MMs02971124 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 59 0 0 1 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 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2448 -1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2551 1.2901 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8551 2.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5103 2.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2654 3.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7345 3.9001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2345 3.9060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9897 2.6100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9794 5.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4794 5.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2242 6.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4691 7.8120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9691 7.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2242 6.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2139 9.1140 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7551 1.2842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3592 2.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7448 -1.3139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7448 -1.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2448 -1.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2551 1.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7551 1.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5059 1.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 -0.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4940 -1.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2032 -1.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8407 -2.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2864 -0.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3947 4.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9382 5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0835 4.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4242 6.5207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 8.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0242 6.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1407 -2.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8407 -2.3733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8592 2.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1592 2.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1059 1.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5106 2.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3059 1.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9975 -0.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1999 -0.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0023 0.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2940 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4892 -2.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -1.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END