MMs01934673 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 -0.0008 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3002 -2.2493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2979 -2.2507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5973 -1.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -2.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1954 -1.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8975 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4956 0.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 2.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9503 -1.4959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4173 -1.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0267 -3.1791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1680 -0.5099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1649 0.6054 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3240 0.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4775 2.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4744 3.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2250 4.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6921 4.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8481 2.6818 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6598 -0.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5409 -1.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0328 -1.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9138 -2.6258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4057 -2.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -2.4990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0006 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8997 -1.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3397 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7007 -3.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 -3.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2343 -2.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8981 1.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5592 0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2809 3.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7375 5.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5843 4.9762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3297 0.7999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7387 0.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4621 -2.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8711 -2.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7026 -0.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1116 -0.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5305 -3.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5992 -2.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2809 -1.2763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0839 -3.6729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END