#------------------------------------------------------------------------------ #$Date: 2013-08-28 13:42:33 +0300 (Wed, 28 Aug 2013) $ #$Revision: 88054 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/88/2018839.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2018839_Fobs loop_ _publ_author_name 'Gomes, Ligia R.' 'Low, John Nicolson' 'Wardell, James L.' 'Pinheiro, Alessandra C.' 'Mendon\,ca, Thais C. N. de' 'de Souza, Marcus V. N.' _publ_section_title ; Three 2-(methysulfanyl)nicotinamides ; _journal_coeditor_code SK3475 _journal_issue 3 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 293 _journal_page_last 298 _journal_volume 69 _journal_year 2013 _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90.000 _cell_angle_beta 90.341 _cell_angle_gamma 90.000 _cell_length_a 7.1940 _cell_length_b 7.2850 _cell_length_c 22.3880 _exptl_crystal_F_000 528.00 _reflns_d_resolution_high 0.8402 _[local]_cod_data_source_file sk3475IIIsup3.hkl _[local]_cod_data_source_block III #BEGIN Tags that were not found in dictionaries: _shelx_title ' 2012ncs0158' _shelx_refln_list_code 4 _shelx_f_calc_maximum 148.83 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma _refln_observed_status 2 0 0 1651.80 1746.36 4.65 o 4 0 0 408.50 367.50 2.47 o 6 0 0 1360.34 1203.72 10.56 o 8 0 0 93.45 91.94 4.21 o 1 1 0 389.19 396.37 1.69 o 2 1 0 8605.27 8659.99 22.55 o 3 1 0 2150.67 2249.36 10.99 o 4 1 0 614.19 644.50 3.62 o 5 1 0 34.87 34.57 2.52 o 6 1 0 3225.40 3209.35 42.73 o 7 1 0 216.03 224.68 6.67 o 8 1 0 232.99 241.06 6.39 o 0 2 0 6109.18 5847.40 19.40 o 1 2 0 6389.48 6513.26 19.54 o 2 2 0 1740.96 1736.38 6.35 o 3 2 0 779.52 875.04 9.74 o 4 2 0 3423.26 3549.82 18.59 o 5 2 0 908.20 928.94 9.44 o 6 2 0 449.44 467.50 10.55 o 7 2 0 345.88 353.35 6.30 o 8 2 0 54.18 51.71 3.06 o 1 3 0 284.07 291.87 1.73 o 2 3 0 1359.03 1398.30 8.15 o 3 3 0 2289.31 2303.90 10.16 o 4 3 0 34.34 35.10 2.75 o 5 3 0 6.04 4.61 1.21 o 6 3 0 1.40 3.67 2.48 o 7 3 0 614.67 654.43 9.37 o 8 3 0 193.30 199.20 3.54 o 0 4 0 145.21 121.53 1.97 o 1 4 0 3259.18 3275.22 16.10 o 2 4 0 66.87 56.70 1.27 o 3 4 0 28.51 29.72 2.42 o 4 4 0 36.20 44.26 3.95 o 5 4 0 654.58 679.49 23.06 o 6 4 0 226.21 211.07 4.11 o 7 4 0 784.49 794.90 18.42 o 1 5 0 8.97 9.78 0.82 o 2 5 0 128.19 121.50 1.46 o 3 5 0 390.90 378.20 3.35 o 4 5 0 186.53 176.65 3.12 o 5 5 0 49.77 48.79 3.87 o 6 5 0 60.40 49.01 7.09 o 0 6 0 806.62 782.82 7.67 o 1 6 0 1014.52 1037.74 12.77 o 2 6 0 315.55 309.61 4.30 o 3 6 0 53.24 51.37 3.69 o 4 6 0 174.03 180.87 2.86 o 5 6 0 4.37 3.07 0.94 o 6 6 0 325.77 306.93 6.60 o 1 7 0 67.00 70.54 3.33 o 2 7 0 727.32 723.11 6.19 o 3 7 0 103.81 98.00 4.01 o 4 7 0 895.14 881.54 23.78 o 5 7 0 17.00 18.65 2.44 o 0 8 0 669.53 666.44 7.68 o 1 8 0 721.55 725.20 9.78 o 2 8 0 26.26 33.79 2.10 o 3 8 0 34.96 30.60 2.80 o -7 0 1 113.44 120.86 4.13 o -5 0 1 11.78 10.88 2.73 o -3 0 1 2245.81 2410.02 35.55 o -1 0 1 289.08 271.37 1.31 o 3 0 1 841.80 697.23 4.69 o 5 0 1 67.02 56.73 1.64 o 7 0 1 902.04 923.27 17.16 o -8 1 1 22.95 29.83 2.42 o -7 1 1 157.19 163.27 4.37 o -6 1 1 1724.55 1715.96 13.63 o -5 1 1 263.00 263.98 5.12 o -4 1 1 72.22 87.59 1.39 o -3 1 1 3.12 2.39 0.32 o -2 1 1 1328.96 1301.38 9.60 o -1 1 1 612.41 657.76 2.63 o 0 1 1 1644.89 1582.43 8.87 o 1 1 1 5602.32 5645.51 28.05 o 2 1 1 3432.01 3730.15 9.63 o 3 1 1 270.39 273.22 1.90 o 4 1 1 3531.34 3719.81 44.15 o 5 1 1 308.71 280.22 2.92 o 6 1 1 0.32 1.24 0.54 o 7 1 1 77.91 82.60 1.94 o 8 1 1 401.76 369.20 8.75 o -8 2 1 553.48 565.02 10.39 o -7 2 1 68.10 71.64 5.87 o -6 2 1 63.64 61.16 3.10 o -5 2 1 181.94 179.20 4.69 o -4 2 1 1552.72 1577.80 7.95 o -3 2 1 215.98 219.75 3.39 o -2 2 1 9052.16 9332.62 41.07 o -1 2 1 1377.28 1333.63 5.79 o 0 2 1 4902.78 5060.72 24.27 o 1 2 1 47.94 62.49 2.17 o 2 2 1 209.16 230.32 1.45 o 3 2 1 1268.31 1159.05 8.52 o 4 2 1 1192.04 1197.51 6.41 o 5 2 1 37.33 27.41 2.75 o 6 2 1 175.80 163.04 3.46 o 7 2 1 402.42 401.35 5.87 o 8 2 1 8.24 10.53 2.78 o -8 3 1 7.04 8.63 1.37 o -7 3 1 76.91 76.96 3.72 o -6 3 1 264.19 246.01 6.35 o -5 3 1 4.84 4.59 0.83 o -4 3 1 26.93 17.94 2.18 o -3 3 1 424.51 515.77 9.33 o -2 3 1 782.14 762.20 6.77 o -1 3 1 590.64 607.96 2.07 o 0 3 1 1659.24 1690.84 4.66 o 1 3 1 991.47 950.40 2.64 o 2 3 1 461.53 522.35 5.38 o 3 3 1 67.92 64.95 1.62 o 4 3 1 1494.23 1447.55 8.48 o 5 3 1 77.31 87.50 2.22 o 6 3 1 129.88 135.96 3.00 o 7 3 1 1.57 2.34 0.93 o 8 3 1 117.96 122.03 3.40 o -7 4 1 35.26 27.79 4.33 o -6 4 1 234.12 238.73 5.84 o -5 4 1 228.12 225.45 12.03 o -4 4 1 1488.32 1449.93 12.98 o -3 4 1 763.12 760.81 4.60 o -2 4 1 190.65 156.37 1.80 o -1 4 1 6.18 2.03 0.60 o 0 4 1 2.55 1.26 0.21 o 1 4 1 487.84 493.51 4.44 o 2 4 1 2462.69 2393.47 8.25 o 3 4 1 36.70 32.08 1.84 o 4 4 1 2.81 4.91 0.42 o 5 4 1 0.76 1.90 0.83 o 6 4 1 159.35 150.48 7.22 o 7 4 1 1.33 3.48 0.90 o -6 5 1 330.86 316.39 6.89 o -5 5 1 58.08 45.13 6.05 o -4 5 1 37.36 44.86 4.61 o -3 5 1 302.40 287.76 3.66 o -2 5 1 154.07 145.38 2.63 o -1 5 1 604.76 613.99 4.43 o 0 5 1 694.84 662.17 3.22 o 1 5 1 767.42 732.04 7.10 o 2 5 1 16.48 19.87 1.62 o 3 5 1 743.31 705.40 12.34 o 4 5 1 64.13 57.88 2.25 o 5 5 1 267.17 279.78 4.65 o 6 5 1 7.70 11.33 1.90 o -6 6 1 8.99 7.71 2.40 o -5 6 1 72.76 82.67 10.79 o -4 6 1 5.62 7.48 1.13 o -3 6 1 2584.20 2597.28 34.63 o -2 6 1 58.49 65.72 3.78 o -1 6 1 260.67 256.10 3.71 o 0 6 1 664.72 654.44 6.72 o 1 6 1 177.41 165.71 3.98 o 2 6 1 142.72 145.03 1.54 o 3 6 1 444.61 448.48 3.79 o 4 6 1 20.70 22.22 2.74 o 5 6 1 121.66 127.27 8.43 o 6 6 1 56.36 48.07 5.51 o -5 7 1 173.97 186.04 3.09 o -4 7 1 117.27 114.84 16.22 o -3 7 1 45.78 40.18 3.11 o -2 7 1 39.32 37.17 3.36 o -1 7 1 1.90 2.45 0.58 o 0 7 1 66.50 70.98 3.91 o 1 7 1 116.11 108.14 2.58 o 2 7 1 1.86 2.93 0.59 o 3 7 1 1166.98 1253.17 18.59 o 4 7 1 261.58 266.79 5.83 o 5 7 1 535.43 553.94 10.31 o -3 8 1 291.44 316.59 6.15 o -2 8 1 325.19 352.91 7.45 o -1 8 1 14.27 13.91 1.28 o 0 8 1 8.72 9.21 0.96 o 1 8 1 0.07 1.43 0.77 o 2 8 1 120.32 130.94 4.27 o 3 8 1 39.68 37.21 4.84 o -8 0 2 106.26 109.27 4.72 o -6 0 2 406.80 376.08 12.62 o -4 0 2 819.72 817.36 5.54 o -2 0 2 2681.05 2712.58 8.40 o 4 0 2 120.16 110.61 1.96 o 6 0 2 335.43 334.66 6.21 o 8 0 2 60.49 51.72 9.29 o -8 1 2 0.11 2.77 0.89 o -7 1 2 9.86 10.10 1.38 o -6 1 2 395.93 384.71 3.16 o -5 1 2 1.86 1.65 0.41 o -4 1 2 85.30 111.04 2.22 o -3 1 2 638.65 660.81 7.38 o -2 1 2 483.05 473.78 2.67 o -1 1 2 1284.13 1252.37 5.27 o 0 1 2 3079.66 3177.58 7.33 o 1 1 2 1333.99 1336.59 6.56 o 2 1 2 7772.31 7639.38 38.73 o 3 1 2 916.38 859.52 5.02 o 4 1 2 1379.65 1395.68 5.48 o 5 1 2 100.86 112.69 2.39 o 6 1 2 11.40 13.09 1.22 o 7 1 2 325.79 337.59 4.28 o 8 1 2 1142.82 1200.01 20.48 o -8 2 2 242.92 238.83 7.77 o -7 2 2 354.44 346.23 7.32 o -6 2 2 1069.44 1085.27 9.52 o -5 2 2 1267.90 1236.59 8.62 o -4 2 2 141.53 159.37 5.13 o -3 2 2 20.77 17.71 1.86 o -2 2 2 2799.41 2906.85 5.72 o -1 2 2 304.72 296.37 1.19 o 0 2 2 2144.20 2129.37 3.73 o 1 2 2 3071.75 3035.75 12.14 o 2 2 2 122.44 145.74 0.97 o 3 2 2 329.52 367.23 2.16 o 4 2 2 1.04 2.69 0.83 o 5 2 2 1036.54 1075.03 11.86 o 6 2 2 294.89 308.21 7.53 o 7 2 2 0.05 0.56 1.09 o 8 2 2 0.83 1.53 0.92 o -8 3 2 115.87 134.86 3.18 o -7 3 2 56.36 60.82 5.94 o -6 3 2 113.45 107.14 2.77 o -5 3 2 217.12 209.86 6.95 o -3 3 2 2426.80 2666.23 14.28 o -2 3 2 19.57 27.06 0.93 o -1 3 2 76.99 100.92 0.81 o 0 3 2 126.45 140.60 0.75 o 1 3 2 4771.38 4867.62 8.59 o 2 3 2 145.09 140.39 2.00 o 3 3 2 1597.41 1609.25 8.11 o 4 3 2 444.04 455.77 3.81 o 5 3 2 14.16 16.98 1.48 o 6 3 2 45.01 50.67 4.05 o 7 3 2 623.22 615.95 7.06 o 8 3 2 24.82 22.77 3.36 o -7 4 2 638.29 663.26 15.75 o -6 4 2 360.57 386.22 7.54 o -5 4 2 2498.17 2600.66 12.83 o -4 4 2 70.71 66.03 2.73 o -3 4 2 128.65 140.44 3.24 o -2 4 2 687.56 655.74 5.29 o -1 4 2 967.23 962.17 4.86 o 0 4 2 138.56 143.93 1.73 o 1 4 2 1889.86 1946.46 11.47 o 2 4 2 18.09 20.45 1.09 o 3 4 2 53.40 59.04 2.05 o 4 4 2 31.31 34.93 1.12 o 5 4 2 537.87 539.55 6.14 o 6 4 2 7.35 9.08 1.12 o 7 4 2 1.81 1.99 0.74 o -6 5 2 14.28 18.38 4.07 o -5 5 2 57.48 57.80 3.13 o -4 5 2 1485.76 1493.07 19.97 o -3 5 2 519.06 503.71 4.48 o -2 5 2 116.57 115.08 3.56 o -1 5 2 113.34 108.66 1.84 o 0 5 2 1089.26 1068.60 5.80 o 1 5 2 2291.83 2328.26 24.14 o 2 5 2 479.66 447.63 2.08 o 3 5 2 1096.75 1072.14 8.85 o 4 5 2 34.79 33.58 2.45 o 5 5 2 57.25 57.69 4.21 o 6 5 2 82.11 91.55 3.35 o -6 6 2 1146.05 1212.15 20.45 o -5 6 2 28.05 31.04 5.36 o -4 6 2 8.38 7.99 1.16 o -3 6 2 79.78 90.81 12.32 o -2 6 2 350.53 331.45 3.67 o -1 6 2 237.47 232.75 4.40 o 0 6 2 1256.26 1234.81 7.27 o 1 6 2 2720.77 2824.55 14.25 o 2 6 2 7.54 9.23 0.78 o 3 6 2 121.10 129.05 2.58 o 4 6 2 243.52 251.08 3.44 o 5 6 2 20.65 22.28 2.53 o 6 6 2 53.64 58.13 2.68 o -5 7 2 348.81 337.98 5.13 o -4 7 2 245.55 268.36 5.58 o -3 7 2 0.13 1.41 0.80 o -2 7 2 1389.66 1386.25 10.39 o -1 7 2 158.01 145.83 4.10 o 0 7 2 36.62 34.38 2.64 o 1 7 2 86.39 89.62 2.50 o 2 7 2 246.36 236.64 2.49 o 3 7 2 526.28 533.78 5.10 o 4 7 2 346.75 345.93 5.32 o 5 7 2 5.63 3.33 1.48 o -3 8 2 515.13 537.08 17.42 o -2 8 2 4.58 3.87 0.65 o -1 8 2 148.00 150.52 2.60 o 0 8 2 111.49 114.96 2.50 o 1 8 2 129.59 130.13 3.32 o 2 8 2 155.01 165.99 4.63 o 3 8 2 49.72 40.80 4.13 o -7 0 3 73.08 76.28 3.28 o -5 0 3 577.37 543.19 9.80 o -3 0 3 103.94 80.92 3.04 o -1 0 3 450.37 486.73 2.06 o 3 0 3 929.63 1082.68 3.11 o 5 0 3 209.20 195.38 2.67 o 7 0 3 2.55 3.15 1.25 o -8 1 3 296.18 297.60 8.59 o -7 1 3 143.33 145.76 3.14 o -6 1 3 25.84 24.43 1.58 o -5 1 3 534.88 576.19 3.42 o -4 1 3 836.21 853.37 5.19 o -3 1 3 1898.30 2057.80 5.94 o -2 1 3 1924.99 1946.38 8.35 o -1 1 3 874.59 889.46 3.93 o 0 1 3 1222.56 1218.99 3.97 o 1 1 3 424.88 470.32 1.99 o 2 1 3 2582.67 2715.00 16.91 o 3 1 3 322.26 276.46 1.67 o 4 1 3 911.30 918.53 11.87 o 5 1 3 20.53 13.70 0.92 o 6 1 3 903.60 905.91 11.31 o 7 1 3 128.21 110.54 2.50 o 8 1 3 1.85 1.05 0.65 o -8 2 3 338.10 360.67 5.88 o -7 2 3 1.58 1.83 1.06 o -6 2 3 86.82 82.75 4.90 o -5 2 3 183.71 192.65 10.08 o -4 2 3 418.58 393.94 8.41 o -3 2 3 4.84 4.96 1.05 o -2 2 3 114.42 123.14 1.66 o -1 2 3 327.73 339.50 1.61 o 0 2 3 3747.44 3717.62 13.40 o 1 2 3 22.01 19.58 0.51 o 2 2 3 238.64 198.73 1.14 o 3 2 3 39.33 44.98 1.01 o 4 2 3 1366.24 1497.39 6.28 o 5 2 3 0.48 1.65 0.76 o 6 2 3 3.30 5.22 1.00 o 7 2 3 0.20 1.41 1.32 o 8 2 3 106.05 119.29 3.85 o -7 3 3 15.00 21.47 2.57 o -6 3 3 124.09 120.02 3.97 o -5 3 3 11.88 13.14 1.78 o -4 3 3 264.18 269.62 4.21 o -3 3 3 1.94 2.54 2.26 o -2 3 3 1138.50 1168.46 10.83 o -1 3 3 39.04 63.88 1.02 o 0 3 3 817.69 784.18 2.37 o 1 3 3 688.94 703.90 3.61 o 2 3 3 339.03 357.69 4.92 o 3 3 3 46.60 43.59 2.05 o 4 3 3 585.38 590.05 5.21 o 5 3 3 2.60 -0.72 0.93 o 6 3 3 271.41 279.67 5.77 o 7 3 3 0.77 3.11 1.17 o -7 4 3 28.33 25.14 4.35 o -6 4 3 47.55 48.71 11.45 o -5 4 3 56.73 70.92 8.84 o -4 4 3 267.02 275.45 5.21 o -3 4 3 0.68 5.03 0.70 o -2 4 3 995.85 957.87 4.14 o -1 4 3 54.04 64.93 0.96 o 0 4 3 379.64 395.71 3.89 o 1 4 3 1.15 0.68 0.28 o 2 4 3 58.81 68.95 1.43 o 3 4 3 69.74 68.85 1.79 o 4 4 3 705.76 688.62 7.57 o 5 4 3 0.65 0.75 0.64 o 6 4 3 73.73 82.72 6.32 o 7 4 3 7.27 7.94 1.40 o -6 5 3 112.68 131.48 4.11 o -5 5 3 105.02 107.58 11.00 o -4 5 3 214.20 202.63 4.63 o -3 5 3 430.34 442.78 3.84 o -2 5 3 2.76 3.16 0.71 o -1 5 3 1242.45 1237.12 14.15 o 0 5 3 0.09 1.58 0.57 o 1 5 3 462.54 480.77 8.58 o 2 5 3 580.63 578.15 7.56 o 3 5 3 252.89 215.74 7.97 o 4 5 3 231.85 231.38 3.82 o 5 5 3 209.73 225.49 4.13 o 6 5 3 10.17 14.90 1.99 o -6 6 3 0.86 4.46 1.19 o -5 6 3 9.98 11.00 1.76 o -4 6 3 9.70 9.45 1.10 o -3 6 3 34.75 42.63 4.25 o -2 6 3 18.10 15.39 1.18 o -1 6 3 534.77 530.85 7.42 o 0 6 3 21.63 25.37 1.60 o 1 6 3 3.01 3.87 0.67 o 2 6 3 649.26 627.67 9.11 o 3 6 3 44.46 38.91 2.25 o 4 6 3 4.09 6.34 0.88 o 5 6 3 2.33 3.33 0.98 o 6 6 3 6.34 5.72 1.21 o -4 7 3 94.03 106.42 8.29 o -3 7 3 246.11 228.79 4.02 o -2 7 3 75.76 75.72 4.36 o -1 7 3 127.41 128.59 2.12 o 0 7 3 2.23 2.07 0.63 o 1 7 3 3.28 3.73 0.46 o 2 7 3 1.97 3.47 0.89 o 3 7 3 406.04 407.91 5.59 o 4 7 3 58.40 63.30 5.83 o -3 8 3 298.97 323.28 11.72 o -2 8 3 65.36 70.70 4.67 o -1 8 3 92.27 97.19 4.71 o 0 8 3 104.65 105.48 3.06 o 1 8 3 97.18 98.68 2.44 o 2 8 3 15.77 14.82 1.13 o 3 8 3 91.17 85.89 4.36 o -8 0 4 16.66 13.66 2.53 o -6 0 4 11.05 8.30 1.64 o -4 0 4 8.73 8.47 1.20 o 0 0 4 3222.70 3201.65 12.67 o 2 0 4 785.52 842.45 2.81 o 4 0 4 900.50 1095.26 5.09 o 6 0 4 1060.75 1075.88 41.45 o 8 0 4 389.42 398.73 10.83 o -8 1 4 11.13 10.02 2.10 o -7 1 4 0.01 2.01 1.59 o -6 1 4 304.90 289.99 7.52 o -5 1 4 402.27 388.71 5.72 o -4 1 4 1764.99 1761.75 7.69 o -3 1 4 82.90 110.35 2.83 o -2 1 4 1198.21 1150.99 22.17 o -1 1 4 1615.36 1644.78 8.32 o 0 1 4 1481.31 1479.94 4.26 o 1 1 4 854.03 905.20 5.22 o 2 1 4 6964.55 7188.82 26.07 o 3 1 4 54.97 33.63 0.72 o 4 1 4 4601.46 4721.69 104.60 o 5 1 4 359.56 328.34 4.69 o 6 1 4 198.83 204.08 2.64 o 7 1 4 39.20 37.72 2.90 o 8 1 4 83.72 78.94 4.98 o -8 2 4 3.25 2.28 2.19 o -7 2 4 62.54 62.38 6.51 o -6 2 4 174.19 171.63 4.64 o -5 2 4 23.57 23.15 2.71 o -4 2 4 1998.18 2116.11 18.60 o -3 2 4 24.21 28.79 2.31 o -2 2 4 9.13 12.55 0.75 o -1 2 4 365.76 357.73 1.33 o 0 2 4 945.19 963.93 5.10 o 1 2 4 42.69 40.05 0.52 o 2 2 4 577.48 583.65 2.91 o 3 2 4 718.55 793.67 7.29 o 4 2 4 2806.78 2909.90 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1.37 o 2 3 23 65.71 61.19 3.98 o 3 3 23 125.04 136.18 7.50 o -1 4 23 110.17 121.24 2.89 o 0 4 23 974.30 1067.68 23.64 o 1 4 23 63.16 60.14 3.61 o -2 0 24 1041.95 1045.39 16.43 o 0 0 24 393.78 433.16 8.83 o 2 0 24 63.37 65.69 10.98 o -3 1 24 22.94 23.55 2.76 o -2 1 24 90.89 79.08 13.36 o -1 1 24 27.66 18.17 2.48 o 0 1 24 382.34 407.20 6.05 o 1 1 24 376.61 410.65 9.65 o 2 1 24 0.86 -1.27 2.40 o -3 2 24 397.69 448.91 7.54 o -2 2 24 247.09 242.55 3.25 o -1 2 24 524.59 547.31 13.62 o 1 2 24 5.17 3.87 1.43 o 2 2 24 0.58 2.51 1.20 o 3 2 24 43.41 40.80 4.47 o -2 3 24 1.51 1.13 1.57 o -1 3 24 0.41 2.37 1.18 o 0 3 24 0.07 -1.10 2.44 o 1 3 24 173.71 185.95 5.58 o 2 3 24 23.62 22.59 2.23 o -3 0 25 333.79 367.15 17.55 o -1 0 25 1.92 0.98 1.64 o 1 0 25 81.06 89.24 14.90 o -2 1 25 0.74 1.96 1.45 o -1 1 25 393.38 383.97 7.33 o 0 1 25 8.69 11.81 1.81 o 1 1 25 14.55 22.09 3.62 o 2 1 25 18.80 17.15 2.57 o -2 2 25 58.96 47.91 9.46 o -1 2 25 123.84 125.22 4.70 o 0 2 25 0.89 1.22 1.26 o 1 2 25 605.06 661.78 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