MMs03956906 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 -1.5000 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2564 -1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5129 -2.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0129 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7435 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7306 -3.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2306 -3.9082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1183 -2.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6619 -1.2702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5426 -3.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7605 -2.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1277 -2.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2771 -4.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6444 -5.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8623 -4.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7129 -2.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3456 -2.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9308 -1.7766 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.2981 -2.3935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7814 -0.2840 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5351 -4.6697 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1063 -5.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6357 -6.5504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 -3.8859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0258 -5.1812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0948 1.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4564 -1.2819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9435 -1.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -4.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 -5.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -1.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3028 -5.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7639 -6.2144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9561 -4.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.5428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1024 -0.0493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 3 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END