MMs01549119 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 52 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 0.7523 -1.2977 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4477 -1.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0047 -2.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2523 -1.2950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6523 -0.2558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2523 -1.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2477 1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7477 1.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4953 2.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 3.9092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9953 2.6142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7477 1.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 1.3192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9953 2.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2430 3.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7430 3.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9907 5.2123 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4907 5.2096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7383 6.5127 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.4953 2.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2430 3.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2523 -1.2788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6019 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -1.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9132 -3.3711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3699 -4.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9675 -5.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0507 -5.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3854 -4.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 -3.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9225 -1.8197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3981 1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1193 1.7169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4539 2.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1495 0.2762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8411 4.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2833 3.3246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8411 4.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2027 4.5208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 -0.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 -2.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2926 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END