MMs01054682 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 1.3015 -0.7456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8996 -0.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9046 -2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 -2.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3066 -2.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 -3.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2062 -2.9825 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 -2.2282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2571 -3.5247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7484 -0.9317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7992 -1.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0907 0.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3973 -1.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1008 -2.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6988 -2.2107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9953 -1.4564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0436 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9903 1.2436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6888 0.7892 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2868 0.7980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7039 -3.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0054 -4.4564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4074 -4.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5965 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 1.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9368 -0.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 -4.1913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2102 -4.1825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7529 0.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0867 1.9805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1048 -3.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4096 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1764 -1.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8903 -0.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3240 1.4015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6833 1.8352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8039 -3.4279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3701 -5.0686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0108 -5.5023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 23 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 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END