MMs01954225 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 -0.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4829 -2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2243 -3.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 -3.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4828 -2.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7414 -1.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9828 -2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7413 -1.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2341 -1.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2304 -2.3178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5556 0.2686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2615 1.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1146 2.5200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1402 0.0308 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9299 0.8697 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9299 -0.3303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1376 -0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5119 0.5811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7196 -0.3085 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.0939 0.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0965 2.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8888 3.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4657 -5.2257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7071 -6.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2829 -2.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6175 -4.9471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3482 -0.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5759 -3.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2689 -0.8478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8021 -1.0192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8474 1.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3806 1.4090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5748 -0.8069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1934 0.7734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6131 1.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6719 -5.9129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1003 -7.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7424 -7.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4708 2.9615 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 16 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 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M CHG 1 44 -1 M END