MMs03933044 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2573 1.2864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5146 2.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0146 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7572 1.2780 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7656 2.7780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7488 -0.2220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2572 1.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2572 1.2527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5145 2.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0145 2.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7571 1.2443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8883 1.1412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3122 0.6697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3038 -0.8303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8747 -1.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4031 -2.7097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5124 -1.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3472 -3.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5558 -4.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9295 -3.4957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0947 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8861 -1.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0513 0.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1381 -4.3841 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 12.4328 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0034 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -1.1890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6253 -0.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6445 2.9937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3128 3.7725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0213 3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1854 2.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0112 1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3941 -1.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0940 -1.0847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1203 3.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4203 3.6070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3630 2.2802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8940 -1.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2483 -3.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4237 -5.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1936 -1.5229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2440 0.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1834 1.5673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8586 0.5067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5761 2.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0684 3.7137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2894 2.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END