MMs02588829 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -1.3035 0.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 2.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0178 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2856 2.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 0.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 0.7731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0405 2.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5059 2.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2636 1.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2665 0.1712 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7563 1.1439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6307 2.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0125 3.7293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1234 2.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9978 3.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4905 3.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1088 1.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2343 0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7416 0.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6015 1.7709 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3592 0.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8245 0.7970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9724 2.2897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5985 2.8916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6159 2.9845 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0071 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3391 0.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3213 2.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8322 -0.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3748 -0.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 3.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2508 0.0506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5033 4.5268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 4.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7289 -0.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0421 -0.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8776 -0.6227 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 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 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END