MMs03572648 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 46 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 -0.7498 -1.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2498 -1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7502 1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9000 1.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3818 1.2128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8084 0.7491 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8084 1.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2350 1.2124 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.4350 1.2124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1165 -0.0013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2347 -1.2147 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3862 -2.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8082 -0.7509 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2082 -1.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3815 -1.2143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6980 -2.6413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8162 -3.8547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6977 -5.0684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1243 -4.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1245 -3.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4237 -2.3552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4238 -1.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7226 -3.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7224 -4.6054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4233 -5.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4230 -6.8552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6987 2.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1660 2.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1497 -2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8497 -2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8503 2.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1503 2.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6162 -3.8546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7619 -2.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5104 2.8061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6570 3.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5370 4.0918 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 39 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 31 32 1 0 0 0 0 31 40 1 0 0 0 0 31 41 1 0 0 0 0 32 42 1 0 0 0 0 M END