MMs01612742 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 1.2941 -0.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6079 1.4829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3138 2.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0099 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3237 3.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6277 4.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9217 3.7243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 2.2243 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9118 1.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 1.4658 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5099 2.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5197 3.7072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 1.4486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0881 -0.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4020 1.4315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1079 2.1901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 -0.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6763 -2.3269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2842 -0.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 -0.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5980 1.3973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3039 2.1559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0000 1.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9019 2.1388 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 -0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2862 -1.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6333 -0.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0254 2.1068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1406 3.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9207 4.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8624 5.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 5.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3396 4.8492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1021 3.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 0.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 2.6486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6137 0.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3762 -1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3107 -1.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8534 -1.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5823 1.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8198 2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3426 3.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8853 3.1042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2763 -2.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6234 -0.7095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3118 3.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9647 2.0213 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END