MMs01245752 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 0.7543 1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 1.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 -1.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 -1.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 1.2768 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5085 2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9029 3.9457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0209 4.9457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3175 4.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0008 2.7252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0008 1.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4691 1.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4691 0.7963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9373 1.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4055 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8738 2.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8738 1.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4056 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9373 -0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3420 2.0244 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.6898 4.7970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1577 2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8577 2.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8423 -2.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1423 -2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2877 -1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6262 -0.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 1.6959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4665 2.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9811 0.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4467 0.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0232 3.0284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4888 2.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6055 3.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2484 3.9754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2056 -0.6021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5628 -1.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 4.0885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8192 5.9900 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END