#------------------------------------------------------------------------------ #$Date: 2024-12-11 01:35:54 +0200 (Wed, 11 Dec 2024) $ #$Revision: 296831 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/24/96/7249677.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_7249677 loop_ _publ_author_name 'Ngom, Fallou' 'Blais, Chlo\'e' 'Badiane, Insa' 'H\'enaff, Christine' 'Camara, Magatte' 'Daiguebonne, Carole' 'Guillou, Olivier' _publ_section_title ; Influence of halogens on the crystal packing of 3,4,5,6-tetra-chloro-phthalate-based lanthanide coordination compounds ; _journal_name_full CrystEngComm _journal_paper_doi 10.1039/D4CE00966E _journal_year 2025 _chemical_formula_sum 'C8 H10 Cl4 O8 Y' _chemical_formula_weight 464.87 _space_group_crystal_system monoclinic _space_group_IT_number 11 _space_group_name_Hall '-P 2yb' _space_group_name_H-M_alt 'P 1 21/m 1' _atom_sites_solution_hydrogens mixed _audit_creation_method SHELXL-2018/3 _audit_update_record ; 2024-10-28 deposited with the CCDC. 2024-11-27 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 95.615(3) _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 8.7595(6) _cell_length_b 6.7789(5) _cell_length_c 11.8297(9) _cell_measurement_reflns_used 2620 _cell_measurement_temperature 150(2) _cell_measurement_theta_max 27.29 _cell_measurement_theta_min 2.34 _cell_volume 699.07(9) _computing_structure_refinement 'SHELXL-2018/3 (Sheldrick, 2018)' _diffrn_ambient_temperature 150(2) _diffrn_measured_fraction_theta_full 0.989 _diffrn_measured_fraction_theta_max 0.972 _diffrn_measurement_device_type 'APEXII Bruker-AXS' _diffrn_measurement_method 'CCD rotation images, thick slices' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0219 _diffrn_reflns_av_unetI/netI 0.0442 _diffrn_reflns_Laue_measured_fraction_full 0.989 _diffrn_reflns_Laue_measured_fraction_max 0.972 _diffrn_reflns_limit_h_max 10 _diffrn_reflns_limit_h_min -11 _diffrn_reflns_limit_k_max 8 _diffrn_reflns_limit_k_min -8 _diffrn_reflns_limit_l_max 15 _diffrn_reflns_limit_l_min 0 _diffrn_reflns_number 2741 _diffrn_reflns_point_group_measured_fraction_full 0.989 _diffrn_reflns_point_group_measured_fraction_max 0.972 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.499 _diffrn_reflns_theta_min 2.768 _diffrn_source 'Enraf Nonius FR590' _exptl_absorpt_coefficient_mu 4.969 _exptl_absorpt_correction_T_max 0.7455 _exptl_absorpt_correction_T_min 0.6274 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; [Sheldrick, G.M. (2014). SADABS Bruker AXS Inc., Madison, Wisconsin, USA] ; _exptl_crystal_colour colorless _exptl_crystal_density_diffrn 2.208 _exptl_crystal_density_method 'not measured' _exptl_crystal_description prism _exptl_crystal_F_000 458 _exptl_crystal_size_max 0.150 _exptl_crystal_size_mid 0.100 _exptl_crystal_size_min 0.070 _refine_diff_density_max 1.955 _refine_diff_density_min -0.849 _refine_diff_density_rms 0.140 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.071 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 136 _refine_ls_number_reflns 1697 _refine_ls_number_restraints 9 _refine_ls_restrained_S_all 1.068 _refine_ls_R_factor_all 0.0582 _refine_ls_R_factor_gt 0.0486 _refine_ls_shift/su_max 0.004 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0538P)^2^+2.9045P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1154 _refine_ls_wR_factor_ref 0.1208 _reflns_Friedel_coverage 0.000 _reflns_number_gt 1491 _reflns_number_total 1697 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d4ce00966e2.cif _cod_data_source_block shelx_CCDC1 _cod_original_sg_symbol_H-M 'P 21/m' _cod_database_code 7249677 _shelx_shelxl_version_number 2018/3 _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_res_file ; TITL shelxt_a.res in P2(1)/m shelx.res created by SHELXL-2018/3 at 14:38:52 on 28-Oct-2024 CELL 0.71073 8.7595 6.7789 11.8297 90.000 95.615 90.000 ZERR 2.00 0.0006 0.0005 0.0009 0.000 0.003 0.000 LATT 1 SYMM - X, 1/2 + Y, - Z SFAC C O CL Y H UNIT 16 16 8 2 20 MERG 2 DFIX 0.84 0.02 O3 H3A DFIX 0.84 0.02 O3 H3B DANG 1.30 0.03 H3A H3B DFIX 0.84 0.02 O4 H4A DFIX 0.84 0.02 O4 H4B DANG 1.30 0.03 H4A H4B DFIX 0.84 0.02 O5 H5A DFIX 0.84 0.02 O5 H5B DANG 1.30 0.03 H5A H5B FMAP 2 PLAN 40 ACTA BOND $H LIST 6 L.S. 30 TEMP -123.00 WGHT 0.053800 2.904500 FVAR 0.49063 Y1 4 0.374699 0.750000 0.957022 10.50000 0.01373 0.02351 = 0.01551 0.00000 -0.00142 0.00000 CL1 3 0.639188 0.250000 0.683507 10.50000 0.01193 0.06552 = 0.05951 0.00000 -0.00512 0.00000 CL2 3 0.521677 0.250000 0.425929 10.50000 0.03041 0.04415 = 0.04098 0.00000 0.02473 0.00000 CL3 3 0.168015 0.250000 0.353744 10.50000 0.03534 0.06401 = 0.01704 0.00000 0.00075 0.00000 CL4 3 -0.060710 0.250000 0.538047 10.50000 0.01165 0.05724 = 0.03507 0.00000 -0.00098 0.00000 O1 2 0.428087 0.408672 0.896826 11.00000 0.10983 0.03614 = 0.02601 -0.00357 -0.02002 -0.00689 O2 2 0.037152 0.411386 0.819591 11.00000 0.05990 0.04547 = 0.04973 -0.01158 0.03792 -0.00599 AFIX 147 H2 5 -0.012173 0.473862 0.766630 10.50000 -1.20000 AFIX 0 O3 2 0.604718 0.750000 0.860693 10.50000 0.06832 0.04874 = 0.05285 0.00000 -0.00030 0.00000 AFIX 2 H3B 5 0.551313 0.750000 0.798451 10.50000 -1.20000 AFIX 0 O4 2 0.205765 0.750000 0.790831 10.50000 0.06751 0.03334 = 0.05857 0.00000 -0.03555 0.00000 AFIX 2 H4A 5 0.172506 0.863345 0.775788 11.00000 -1.20000 H4B 5 0.298979 0.750000 0.782910 10.50000 -1.20000 AFIX 0 O5 2 0.199762 0.539660 1.045861 11.00000 0.05430 0.06648 = 0.06088 0.00758 0.03663 0.01906 AFIX 2 H5A 5 0.133961 0.574088 1.088156 11.00000 -1.20000 AFIX 0 C1 1 0.343006 0.250000 0.723839 10.50000 0.01950 0.02092 = 0.02024 0.00000 0.00345 0.00000 C2 1 0.445650 0.250000 0.641359 10.50000 0.01705 0.02822 = 0.02831 0.00000 -0.00068 0.00000 C3 1 0.392264 0.250000 0.526375 10.50000 0.02099 0.03109 = 0.02435 0.00000 0.01497 0.00000 C4 1 0.235440 0.250000 0.493959 10.50000 0.02778 0.03194 = 0.01764 0.00000 0.00030 0.00000 C5 1 0.134200 0.250000 0.578084 10.50000 0.01269 0.03544 = 0.02015 0.00000 0.00345 0.00000 C6 1 0.186853 0.250000 0.692044 10.50000 0.01750 0.02644 = 0.01938 0.00000 0.00412 0.00000 C7 1 0.405005 0.250000 0.847929 10.50000 0.03342 0.02825 = 0.01976 0.00000 -0.00257 0.00000 C8 1 0.076159 0.250000 0.784130 10.50000 0.02282 0.03722 = 0.02194 0.00000 0.00860 0.00000 H5B 5 0.192896 0.415437 1.047673 11.00000 0.29254 H3A 5 0.694444 0.750000 0.841786 10.50000 0.59502 HKLF 4 REM shelxt_a.res in P2(1)/m REM wR2 = 0.1208, GooF = S = 1.071, Restrained GooF = 1.068 for all data REM R1 = 0.0486 for 1491 Fo > 4sig(Fo) and 0.0582 for all 1697 data REM 136 parameters refined using 9 restraints END WGHT 0.0529 2.8834 REM Highest difference peak 1.955, deepest hole -0.849, 1-sigma level 0.140 Q1 1 0.0384 0.7500 0.8935 10.50000 0.05 1.95 Q2 1 0.3779 0.8764 0.9647 11.00000 0.05 1.52 Q3 1 0.2888 0.2500 0.9820 10.50000 0.05 1.12 Q4 1 0.5347 0.1148 0.4368 11.00000 0.05 0.70 Q5 1 0.5138 0.4157 0.8644 11.00000 0.05 0.66 Q6 1 0.6411 0.1182 0.6626 11.00000 0.05 0.62 Q7 1 -0.1561 0.2500 0.4766 10.50000 0.05 0.62 Q8 1 0.1802 0.1118 0.3690 11.00000 0.05 0.60 Q9 1 -0.0316 0.2500 0.7412 10.50000 0.05 0.56 Q10 1 -0.0712 0.1236 0.5089 11.00000 0.05 0.55 Q11 1 0.8658 0.7500 0.7924 10.50000 0.05 0.53 Q12 1 0.4461 0.7500 0.9270 10.50000 0.05 0.50 Q13 1 0.6600 0.8783 0.8780 11.00000 0.05 0.46 Q14 1 0.1033 0.2500 0.7337 10.50000 0.05 0.45 Q15 1 0.2829 0.2500 0.6147 10.50000 0.05 0.44 Q16 1 0.2822 0.6001 1.0008 11.00000 0.05 0.42 Q17 1 0.5269 0.2500 0.7664 10.50000 0.05 0.37 Q18 1 0.2183 0.2500 0.3377 10.50000 0.05 0.36 Q19 1 0.1909 0.7500 0.7119 10.50000 0.05 0.35 Q20 1 0.6481 0.2500 0.4941 10.50000 0.05 0.35 Q21 1 0.3187 0.7500 0.9951 10.50000 0.05 0.34 Q22 1 0.3953 0.2500 0.9254 10.50000 0.05 0.34 Q23 1 -0.1523 0.2500 0.3834 10.50000 0.05 0.34 Q24 1 0.5582 0.2500 0.3912 10.50000 0.05 0.33 Q25 1 0.1620 0.4021 0.9878 11.00000 0.05 0.32 Q26 1 0.7660 0.2500 0.6732 10.50000 0.05 0.32 Q27 1 0.1675 0.2500 0.8011 10.50000 0.05 0.32 Q28 1 0.7218 0.7500 0.8908 10.50000 0.05 0.32 Q29 1 0.1422 0.7500 0.7068 10.50000 0.05 0.32 Q30 1 0.1611 0.2500 1.0003 10.50000 0.05 0.30 Q31 1 0.1713 0.1428 0.6224 11.00000 0.05 0.30 Q32 1 0.0368 0.5634 0.8158 11.00000 0.05 0.29 Q33 1 0.7613 0.2500 0.8024 10.50000 0.05 0.29 Q34 1 0.1849 0.7500 1.1782 10.50000 0.05 0.29 Q35 1 0.0009 0.4371 0.8001 11.00000 0.05 0.29 Q36 1 -0.1498 0.0339 0.4745 11.00000 0.05 0.28 Q37 1 0.0453 0.2500 0.9227 10.50000 0.05 0.28 Q38 1 0.4774 0.2500 0.8165 10.50000 0.05 0.28 Q39 1 0.2026 0.2500 0.4361 10.50000 0.05 0.28 Q40 1 0.1922 0.2500 0.5415 10.50000 0.05 0.28 ; _shelx_res_checksum 89019 _shelx_hkl_file ; -11 0 4 0.68 4.57412 1 -11 0 5 85.57 7.09975 1 -11 1 1 37.81 5.74096 1 -11 1 2 58.31 6.82553 1 -11 1 3 315.71 14.7909 1 -11 1 4 -7.42 4.53105 1 -11 2 2 -0.34 4.66133 1 -10 -2 5 262.49 12.2251 1 -10 -2 6 99.51 7.5626 1 -10 -2 7 89.30 7.38476 1 -10 -1 3 12.00 4.31657 1 -10 -1 4 59.77 6.20992 1 -10 -1 5 12.85 4.71664 1 -10 -1 6 -2.72 4.64825 1 -10 -1 7 -5.25 4.68517 1 -10 -1 8 126.59 8.97968 1 -10 0 1 45.37 5.56544 1 -10 0 2 95.26 7.1677 1 -10 0 3 29.47 5.29202 1 -10 0 4 19.57 5.1336 1 -10 0 5 277.09 13.0476 1 -10 0 6 38.39 6.15834 1 -10 0 7 42.06 6.63344 1 -10 0 8 139.86 9.50348 1 -10 1 0 335.47 14.6396 1 -10 1 1 -6.31 4.11644 1 -10 1 2 375.04 16.1028 1 -10 1 3 4.43 4.76596 1 -10 1 4 63.45 6.7396 1 -10 1 5 11.47 4.95679 1 -10 1 6 1.39 4.78969 1 -10 1 7 9.81 5.12882 1 -10 1 8 130.44 9.42074 1 -10 2 0 80.06 7.22562 1 -10 2 1 16.44 5.20945 1 -10 2 2 53.96 6.87601 1 -10 2 3 15.47 5.19128 1 -10 2 4 8.24 4.99794 1 -10 2 5 241.72 12.9083 1 -10 2 6 87.97 8.56201 1 -10 2 7 69.73 7.80279 1 -10 3 0 204.32 11.7392 1 -10 3 1 -4.08 4.75206 1 -10 3 2 244.06 12.8244 1 -10 3 3 3.77 5.23941 1 -10 3 4 21.48 6.22813 1 -10 3 5 6.67 5.33875 1 -10 3 6 -1.94 5.17973 1 -10 4 0 25.68 6.32336 1 -10 4 1 22.32 6.2487 1 -10 4 2 38.46 6.96514 1 -10 4 3 14.65 5.99648 1 -9 -2 2 197.19 9.16228 1 -9 -2 3 256.35 11.2655 1 -9 -2 4 5.58 3.92381 1 -9 -2 5 188.98 9.90781 1 -9 -2 6 33.01 5.48652 1 -9 -2 7 2.77 4.61151 1 -9 -1 1 2.53 3.13418 1 -9 -1 2 9.64 3.51467 1 -9 -1 3 40.90 5.17256 1 -9 -1 4 167.90 9.35143 1 -9 -1 5 7.56 4.36655 1 -9 -1 6 253.30 12.1373 1 -9 -1 7 -7.85 4.07715 1 -9 -1 8 353.94 16.0257 1 -9 -1 9 11.69 5.25259 1 -9 -1 10 104.16 8.63642 1 -9 0 1 3.46 3.60371 1 -9 0 2 281.25 12.3933 1 -9 0 3 296.86 12.9644 1 -9 0 4 1.66 3.99484 1 -9 0 5 323.25 14.456 1 -9 0 6 162.25 9.71918 1 -9 0 7 29.42 5.55201 1 -9 0 8 42.85 6.59773 1 -9 0 9 6.56 5.40578 1 -9 0 10 33.75 6.74258 1 -9 1 0 289.13 9.90688 1 -9 1 1 -0.13 3.36908 1 -9 1 2 7.09 4.30463 1 -9 1 3 34.42 5.40936 1 -9 1 4 177.46 10.1547 1 -9 1 5 9.61 4.78193 1 -9 1 6 235.90 12.1708 1 -9 1 7 2.04 4.62723 1 -9 1 8 332.71 15.8628 1 -9 1 9 7.93 5.50835 1 -9 1 10 103.82 8.91624 1 -9 2 0 291.96 10.1866 1 -9 2 1 1.59 2.88261 1 -9 2 2 190.295 7.70707 1 -9 2 3 258.23 12.5094 1 -9 2 4 -3.75 4.69063 1 -9 2 5 186.56 10.6516 1 -9 2 6 36.29 6.27699 1 -9 2 7 -1.39 4.79476 1 -9 2 8 6.74 5.22134 1 -9 2 9 -0.79 5.34614 1 -9 3 0 231.21 16.8901 1 -9 3 1 -0.52 4.29002 1 -9 3 2 3.205 3.24556 1 -9 3 3 9.47 3.41869 1 -9 3 4 56.05 7.2392 1 -9 3 5 9.96 5.51112 1 -9 3 6 95.40 8.27722 1 -9 3 7 -1.94 5.1375 1 -9 3 8 307.03 15.36 1 -9 4 0 154.15 7.42759 1 -9 4 1 1.72 3.77226 1 -9 4 2 144.745 7.44633 1 -9 4 3 203.765 8.50827 1 -9 4 4 10.98 9.94344 1 -9 4 5 145.90 10.0069 1 -9 4 6 28.83 6.69873 1 -9 4 7 -1.11 5.5439 1 -9 5 0 102.88 12.1304 1 -9 5 1 6.525 4.08105 1 -9 5 2 1.825 3.8194 1 -9 5 3 8.105 4.03007 1 -9 5 4 45.34 6.99222 1 -8 -2 1 439.89 16.0833 1 -8 -2 2 100.59 6.32477 1 -8 -2 3 283.39 12.2211 1 -8 -2 4 0.02 3.496 1 -8 -2 5 37.26 5.26377 1 -8 -2 6 -5.79 3.43067 1 -8 -2 7 1.19 4.00271 1 -8 -1 1 62.46 5.27206 1 -8 -1 2 64.30 5.83767 1 -8 -1 3 151.71 8.53752 1 -8 -1 4 102.05 7.14054 1 -8 -1 5 342.78 14.5982 1 -8 -1 6 53.57 6.12091 1 -8 -1 7 97.72 7.73933 1 -8 -1 8 233.48 11.8719 1 -8 -1 9 28.81 5.97953 1 -8 -1 10 45.33 6.96487 1 -8 -1 11 21.99 6.34106 1 -8 0 1 213.025 12.0147 1 -8 0 2 7.65 3.58007 1 -8 0 3 211.77 10.3831 1 -8 0 4 5.33 3.8352 1 -8 0 5 26.38 4.95431 1 -8 0 6 7.68 4.63029 1 -8 0 7 9.80 4.5209 1 -8 0 8 57.41 6.79167 1 -8 0 9 48.08 6.9503 1 -8 0 10 -0.38 4.98865 1 -8 0 11 435.65 19.5515 1 -8 1 0 188.465 7.27684 1 -8 1 1 61.59 3.9985 1 -8 1 2 70.63 5.77991 1 -8 1 3 162.11 6.5428 1 -8 1 4 100.56 7.74206 1 -8 1 5 345.95 15.014 1 -8 1 6 59.32 6.54899 1 -8 1 7 103.03 8.1115 1 -8 1 8 213.30 11.6066 1 -8 1 9 24.89 5.739 1 -8 1 10 45.48 7.08086 1 -8 1 11 17.11 6.31348 1 -8 2 0 168.715 7.28301 1 -8 2 1 415.255 13.3736 1 -8 2 2 95.54 5.29655 1 -8 2 3 281.39 11.9862 1 -8 2 4 2.27 2.72917 1 -8 2 5 40.75 6.00517 1 -8 2 6 2.80 4.58487 1 -8 2 7 -1.04 4.44894 1 -8 2 8 76.77 7.57012 1 -8 2 9 135.81 9.60575 1 -8 2 10 18.46 5.94082 1 -8 2 11 374.47 17.7495 1 -8 3 0 46.865 6.25948 1 -8 3 1 75.515 5.22181 1 -8 3 2 23.245 3.59065 1 -8 3 3 57.125 4.64593 1 -8 3 4 56.43 4.67221 1 -8 3 5 226.25 8.81382 1 -8 3 6 49.48 6.82534 1 -8 3 7 34.20 6.30611 1 -8 3 8 67.17 7.58185 1 -8 3 9 10.08 5.46695 1 -8 3 10 43.58 7.23857 1 -8 4 0 85.515 5.68404 1 -8 4 1 204.885 23.7755 1 -8 4 2 37.665 7.9067 1 -8 4 3 89.03 5.92055 1 -8 4 4 -3.315 4.85 1 -8 4 5 11.26 3.73117 1 -8 4 6 -2.725 7.53 1 -8 4 7 5.19 5.00722 1 -8 4 8 15.73 5.83269 1 -8 4 9 67.39 7.81651 1 -8 5 0 42.935 4.94003 1 -8 5 1 18.495 4.26788 1 -8 5 2 11.16 4.13523 1 -8 5 3 59.50 10.6342 1 -8 5 4 52.675 10.7873 1 -8 5 5 113.155 18.0705 1 -8 5 6 43.06 5.431 1 -8 5 7 46.99 7.48303 1 -8 6 0 56.985 5.79279 1 -8 6 1 81.115 6.19839 1 -8 6 2 13.99 5.92968 1 -8 6 3 47.67 9.64614 1 -7 -3 1 88.37 8.57165 1 -7 -3 2 98.755 4.37041 1 -7 -3 3 1063.57 36.6568 1 -7 -2 1 2.72 1.65559 1 -7 -2 2 19.43 3.45427 1 -7 -2 3 16.59 3.66682 1 -7 -2 4 31.73 4.59417 1 -7 -2 5 75.60 5.8493 1 -7 -2 6 161.20 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78.44 7.19994 1 -3 2 0 142.376 4.50841 1 -3 2 1 1220.84 38.3805 1 -3 2 2 274.092 11.7409 1 -3 2 3 6.23593 1.14385 1 -3 2 4 168.143 6.75874 1 -3 2 5 661.46 20.2648 1 -3 2 6 250.795 18.3171 1 -3 2 7 22.82 3.9829 1 -3 2 8 318.56 13.9499 1 -3 2 9 310.95 14.0428 1 -3 2 10 176.83 9.9058 1 -3 2 11 87.25 7.18166 1 -3 2 12 207.50 10.8747 1 -3 2 13 18.88 5.60235 1 -3 2 14 45.33 6.26614 1 -3 3 0 823.424 29.3156 1 -3 3 1 11.694 1.50431 1 -3 3 2 2162.51 53.896 1 -3 3 3 84.4723 3.76242 1 -3 3 4 209.37 7.85639 1 -3 3 5 9.09 2.299 1 -3 3 6 180.85 9.35815 1 -3 3 7 32.59 4.57943 1 -3 3 8 3.70 3.69599 1 -3 3 9 3.93 3.92978 1 -3 3 10 27.38 4.99075 1 -3 3 11 7.86 4.56993 1 -3 3 12 99.02 8.01084 1 -3 3 13 42.29 6.38294 1 -3 3 14 110.71 8.33386 1 -3 4 0 15.035 4.22812 1 -3 4 1 281.915 10.1957 1 -3 4 2 33.915 3.4432 1 -3 4 3 11.975 2.62708 1 -3 4 4 16.75 2.87739 1 -3 4 5 432.83 14.2146 1 -3 4 6 218.89 8.63243 1 -3 4 7 58.37 5.98635 1 -3 4 8 175.37 9.84457 1 -3 4 9 159.88 9.32572 1 -3 4 10 91.76 7.51255 1 -3 4 11 29.83 5.58364 1 -3 4 12 78.93 7.17911 1 -3 4 13 29.46 5.98469 1 -3 5 0 68.995 7.09183 1 -3 5 1 40.815 7.37513 1 -3 5 2 718.77 21.325 1 -3 5 3 187.97 7.86851 1 -3 5 4 375.50 12.9076 1 -3 5 5 52.67 6.03981 1 -3 5 6 112.16 6.22379 1 -3 5 7 34.80 5.45821 1 -3 5 8 14.67 4.57228 1 -3 5 9 5.63 4.50906 1 -3 5 10 7.22 4.2987 1 -3 5 11 11.43 4.71846 1 -3 5 12 60.27 6.47485 1 -3 6 0 39.65 4.82322 1 -3 6 1 63.82 6.83484 1 -3 6 2 3.845 9.62391 1 -3 6 3 33.115 4.32396 1 -3 6 4 14.115 7.35023 1 -3 6 5 79.00 8.28302 1 -3 6 6 44.545 4.82054 1 -3 6 7 26.42 5.25769 1 -3 6 8 104.11 7.86592 1 -3 6 9 96.46 8.01136 1 -3 6 10 37.42 6.03717 1 -3 7 0 42.495 5.22244 1 -3 7 1 5.755 6.92317 1 -3 7 2 278.875 10.5607 1 -3 7 3 98.55 6.49735 1 -3 7 4 161.64 7.87405 1 -3 7 5 17.395 4.29382 1 -3 7 6 31.04 4.90366 1 -3 7 7 9.60 5.0428 1 -3 7 8 7.26 5.10111 1 -3 8 0 8.22 4.56924 1 -3 8 1 37.165 9.50049 1 -3 8 2 7.39 4.14042 1 -3 8 3 -2.455 8.93 1 -3 8 4 7.905 6.98026 1 -3 8 5 68.73 7.34889 1 -2 -8 1 3.78 5.55637 1 -2 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8.38865 1 0 -3 1 233.528 13.4261 1 0 -3 2 1243.54 32.5315 1 0 -3 3 1084.50 28.0931 1 0 -3 4 172.556 5.46796 1 0 -3 5 122.177 4.35912 1 0 -3 6 1091.02 30.3415 1 0 -3 7 42.265 5.45049 1 0 -3 8 167.50 7.33929 1 0 -3 9 45.275 3.97365 1 0 -3 10 75.14 6.02462 1 0 -3 11 9.94 3.80505 1 0 -3 12 93.94 7.07814 1 0 -3 13 16.14 4.64905 1 0 -3 14 62.23 6.56041 1 0 -2 1 952.607 28.1618 1 0 -2 2 234.16 6.44299 1 0 -2 3 243.277 11.3989 1 0 -2 4 60.9189 2.67765 1 0 -2 5 -0.01 1.54151 1 0 -2 6 73.65 4.67049 1 0 -2 7 7.59 2.41471 1 0 -2 8 168.57 8.60943 1 0 -2 9 5.12 2.91963 1 0 -2 10 338.88 14.1544 1 0 -2 11 146.40 8.4259 1 0 -2 12 132.87 8.21788 1 0 -2 13 115.92 7.79941 1 0 -2 14 -0.75 3.9887 1 0 -1 1 205.889 5.31371 1 0 -1 2 162.97 8.09998 1 0 -1 3 662.995 20.1193 1 0 -1 4 200.51 7.66136 1 0 -1 5 216.30 8.90887 1 0 -1 6 1815.94 50.3823 1 0 -1 7 18.17 2.79109 1 0 -1 8 298.28 12.9791 1 0 -1 9 183.36 9.22911 1 0 -1 10 146.85 8.30791 1 0 -1 11 48.46 5.21365 1 0 -1 12 45.41 5.5091 1 0 -1 13 94.73 7.44939 1 0 -1 14 85.06 7.36137 1 0 -1 15 8.95 4.60698 1 0 0 2 1058.73 41.2174 1 0 0 3 58.89 3.20458 1 0 0 4 6.53 1.2094 1 0 0 5 7.885 1.37033 1 0 0 6 97.14 4.05508 1 0 0 7 103.095 4.50527 1 0 0 8 487.93 18.8573 1 0 0 9 13.82 3.20918 1 0 0 10 311.75 13.5055 1 0 0 11 116.46 7.46291 1 0 0 12 183.00 9.75466 1 0 0 13 258.26 12.4019 1 0 0 14 19.47 5.05216 1 0 0 15 81.98 7.56841 1 0 1 1 193.10 6.66689 1 0 1 2 165.178 4.6971 1 0 1 3 652.365 20.0105 1 0 1 4 180.20 6.09509 1 0 1 5 213.075 12.5181 1 0 1 6 1788.19 126.305 1 0 1 7 22.5079 1.7957 1 0 1 8 326.68 13.4874 1 0 1 9 186.05 9.27229 1 0 1 10 146.03 8.21255 1 0 1 11 45.98 5.62167 1 0 1 12 44.58 5.73914 1 0 1 13 88.61 7.65038 1 0 1 14 78.39 7.6167 1 0 1 15 9.58 4.84834 1 0 2 0 9871.74 239.294 1 0 2 1 943.295 54.4576 1 0 2 2 234.416 6.94397 1 0 2 3 258.968 8.06887 1 0 2 4 63.4125 2.67565 1 0 2 5 0.85486 1.63474 1 0 2 6 82.56 3.66659 1 0 2 7 10.145 1.79336 1 0 2 8 180.59 6.09294 1 0 2 9 6.175 2.2337 1 0 2 10 346.26 14.6811 1 0 2 11 152.40 9.15116 1 0 2 12 143.24 8.57386 1 0 2 13 105.71 8.1728 1 0 2 14 1.32 4.54453 1 0 3 0 -1.0363 1.89366 1 0 3 1 236.70 8.20582 1 0 3 2 1208.09 62.4827 1 0 3 3 998.881 49.4526 1 0 3 4 170.535 7.54377 1 0 3 5 130.965 4.98837 1 0 3 6 1069.29 31.6269 1 0 3 7 37.63 3.04425 1 0 3 8 170.81 8.37601 1 0 3 9 46.875 3.59902 1 0 3 10 63.205 4.3741 1 0 3 11 0.41 3.71647 1 0 3 12 89.42 7.67461 1 0 3 13 20.71 5.19964 1 0 3 14 54.46 6.91148 1 0 4 0 3935.81 84.142 1 0 4 2 357.64 15.2308 1 0 4 3 302.85 22.4787 1 0 4 4 120.42 5.4074 1 0 4 5 12.13 2.78882 1 0 4 6 26.23 3.53541 1 0 4 7 15.93 3.17535 1 0 4 8 160.18 8.26339 1 0 4 9 25.115 3.06802 1 0 4 10 263.38 16.7745 1 0 4 11 159.58 6.93408 1 0 4 12 149.95 9.28556 1 0 4 13 93.65 8.02426 1 0 5 0 -2.21 2.29299 1 0 5 1 0.725 2.05695 1 0 5 2 42.86 3.74564 1 0 5 3 171.245 7.0391 1 0 5 4 66.205 4.41848 1 0 5 5 65.87 5.08244 1 0 5 6 355.34 14.1529 1 0 5 7 22.44 3.97827 1 0 5 8 112.73 6.63472 1 0 5 9 45.63 6.30637 1 0 5 10 49.845 4.0444 1 0 5 11 4.55 4.53025 1 0 5 12 9.26 4.89312 1 0 6 0 2036.46 71.3193 1 0 6 1 52.775 10.872 1 0 6 2 101.58 8.41373 1 0 6 3 24.00 3.53515 1 0 6 4 11.015 3.13589 1 0 6 5 2.39 3.3618 1 0 6 6 11.62 3.51996 1 0 6 7 5.41 3.59674 1 0 6 8 87.34 6.24155 1 0 6 9 12.98 4.3824 1 0 6 10 41.62 5.73233 1 0 6 11 37.25 5.80701 1 0 7 0 -1.77 5.0341 1 0 7 1 -2.11 6.80 1 0 7 2 25.38 4.25558 1 0 7 3 113.59 6.30772 1 0 7 4 60.01 5.11773 1 0 7 5 97.65 7.04266 1 0 7 6 229.79 10.768 1 0 8 0 453.73 20.5472 1 0 8 1 14.62 4.60641 1 0 8 2 51.56 5.36642 1 0 8 3 29.165 6.52876 1 0 8 4 16.69 6.62257 1 1 -8 1 -0.33 6.21451 1 1 -8 2 0.07 6.0159 1 1 -8 3 2.44 6.02008 1 1 -8 4 8.74 6.06678 1 1 -8 5 36.82 7.22943 1 1 -8 6 40.21 7.42501 1 1 -7 1 59.83 8.03909 1 1 -7 2 54.21 7.82096 1 1 -7 3 146.47 10.2254 1 1 -7 4 13.57 5.74583 1 1 -7 5 200.79 11.7094 1 1 -7 6 17.30 6.10395 1 1 -7 7 45.75 7.67234 1 1 -7 8 1.33 5.54755 1 1 -6 1 28.39 6.2275 1 1 -6 2 -3.10 3.9495 1 1 -6 3 14.43 5.1237 1 1 -6 5 187.65 10.9021 1 1 -6 6 136.695 11.9284 1 1 -6 7 14.975 3.32113 1 1 -6 8 133.79 6.59442 1 1 -6 9 41.39 7.34128 1 1 -6 10 51.47 7.72199 1 1 -5 1 285.36 13.3708 1 1 -5 2 266.655 19.1171 1 1 -5 3 442.90 14.4122 1 1 -5 4 44.0743 2.78648 1 1 -5 5 534.844 18.8623 1 1 -5 6 17.00 3.0945 1 1 -5 7 64.565 4.64119 1 1 -5 8 3.095 2.8477 1 1 -5 9 7.13 3.12678 1 1 -5 10 2.835 3.1257 1 1 -5 11 72.74 8.2008 1 1 -5 12 79.36 9.78232 1 1 -4 1 90.12 7.56012 1 1 -4 2 17.63 2.15985 1 1 -4 3 37.4503 4.00996 1 1 -4 4 3.28206 1.34558 1 1 -4 5 124.435 5.57574 1 1 -4 6 85.63 4.69974 1 1 -4 7 2.195 2.35404 1 1 -4 8 498.35 33.5502 1 1 -4 9 162.90 24.4605 1 1 -4 10 133.28 6.60971 1 1 -4 11 198.88 8.28147 1 1 -4 12 -4.08 6.36 1 1 -4 13 10.575 3.94595 1 1 -3 1 286.426 9.82905 1 1 -3 2 278.876 12.6909 1 1 -3 3 1101.11 30.1058 1 1 -3 4 94.1349 3.60863 1 1 -3 5 1117.17 29.5426 1 1 -3 6 30.4122 3.39447 1 1 -3 7 10.145 2.42492 1 1 -3 8 37.465 8.59764 1 1 -3 9 -0.35 8.00 1 1 -3 10 53.00 5.72336 1 1 -3 11 56.31 5.76392 1 1 -3 12 88.12 7.37634 1 1 -3 13 17.59 4.73668 1 1 -3 14 200.33 11.1613 1 1 -2 1 275.824 10.4082 1 1 -2 2 137.693 6.20705 1 1 -2 3 47.9216 4.9234 1 1 -2 4 50.4696 2.42364 1 1 -2 5 642.89 19.6728 1 1 -2 6 378.26 12.2052 1 1 -2 7 21.26 3.07523 1 1 -2 8 1029.04 36.6349 1 1 -2 9 254.49 11.526 1 1 -2 10 185.16 9.61974 1 1 -2 11 328.35 13.9713 1 1 -2 12 1.93 3.73954 1 1 -2 13 22.03 4.90692 1 1 -2 14 5.83 4.54852 1 1 -1 1 978.762 26.493 1 1 -1 2 846.115 33.3158 1 1 -1 3 1811.49 85.9674 1 1 -1 4 9.05 1.21101 1 1 -1 5 2219.85 64.317 1 1 -1 6 13.80 1.68893 1 1 -1 7 316.97 13.1247 1 1 -1 8 9.29 2.79646 1 1 -1 9 7.25 2.77079 1 1 -1 10 1.52 2.98142 1 1 -1 11 162.67 9.18491 1 1 -1 12 183.58 9.7803 1 1 -1 13 31.07 5.20175 1 1 -1 14 243.18 12.2537 1 1 0 1 262.045 7.58168 1 1 0 2 18.36 1.23412 1 1 0 3 622.745 44.512 1 1 0 4 22.195 1.63879 1 1 0 5 1377.22 41.1453 1 1 0 6 553.415 35.1399 1 1 0 7 53.575 3.24717 1 1 0 8 389.62 15.8151 1 1 0 9 18.50 3.46885 1 1 0 10 105.47 7.14365 1 1 0 11 461.59 18.4759 1 1 0 12 5.44 3.58691 1 1 0 13 64.86 6.71163 1 1 0 14 7.23 4.16421 1 1 0 15 0.43 4.33158 1 1 1 0 8.54531 0.61543 1 1 1 1 938.771 39.5115 1 1 1 2 765.468 32.5545 1 1 1 3 1708.36 71.0057 1 1 1 4 8.86 1.2039 1 1 1 5 2261.03 63.5738 1 1 1 6 14.115 2.63284 1 1 1 7 314.74 10.4701 1 1 1 8 7.38 1.84382 1 1 1 9 5.42 2.84949 1 1 1 10 1.03 3.14992 1 1 1 11 162.07 9.22728 1 1 1 12 170.66 9.95977 1 1 1 13 32.68 5.49098 1 1 2 0 1088.76 30.7365 1 1 2 1 278.873 10.4317 1 1 2 2 134.857 4.17558 1 1 2 3 47.5115 2.77055 1 1 2 4 50.1385 2.09209 1 1 2 5 651.41 18.1207 1 1 2 6 385.455 11.1471 1 1 2 7 23.135 2.25805 1 1 2 8 1049.29 79.7735 1 1 2 9 257.46 11.8729 1 1 2 10 192.75 10.0701 1 1 2 11 331.12 14.4349 1 1 2 12 0.56 3.56438 1 1 2 13 19.64 4.8029 1 1 2 14 6.46 4.80385 1 1 3 0 49.275 3.00922 1 1 3 1 289.06 10.5837 1 1 3 2 284.945 8.54014 1 1 3 3 1117.64 32.6903 1 1 3 4 98.51 4.80161 1 1 3 5 1109.82 29.2494 1 1 3 6 30.074 3.12488 1 1 3 7 11.4338 2.81844 1 1 3 8 31.3929 2.78559 1 1 3 9 -0.72 3.26325 1 1 3 10 55.59 6.01637 1 1 3 11 36.04 5.72366 1 1 3 12 95.99 7.89382 1 1 3 13 18.63 5.29205 1 1 3 14 191.99 11.4422 1 1 4 0 294.198 12.0708 1 1 4 1 90.50 6.38719 1 1 4 2 16.67 2.6014 1 1 4 3 41.465 3.16802 1 1 4 4 5.68 2.15961 1 1 4 5 117.57 6.0313 1 1 4 6 81.82 3.98739 1 1 4 7 0.3789 1.94563 1 1 4 8 431.14 13.9076 1 1 4 9 158.415 15.638 1 1 4 10 145.79 9.00536 1 1 4 11 186.83 10.4599 1 1 4 12 -1.54 4.26916 1 1 4 13 6.36 4.7821 1 1 5 0 75.685 6.27408 1 1 5 1 300.61 13.5855 1 1 5 2 275.885 15.6192 1 1 5 3 488.225 14.9965 1 1 5 4 39.83 3.99831 1 1 5 5 551.645 16.092 1 1 5 6 17.835 2.48705 1 1 5 7 69.315 3.99515 1 1 5 8 2.07 2.29131 1 1 5 9 8.13 2.76071 1 1 5 10 1.77 3.95671 1 1 5 11 46.04 6.2633 1 1 5 12 73.25 7.3471 1 1 6 0 162.87 10.1121 1 1 6 1 26.15 5.91872 1 1 6 2 0.22 2.83956 1 1 6 3 11.25 3.12227 1 1 6 4 29.75 3.54422 1 1 6 5 167.42 8.63456 1 1 6 6 139.315 15.3126 1 1 6 7 12.325 2.49636 1 1 6 8 152.08 8.52131 1 1 6 9 36.84 5.2529 1 1 6 10 57.83 6.36197 1 1 7 0 2.97 5.26667 1 1 7 1 61.01 10.059 1 1 7 2 57.625 8.24586 1 1 7 3 141.075 6.77993 1 1 7 4 18.36 9.55035 1 1 8 0 79.69 14.4235 1 1 8 1 5.005 8.56343 1 1 8 2 -1.455 5.28668 1 1 8 3 3.62 6.12444 1 2 -8 1 11.665 4.93198 1 2 -8 2 1.72 6.15938 1 2 -8 3 84.53 9.31052 1 2 -8 4 55.40 8.22137 1 2 -8 5 55.22 8.20263 1 2 -7 1 33.42 6.81039 1 2 -7 2 11.69 5.39313 1 2 -7 3 185.88 11.6347 1 2 -7 4 31.02 6.54859 1 2 -7 5 27.05 6.49822 1 2 -7 6 13.09 5.96796 1 2 -7 7 40.03 7.28851 1 2 -7 8 4.71 5.75034 1 2 -6 1 21.56 5.85289 1 2 -6 2 0.36 4.60412 1 2 -6 3 447.02 19.0227 1 2 -6 4 158.78 10.2849 1 2 -6 5 100.25 8.24279 1 2 -6 6 166.705 8.09889 1 2 -6 7 26.995 3.87275 1 2 -6 8 36.335 4.93381 1 2 -6 9 97.42 8.95812 1 2 -6 10 12.31 6.26775 1 2 -5 1 47.58 3.88352 1 2 -5 2 28.33 3.15735 1 2 -5 3 540.515 16.7135 1 2 -5 4 57.74 7.84561 1 2 -5 5 63.545 7.37319 1 2 -5 6 2.945 2.75683 1 2 -5 7 64.44 4.80231 1 2 -5 8 4.19 3.01559 1 2 -5 9 119.075 6.34945 1 2 -5 10 13.21 5.8727 1 2 -5 11 193.325 8.26681 1 2 -4 1 172.315 11.4516 1 2 -4 2 28.695 2.71009 1 2 -4 3 514.25 28.0942 1 2 -4 4 88.0569 3.79252 1 2 -4 5 199.215 15.0759 1 2 -4 6 578.99 29.4465 1 2 -4 7 128.825 6.18364 1 2 -4 8 128.115 8.19511 1 2 -4 9 252.72 16.8845 1 2 -4 10 2.77 3.0927 1 2 -4 11 10.77 3.48832 1 2 -4 12 16.355 4.17288 1 2 -4 13 72.20 6.98709 1 2 -3 1 618.956 17.6331 1 2 -3 2 428.258 14.3458 1 2 -3 3 1583.55 56.5382 1 2 -3 4 9.19462 1.50914 1 2 -3 5 11.0681 1.67547 1 2 -3 6 122.56 5.59425 1 2 -3 7 258.105 10.0382 1 2 -3 8 15.395 3.31115 1 2 -3 9 226.02 8.93367 1 2 -3 10 10.74 3.62645 1 2 -3 11 246.65 11.4586 1 2 -3 12 28.12 5.13893 1 2 -3 13 118.76 8.11261 1 2 -2 1 55.3712 2.23035 1 2 -2 2 542.732 21.5899 1 2 -2 3 728.449 20.5747 1 2 -2 4 45.8733 2.45595 1 2 -2 5 258.645 8.75328 1 2 -2 6 915.48 32.6594 1 2 -2 7 111.14 6.64118 1 2 -2 8 182.77 9.10466 1 2 -2 9 473.05 18.6209 1 2 -2 10 2.59 2.95392 1 2 -2 11 4.54 3.50264 1 2 -2 12 40.61 5.46036 1 2 -2 13 73.16 6.97686 1 2 -2 14 35.23 5.73215 1 2 -1 1 4.49287 0.83761 1 2 -1 2 13.015 1.18469 1 2 -1 3 2991.25 98.0777 1 2 -1 4 139.125 5.1115 1 2 -1 5 303.95 15.0838 1 2 -1 6 7.38 2.38775 1 2 -1 7 275.93 11.8743 1 2 -1 8 13.75 3.08416 1 2 -1 9 361.54 14.6546 1 2 -1 10 25.15 4.15002 1 2 -1 11 429.79 17.2442 1 2 -1 12 73.43 6.37255 1 2 -1 13 186.82 10.1828 1 2 -1 14 8.30 4.46791 1 2 0 0 328.174 8.67689 1 2 0 1 286.85 8.68265 1 2 0 2 15.345 1.20035 1 2 0 3 7343.19 166.258 1 2 0 4 1649.59 123.261 1 2 0 5 739.735 33.6161 1 2 0 6 843.40 30.1147 1 2 0 7 18.65 2.07187 1 2 0 8 97.68 6.01973 1 2 0 9 393.27 15.8459 1 2 0 10 12.54 3.73453 1 2 0 11 19.04 3.97049 1 2 0 12 49.80 5.63771 1 2 0 13 58.17 6.15251 1 2 0 14 15.91 5.04915 1 2 1 0 941.105 26.9766 1 2 1 1 6.065 1.7633 1 2 1 2 16.205 1.20664 1 2 1 3 2962.13 84.2129 1 2 1 4 142.681 5.13936 1 2 1 5 316.366 9.20827 1 2 1 6 11.21 4.09092 1 2 1 7 271.05 11.5184 1 2 1 8 12.025 7.06656 1 2 1 9 337.19 14.5457 1 2 1 10 21.53 4.14061 1 2 1 11 410.11 17.2156 1 2 1 12 76.20 6.88079 1 2 1 13 185.11 10.0489 1 2 1 14 3.37 4.38221 1 2 2 0 47.28 1.70263 1 2 2 1 55.0086 3.47639 1 2 2 2 565.035 18.6488 1 2 2 3 737.89 26.7449 1 2 2 4 40.185 2.16688 1 2 2 5 261.365 8.52762 1 2 2 6 940.97 26.7634 1 2 2 7 121.725 4.97197 1 2 2 8 179.42 6.77935 1 2 2 9 488.66 28.8843 1 2 2 10 -1.05 3.4723 1 2 2 11 -0.44 3.43055 1 2 2 12 30.22 5.41112 1 2 2 13 73.06 7.22741 1 2 2 14 33.87 5.9967 1 2 3 0 951.425 28.4206 1 2 3 1 614.208 17.34 1 2 3 2 421.685 12.0764 1 2 3 3 1595.93 41.3148 1 2 3 4 10.095 3.08005 1 2 3 5 10.025 1.51195 1 2 3 6 116.445 6.90391 1 2 3 7 258.05 8.79594 1 2 3 8 11.24 3.0034 1 2 3 9 230.17 11.2039 1 2 3 10 9.94 4.07182 1 2 3 11 239.01 11.9545 1 2 3 12 32.18 5.54096 1 2 3 13 114.06 8.558 1 2 4 0 3.93 1.88319 1 2 4 1 170.789 9.4095 1 2 4 2 27.8741 3.06308 1 2 4 3 525.91 15.6331 1 2 4 4 87.47 5.33029 1 2 4 5 191.895 8.58005 1 2 4 6 537.595 21.8393 1 2 4 7 123.445 7.69742 1 2 4 8 134.22 8.16415 1 2 4 9 240.32 11.6747 1 2 4 10 3.37 4.02541 1 2 4 11 4.67 4.28516 1 2 4 12 7.20 4.71071 1 2 4 13 53.88 6.75828 1 2 5 0 224.62 11.0967 1 2 5 1 52.30 5.8783 1 2 5 2 29.9823 4.21743 1 2 5 3 556.105 31.1966 1 2 5 4 53.715 3.7531 1 2 5 5 58.365 8.79546 1 2 5 6 3.82 6.1097 1 2 5 7 61.65 11.2429 1 2 5 8 5.61 3.69503 1 2 5 9 107.81 7.70712 1 2 5 10 11.44 4.51971 1 2 5 11 202.81 11.1854 1 2 6 0 36.99 5.77173 1 2 6 1 26.35 5.73618 1 2 6 2 0.97 5.58616 1 2 6 3 442.53 18.7594 1 2 6 4 148.89 5.68992 1 2 6 5 102.64 5.78995 1 2 6 6 150.36 8.15807 1 2 6 7 17.91 3.86015 1 2 6 8 35.76 4.95708 1 2 6 9 100.93 7.49962 1 2 6 10 2.25 4.22165 1 2 7 0 121.60 9.84479 1 2 7 1 40.095 4.35805 1 2 7 2 16.375 4.38464 1 2 7 3 196.01 11.4794 1 2 8 0 1.93 3.6979 1 2 8 1 5.71 6.06531 1 2 8 2 0.76 5.86013 1 3 -8 1 93.69 6.71215 1 3 -8 2 51.645 5.86586 1 3 -8 3 81.04 9.17733 1 3 -8 4 87.50 9.28029 1 3 -7 1 26.995 4.69262 1 3 -7 2 7.38 5.73901 1 3 -7 3 17.12 6.01635 1 3 -7 4 8.98 5.67056 1 3 -7 5 30.90 7.00064 1 3 -7 6 41.69 7.51076 1 3 -7 7 16.74 6.6685 1 3 -6 1 277.55 14.5859 1 3 -6 2 147.57 10.0019 1 3 -6 3 151.77 10.0729 1 3 -6 4 202.10 11.8122 1 3 -6 5 24.58 6.32094 1 3 -6 6 113.235 6.22515 1 3 -6 7 13.225 4.18423 1 3 -6 8 2.12 5.4024 1 3 -6 9 27.205 4.25327 1 3 -5 1 47.07 6.43737 1 3 -5 2 7.31 4.13952 1 3 -5 3 7.27 4.25327 1 3 -5 4 20.41 3.16149 1 3 -5 5 130.345 7.48076 1 3 -5 6 117.13 6.9545 1 3 -5 7 32.765 5.22299 1 3 -5 8 283.445 26.5092 1 3 -5 9 82.91 7.66484 1 3 -5 10 83.885 8.7071 1 3 -5 11 57.255 7.09372 1 3 -4 1 244.72 12.0919 1 3 -4 2 114.60 7.59789 1 3 -4 3 213.41 8.06363 1 3 -4 4 397.925 13.1347 1 3 -4 5 13.985 2.74045 1 3 -4 6 290.185 10.2348 1 3 -4 7 44.145 4.05784 1 3 -4 8 54.41 5.88973 1 3 -4 9 1.185 3.02541 1 3 -4 10 -0.03 4.63633 1 3 -4 11 104.73 9.47712 1 3 -4 12 86.975 6.55924 1 3 -3 1 373.469 11.1139 1 3 -3 2 9.58918 1.72743 1 3 -3 3 45.9426 3.18524 1 3 -3 4 2.605 1.89903 1 3 -3 5 256.015 9.2781 1 3 -3 6 228.295 14.0549 1 3 -3 7 82.355 4.94356 1 3 -3 8 545.535 19.3084 1 3 -3 9 55.045 4.64722 1 3 -3 10 63.37 5.01484 1 3 -3 11 55.265 5.13284 1 3 -3 12 14.685 4.0019 1 3 -3 13 31.705 8.01307 1 3 -2 1 805.45 38.0719 1 3 -2 2 373.597 10.9789 1 3 -2 3 481.442 13.9312 1 3 -2 4 750.574 21.0757 1 3 -2 5 4.88 2.25339 1 3 -2 6 425.25 16.682 1 3 -2 7 33.49 3.93441 1 3 -2 8 35.52 4.3188 1 3 -2 9 26.19 4.25995 1 3 -2 10 4.01 3.16813 1 3 -2 11 199.15 10.3161 1 3 -2 12 110.39 7.93883 1 3 -2 13 13.64 4.6479 1 3 -1 1 198.522 6.01938 1 3 -1 2 4.805 1.15249 1 3 -1 3 77.305 3.47021 1 3 -1 4 3.13 1.3076 1 3 -1 5 471.76 18.6134 1 3 -1 6 197.16 9.29894 1 3 -1 7 24.95 3.62223 1 3 -1 8 836.65 31.511 1 3 -1 9 139.71 8.29548 1 3 -1 10 222.35 10.8888 1 3 -1 11 164.79 9.42957 1 3 -1 12 16.59 4.54055 1 3 -1 13 17.96 4.94896 1 3 -1 14 48.16 6.28035 1 3 0 0 22.649 1.18717 1 3 0 1 1744.28 49.7779 1 3 0 2 680.03 20.8548 1 3 0 3 635.025 19.5389 1 3 0 4 1287.53 37.7528 1 3 0 5 39.39 3.70373 1 3 0 6 979.89 34.4145 1 3 0 7 48.25 4.26642 1 3 0 8 12.65 3.03649 1 3 0 9 57.89 5.44048 1 3 0 10 2.38 3.21159 1 3 0 11 111.79 7.85235 1 3 0 12 30.75 5.08368 1 3 0 13 2.62 4.2107 1 3 1 0 161.469 4.47795 1 3 1 1 200.976 5.79382 1 3 1 2 5.50831 0.81408 1 3 1 3 86.005 3.6105 1 3 1 4 2.395 2.04389 1 3 1 5 490.662 13.8737 1 3 1 6 200.235 7.01196 1 3 1 7 25.28 3.37544 1 3 1 8 906.395 54.3007 1 3 1 9 161.18 13.5357 1 3 1 10 211.48 10.834 1 3 1 11 166.50 9.2623 1 3 1 12 12.53 4.34979 1 3 1 13 18.78 4.77555 1 3 1 14 42.93 6.26377 1 3 2 0 154.895 4.28988 1 3 2 1 874.888 22.7625 1 3 2 2 375.857 11.0826 1 3 2 3 485.22 19.2966 1 3 2 4 780.295 22.9122 1 3 2 5 3.12 1.12206 1 3 2 6 420.07 13.0677 1 3 2 7 34.20 2.68545 1 3 2 8 40.765 5.72858 1 3 2 9 24.65 4.30511 1 3 2 10 3.39 3.22447 1 3 2 11 192.89 10.5124 1 3 2 12 113.77 8.27095 1 3 2 13 12.56 4.8321 1 3 3 0 834.39 21.7556 1 3 3 1 361.825 10.4168 1 3 3 2 8.695 2.7682 1 3 3 3 51.48 7.28638 1 3 3 4 0.67 1.81107 1 3 3 5 246.52 10.8706 1 3 3 6 234.52 10.396 1 3 3 7 77.235 6.14014 1 3 3 8 598.75 21.5678 1 3 3 9 51.39 5.59313 1 3 3 10 63.62 6.32168 1 3 3 11 59.14 6.45971 1 3 3 12 8.00 4.51052 1 3 3 13 30.94 5.78432 1 3 4 0 16.755 4.73796 1 3 4 1 253.46 11.1258 1 3 4 2 99.225 4.95708 1 3 4 3 191.77 8.6301 1 3 4 4 387.61 15.0403 1 3 4 5 11.87 2.78415 1 3 4 6 242.11 11.5251 1 3 4 7 35.32 4.63046 1 3 4 8 61.16 5.92764 1 3 4 9 2.64 3.47403 1 3 4 10 1.39 3.7747 1 3 4 12 83.41 7.60392 1 3 5 0 65.72 6.21109 1 3 5 1 44.78 5.49954 1 3 5 2 -1.085 3.05 1 3 5 3 1.195 4.44774 1 3 5 4 14.28 2.68539 1 3 5 5 133.48 7.14105 1 3 5 6 102.17 6.71705 1 3 5 7 29.18 4.29857 1 3 5 8 303.33 12.8628 1 3 5 9 81.32 6.64496 1 3 5 10 99.44 7.57752 1 3 5 11 64.62 7.06608 1 3 6 0 44.36 6.59019 1 3 6 1 326.24 14.2746 1 3 6 2 125.76 6.84329 1 3 6 3 138.49 6.69357 1 3 7 0 38.83 6.8591 1 3 7 1 26.755 3.89886 1 3 8 0 10.18 6.13781 1 3 8 1 106.11 9.68713 1 4 -8 1 83.95 6.49757 1 4 -8 2 13.75 4.7744 1 4 -7 1 8.40 6.11085 1 4 -7 2 121.04 10.1106 1 4 -7 3 50.49 7.84024 1 4 -7 4 56.81 8.08965 1 4 -7 5 3.74 5.83312 1 4 -7 6 190.66 12.4568 1 4 -6 1 159.87 7.72081 1 4 -6 2 24.07 6.17189 1 4 -6 3 252.54 13.3111 1 4 -6 4 4.60 5.21275 1 4 -6 5 4.48 5.53025 1 4 -6 6 9.63 3.41376 1 4 -6 7 6.85 3.58527 1 4 -6 8 45.72 4.95699 1 4 -6 9 61.41 16.8148 1 4 -5 1 82.50 6.2886 1 4 -5 2 190.65 10.7743 1 4 -5 3 100.33 8.23914 1 4 -5 4 101.645 6.10552 1 4 -5 5 9.415 3.17283 1 4 -5 6 533.59 30.7512 1 4 -5 7 70.60 6.32188 1 4 -5 8 86.23 5.78937 1 4 -5 9 159.605 7.67928 1 4 -5 10 15.79 6.46716 1 4 -4 1 373.23 12.8029 1 4 -4 2 4.84 3.68266 1 4 -4 3 273.965 9.95087 1 4 -4 4 32.83 3.52293 1 4 -4 5 12.035 2.92638 1 4 -4 6 3.935 2.63335 1 4 -4 7 24.32 7.51931 1 4 -4 8 57.545 4.93825 1 4 -4 9 114.725 6.92399 1 4 -4 10 154.015 16.3399 1 4 -4 11 72.88 5.71391 1 4 -3 1 261.33 14.9779 1 4 -3 2 357.92 12.3853 1 4 -3 3 261.815 9.47869 1 4 -3 4 301.195 10.6618 1 4 -3 5 46.56 3.87964 1 4 -3 6 1164.55 31.3199 1 4 -3 7 37.595 3.83298 1 4 -3 8 43.415 4.29055 1 4 -3 9 186.92 8.0812 1 4 -3 10 55.645 5.02064 1 4 -3 11 18.16 3.96334 1 4 -3 12 2.905 3.60317 1 4 -2 1 896.916 23.7914 1 4 -2 2 10.585 2.00613 1 4 -2 3 867.895 38.1691 1 4 -2 4 10.125 2.11685 1 4 -2 5 96.605 9.21381 1 4 -2 6 3.67 2.5562 1 4 -2 7 58.75 5.46527 1 4 -2 8 85.41 6.28747 1 4 -2 9 158.20 8.94306 1 4 -2 10 199.60 10.3861 1 4 -2 11 94.14 7.40875 1 4 -2 12 296.04 13.9673 1 4 -2 13 47.39 6.23473 1 4 -1 1 465.092 13.0403 1 4 -1 2 1141.43 41.5406 1 4 -1 3 453.85 17.4424 1 4 -1 4 155.69 7.62094 1 4 -1 5 11.30 2.71538 1 4 -1 6 1467.42 52.8769 1 4 -1 7 86.09 6.17028 1 4 -1 8 199.80 10.3734 1 4 -1 9 514.97 19.9366 1 4 -1 10 39.87 5.19645 1 4 -1 11 52.09 6.03213 1 4 -1 12 2.52 3.9565 1 4 -1 13 14.50 4.82338 1 4 0 0 1250.79 32.0451 1 4 0 1 688.012 19.306 1 4 0 2 12.0017 1.3266 1 4 0 3 1560.95 43.9487 1 4 0 4 32.49 3.36823 1 4 0 5 8.26 2.31269 1 4 0 6 139.57 7.34206 1 4 0 7 5.43 2.80283 1 4 0 8 226.93 10.8421 1 4 0 9 171.47 9.31089 1 4 0 10 157.99 9.11305 1 4 0 11 48.28 5.9618 1 4 0 12 232.97 11.7532 1 4 0 13 28.93 5.19659 1 4 1 0 443.042 14.5821 1 4 1 1 463.657 14.4135 1 4 1 2 1154.89 31.153 1 4 1 3 445.279 12.7004 1 4 1 4 147.91 7.3552 1 4 1 5 12.27 2.6495 1 4 1 6 1569.06 75.7512 1 4 1 7 84.23 4.09496 1 4 1 8 223.34 12.8412 1 4 1 9 506.79 19.9156 1 4 1 10 42.74 5.35799 1 4 1 11 41.94 5.67972 1 4 1 12 5.61 4.11449 1 4 1 13 20.68 5.14937 1 4 2 0 1299.38 33.095 1 4 2 1 923.347 23.9044 1 4 2 2 12.815 1.43247 1 4 2 3 893.52 33.0537 1 4 2 4 12.41 1.67748 1 4 2 5 100.94 5.85693 1 4 2 6 9.70 2.76685 1 4 2 7 55.035 4.53203 1 4 2 8 87.07 6.41704 1 4 2 9 154.04 8.88501 1 4 2 10 201.58 10.4724 1 4 2 11 93.63 7.47255 1 4 2 12 302.51 14.1961 1 4 2 13 43.82 6.29618 1 4 3 0 303.666 8.34039 1 4 3 1 262.732 7.29819 1 4 3 2 363.054 10.5461 1 4 3 3 264.088 8.07226 1 4 3 4 326.94 12.6868 1 4 3 5 49.49 4.46115 1 4 3 6 1127.51 40.2418 1 4 3 7 39.78 4.55713 1 4 3 8 51.88 5.30287 1 4 3 9 203.73 10.1206 1 4 3 10 45.84 5.7861 1 4 3 11 16.82 4.75653 1 4 3 12 -0.43 4.31774 1 4 4 0 533.865 36.4247 1 4 4 1 379.651 12.2205 1 4 4 2 4.08 1.71924 1 4 4 3 281.77 11.2297 1 4 4 4 28.13 3.29882 1 4 4 5 11.23 2.97653 1 4 4 6 4.89 2.97679 1 4 4 7 21.03 3.9362 1 4 4 8 61.30 5.81115 1 4 4 9 106.09 7.54606 1 4 4 10 146.71 9.01291 1 4 4 11 77.14 7.16677 1 4 5 0 39.14 4.34352 1 4 5 1 71.03 4.50444 1 4 5 2 168.595 10.2726 1 4 5 3 88.77 5.0327 1 4 5 4 92.45 5.53278 1 4 5 5 3.82 2.54473 1 4 5 6 527.39 19.8437 1 4 5 7 68.51 5.8643 1 4 5 8 93.51 6.89101 1 4 5 9 165.00 9.1636 1 4 5 10 8.27 4.32438 1 4 6 0 178.53 10.5205 1 4 7 0 25.32 6.52548 1 4 8 0 113.18 9.46023 1 5 -7 1 123.10 9.70079 1 5 -7 2 48.44 5.45232 1 5 -7 3 70.175 5.97479 1 5 -7 4 48.34 8.13938 1 5 -7 5 32.96 7.42798 1 5 -6 1 161.805 14.1282 1 5 -6 2 15.925 7.43596 1 5 -6 3 9.63 5.47789 1 5 -6 4 6.74 5.08749 1 5 -6 5 217.37 12.3232 1 5 -6 6 10.23 3.77624 1 5 -6 7 125.575 6.85076 1 5 -6 8 82.69 7.13567 1 5 -5 1 234.905 9.55492 1 5 -5 2 69.425 9.9672 1 5 -5 3 137.07 9.69445 1 5 -5 4 86.52 5.6277 1 5 -5 5 44.99 4.69417 1 5 -5 6 180.835 8.11094 1 5 -5 7 2.39 7.33987 1 5 -5 8 1.20 4.08712 1 5 -5 9 1.315 3.66994 1 5 -4 1 218.035 23.4269 1 5 -4 2 70.57 16.6826 1 5 -4 3 -0.94 3.583 1 5 -4 4 7.255 2.90619 1 5 -4 5 372.015 12.5331 1 5 -4 6 34.65 5.55665 1 5 -4 7 206.325 8.61108 1 5 -4 8 99.89 5.92742 1 5 -4 9 179.535 8.10626 1 5 -4 10 34.995 4.7045 1 5 -4 11 166.385 8.24453 1 5 -3 1 615.525 18.9785 1 5 -3 2 289.53 9.36042 1 5 -3 3 629.115 19.2833 1 5 -3 4 292.71 10.5857 1 5 -3 5 102.76 8.237 1 5 -3 6 392.415 31.8155 1 5 -3 7 5.305 2.92558 1 5 -3 8 8.70 3.14178 1 5 -3 9 -0.86 4.3528 1 5 -3 10 0.765 3.75476 1 5 -3 11 153.35 10.1097 1 5 -2 1 314.113 10.654 1 5 -2 2 255.221 8.20209 1 5 -2 3 0.19 1.82242 1 5 -2 4 4.575 4.64626 1 5 -2 5 794.39 22.9022 1 5 -2 6 65.55 4.53552 1 5 -2 7 312.66 13.6079 1 5 -2 8 136.21 8.32453 1 5 -2 9 211.27 10.5335 1 5 -2 10 33.14 5.17514 1 5 -2 11 194.69 10.4431 1 5 -2 12 21.53 5.22155 1 5 -1 1 1069.33 28.7423 1 5 -1 2 113.214 4.27568 1 5 -1 3 404.29 16.5487 1 5 -1 4 205.30 9.75932 1 5 -1 5 90.54 6.13708 1 5 -1 6 589.08 22.0128 1 5 -1 7 8.79 3.07805 1 5 -1 8 6.04 3.18691 1 5 -1 9 2.53 3.5214 1 5 -1 10 6.49 4.03017 1 5 -1 11 167.12 9.7197 1 5 -1 12 2.27 4.25057 1 5 0 0 1273.02 31.7703 1 5 0 1 1987.69 49.5479 1 5 0 2 21.275 2.08005 1 5 0 3 22.615 3.23714 1 5 0 4 5.97 2.49116 1 5 0 5 1293.73 45.1243 1 5 0 6 45.01 4.52721 1 5 0 7 514.46 19.6938 1 5 0 8 261.99 11.8878 1 5 0 9 342.18 14.5579 1 5 0 10 38.03 5.20317 1 5 0 11 188.76 10.1703 1 5 0 12 4.42 4.16901 1 5 1 0 65.3831 3.81929 1 5 1 1 1080.41 32.1485 1 5 1 2 113.935 6.1704 1 5 1 3 428.865 13.1783 1 5 1 4 214.075 7.37723 1 5 1 5 88.575 4.03351 1 5 1 6 586.03 21.8313 1 5 1 7 11.14 3.35644 1 5 1 8 9.10 3.49749 1 5 1 9 5.54 3.56268 1 5 1 10 7.35 3.68693 1 5 1 11 182.21 9.96132 1 5 1 12 6.05 4.28582 1 5 2 0 211.822 5.7974 1 5 2 1 329.062 11.1308 1 5 2 2 266.77 16.9248 1 5 2 3 0.40 1.97623 1 5 2 4 2.74 2.28469 1 5 2 5 817.44 28.7467 1 5 2 6 63.99 5.31089 1 5 2 7 316.04 13.334 1 5 2 8 133.99 8.07402 1 5 2 9 211.74 10.6026 1 5 2 10 32.13 5.06812 1 5 2 11 209.72 10.9134 1 5 2 12 15.83 4.9063 1 5 3 0 4.90302 0.94887 1 5 3 1 626.867 18.1076 1 5 3 2 317.229 9.23225 1 5 3 3 659.515 24.4596 1 5 3 4 306.97 12.3933 1 5 3 5 107.58 6.5419 1 5 3 6 403.54 15.5527 1 5 3 7 9.77 3.26844 1 5 3 8 6.83 3.43218 1 5 3 9 3.03 3.57563 1 5 3 10 2.95 3.79898 1 5 3 11 144.02 9.19351 1 5 3 12 10.46 4.59654 1 5 4 0 200.935 6.14655 1 5 4 1 235.035 7.96788 1 5 4 2 61.02 4.31601 1 5 4 3 0.87 2.14113 1 5 4 4 9.68 2.6853 1 5 4 5 373.47 14.5186 1 5 4 6 30.99 4.06924 1 5 4 7 205.36 9.98943 1 5 4 8 115.47 7.43466 1 5 4 9 182.58 9.72628 1 5 4 10 37.17 5.43231 1 5 4 11 165.23 9.8693 1 5 5 4 91.91 5.40192 1 5 5 5 47.08 4.55889 1 5 5 6 197.84 9.09957 1 5 5 7 4.95 3.23036 1 5 5 8 -1.42 3.37096 1 5 5 9 -2.88 3.57903 1 6 -7 1 27.21 7.69122 1 6 -7 2 43.675 5.38243 1 6 -7 3 7.66 4.39058 1 6 -6 1 4.58 5.24723 1 6 -6 2 59.83 8.08052 1 6 -6 3 75.355 11.2849 1 6 -6 4 52.885 5.60568 1 6 -6 5 100.34 9.39289 1 6 -6 6 143.28 10.6667 1 6 -5 1 82.06 5.71677 1 6 -5 2 159.76 7.62156 1 6 -5 3 19.11 9.35283 1 6 -5 4 109.63 9.28327 1 6 -5 5 8.54 3.58283 1 6 -5 6 -2.93 5.08 1 6 -5 7 35.18 4.61797 1 6 -5 8 11.34 3.94658 1 6 -4 1 8.735 4.08234 1 6 -4 2 105.95 5.99444 1 6 -4 3 199.595 7.25628 1 6 -4 4 70.23 5.081 1 6 -4 5 99.205 5.87479 1 6 -4 6 173.285 9.40922 1 6 -4 7 34.475 4.9867 1 6 -4 8 37.39 4.61743 1 6 -4 9 49.795 8.8527 1 6 -4 10 21.80 4.29467 1 6 -3 1 78.58 4.88764 1 6 -3 2 222.48 7.63679 1 6 -3 3 27.1777 2.85108 1 6 -3 4 272.725 10.0279 1 6 -3 5 8.665 2.97024 1 6 -3 6 -2.88 3.73913 1 6 -3 7 79.425 5.40319 1 6 -3 8 24.71 4.51414 1 6 -3 9 133.50 10.7314 1 6 -3 10 63.555 5.53084 1 6 -3 11 21.18 12.5061 1 6 -2 1 47.3479 3.07977 1 6 -2 2 187.454 9.86746 1 6 -2 3 416.953 12.3619 1 6 -2 4 111.77 5.65157 1 6 -2 5 207.085 8.26301 1 6 -2 6 410.49 13.5599 1 6 -2 7 73.19 6.32923 1 6 -2 8 101.36 6.00667 1 6 -2 9 97.82 7.31284 1 6 -2 10 24.37 5.22302 1 6 -2 11 18.62 5.01134 1 6 -1 1 100.423 4.02223 1 6 -1 2 446.421 13.0077 1 6 -1 3 45.9606 2.96257 1 6 -1 4 350.685 11.6756 1 6 -1 5 6.29 3.01161 1 6 -1 6 -0.16 2.9261 1 6 -1 7 64.36 6.14662 1 6 -1 8 2.98 3.561 1 6 -1 9 124.60 7.96502 1 6 -1 10 53.00 5.83694 1 6 -1 11 46.65 6.03279 1 6 0 0 55.525 3.25099 1 6 0 1 40.8709 2.52547 1 6 0 2 242.005 8.41574 1 6 0 3 364.39 11.811 1 6 0 4 49.59 3.89805 1 6 0 5 222.325 8.02599 1 6 0 6 577.40 21.9047 1 6 0 7 77.43 6.02685 1 6 0 8 96.42 7.11225 1 6 0 9 59.26 6.15433 1 6 0 10 7.46 4.16231 1 6 0 11 7.39 3.98427 1 6 0 12 3.85 4.27792 1 6 1 0 635.064 17.3701 1 6 1 1 100.99 4.31178 1 6 1 2 454.94 13.9612 1 6 1 3 46.29 2.86786 1 6 1 4 354.315 11.2699 1 6 1 5 2.915 4.27824 1 6 1 6 0.935 1.7999 1 6 1 7 73.57 6.08656 1 6 1 8 7.23 3.72299 1 6 1 9 125.17 8.18165 1 6 1 10 55.97 6.34152 1 6 1 11 53.21 6.30055 1 6 1 12 235.92 12.4162 1 6 2 0 30.44 1.79585 1 6 2 1 51.6522 2.45644 1 6 2 2 196.66 10.6465 1 6 2 3 426.48 16.2192 1 6 2 4 117.12 6.93735 1 6 2 5 205.27 9.99307 1 6 2 6 429.64 16.5282 1 6 2 7 73.68 6.1278 1 6 2 8 109.48 7.393 1 6 2 9 103.57 7.4904 1 6 2 10 26.01 5.15546 1 6 2 11 24.77 5.12473 1 6 3 0 460.516 13.5983 1 6 3 1 88.4251 3.4838 1 6 3 2 232.06 8.04928 1 6 3 3 28.22 3.52042 1 6 3 4 266.99 11.5585 1 6 3 5 6.55 3.16277 1 6 3 6 -4.43 2.94078 1 6 3 7 76.65 6.18445 1 6 3 8 27.62 4.56719 1 6 3 9 127.84 8.26411 1 6 3 10 59.77 6.4957 1 6 4 0 19.964 2.22081 1 6 4 1 9.7569 1.35474 1 6 4 2 111.00 5.93088 1 6 4 3 204.04 9.10445 1 6 4 4 71.63 5.4854 1 6 4 5 99.16 6.43373 1 6 4 6 193.13 9.19579 1 6 4 7 32.12 4.57168 1 6 4 8 33.95 4.88447 1 6 4 9 46.31 5.7405 1 6 4 10 18.52 4.6942 1 7 -6 1 8.96 4.64078 1 7 -6 2 69.77 5.86332 1 7 -6 3 70.805 5.9978 1 7 -6 4 119.88 7.09856 1 7 -6 5 18.02 6.49656 1 7 -5 1 94.17 10.9768 1 7 -5 2 39.43 11.2744 1 7 -5 3 27.865 4.68951 1 7 -5 4 -4.52 12.38 1 7 -5 5 29.4461 3.67417 1 7 -5 6 68.05 5.66402 1 7 -5 7 35.01 4.76568 1 7 -4 1 36.95 4.29887 1 7 -4 2 166.47 17.1735 1 7 -4 3 135.455 7.0735 1 7 -4 4 223.644 7.93245 1 7 -4 5 17.7335 3.21536 1 7 -4 6 76.33 5.62377 1 7 -4 7 65.955 5.50606 1 7 -3 1 235.655 10.7299 1 7 -3 2 60.935 4.90766 1 7 -3 3 95.2876 4.79925 1 7 -3 4-1.81782 9.80987 1 7 -3 5 83.1497 4.61962 1 7 -3 6 168.245 7.63269 1 7 -3 7 77.53 8.8394 1 7 -3 8 212.095 8.77759 1 7 -3 9 66.74 5.4308 1 7 -2 1 14.31 3.61333 1 7 -2 2 147.458 5.68657 1 7 -2 3 145.095 5.691 1 7 -2 4 333.438 10.2892 1 7 -2 5 9.31128 2.40532 1 7 -2 6 118.52 12.6553 1 7 -2 7 82.61 5.48712 1 7 -2 8 74.42 5.45791 1 7 -2 9 74.865 7.19038 1 7 -2 10 8.81 5.75753 1 7 -1 1 370.019 13.0993 1 7 -1 2 186.769 6.46491 1 7 -1 3 84.7607 3.9795 1 7 -1 4 12.8309 2.20494 1 7 -1 5 69.6715 3.98709 1 7 -1 6 151.80 7.73568 1 7 -1 7 55.36 5.6524 1 7 -1 8 228.10 11.2634 1 7 -1 9 70.90 6.73844 1 7 -1 10 153.80 9.12061 1 7 0 0 849.845 23.431 1 7 0 1 18.0482 2.07044 1 7 0 2 242.113 7.71793 1 7 0 3 357.915 11.6479 1 7 0 4 700.51 29.6265 1 7 0 5 49.46 3.72299 1 7 0 6 191.89 7.40389 1 7 0 7 92.67 6.81381 1 7 0 8 106.50 7.36683 1 7 0 9 64.01 6.66294 1 7 0 10 25.86 5.09194 1 7 0 11 92.57 7.72019 1 7 1 0 63.865 3.3897 1 7 1 1 376.095 11.936 1 7 1 2 183.99 6.82822 1 7 1 3 86.68 4.12937 1 7 1 4 12.835 2.06072 1 7 1 5 78.69 6.14331 1 7 1 6 151.70 8.72834 1 7 1 7 57.18 5.93137 1 7 1 8 246.48 11.5559 1 7 1 9 68.49 6.65948 1 7 1 10 153.94 9.03215 1 7 2 0 570.16 16.424 1 7 2 1 17.3804 1.9878 1 7 2 2 159.505 5.83457 1 7 2 3 154.12 7.99779 1 7 2 4 333.74 13.6808 1 7 2 5 12.15 3.51852 1 7 2 6 119.79 7.56756 1 7 2 7 77.14 6.52703 1 7 2 8 79.23 6.6471 1 7 2 9 75.76 7.00054 1 7 2 10 5.68 4.25021 1 7 3 1 242.97 10.5468 1 7 3 2 61.92 5.27433 1 7 3 3 101.09 6.56246 1 7 3 4 3.84 3.26538 1 7 3 5 87.82 6.26787 1 7 3 6 167.44 9.10827 1 7 3 7 88.63 6.59897 1 7 3 8 206.63 10.5248 1 7 3 9 70.20 6.92291 1 7 4 2 180.37 8.24089 1 7 4 3 144.99 7.32785 1 7 4 4 240.35 10.1937 1 7 4 5 18.14 3.8312 1 7 4 6 78.13 6.37509 1 7 4 7 70.09 6.35564 1 8 -6 1 56.13 6.57966 1 8 -6 2 87.31 8.63451 1 8 -5 1 -4.865 7.01 1 8 -5 2 30.685 4.65796 1 8 -5 3 113.235 7.9058 1 8 -5 4 5.01 8.85333 1 8 -5 5 158.12 7.83425 1 8 -4 1 64.205 5.83772 1 8 -4 2 71.115 5.46275 1 8 -4 3 42.875 4.81843 1 8 -4 4 30.625 4.61718 1 8 -4 5-1.49428 4.73388 1 8 -4 6 16.8075 3.36733 1 8 -4 7 0.69341 3.15449 1 8 -3 1 12.60 3.33179 1 8 -3 2 43.235 9.63387 1 8 -3 3 226.29 7.84081 1 8 -3 4-1.84893 6.66214 1 8 -3 5 284.039 13.1364 1 8 -3 6 98.1298 5.097 1 8 -3 7 148.885 6.18929 1 8 -3 8 12.5551 3.21668 1 8 -2 1 159.735 7.84914 1 8 -2 2 143.232 5.69364 1 8 -2 3 95.1732 4.62986 1 8 -2 4 59.1263 4.14157 1 8 -2 5 -0.9318 5.75831 1 8 -2 6 29.9125 3.28159 1 8 -2 7 6.95583 2.73972 1 8 -2 8 37.22 9.67699 1 8 -2 9 135.865 11.0508 1 8 -1 1 5.64 2.44263 1 8 -1 2 71.1859 3.86888 1 8 -1 3 320.89 9.85168 1 8 -1 4 9.52563 2.32398 1 8 -1 5 414.668 14.4012 1 8 -1 6 122.888 5.31706 1 8 -1 7 167.18 7.46164 1 8 -1 8 12.61 4.38313 1 8 -1 9 180.05 10.4956 1 8 0 0 104.88 8.20212 1 8 0 1 210.915 9.08419 1 8 0 2 198.019 6.70639 1 8 0 3 131.35 5.07639 1 8 0 4 75.305 4.3019 1 8 0 5 3.24 3.64048 1 8 0 6 24.99 4.82074 1 8 0 7 22.38 5.06514 1 8 0 8 44.85 5.89118 1 8 0 9 156.84 9.55954 1 8 1 0 183.935 6.58054 1 8 1 1 5.63601 1.67775 1 8 1 2 67.61 5.27141 1 8 1 3 329.46 13.7214 1 8 1 4 5.39 3.5597 1 8 1 5 410.40 16.9154 1 8 1 6 129.00 8.08388 1 8 1 7 164.02 9.38546 1 8 1 8 14.71 4.49759 1 8 1 9 195.34 10.6408 1 8 2 0 176.74 7.97452 1 8 2 2 155.13 8.30271 1 8 2 3 99.76 7.14422 1 8 2 4 53.87 5.63553 1 8 2 5 1.44 3.62414 1 8 2 6 33.98 4.86202 1 8 2 7 8.97 4.18589 1 8 2 8 39.09 5.51176 1 8 2 9 140.71 8.94141 1 8 3 2 44.43 5.18128 1 8 3 3 227.83 10.5651 1 8 3 4 3.69 3.44889 1 8 3 5 325.31 13.2748 1 8 3 6 108.53 7.40069 1 8 3 7 155.84 8.97631 1 8 3 8 16.53 4.64434 1 9 -5 1 54.75 5.5002 1 9 -4 1 15.38 4.03925 1 9 -4 2 27.825 4.62647 1 9 -4 3 67.585 7.84423 1 9 -4 4 -2.60 4.81925 1 9 -3 1 114.07 6.27395 1 9 -3 2 24.87 4.07018 1 9 -3 3 207.82 8.56606 1 9 -3 4 152.335 7.5877 1 9 -3 5 0.53514 2.70551 1 9 -3 6 192.891 7.15094 1 9 -2 1 23.885 3.56381 1 9 -2 2 75.94 5.27953 1 9 -2 3 90.7657 4.71383 1 9 -2 4 9.43025 2.73196 1 9 -2 5 122.607 5.5518 1 9 -2 6 24.615 6.22764 1 9 -2 7 22.465 11.0013 1 9 -1 1 132.40 6.02069 1 9 -1 2 25.535 3.37706 1 9 -1 3 303.634 9.36949 1 9 -1 4 200.643 6.98826 1 9 -1 5 1.18 2.99801 1 9 -1 6 256.275 11.6653 1 9 -1 7 -1.77 4.38054 1 9 0 0 391.35 15.6182 1 9 0 1 14.035 2.58129 1 9 0 2 58.3191 3.72958 1 9 0 3 139.795 6.62345 1 9 0 4 18.24 3.74465 1 9 0 5 172.685 7.43026 1 9 0 6 35.285 4.05993 1 9 0 7 43.48 5.99877 1 9 0 8 161.51 9.9026 1 9 1 0 302.28 12.0261 1 9 1 2 19.37 4.61217 1 9 1 3 319.415 10.4834 1 9 1 4 202.06 10.3499 1 9 1 5 4.78 3.96653 1 9 1 6 267.39 12.6459 1 9 1 7 -4.98 3.74852 1 9 2 2 80.42 6.84928 1 9 2 3 107.82 7.60024 1 9 2 4 13.20 4.33944 1 9 2 5 129.85 8.13181 1 9 2 6 19.23 4.6929 1 9 2 7 14.31 4.77328 1 9 3 3 214.70 10.4333 1 9 3 4 175.42 9.17918 1 9 3 5 -3.13 3.58495 1 9 3 6 186.67 10.3006 1 10 -3 1 55.12 7.44888 1 10 -3 2 71.78 6.40869 1 10 -3 3 37.90 5.22464 1 10 -2 1 33.01 5.86137 1 10 -2 2 102.69 8.0803 1 10 -2 3 99.05 5.7681 1 10 -2 4 44.865 4.61206 1 10 -1 1 83.14 7.27142 1 10 -1 4 40.29 6.27587 1 10 -1 5 1.81 4.502 1 10 0 3 96.39 7.77255 1 10 0 4 55.23 6.46343 1 10 0 5 74.69 7.34887 1 10 1 3 29.25 5.25553 1 10 1 4 44.82 5.96075 1 10 1 5 5.44 4.72713 1 10 2 3 99.47 7.88979 1 10 2 4 44.88 6.01883 1 0 0 0 0.00 0.00 1 ; _shelx_hkl_checksum 50989 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z' '-x, -y, -z' 'x, -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 Y1 Y 0.37470(6) 0.750000 0.95702(5) 0.01777(19) Uani 1 2 d S T P . . Cl1 Cl 0.63919(19) 0.250000 0.6835(2) 0.0462(5) Uani 1 2 d S T P . . Cl2 Cl 0.5217(2) 0.250000 0.42593(17) 0.0371(4) Uani 1 2 d S T P . . Cl3 Cl 0.1680(2) 0.250000 0.35374(14) 0.0389(5) Uani 1 2 d S T P . . Cl4 Cl -0.06071(18) 0.250000 0.53805(15) 0.0349(4) Uani 1 2 d S T P . . O1 O 0.4281(6) 0.4087(6) 0.8968(3) 0.0591(14) Uani 1 1 d . . . . . O2 O 0.0372(5) 0.4114(7) 0.8196(4) 0.0496(11) Uani 1 1 d . . . . . H2 H -0.012173 0.473862 0.766630 0.059 Uiso 0.5 1 calc R U P . . O3 O 0.6047(9) 0.750000 0.8607(6) 0.0570(18) Uani 1 2 d DS T P . . H3B H 0.551(12) 0.750000 0.798(5) 0.068 Uiso 1 2 d DS U P . . O4 O 0.2058(8) 0.750000 0.7908(6) 0.0559(19) Uani 1 2 d DS T P . . H4A H 0.173(6) 0.863(5) 0.776(6) 0.067 Uiso 1 1 d D U . . . H4B H 0.299(4) 0.750000 0.783(10) 0.067 Uiso 1 2 d DS U P . . O5 O 0.1998(6) 0.5397(9) 1.0459(4) 0.0585(13) Uani 1 1 d D . . . . H5A H 0.134(7) 0.574(12) 1.088(6) 0.070 Uiso 1 1 d D U . . . C1 C 0.3430(7) 0.250000 0.7238(5) 0.0201(12) Uani 1 2 d S T P . . C2 C 0.4456(7) 0.250000 0.6414(6) 0.0247(14) Uani 1 2 d S T P . . C3 C 0.3923(7) 0.250000 0.5264(6) 0.0246(14) Uani 1 2 d S T P . . C4 C 0.2354(8) 0.250000 0.4940(5) 0.0259(14) Uani 1 2 d S T P . . C5 C 0.1342(7) 0.250000 0.5781(5) 0.0226(13) Uani 1 2 d S T P . . C6 C 0.1869(7) 0.250000 0.6920(5) 0.0210(13) Uani 1 2 d S T P . . C7 C 0.4050(8) 0.250000 0.8479(6) 0.0275(15) Uani 1 2 d S T P . . C8 C 0.0762(8) 0.250000 0.7841(6) 0.0269(15) Uani 1 2 d S T P . . H5B H 0.193(18) 0.415(3) 1.048(14) 0.29(11) Uiso 1 1 d D . . . . H3A H 0.694(6) 0.750000 0.842(12) 0.6(4) Uiso 1 2 d DS . P . . 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 Y1 0.0137(3) 0.0235(3) 0.0155(3) 0.000 -0.00142(19) 0.000 Cl1 0.0119(8) 0.0655(14) 0.0595(13) 0.000 -0.0051(8) 0.000 Cl2 0.0304(9) 0.0441(11) 0.0410(10) 0.000 0.0247(8) 0.000 Cl3 0.0353(9) 0.0640(13) 0.0170(8) 0.000 0.0007(7) 0.000 Cl4 0.0117(7) 0.0572(12) 0.0351(9) 0.000 -0.0010(6) 0.000 O1 0.110(4) 0.036(2) 0.0260(19) -0.0036(18) -0.020(2) -0.007(3) O2 0.060(3) 0.045(3) 0.050(2) -0.012(2) 0.038(2) -0.006(2) O3 0.068(5) 0.049(4) 0.053(4) 0.000 0.000(3) 0.000 O4 0.068(4) 0.033(3) 0.059(4) 0.000 -0.036(4) 0.000 O5 0.054(3) 0.066(3) 0.061(3) 0.008(3) 0.037(2) 0.019(3) C1 0.020(3) 0.021(3) 0.020(3) 0.000 0.003(2) 0.000 C2 0.017(3) 0.028(4) 0.028(3) 0.000 -0.001(2) 0.000 C3 0.021(3) 0.031(4) 0.024(3) 0.000 0.015(3) 0.000 C4 0.028(3) 0.032(4) 0.018(3) 0.000 0.000(3) 0.000 C5 0.013(3) 0.035(4) 0.020(3) 0.000 0.003(2) 0.000 C6 0.018(3) 0.026(3) 0.019(3) 0.000 0.004(2) 0.000 C7 0.033(4) 0.028(4) 0.020(3) 0.000 -0.003(3) 0.000 C8 0.023(3) 0.037(4) 0.022(3) 0.000 0.009(3) 0.000 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' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Y Y -2.7962 3.5667 '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' 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 O4 Y1 O5 89.4(2) . 4_575 ? O4 Y1 O5 89.4(2) . . ? O5 Y1 O5 72.6(2) 4_575 . ? O4 Y1 O3 95.3(3) . . ? O5 Y1 O3 143.46(12) 4_575 . ? O5 Y1 O3 143.46(12) . . ? O4 Y1 O1 83.13(12) . 4_575 ? O5 Y1 O1 73.66(18) 4_575 4_575 ? O5 Y1 O1 145.48(18) . 4_575 ? O3 Y1 O1 70.99(13) . 4_575 ? O4 Y1 O1 83.13(12) . . ? O5 Y1 O1 145.48(18) 4_575 . ? O5 Y1 O1 73.66(18) . . ? O3 Y1 O1 70.99(13) . . ? O1 Y1 O1 137.9(2) 4_575 . ? O4 Y1 O1 153.71(12) . 2_657 ? O5 Y1 O1 82.68(18) 4_575 2_657 ? O5 Y1 O1 111.74(18) . 2_657 ? O3 Y1 O1 77.2(2) . 2_657 ? O1 Y1 O1 70.60(14) 4_575 2_657 ? O1 Y1 O1 116.91(11) . 2_657 ? O4 Y1 O1 153.71(12) . 3_667 ? O5 Y1 O1 111.74(18) 4_575 3_667 ? O5 Y1 O1 82.68(18) . 3_667 ? O3 Y1 O1 77.2(2) . 3_667 ? O1 Y1 O1 116.92(11) 4_575 3_667 ? O1 Y1 O1 70.60(14) . 3_667 ? O1 Y1 O1 49.72(19) 2_657 3_667 ? O4 Y1 C7 176.8(3) . 3_667 ? O5 Y1 C7 93.20(18) 4_575 3_667 ? O5 Y1 C7 93.20(18) . 3_667 ? O3 Y1 C7 81.5(2) . 3_667 ? O1 Y1 C7 95.76(11) 4_575 3_667 ? O1 Y1 C7 95.76(11) . 3_667 ? O1 Y1 C7 25.44(10) 2_657 3_667 ? O1 Y1 C7 25.44(10) 3_667 3_667 ? O4 Y1 H3B 76.2(10) . . ? O5 Y1 H3B 141.3(4) 4_575 . ? O5 Y1 H3B 141.3(4) . . ? O3 Y1 H3B 19.1(10) . . ? O1 Y1 H3B 69.08(13) 4_575 . ? O1 Y1 H3B 69.08(12) . . ? O1 Y1 H3B 94.5(9) 2_657 . ? O1 Y1 H3B 94.5(9) 3_667 . ? C7 Y1 H3B 100.6(10) 3_667 . ? O4 Y1 H4B 20.7(7) . . ? O5 Y1 H4B 105.9(6) 4_575 . ? O5 Y1 H4B 105.9(6) . . ? O3 Y1 H4B 74.6(7) . . ? O1 Y1 H4B 76.6(2) 4_575 . ? O1 Y1 H4B 76.6(2) . . ? O1 Y1 H4B 142.2(5) 2_657 . ? O1 Y1 H4B 142.2(5) 3_667 . ? C7 Y1 H4B 156.1(7) 3_667 . ? H3B Y1 H4B 55.5(12) . . ? C7 O1 Y1 157.7(5) . . ? C7 O1 Y1 91.1(4) . 3_667 ? Y1 O1 Y1 109.40(14) . 3_667 ? C8 O2 H2 109.5 . . ? Y1 O3 H3B 90(9) . . ? Y1 O3 H3A 167(10) . . ? H3B O3 H3A 103(4) . . ? Y1 O4 H4A 111(5) . . ? Y1 O4 H4B 63(8) . . ? H4A O4 H4B 108(4) . . ? Y1 O4 H4A 111(5) . 4_575 ? H4A O4 H4A 134(9) . 4_575 ? H4B O4 H4A 108(4) . 4_575 ? Y1 O5 H5A 127(6) . . ? Y1 O5 H5B 131(7) . . ? H5A O5 H5B 102(4) . . ? C6 C1 C2 120.0(6) . . ? C6 C1 C7 121.0(6) . . ? C2 C1 C7 119.0(6) . . ? C1 C2 C3 120.4(6) . . ? C1 C2 Cl1 118.9(5) . . ? C3 C2 Cl1 120.7(5) . . ? C4 C3 C2 119.8(6) . . ? C4 C3 Cl2 120.6(5) . . ? C2 C3 Cl2 119.5(5) . . ? C3 C4 C5 118.9(6) . . ? C3 C4 Cl3 120.5(5) . . ? C5 C4 Cl3 120.6(5) . . ? C6 C5 C4 121.4(6) . . ? C6 C5 Cl4 119.6(5) . . ? C4 C5 Cl4 119.0(5) . . ? C5 C6 C1 119.5(6) . . ? C5 C6 C8 121.4(6) . . ? C1 C6 C8 119.1(6) . . ? O1 C7 O1 122.2(6) . 4_565 ? O1 C7 C1 118.9(3) . . ? O1 C7 C1 118.9(3) 4_565 . ? O1 C7 Y1 63.5(3) . 3_667 ? O1 C7 Y1 63.5(3) 4_565 3_667 ? C1 C7 Y1 158.7(5) . 3_667 ? O2 C8 O2 125.3(7) . 4_565 ? O2 C8 C6 117.3(3) . . ? O2 C8 C6 117.3(3) 4_565 . ? 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 Y1 O4 2.342(6) . ? Y1 O5 2.408(5) 4_575 ? Y1 O5 2.409(5) . ? Y1 O3 2.410(8) . ? Y1 O1 2.479(5) 4_575 ? Y1 O1 2.479(5) . ? Y1 O1 2.559(5) 2_657 ? Y1 O1 2.559(4) 3_667 ? Y1 C7 2.859(7) 3_667 ? Y1 H3B 2.55(12) . ? Y1 H4B 2.10(11) . ? Cl1 C2 1.720(6) . ? Cl2 C3 1.721(6) . ? Cl3 C4 1.705(7) . ? Cl4 C5 1.727(6) . ? O1 C7 1.229(5) . ? O2 C8 1.232(5) . ? O2 H2 0.8400 . ? O3 H3B 0.83(2) . ? O3 H3A 0.84(2) . ? O4 H4A 0.83(2) . ? O4 H4B 0.83(2) . ? O4 H4A 0.83(2) 4_575 ? O5 H5A 0.83(2) . ? O5 H5B 0.84(2) . ? C1 C6 1.383(9) . ? C1 C2 1.390(9) . ? C1 C7 1.515(9) . ? C2 C3 1.394(9) . ? C3 C4 1.390(9) . ? C4 C5 1.396(9) . ? C5 C6 1.381(8) . ? C6 C8 1.528(9) . ?