MMs02029690 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.1718 0.9365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1029 2.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5067 2.9634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4432 1.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6181 0.5389 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5546 -0.6329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9584 -0.1043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8895 1.3941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2111 -0.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -2.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3757 -3.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7165 -2.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8047 -1.0821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5520 -0.2570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1456 -0.4097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3983 -1.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3101 -2.7322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7391 -0.5624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9919 -1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3327 -0.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4209 0.7823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1682 1.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8273 0.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7618 1.4547 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.4341 0.1138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0894 2.7956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1026 2.1271 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 19.1048 1.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7492 0.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9374 -0.7492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7492 -0.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1007 3.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2365 -1.7900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0503 -2.9647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3052 -4.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7187 -3.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6225 0.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2161 0.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9213 -2.5854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3349 -1.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2387 2.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8251 1.5951 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 34 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 28 -1 M END