MMs01689453 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 0.0001 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0391 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2992 -2.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 -3.7499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2988 -3.7501 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3380 -3.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2989 -2.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5978 -4.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5984 -4.4998 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3483 -3.2007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8485 -5.7989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8975 -5.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8976 -6.7497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1967 -7.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4956 -6.7496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4955 -5.2496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1965 -4.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7945 -4.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7944 -2.9995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0936 -5.2494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3926 -4.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5493 -3.0075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6575 -2.2046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0165 -2.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7664 -1.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2664 -1.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0165 -2.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2666 -3.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7666 -3.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 -5.1093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7095 -1.1223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -2.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7717 -5.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.4193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1978 -3.4610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -5.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9977 -5.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8584 -7.3498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1967 -8.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5349 -7.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1964 -3.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0937 -6.4494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1663 -0.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8663 -0.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2165 -2.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8667 -5.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 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 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 32 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 M END