59 6.80 4 8 -2 80.89 30.90 4 8 2 73.49 6.80 4 8 2 78.69 5.00 4 -8 -2 75.99 4.50 4 -8 -2 79.29 6.10 0 9 -2 1062.79 55.69 0 -9 -2 1113.09 53.19 0 9 -2 1158.98 53.49 0 -9 2 1153.78 53.29 0 9 2 1121.69 53.49 0 9 2 1006.10 55.29 0 9 2 1098.79 53.59 0 9 -2 1110.59 55.19 -1 9 2 449.76 22.40 1 -9 2 484.35 22.10 1 9 -2 438.06 22.60 1 9 -2 448.46 25.30 1 9 -2 423.46 22.40 -1 9 2 412.66 22.40 1 9 -2 469.35 22.40 1 -9 2 452.65 22.40 1 9 2 469.15 23.70 1 -9 -2 465.05 23.40 1 9 2 454.95 26.10 1 9 2 464.05 23.90 -1 -9 2 509.35 23.40 1 -9 -2 496.15 23.20 -1 9 -2 451.35 23.50 -2 9 2 32.80 4.00 2 9 -2 35.80 3.70 2 9 -2 35.40 3.90 2 -9 2 41.80 3.70 2 9 -2 34.80 3.20 2 -9 2 37.40 3.00 2 9 -2 39.70 8.40 2 9 2 33.20 3.50 -2 -9 2 32.90 3.20 2 9 2 36.10 3.20 -2 9 -2 29.90 3.50 2 -9 -2 39.60 3.50 2 9 2 32.40 7.50 2 -9 -2 37.00 2.90 2 9 2 33.90 4.00 3 9 -2 204.58 11.90 3 9 -2 203.88 14.90 3 9 -2 196.68 11.30 3 9 -2 202.98 11.20 3 -9 2 201.78 12.00 3 9 -2 205.68 10.90 3 9 2 206.78 11.30 3 9 2 203.28 14.70 3 9 2 216.18 12.10 3 9 2 223.38 13.00 3 9 2 227.38 13.50 3 -9 -2 207.78 12.30 3 9 2 223.28 12.40 4 -9 2 525.45 26.30 4 9 -2 511.35 25.30 4 -9 2 504.15 24.90 4 -9 -2 489.85 25.20 4 -9 -2 503.45 24.10 0 -10 -2 43.20 3.70 0 10 2 46.20 8.20 0 10 2 48.10 3.90 0 -10 2 49.30 3.70 0 10 -2 42.30 4.50 0 10 2 58.19 4.50 0 10 -2 49.00 3.90 0 10 -2 46.80 7.90 1 -10 2 406.06 19.90 1 10 -2 411.56 20.00 1 10 -2 413.96 20.30 -1 10 2 337.17 22.40 1 10 -2 406.36 22.90 -1 10 2 404.16 20.00 -1 10 2 381.86 20.10 1 10 2 410.66 20.80 1 -10 -2 402.36 20.60 1 10 2 424.26 23.30 1 -10 -2 428.76 20.30 1 10 2 424.16 21.10 -1 10 -2 374.96 23.30 -1 -10 2 400.96 20.40 -1 10 -2 420.46 20.70 2 10 -2 1083.49 52.19 2 10 -2 1083.89 52.39 2 -10 2 1051.39 52.29 2 -10 2 1098.99 51.79 2 10 -2 1071.59 52.59 -2 10 -2 991.60 50.89 2 10 2 1085.89 51.09 2 10 2 1076.09 51.39 2 -10 -2 996.20 50.79 2 10 2 1137.89 53.99 2 -10 -2 1095.89 50.49 2 -10 -2 992.90 51.39 -2 -10 2 1019.80 50.59 3 10 -2 493.75 27.80 3 10 -2 514.65 25.20 3 -10 2 504.65 24.80 3 -10 2 507.55 26.00 3 10 -2 523.25 25.60 3 -10 -2 504.15 25.80 3 -10 -2 506.95 24.60 3 10 2 508.65 25.50 0 -11 2 552.74 26.90 0 11 -2 495.25 27.70 0 11 2 574.34 27.40 0 11 2 557.44 27.20 0 11 -2 552.64 27.10 1 11 -2 109.09 6.60 -1 11 2 98.99 10.90 1 -11 2 107.69 6.40 1 11 -2 113.49 7.10 1 11 -2 113.99 10.00 -1 11 2 107.79 6.50 -1 11 -2 98.79 10.10 -1 11 -2 105.09 6.50 -1 -11 2 122.09 6.50 1 11 2 110.39 10.70 1 11 2 110.49 7.00 1 -11 -2 104.29 6.60 1 11 2 111.59 6.60 2 11 -2 138.69 8.40 2 11 -2 148.79 8.40 2 11 -2 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93.69 4 -1 8 2150.28 117.89 4 -1 8 1861.31 92.89 4 1 -8 1820.12 92.69 4 -1 -8 1878.61 92.29 4 -1 -8 1986.40 92.89 -4 -1 8 1930.11 92.49 4 1 8 1765.92 92.39 4 1 8 2173.08 116.89 4 -1 -8 1941.01 92.89 4 -1 -8 1798.12 120.09 -5 1 8 157.38 8.50 5 -1 8 159.98 21.50 5 1 -8 138.99 8.60 5 1 -8 148.09 8.50 5 1 -8 137.99 8.60 5 1 -8 157.18 26.70 5 -1 -8 160.78 22.30 5 -1 -8 148.29 9.10 5 1 8 170.38 21.80 5 -1 -8 154.68 9.40 5 -1 -8 164.78 8.60 0 2 8 6378.56 303.37 1 -2 8 2231.98 109.29 1 2 -8 2332.37 109.69 1 2 -8 2349.56 108.99 -1 2 8 2365.26 109.09 1 -2 8 2154.18 109.19 -1 2 -8 2463.15 109.69 1 2 8 2387.56 110.29 1 2 8 2244.08 109.79 -1 -2 8 2285.57 109.79 1 2 8 2126.49 109.89 2 -2 8 1860.31 92.19 2 2 -8 1969.30 92.09 2 2 -8 1871.51 92.69 2 -2 8 1818.92 91.79 2 -2 8 2025.20 111.89 2 2 -8 1987.90 92.29 2 2 -8 1915.01 91.79 2 2 8 1858.21 88.09 2 2 8 1632.14 88.49 2 -2 -8 1947.21 88.59 2 2 8 1831.22 88.39 -2 2 -8 1926.91 87.89 2 -2 -8 1862.21 87.99 3 -2 8 1485.35 76.59 3 2 -8 1518.75 77.19 3 -2 8 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101.39 2 -3 8 2025.10 101.19 2 3 -8 2080.79 100.99 2 3 -8 2105.19 101.49 2 3 -8 2193.28 101.29 2 3 -8 2098.99 101.19 2 -3 8 2225.18 122.39 2 3 -8 2105.59 102.19 2 -3 8 2009.20 100.79 2 3 -8 2235.28 100.99 -2 3 -8 2050.79 94.09 2 -3 -8 1948.80 94.19 2 -3 -8 2020.40 94.69 2 3 8 1961.30 94.29 2 3 8 1960.70 94.59 -2 -3 8 1976.10 94.29 2 3 8 1887.01 94.99 2 -3 -8 1977.20 94.19 3 -3 8 67.19 4.50 3 3 -8 65.99 6.00 3 -3 8 77.19 5.80 3 3 -8 73.49 5.10 3 -3 8 75.89 17.20 3 3 -8 76.49 5.20 3 -3 -8 54.19 4.40 -3 -3 8 58.79 4.00 3 3 8 52.39 16.30 3 3 8 56.29 4.60 3 -3 -8 49.30 4.20 3 -3 -8 40.20 30.20 3 -3 -8 49.99 3.90 4 -3 8 549.85 27.10 4 3 -8 494.25 24.80 4 3 -8 524.15 25.00 4 3 -8 413.86 61.89 4 -3 8 493.35 43.20 4 3 -8 494.45 25.90 4 3 -8 456.25 24.70 4 -3 -8 464.15 22.90 4 -3 -8 422.96 39.30 4 -3 -8 451.55 21.90 -4 -3 8 379.06 22.20 4 -3 -8 453.15 22.80 4 3 8 484.85 39.80 5 3 -8 74.89 23.80 5 3 -8 78.09 5.30 -5 3 8 72.99 5.10 5 3 -8 68.69 5.10 5 -3 -8 82.79 4.60 5 -3 -8 85.49 7.20 5 -3 -8 67.99 5.70 5 3 8 75.29 15.50 0 -4 8 129.99 7.30 0 4 -8 127.09 7.20 0 4 8 142.89 8.00 0 -4 8 153.28 7.60 0 4 -8 153.38 9.00 0 4 8 121.29 7.30 0 4 -8 122.09 7.10 0 4 -8 144.89 7.00 0 4 8 135.19 7.90 -1 4 8 5801.32 277.97 1 -4 8 5874.11 301.57 1 -4 -8 5292.77 254.67 1 4 8 5425.26 255.17 2 -4 8 284.87 14.20 2 4 -8 259.87 13.50 2 -4 8 251.27 29.70 2 4 -8 279.87 13.80 2 4 -8 265.47 13.90 2 -4 8 253.77 13.40 2 4 -8 273.47 15.30 2 -4 -8 225.08 11.80 2 -4 -8 242.78 12.30 2 4 8 235.58 12.00 -2 -4 8 225.18 11.90 2 4 8 238.38 12.90 2 -4 -8 229.18 11.90 -2 4 -8 234.88 11.80 3 -4 8 2634.04 132.49 3 -4 8 2795.72 132.99 3 -4 8 2819.62 156.28 3 4 -8 2931.01 132.89 3 4 -8 2767.92 133.99 3 4 -8 2887.81 132.59 3 -4 8 2537.95 131.89 3 -4 -8 2503.25 117.49 3 4 8 2154.68 117.49 3 4 8 2361.86 117.09 3 -4 -8 2567.04 116.79 3 -4 -8 2595.34 117.79 -3 -4 8 2487.45 116.79 4 -4 8 432.76 21.70 4 4 -8 415.16 22.60 4 4 -8 377.16 21.70 4 4 -8 435.86 21.30 4 4 -8 432.86 21.10 4 -4 8 439.06 39.30 4 4 -8 368.66 59.59 4 -4 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373.06 18.40 3 -5 -8 357.06 18.80 3 5 8 318.67 19.60 3 -5 -8 388.36 18.10 3 5 8 349.57 18.50 4 5 -8 2073.19 95.79 4 5 -8 1869.71 97.29 4 -5 8 2036.10 96.29 4 -5 -8 1951.90 93.89 4 -5 -8 1882.91 93.29 4 -5 -8 1971.40 92.49 0 6 8 43.20 4.10 0 -6 8 47.90 3.50 0 6 8 44.60 4.30 0 -6 8 44.50 3.40 0 6 -8 46.80 3.30 1 -6 8 2875.31 147.59 1 -6 8 3333.27 148.09 1 6 -8 3156.88 147.79 1 6 -8 3120.29 149.69 -1 6 8 3200.48 148.19 -1 6 8 3046.50 148.29 1 6 -8 3011.30 147.59 1 6 -8 2946.71 147.49 1 6 -8 3111.89 147.39 -1 6 8 3133.09 147.69 1 6 8 2857.91 133.39 1 6 8 2897.01 133.99 -1 6 -8 2767.62 133.09 -1 -6 8 2877.21 133.39 1 -6 -8 2827.42 133.49 1 6 8 2821.42 133.69 -1 -6 8 2623.04 132.99 1 -6 -8 2659.73 132.89 2 6 -8 791.12 37.40 2 -6 8 715.03 57.39 2 6 -8 799.12 37.20 2 6 -8 767.02 39.70 2 6 -8 769.92 37.30 -2 6 8 754.12 37.90 2 6 -8 782.62 37.60 -2 6 8 737.13 37.20 2 -6 8 770.02 38.10 2 6 8 674.33 33.30 2 -6 -8 678.73 32.80 2 6 8 692.53 34.00 -2 -6 8 698.43 33.30 2 6 8 644.14 33.40 3 -6 8 2154.18 133.39 -3 6 8 2231.58 112.09 3 -6 8 2297.57 112.49 3 6 -8 2367.76 114.19 3 6 -8 2461.65 111.89 3 -6 8 2478.75 113.19 3 6 8 2403.66 115.39 3 -6 -8 2539.35 113.89 -3 -6 8 2407.76 114.39 3 6 8 2192.98 114.09 3 -6 -8 2331.17 114.59 3 6 8 2432.66 114.29 4 -6 8 403.16 37.00 4 -6 8 481.55 23.10 4 6 -8 427.16 24.40 4 6 -8 457.05 22.20 4 6 -8 449.95 54.39 4 -6 -8 454.85 21.60 -4 -6 8 440.16 22.10 4 -6 -8 426.96 22.40 4 -6 -8 444.26 23.20 0 7 8 6086.19 286.47 0 7 -8 5928.31 285.87 0 7 -8 6307.17 288.27 0 -7 8 5715.13 285.77 -1 7 8 46.60 4.50 1 7 -8 49.20 3.90 -1 7 8 44.80 3.90 1 7 -8 42.00 3.60 1 -7 8 54.39 4.00 1 7 -8 47.20 3.60 1 7 -8 48.00 6.80 1 7 -8 49.10 3.50 -1 7 -8 47.50 3.40 1 7 8 42.50 4.20 -1 -7 8 52.89 3.60 1 7 8 42.60 4.20 -1 -7 8 37.90 3.80 1 7 8 42.30 3.60 1 -7 -8 42.20 3.80 -2 7 8 917.31 49.10 2 7 -8 985.70 48.80 2 7 -8 1017.30 48.90 2 7 -8 1028.20 48.70 2 7 -8 1012.30 49.20 2 -7 8 1085.39 49.60 -2 7 8 1034.00 49.40 2 7 -8 1080.29 51.79 2 -7 8 905.71 68.69 -2 -7 8 949.80 46.00 2 7 8 965.70 46.70 2 7 8 918.71 46.20 2 -7 -8 978.60 45.60 2 -7 -8 880.71 46.20 2 7 8 982.60 46.10 3 7 -8 377.76 18.30 3 -7 8 377.16 19.20 3 -7 8 337.27 34.60 3 7 -8 352.76 18.00 3 7 -8 341.87 23.80 3 7 -8 362.36 18.60 3 -7 8 387.96 20.00 3 7 -8 322.07 46.80 3 7 8 383.36 19.80 3 7 8 403.76 20.80 -3 -7 8 388.56 19.60 3 -7 -8 374.46 19.90 3 -7 -8 383.46 19.10 4 -7 8 46.70 5.00 4 7 -8 61.39 4.10 4 7 -8 56.59 20.40 4 -7 8 47.70 12.30 4 -7 -8 59.69 5.80 -4 -7 8 55.59 4.40 4 -7 -8 47.90 4.60 4 -7 -8 54.39 3.40 0 8 -8 1484.75 74.09 0 8 8 1465.75 72.19 0 8 8 1492.95 71.89 0 -8 8 1537.15 71.79 0 8 8 1471.65 72.29 1 8 -8 804.12 39.50 1 8 -8 823.22 39.80 -1 8 8 825.92 39.70 1 8 -8 828.12 42.20 1 -8 8 820.62 39.80 -1 8 8 778.62 40.10 1 8 -8 803.82 39.30 -1 -8 8 798.72 37.80 1 8 8 778.22 38.40 -1 8 -8 735.53 40.10 1 8 8 787.12 38.20 1 8 8 770.42 37.90 2 8 -8 975.90 46.60 2 8 -8 953.70 46.00 2 8 -8 905.41 45.70 -2 8 8 874.31 46.20 2 8 -8 976.40 48.70 2 8 -8 921.01 45.80 2 -8 8 1003.70 46.40 2 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3 -9 8 292.47 15.50 3 -9 -8 291.67 14.00 -3 -9 8 291.67 14.40 3 9 8 282.37 15.20 3 -9 -8 280.17 15.10 3 -9 -8 263.47 14.80 0 -10 8 159.58 9.00 0 10 8 164.28 9.70 0 10 8 173.38 9.40 0 10 -8 171.38 9.30 1 10 -8 437.16 23.70 1 10 -8 403.26 21.40 -1 10 8 418.76 21.50 1 10 -8 391.36 20.90 1 -10 8 425.76 21.10 -1 10 8 437.56 21.20 1 10 -8 423.66 21.10 -1 -10 8 410.36 21.30 1 10 8 442.36 21.90 1 10 8 442.36 21.60 -1 10 -8 414.46 24.00 -1 10 -8 426.36 21.40 2 -10 8 740.03 36.30 2 10 -8 749.42 36.20 2 10 -8 752.12 38.40 2 10 -8 724.53 36.10 -2 10 -8 711.83 40.30 -2 -10 8 807.72 37.80 2 10 8 795.82 38.30 2 10 8 787.72 38.00 0 -11 8 561.64 27.20 0 11 8 544.35 27.50 0 11 -8 548.75 29.60 1 11 -8 201.38 10.60 1 11 -8 202.88 13.40 -1 11 8 206.68 10.70 1 -11 8 192.88 10.50 -1 11 8 187.28 12.30 1 11 8 214.98 10.90 1 11 8 206.88 11.20 -1 -11 8 191.58 10.60 -1 11 -8 203.48 14.30 -1 11 -8 199.38 10.70 2 -11 8 47.50 3.80 2 11 -8 43.60 4.40 2 11 8 47.80 4.60 -2 -11 8 51.09 3.80 2 11 8 55.29 4.20 0 -12 8 299.67 15.40 0 12 -8 326.27 15.60 0 12 8 295.37 16.20 0 12 8 309.47 15.60 1 -12 8 195.38 10.20 1 12 8 231.58 13.20 0 0 9 11.60 2.20 0 0 9 16.50 2.30 2 0 9 51.79 4.30 2 0 -9 61.59 3.90 -2 0 -9 67.49 3.70 2 0 -9 56.19 4.30 2 0 9 61.09 16.00 2 0 -9 68.39 4.20 -2 0 9 64.79 4.20 2 0 -9 57.59 4.00 3 0 -9 26.30 3.30 3 0 -9 30.40 20.40 3 0 -9 24.70 2.90 3 0 9 24.60 3.50 4 0 9 6.50 2.30 4 0 -9 4.50 10.30 4 0 9 3.20 6.90 -4 0 9 6.50 2.40 4 0 -9 5.80 1.60 -5 0 9 163.78 8.70 5 0 -9 140.19 8.90 5 0 -9 162.18 23.50 5 0 -9 161.88 8.60 5 0 9 173.78 21.40 5 0 -9 140.49 8.90 0 -1 9 1176.28 57.39 0 -1 -9 1182.68 57.29 0 1 -9 1197.18 57.29 0 1 -9 1186.28 57.39 0 1 9 1143.19 57.39 0 -1 9 1271.07 57.39 1 1 -9 564.34 28.10 1 1 -9 601.54 28.00 1 1 -9 559.54 27.80 -1 1 9 568.34 27.90 -1 -1 -9 616.74 27.80 1 1 -9 589.54 27.80 1 -1 9 587.44 28.10 1 -1 9 540.35 27.60 1 -1 9 525.05 28.00 1 -1 -9 623.94 28.20 1 -1 -9 589.44 28.20 1 1 9 609.44 28.90 1 1 9 553.64 28.60 1 1 9 522.45 28.40 -1 1 -9 616.44 28.20 -1 -1 9 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233.58 1 4 9 5009.10 234.08 1 -4 -9 4929.21 233.88 2 4 -9 2083.39 97.49 2 4 -9 2025.90 97.79 2 4 -9 2113.69 97.59 2 4 -9 2020.70 98.69 2 -4 9 1938.81 97.59 2 4 -9 2129.39 97.19 2 4 -9 2007.00 97.29 2 -4 9 1947.11 97.69 2 4 9 2009.20 95.59 2 -4 -9 1961.10 95.09 2 4 9 1995.70 96.19 2 -4 -9 1930.31 95.09 2 -4 -9 1995.40 95.59 2 4 9 2041.40 95.39 -2 4 -9 2024.10 94.99 -2 -4 9 1964.90 95.19 3 -4 9 301.77 16.30 3 -4 9 301.27 33.40 3 4 -9 318.97 16.00 3 4 -9 287.37 16.90 3 -4 9 286.17 15.70 3 4 -9 309.07 15.70 3 -4 -9 283.77 15.60 3 -4 -9 287.77 14.80 3 4 9 273.67 15.20 -3 -4 9 291.27 14.90 3 -4 -9 325.67 15.60 4 4 -9 795.12 90.89 4 4 -9 897.11 45.10 4 -4 9 914.41 65.99 4 4 -9 961.10 45.10 4 4 -9 905.81 46.30 4 -4 9 994.10 45.60 4 4 -9 980.60 45.30 4 -4 -9 997.10 46.40 4 -4 -9 945.31 47.00 4 -4 -9 934.61 47.30 0 5 -9 60.09 3.70 0 5 9 63.09 4.20 0 5 -9 63.39 4.10 0 5 -9 65.39 6.30 0 -5 9 76.89 4.50 0 -5 9 68.29 4.10 0 5 9 67.29 5.40 0 5 -9 58.49 3.90 -1 5 9 3631.74 176.08 1 5 -9 3746.63 175.78 1 5 -9 4186.88 179.48 1 5 -9 3460.95 175.88 1 -5 9 3679.73 202.58 1 -5 9 3534.15 175.98 1 5 -9 3616.14 176.28 -1 5 -9 3437.26 161.38 -1 -5 9 3377.46 161.38 1 5 9 3629.94 162.38 1 5 9 3294.67 161.88 1 -5 -9 3202.58 161.28 1 -5 -9 3255.87 161.58 -1 -5 9 3523.25 161.78 2 5 -9 1606.64 76.59 2 -5 9 1640.54 78.09 2 5 -9 1590.04 76.39 2 -5 9 1467.35 98.59 2 5 -9 1602.84 76.19 2 5 -9 1606.34 76.69 2 5 -9 1622.44 78.29 -2 5 -9 1476.05 70.49 2 -5 -9 1426.86 70.59 2 -5 -9 1443.16 70.99 2 5 9 1568.14 70.99 2 -5 -9 1474.95 70.49 2 5 9 1409.86 70.99 -2 -5 9 1448.46 70.59 2 5 9 1525.55 72.69 3 5 -9 481.95 26.10 3 5 -9 517.45 24.30 3 -5 9 470.05 24.60 3 -5 9 449.95 42.90 3 -5 9 485.55 25.10 3 5 -9 498.75 24.60 3 5 9 434.46 23.60 3 -5 -9 469.95 24.30 3 -5 -9 504.75 24.00 3 -5 -9 475.95 23.20 4 5 -9 13.00 2.80 4 5 -9 12.00 18.30 4 5 -9 9.50 3.60 4 -5 -9 13.70 2.10 4 -5 -9 11.90 3.40 0 6 9 3543.65 170.78 0 -6 9 3355.56 169.88 0 6 -9 3690.73 170.28 0 6 9 3622.14 170.58 0 6 -9 3848.52 172.08 0 6 9 3485.25 170.18 0 6 -9 3446.66 169.98 0 6 -9 3546.55 169.68 1 6 -9 4749.02 235.38 -1 6 9 4919.01 236.28 1 6 -9 5066.99 235.58 -1 6 9 4950.20 235.98 1 6 -9 5089.09 237.38 1 6 -9 4717.83 235.28 1 6 -9 5115.49 235.18 -1 6 -9 4573.94 215.68 1 6 9 4581.04 216.08 -1 -6 9 4446.35 215.38 1 -6 -9 4465.35 215.28 1 -6 -9 4238.58 215.88 1 6 9 4860.81 216.58 2 6 -9 791.22 37.90 -2 6 9 779.42 38.60 2 -6 9 704.13 58.09 2 6 -9 775.52 37.90 2 6 -9 802.82 38.20 -2 6 9 735.63 38.00 2 -6 9 827.12 38.70 2 6 -9 776.42 40.00 2 6 -9 792.32 37.70 2 6 9 699.13 34.50 2 -6 -9 661.13 34.10 2 -6 -9 694.33 33.80 2 -6 -9 690.23 34.50 -2 -6 9 706.63 34.30 -2 -6 9 670.93 33.90 2 6 9 734.93 34.40 2 6 9 733.13 35.10 3 6 -9 32.00 27.20 3 -6 9 33.00 4.70 3 -6 9 27.80 5.30 -3 6 9 32.60 5.50 3 6 -9 26.10 3.00 3 6 -9 25.10 5.70 3 -6 -9 20.40 2.50 3 6 9 30.40 5.30 3 6 9 22.30 4.00 3 6 9 29.40 4.00 -3 -6 9 25.20 3.20 3 -6 -9 18.90 3.80 3 -6 -9 27.10 3.30 4 6 -9 148.79 33.00 4 6 -9 148.89 8.00 4 -6 9 155.58 9.00 4 -6 9 127.39 20.20 4 6 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47.30 3 -8 -9 1022.40 50.29 3 8 9 968.70 47.70 3 -8 -9 985.90 46.90 0 9 9 119.59 7.40 0 9 -9 142.89 10.80 0 9 9 114.89 7.90 0 -9 9 125.59 7.10 1 -9 9 343.97 18.00 1 9 -9 377.86 20.70 1 9 -9 347.97 18.30 1 9 -9 342.37 17.80 1 9 -9 356.36 18.00 -1 9 9 341.87 18.50 -1 9 9 366.46 18.10 -1 9 -9 354.26 20.80 1 9 9 365.56 18.20 -1 9 -9 354.66 18.00 1 9 9 348.87 18.50 -1 -9 9 348.87 17.90 2 9 -9 1344.57 68.89 2 9 -9 1520.95 70.99 -2 9 9 1330.07 70.19 2 -9 9 1494.55 68.99 2 9 -9 1478.15 68.79 2 9 -9 1325.77 68.49 2 9 -9 1493.65 69.49 -2 9 -9 1353.76 71.59 2 -9 -9 1475.35 68.89 2 9 9 1484.85 69.99 2 9 9 1489.15 69.59 -2 -9 9 1486.75 69.39 -2 9 -9 1356.06 69.29 3 -9 9 253.97 13.40 3 9 -9 251.07 13.00 3 -9 9 259.27 14.20 3 9 -9 243.18 30.70 -3 -9 9 253.37 13.30 3 9 9 260.07 14.30 3 -9 -9 276.97 12.90 3 -9 -9 250.57 13.90 0 10 -9 3.00 1.60 0 -10 9 7.40 2.00 0 10 -9 4.70 5.20 0 10 9 6.60 2.40 0 10 9 3.80 1.60 1 10 -9 2163.88 101.89 -1 10 9 2001.30 102.29 -1 10 9 2149.69 101.89 1 10 -9 2142.89 103.69 1 -10 9 2164.38 101.79 -1 -10 9 2079.89 100.39 1 10 9 2058.19 100.89 -1 10 -9 1997.30 102.39 -1 10 -9 2134.99 100.49 1 10 9 2212.78 100.69 2 10 -9 11.10 2.10 2 10 -9 9.80 11.20 2 10 -9 7.20 4.50 -2 10 -9 17.20 7.30 -2 -10 9 10.90 2.40 2 10 9 12.10 2.80 0 11 -9 437.86 21.20 0 -11 9 414.66 21.10 0 11 9 434.36 21.30 0 11 -9 420.16 23.70 0 11 9 417.06 21.50 -1 11 9 153.18 10.00 1 -11 9 168.78 9.30 1 11 -9 202.78 14.10 1 11 -9 189.78 9.60 -1 11 9 170.08 9.60 1 11 9 181.48 10.30 -1 -11 9 175.48 9.60 -1 11 -9 190.68 9.80 1 11 9 185.18 9.90 0 0 -10 154.68 7.80 0 0 10 152.58 7.90 0 0 10 136.19 8.40 0 0 10 156.58 8.10 1 0 10 347.97 19.00 1 0 -10 396.56 18.70 -1 0 10 398.26 18.90 1 0 -10 352.76 18.70 -1 0 -10 409.56 18.70 1 0 10 400.36 19.20 1 0 -10 362.66 18.70 1 0 -10 374.36 18.80 2 0 -10 523.75 26.10 2 0 -10 519.35 25.90 2 0 -10 541.25 26.00 2 0 10 474.95 26.20 2 0 -10 526.75 25.60 -2 0 10 521.55 25.80 -2 0 -10 553.54 25.50 2 0 10 515.55 26.00 2 0 10 534.35 43.60 3 0 -10 189.28 10.50 -3 0 10 192.18 10.30 3 0 -10 178.38 10.30 3 0 10 197.48 25.60 3 0 -10 182.78 10.70 3 0 10 182.48 10.50 4 0 10 2385.66 132.69 4 0 -10 2330.57 110.29 4 0 -10 2310.97 110.39 -4 0 10 2350.16 110.09 4 0 10 2243.08 110.09 4 0 -10 2154.58 140.99 4 0 -10 2291.67 109.99 0 1 10 5078.89 249.78 0 1 10 5526.85 249.78 0 -1 10 5137.89 249.78 -1 1 10 3672.23 169.48 -1 1 10 3656.73 169.78 1 -1 10 3470.15 169.38 1 -1 10 3783.62 169.48 1 -1 10 3313.37 189.88 1 -1 10 3418.06 168.98 1 -1 -10 3781.22 179.08 1 1 10 3897.91 179.58 1 1 10 3552.64 179.28 1 1 10 3815.52 179.78 2 1 -10 459.15 23.10 -2 1 10 476.65 23.20 2 -1 10 453.85 23.40 2 1 -10 467.25 22.90 2 -1 10 477.35 41.70 2 -1 10 439.96 23.60 2 1 -10 468.45 23.60 -2 -1 -10 476.55 22.90 2 1 -10 486.95 23.40 2 -1 -10 484.95 23.90 -2 -1 10 486.55 24.10 2 1 10 472.35 24.30 2 -1 -10 504.35 24.20 -2 1 -10 487.95 23.80 2 -1 -10 530.05 24.40 2 1 10 478.05 40.90 2 -1 -10 456.45 24.10 3 -1 10 2008.40 117.29 3 1 -10 2068.09 94.59 3 -1 10 1899.71 94.39 3 1 -10 1912.41 94.79 3 1 -10 1914.81 94.29 3 -1 -10 1591.34 114.59 3 -1 -10 1951.40 89.29 3 1 10 1981.30 111.09 -3 -1 10 1867.31 88.89 3 1 10 1840.42 89.09 3 -1 -10 1876.81 88.79 3 -1 -10 1847.82 89.19 4 1 -10 507.75 26.20 4 1 -10 515.95 26.90 4 1 -10 501.35 56.29 4 1 -10 529.45 26.40 4 -1 10 511.85 26.30 4 -1 10 549.15 45.30 -4 1 10 534.05 26.20 4 1 -10 533.15 26.30 4 1 10 535.85 44.30 4 1 10 529.65 26.50 4 -1 -10 518.85 26.60 4 -1 -10 526.55 26.10 4 -1 -10 536.35 26.70 4 -1 -10 490.25 47.90 -4 -1 10 564.24 26.30 0 -2 10 9999.00 475.15 -1 -2 -10 2933.51 132.49 -1 2 10 2567.04 132.69 1 -2 10 2992.60 132.79 1 -2 10 2671.73 154.78 1 2 -10 2866.21 132.99 1 2 -10 2650.33 132.39 1 -2 10 2807.42 132.79 1 -2 10 2726.43 132.49 1 -2 -10 2826.32 132.39 1 2 10 2676.73 132.59 1 2 10 2865.61 133.19 -1 2 -10 2866.61 132.29 -1 -2 10 2646.14 132.49 1 -2 -10 2747.63 132.39 1 2 10 2804.52 132.79 2 2 -10 1646.64 77.09 2 -2 10 1491.35 76.49 2 2 -10 1606.54 76.79 2 2 -10 1627.74 77.49 2 -2 10 1596.44 77.19 -2 -2 -10 1658.33 76.59 2 2 -10 1583.04 76.59 2 -2 10 1589.44 98.69 2 -2 10 1584.34 77.09 2 -2 -10 1483.35 70.69 2 2 10 1437.76 88.79 -2 2 -10 1557.14 70.09 2 2 10 1228.98 70.89 2 -2 -10 1493.25 70.19 2 -2 -10 1588.94 70.79 2 2 10 1483.65 70.59 -2 -2 10 1446.46 70.39 3 2 -10 1145.29 56.09 3 -2 10 1138.99 77.79 3 2 -10 1182.28 56.89 3 -2 10 1123.99 56.29 3 2 -10 1188.28 56.39 3 -2 -10 937.01 73.89 3 2 10 1061.99 52.49 3 -2 -10 1097.79 52.69 3 -2 -10 1133.79 52.19 -3 -2 10 1079.59 52.19 3 2 10 1090.09 71.39 3 -2 -10 1159.08 52.79 4 -2 10 62.59 5.70 4 2 -10 65.59 5.90 4 2 -10 65.89 4.90 4 2 -10 60.49 28.40 -4 2 10 67.39 5.00 4 2 -10 59.89 4.80 4 -2 -10 64.69 5.10 4 2 10 67.79 18.40 4 2 10 65.19 5.60 4 -2 -10 67.09 5.40 -4 -2 10 66.99 4.70 4 -2 -10 72.79 5.30 0 -3 10 67.99 4.50 0 3 -10 67.89 4.20 0 3 10 59.59 4.20 0 -3 10 71.49 5.40 0 3 10 69.09 5.00 0 3 10 77.99 4.80 0 -3 10 78.79 4.50 1 3 -10 2214.48 103.49 -1 3 10 2309.77 103.69 1 -3 10 2166.88 103.69 1 -3 10 2175.48 127.89 -1 3 10 2101.39 103.89 1 -3 10 2253.17 103.89 1 3 -10 2021.10 103.39 -1 3 10 2059.69 103.59 1 -3 10 2140.89 103.89 1 3 -10 2227.28 104.39 1 -3 -10 2153.98 101.39 1 3 10 2113.69 101.39 1 -3 -10 2018.00 101.29 1 3 10 2253.87 102.19 -1 -3 10 2083.29 101.29 1 3 10 2009.50 101.59 -1 3 -10 2214.28 101.29 2 -3 10 348.67 18.50 2 -3 10 342.67 18.00 2 3 -10 357.36 18.10 2 3 -10 358.26 17.90 -2 -3 -10 359.96 17.90 2 3 -10 357.76 19.00 2 3 -10 374.66 18.40 2 -3 10 371.56 18.50 2 -3 -10 355.96 18.10 -2 3 -10 390.46 18.00 2 3 10 335.17 19.30 2 -3 -10 384.86 18.50 2 3 10 365.36 18.20 2 3 10 362.76 18.50 -2 -3 10 355.06 18.10 2 -3 -10 357.06 18.10 3 -3 10 909.21 45.50 3 3 -10 974.50 45.40 3 3 -10 897.11 45.00 3 3 -10 932.71 46.10 3 -3 10 902.41 66.59 3 3 10 837.52 59.59 3 -3 -10 893.61 42.60 3 -3 -10 912.11 43.20 3 3 10 846.52 42.90 3 -3 -10 893.31 43.30 -3 -3 10 890.91 42.70 4 3 -10 1273.07 119.89 4 3 -10 1376.06 68.19 4 -3 10 1460.15 67.69 -4 3 10 1502.25 67.39 4 3 -10 1419.86 67.49 4 3 -10 1254.27 67.39 4 -3 10 1401.76 93.59 4 3 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-1 -17 647.54 34.70 3 1 17 727.83 35.00 3 -1 -17 774.32 34.60 -3 -1 17 699.03 34.60 0 2 17 202.78 11.20 0 2 -17 189.58 10.50 0 -2 17 203.28 11.30 0 2 17 190.38 10.60 0 -2 17 200.38 10.60 0 2 17 186.68 11.80 0 -2 -17 193.08 10.50 1 -2 17 22.80 3.90 1 -2 17 17.70 3.10 -1 2 17 22.20 2.90 1 2 -17 24.00 2.90 1 2 17 21.40 3.50 1 -2 -17 17.90 2.70 1 2 17 19.70 3.60 -1 2 -17 16.20 2.70 -1 -2 17 19.10 2.70 2 2 -17 787.52 40.40 -2 -2 -17 808.22 40.40 2 -2 17 886.21 40.90 2 -2 17 862.81 40.80 -2 2 17 811.42 40.40 2 -2 -17 781.92 39.60 -2 -2 17 822.42 39.60 2 2 17 845.62 40.00 2 -2 -17 870.51 39.50 2 -2 -17 750.12 39.90 3 -2 17 11.20 2.80 3 2 -17 14.10 15.20 -3 2 17 13.50 2.20 3 2 -17 12.70 2.30 3 -2 -17 11.70 1.80 3 -2 -17 11.10 2.80 3 2 17 12.10 2.70 -3 -2 17 11.10 2.00 0 -3 17 1295.47 64.19 0 3 17 1373.36 64.79 0 3 17 1318.57 64.19 0 -3 -17 1267.47 64.29 0 3 17 1313.07 65.09 0 3 -17 1425.16 64.29 1 3 -17 4580.04 228.88 1 -3 17 5032.50 229.18 -1 3 17 4577.24 228.88 -1 3 17 4771.52 229.28 1 -3 17 5212.88 229.78 -1 -3 -17 4667.83 228.98 -1 3 -17 4610.94 215.28 -1 -3 17 4411.16 215.28 1 3 17 4529.75 216.08 1 -3 -17 4526.75 215.38 -2 3 17 373.36 19.00 2 -3 17 404.16 19.50 -2 -3 -17 376.96 19.10 2 3 -17 363.46 19.00 2 -3 -17 346.87 18.10 2 -3 -17 385.96 17.80 -2 -3 17 380.66 18.00 2 3 17 386.36 18.50 -2 -3 17 309.67 17.90 2 -3 -17 339.37 18.10 -3 3 17 53.09 3.60 3 -3 17 49.90 4.10 3 3 -17 48.80 17.40 3 -3 -17 43.80 2.90 -3 -3 17 44.50 4.60 3 3 17 43.50 3.80 0 -4 -17 76.49 5.30 0 -4 17 76.09 5.00 0 4 17 79.79 6.60 0 4 17 83.99 6.10 0 4 -17 79.49 5.10 1 -4 17 7.00 2.00 -1 4 17 7.40 2.50 1 -4 17 5.00 2.20 -1 4 17 7.30 2.20 -1 -4 -17 2.70 1.80 -1 4 17 12.70 3.40 1 4 -17 5.70 1.90 -1 -4 17 8.40 1.80 -1 4 -17 5.60 2.40 1 -4 -17 8.80 2.10 1 4 17 9.20 6.10 -2 4 17 1253.87 61.89 2 -4 17 1382.76 62.39 -2 -4 -17 1249.47 61.99 2 4 -17 1280.27 61.99 -2 4 17 1274.57 62.79 -2 -4 17 1327.37 60.29 2 4 17 1363.66 60.79 2 -4 -17 1211.28 60.49 2 -4 -17 1329.77 60.09 -2 -4 17 1126.09 60.19 2 -4 -17 1165.78 60.39 0 5 17 161.48 10.10 0 -5 17 168.08 8.90 0 5 17 167.88 9.70 1 5 -17 92.39 5.70 1 -5 17 94.89 5.60 1 -5 17 87.39 6.30 -1 5 17 83.39 5.60 -1 -5 -17 96.89 5.80 -1 5 -17 92.99 5.70 -1 -5 17 82.69 5.70 1 5 17 96.19 7.60 -1 -5 17 90.69 5.40 1 -5 -17 89.19 5.80 1 5 17 97.29 6.20 -2 5 17 64.39 4.40 -2 5 17 75.99 6.10 2 5 -17 66.69 4.80 2 -5 17 65.59 4.90 -2 -5 -17 68.09 5.20 -2 -5 17 67.69 4.00 2 -5 -17 63.29 4.30 -2 -5 17 54.39 4.40 2 5 17 64.69 4.70 2 -5 -17 62.79 4.90 0 6 17 5.40 1.90 0 -6 17 5.90 1.70 0 -6 -17 4.50 1.90 0 6 -17 4.20 1.90 -1 -6 -17 57.19 4.40 1 -6 17 60.99 4.10 1 6 -17 64.69 4.40 1 -6 17 57.09 5.20 -1 6 17 60.79 5.50 1 6 17 48.60 4.20 -1 -6 17 47.20 3.40 -1 -6 17 42.90 4.00 -1 6 -17 53.69 4.10 1 6 17 50.09 6.00 1 -6 -17 48.70 5.70 1 -6 -17 50.99 4.30 -2 6 17 795.22 40.10 -2 6 17 760.62 39.30 2 -6 17 891.71 39.70 2 6 17 874.81 41.00 -2 -6 17 808.02 40.50 0 7 -17 146.49 8.20 0 7 17 155.98 8.50 0 -7 17 147.49 7.90 0 -7 -17 147.79 8.30 0 7 17 143.99 9.10 -1 7 17 1877.11 91.69 1 7 -17 1962.70 91.19 -1 -7 -17 1878.31 91.29 1 7 17 2083.29 94.69 1 7 17 1862.01 95.09 0 0 -18 1861.31 86.99 0 0 18 1816.12 87.59 0 0 18 1691.73 87.59 0 0 18 1875.21 86.99 -1 0 18 125.59 7.20 1 0 18 133.99 7.50 -1 0 -18 122.59 7.20 1 0 -18 118.99 7.20 1 0 18 121.39 7.70 2 0 18 309.57 15.50 -2 0 18 289.87 15.10 2 0 -18 280.87 15.20 -2 0 -18 309.47 16.90 0 -1 18 1694.33 75.59 0 1 -18 1553.94 75.19 0 1 18 1610.24 75.59 0 -1 18 1556.14 75.19 0 1 18 1473.25 75.89 0 -1 -18 1503.35 75.19 0 1 18 1546.75 75.19 1 -1 18 2220.88 104.89 -1 -1 -18 2196.28 104.59 1 -1 18 2289.07 104.79 -1 1 18 2091.99 104.59 1 1 -18 2126.49 104.59 -1 -1 18 2090.29 101.49 1 1 18 2151.98 101.59 1 1 18 2212.28 101.89 -1 1 -18 2112.79 101.49 1 -1 -18 2031.30 101.49 2 -1 18 333.17 16.40 -2 -1 -18 309.67 16.10 2 1 -18 305.67 16.00 -2 1 18 310.67 15.90 2 -1 -18 299.87 16.70 2 1 18 337.27 17.00 -2 -1 18 330.67 16.50 2 -1 -18 341.67 16.40 0 2 -18 1399.86 67.49 0 -2 -18 1387.96 67.59 0 2 18 1367.96 67.49 0 2 18 1445.46 67.99 0 -2 18 1479.25 67.79 0 -2 18 1412.76 67.49 0 2 18 1319.47 68.29 -1 2 18 188.98 10.50 1 2 -18 186.38 10.80 1 -2 18 208.68 11.00 1 -2 18 207.28 10.70 1 -2 -18 209.68 10.90 1 2 18 184.78 10.40 -1 -2 18 189.18 10.20 1 -2 -18 188.28 10.10 1 2 18 198.28 10.90 2 2 -18 11.30 2.30 -2 -2 -18 15.90 3.10 2 -2 18 9.10 2.00 -2 2 18 13.20 2.20 -2 -2 18 9.60 2.00 2 -2 -18 7.40 2.30 2 -2 -18 7.10 1.40 2 2 18 5.70 1.80 0 3 18 66.29 4.70 0 3 18 70.19 6.50 0 3 18 69.49 5.60 0 -3 18 73.19 4.70 0 3 -18 65.99 4.70 0 -3 -18 72.69 4.80 -1 3 18 1064.19 52.69 1 3 -18 1014.60 52.29 1 -3 18 1107.09 52.49 -1 3 18 1018.10 52.29 1 -3 18 1103.59 52.59 -1 3 18 1200.68 55.79 -1 -3 -18 1079.69 52.39 1 3 18 1081.59 51.09 1 -3 -18 1025.60 50.79 -1 3 -18 1052.19 50.69 -1 -3 18 1037.20 50.69 2 -3 18 602.04 27.60 -2 3 18 551.54 27.10 -2 -3 -18 534.95 27.30 2 3 -18 527.65 27.20 2 -3 -18 556.24 25.50 -2 -3 18 531.85 25.70 2 3 18 545.65 26.10 2 -3 -18 460.45 25.80 0 4 18 994.40 48.20 0 -4 -18 994.60 47.90 0 4 18 953.50 48.60 0 4 -18 1022.00 47.80 0 -4 18 970.10 47.70 1 4 -18 24.10 2.90 1 -4 18 26.40 2.90 -1 -4 -18 22.50 3.20 -1 4 18 21.50 2.90 1 -4 18 24.40 3.80 -1 4 -18 21.60 3.00 -1 -4 18 25.10 2.60 1 -4 -18 24.10 3.20 1 4 18 27.20 3.50 2 4 -18 150.08 8.70 -2 4 18 155.78 9.60 2 -4 18 161.58 8.70 -2 4 18 152.78 8.30 -2 -4 18 156.18 8.50 2 -4 -18 163.88 8.30 2 4 18 168.08 9.10 0 5 18 3647.03 168.88 0 -5 -18 3566.34 168.58 0 -5 18 3448.65 168.38 0 5 18 3288.97 168.98 0 5 -18 3715.03 168.48 1 5 -18 225.78 12.10 -1 -5 -18 229.18 12.20 1 -5 18 230.88 12.00 1 -5 18 251.77 12.50 -1 5 18 226.98 13.00 -1 5 -18 207.78 11.40 1 -5 -18 219.38 11.40 1 5 18 222.08 11.70 1 5 18 218.18 13.80 -1 -5 18 214.78 11.10 -2 5 18 642.74 33.10 -2 5 18 635.34 32.30 2 -5 18 725.03 32.70 2 5 18 722.63 34.50 -2 -5 18 686.83 34.10 0 6 18 892.31 45.00 0 6 -18 911.41 44.40 0 -6 18 908.11 44.30 0 -6 -18 936.21 44.50 0 6 18 940.21 44.70 -1 6 18 35.60 4.50 -1 -6 -18 42.20 4.00 1 6 -18 36.70 3.60 1 6 18 32.90 3.50 -1 -6 18 36.90 2.80 -1 0 -19 495.55 24.40 1 0 19 515.65 24.50 1 0 -19 452.55 24.30 1 0 19 527.45 24.80 -1 0 19 473.05 24.30 2 0 19 104.89 6.50 -2 0 19 99.89 5.90 2 0 -19 107.79 5.90 0 1 19 1049.70 57.09 0 -1 19 1188.08 55.69 0 1 19 1090.49 55.59 0 1 -19 1187.68 55.69 0 1 19 1210.18 55.99 0 -1 19 1233.88 55.99 0 -1 -19 1109.99 55.69 -1 -1 -19 835.02 41.50 1 -1 19 883.81 41.80 1 -1 19 901.81 41.60 -1 1 19 827.02 41.40 1 1 -19 821.52 41.40 1 1 19 825.12 39.60 1 -1 -19 812.92 39.30 1 1 19 862.51 40.00 -1 -1 19 810.62 39.50 -1 1 -19 793.22 39.50 1 -1 -19 782.82 39.60 2 1 -19 2015.60 97.99 2 1 -19 1783.12 116.29 -2 1 19 2080.49 97.89 2 -1 19 2307.37 98.29 2 -1 -19 2300.37 106.09 -2 -1 19 2109.99 106.09 2 1 19 2254.97 106.49 0 -2 19 3.90 1.80 0 2 -19 2.30 1.50 0 -2 -19 5.80 1.70 0 2 19 2.90 2.10 -1 2 19 685.93 36.40 -1 -2 -19 739.23 35.70 1 2 -19 682.83 35.60 1 -2 19 799.02 35.90 1 -2 19 790.92 36.00 -1 2 19 692.03 35.50 1 -2 -19 689.03 34.70 1 -2 -19 701.93 34.40 1 2 19 764.82 35.20 -1 2 -19 699.43 34.70 -1 -2 19 708.93 34.70 2 2 -19 487.05 45.10 2 -2 19 622.44 27.80 -2 2 19 571.74 27.40 2 2 19 611.04 29.60 2 -2 -19 611.94 29.10 -2 -2 19 579.04 29.20 0 -3 19 327.67 15.70 0 3 19 279.37 15.50 0 3 19 334.87 16.20 0 -3 -19 317.47 15.80 0 3 19 287.77 16.70 -1 3 19 186.38 11.60 1 -3 19 208.08 10.50 -1 3 19 182.08 10.20 1 3 -19 205.58 10.50 -1 -3 -19 190.08 10.40 1 -3 19 207.98 10.80 1 -3 -19 189.98 10.40 -1 3 -19 194.18 10.40 1 3 19 209.78 10.80 -1 -3 19 192.28 10.20 2 -3 19 712.73 33.00 -2 3 19 684.13 33.30 -2 3 19 626.24 33.50 2 -3 -19 664.23 31.90 2 3 19 689.73 32.50 -2 -3 19 631.24 32.00 0 4 -19 19.50 2.70 0 4 19 18.50 3.50 0 -4 19 24.80 2.50 0 4 19 19.00 3.80 0 -4 -19 14.40 2.90 1 -4 19 915.91 42.10 -1 4 19 831.32 42.60 1 4 -19 834.52 41.90 -1 -4 -19 843.42 42.00 1 -4 19 901.51 42.00 1 4 19 930.31 42.30 -1 4 -19 842.62 42.00 1 -4 -19 821.62 42.00 -1 -4 19 875.61 41.90 0 -5 19 13.50 2.00 0 -5 -19 14.20 2.40 0 5 19 10.40 3.50 0 5 -19 14.80 2.40 0 5 19 12.40 3.10 1 -5 19 1645.04 73.69 1 -5 19 1581.44 74.49 1 5 -19 1515.95 73.69 -1 5 19 1402.76 74.09 1 5 19 1619.64 74.99 -1 -5 19 1500.35 74.59 0 0 20 14.30 3.00 0 0 -20 12.90 2.70 1 0 20 764.12 35.40 -1 0 20 702.33 35.20 1 0 20 791.82 35.70 1 0 -20 681.23 35.30 -1 0 -20 694.33 35.30 0 -1 20 909.41 43.70 0 -1 -20 868.31 43.80 0 1 20 980.20 44.10 0 1 20 862.91 43.60 0 1 -20 899.51 43.80 -1 -1 -20 727.83 36.80 1 -1 20 825.42 37.10 1 1 -20 737.93 36.80 -1 1 20 753.52 36.70 -1 1 20 698.83 37.60 1 -1 20 805.92 36.90 1 -1 -20 670.83 35.00 -1 1 -20 683.03 35.00 1 1 20 805.92 35.40 1 1 20 694.93 35.70 1 -1 -20 756.42 34.80 -1 -1 20 713.33 35.00 0 2 -20 25.00 3.40 0 2 20 29.80 4.20 0 2 20 30.20 3.00 0 -2 -20 26.80 3.30 0 -2 20 36.60 2.90 -1 2 20 197.88 12.70 1 2 -20 214.08 11.40 -1 -2 -20 209.88 11.50 1 -2 20 238.48 11.80 1 -2 20 239.48 11.50 -1 2 20 219.88 11.30 -1 2 -20 201.38 11.20 1 -2 -20 198.38 10.90 -1 -2 20 202.78 10.70 1 2 20 230.18 11.20 0 3 20 4074.89 187.38 0 -3 -20 3832.02 187.18 0 -3 20 3885.11 187.08 0 3 -20 3924.71 187.18 1 -3 20 403.06 20.60 -1 3 20 361.16 19.40 1 3 -20 383.16 19.70 -1 3 20 410.16 21.00 1 -3 20 424.16 19.70 -1 -3 20 403.26 20.40 1 3 20 427.26 20.80 0 -4 20 17.60 2.10 0 4 20 17.60 3.30 0 -4 -20 17.30 3.00 0 0 -21 1.20 2.00 0 1 21 919.51 46.40 0 -1 21 1012.80 46.60 _computing_structure_solution 'SHELXT 2014/4 (Sheldrick, 2014)' ; _shelx_hkl_checksum 42344 _shelx_shelxl_version_number 2014/7 _olex2_submission_special_instructions 'No special instructions were received' loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, -y, z+1/2' '-x, y+1/2, -z+1/2' 'x+1/2, -y+1/2, -z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Br1 Br 0.48269(9) 0.30256(3) 0.73768(2) 0.02454(14) Uani 1 1 d . . . . . Br2 Br 0.61174(8) 0.49455(3) 0.41223(2) 0.02188(13) Uani 1 1 d . . . . . N1 N 0.7047(7) 0.3051(3) 0.55826(18) 0.0196(6) Uani 1 1 d . . . . . C1 C 0.5198(8) 0.4115(3) 0.57704(18) 0.0173(6) Uani 1 1 d . . . . . C2 C 0.3833(8) 0.4270(3) 0.6551(2) 0.0194(6) Uani 1 1 d . . . . . C3 C 0.1867(8) 0.5306(3) 0.6741(2) 0.0210(6) Uani 1 1 d . . . . . C4 C 0.1146(8) 0.6235(3) 0.6142(2) 0.0222(6) Uani 1 1 d . . . . . C5 C 0.2408(8) 0.6116(3) 0.5366(2) 0.0202(6) Uani 1 1 d . . . . . C6 C 0.4388(7) 0.5069(3) 0.51943(18) 0.0186(6) Uani 1 1 d . . . . . H1A H 0.809(16) 0.318(5) 0.522(4) 0.046(17) Uiso 1 1 d . . . . . H1B H 0.759(11) 0.261(5) 0.600(3) 0.025(11) Uiso 1 1 d . . . . . H4 H -0.007(14) 0.692(5) 0.625(4) 0.042(15) Uiso 1 1 d . . . . . H3 H 0.104(11) 0.533(4) 0.734(3) 0.020(10) Uiso 1 1 d . . . . . H5 H 0.194(12) 0.676(4) 0.490(3) 0.030(12) Uiso 1 1 d . . . . . 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 Br1 0.0290(2) 0.0283(2) 0.01638(19) 0.00556(11) -0.00067(13) 0.00118(14) Br2 0.0255(2) 0.0254(2) 0.01470(19) 0.00162(12) 0.00136(11) -0.00301(14) N1 0.0215(14) 0.0206(13) 0.0168(14) -0.0003(11) 0.0003(11) 0.0034(12) C1 0.0156(13) 0.0192(13) 0.0170(13) -0.0020(11) -0.0035(12) -0.0030(11) C2 0.0199(15) 0.0209(14) 0.0174(14) 0.0020(11) -0.0012(13) -0.0030(13) C3 0.0207(15) 0.0217(15) 0.0205(14) -0.0050(12) 0.0003(12) -0.0021(12) C4 0.0198(15) 0.0190(14) 0.0277(17) -0.0055(13) 0.0007(13) 0.0010(13) C5 0.0213(15) 0.0174(14) 0.0220(15) 0.0008(12) -0.0031(13) -0.0002(12) C6 0.0185(14) 0.0200(13) 0.0172(12) -0.0001(11) -0.0003(11) -0.0015(13) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0140 0.0070 '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' Br Br -0.9340 1.0410 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0250 0.0140 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 C1 N1 H1A 112(4) . . C1 N1 H1B 113(3) . . H1A N1 H1B 124(6) . . N1 C1 C2 122.0(3) . . N1 C1 C6 122.7(3) . . C6 C1 C2 115.2(3) . . C1 C2 Br1 118.2(2) . . C3 C2 Br1 119.0(3) . . C3 C2 C1 122.8(3) . . C2 C3 C4 119.5(3) . . C2 C3 H3 116(2) . . C4 C3 H3 125(2) . . C3 C4 H4 121(4) . . C5 C4 C3 119.6(3) . . C5 C4 H4 119(4) . . C4 C5 C6 119.5(3) . . C4 C5 H5 123(3) . . C6 C5 H5 117(3) . . C1 C6 Br2 118.3(2) . . C5 C6 Br2 118.4(2) . . C5 C6 C1 123.3(3) . . loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 Br1 C2 1.898(3) . Br2 C6 1.907(3) . N1 C1 1.380(4) . N1 H1A 0.76(7) . N1 H1B 0.85(5) . C1 C2 1.413(5) . C1 C6 1.396(4) . C2 C3 1.389(5) . C3 C4 1.395(5) . C3 H3 1.04(5) . C4 C5 1.385(5) . C4 H4 0.89(5) . C5 C6 1.394(5) . C5 H5 1.02(5) . 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 N1 H1A Br2 0.76(7) 2.67(6) 3.091(3) 117(5) . N1 H1A N1 0.76(7) 2.49(7) 3.090(4) 137(5) 4_556 N1 H1B Br1 0.85(5) 2.58(5) 3.082(3) 119(4) . N1 H1B Br2 0.85(5) 3.02(5) 3.551(3) 122(4) 4_556 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 Br1 C2 C3 C4 179.3(2) . . . . N1 C1 C2 Br1 4.2(4) . . . . N1 C1 C2 C3 -177.4(3) . . . . N1 C1 C6 Br2 -3.8(4) . . . . N1 C1 C6 C5 176.9(3) . . . . C1 C2 C3 C4 0.9(5) . . . . C2 C1 C6 Br2 180.0(2) . . . . C2 C1 C6 C5 0.7(5) . . . . C2 C3 C4 C5 -0.3(5) . . . . C3 C4 C5 C6 -0.1(5) . . . . C4 C5 C6 Br2 -179.4(2) . . . . C4 C5 C6 C1 -0.1(5) . . . . C6 C1 C2 Br1 -179.5(2) . . . . C6 C1 C2 C3 -1.1(5) . . . . loop_ _cod_related_entry_id _cod_related_entry_database _cod_related_entry_code 1 PubChem 69098