MMs03921963 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 52 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 0.7394 -1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -1.3174 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4393 -1.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2605 1.2806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2604 1.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7604 1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 2.5368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0734 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3997 -1.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7603 1.2194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2602 1.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0208 2.5001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7391 -1.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2390 -1.3908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9787 -2.6225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2181 -3.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9575 -5.2205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7182 -3.9031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2393 1.3174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7393 1.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4786 2.6347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1309 0.4012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1987 1.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3916 -1.7063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8387 -1.8968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0913 -1.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1362 1.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4784 2.4362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8913 -1.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 1.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9783 2.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1787 -2.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8272 -3.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4061 -3.4835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2424 -5.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3012 -1.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6309 -0.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6309 2.3517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8702 3.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6786 2.6445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 -0.0979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9785 -2.6714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0424 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5491 -6.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6998 0.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -3.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1996 -0.1077 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 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 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 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 50 2 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 40 48 1 0 0 0 0 46 53 1 0 0 0 0 47 52 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M END