MMs02101691 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 -1.2941 -0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2842 -2.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0198 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3139 -2.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9723 -0.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9686 0.5374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2101 1.8315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 1.5099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4614 0.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3351 1.6098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8279 1.4629 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9748 2.9557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6809 -0.0299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3207 1.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4326 -0.1973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3062 1.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6871 2.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1943 2.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5752 3.9015 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.0517 -1.5635 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5782 -3.0171 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3372 -0.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0277 -4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -2.8345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2296 -1.7560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1383 -0.7652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5434 -0.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8398 2.7028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2409 -1.0258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5005 0.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3860 3.3638 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 M END