MMs01484554 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.5000 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7484 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 -1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 1.2907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3516 0.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0032 2.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 1.2888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0032 2.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2548 3.8869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5032 2.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2548 3.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7548 3.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5032 2.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7516 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 1.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0167 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7484 -1.3148 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.5064 5.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7580 6.4794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0064 5.1776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7580 6.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6529 2.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3529 2.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3471 -2.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6471 -2.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0432 3.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4045 3.6306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9632 1.9919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6561 4.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7032 2.5799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6503 0.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7965 5.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3593 7.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7195 7.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 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 39 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END