MMs01287775 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.9690 -1.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6123 -2.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8878 -3.3914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0327 -2.4224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4649 -1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2544 0.2414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7537 0.1954 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7077 -1.3039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7997 1.6947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 0.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0425 1.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5418 1.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2516 0.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4621 -1.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9628 -1.1720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7509 0.0115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5404 1.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8306 2.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0397 1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8291 2.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3284 2.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0383 1.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2488 -0.1265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7495 -0.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7761 -3.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 0.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7752 0.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -0.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6866 1.2986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4746 2.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1734 2.3992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0300 -2.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3312 -2.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3187 -1.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2613 3.5735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9600 3.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2377 1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1179 -1.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2303 -2.0590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8868 -3.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3218 -4.2804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END