MMs00439940 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 0.7391 -1.3052 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3391 -2.3445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0217 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5216 -2.5855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1303 -3.6197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2607 1.2552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7606 1.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 -0.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7605 1.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0214 2.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5214 2.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7823 3.8407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5431 5.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 5.1209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7822 3.8157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2604 1.2052 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.9996 -0.1001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0213 2.4979 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0442 0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 -0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1025 -3.0178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2399 -3.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2181 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8757 0.3948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2816 -1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -0.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6693 2.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8911 -1.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 -1.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9518 6.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6517 6.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9821 3.8056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2391 -1.3178 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0209 -2.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 -1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 38 1 M END