MMs01229946 MOE2007 2D CORINA 3.40 0006 02.08.2006 18 18 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 -1.3049 -0.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3168 -2.2397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3607 -2.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0237 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0355 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2812 -2.2602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3157 -2.8684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2931 -0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9029 -0.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8194 0.9336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3621 0.9458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9147 -2.2192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9587 -2.8110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 M END