MMs02452582 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 36 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 -1.4945 0.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0779 -1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9439 -2.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3403 -1.4609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7222 -2.0443 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8737 -2.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0064 -1.2692 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0457 -0.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1404 -2.2511 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9889 -3.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -3.6330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9570 -4.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -3.5052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3321 -4.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6075 -6.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6013 -1.9108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1342 0.2253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2273 -3.7090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6446 -4.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7786 -3.2182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4953 -1.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8086 -1.0206 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9036 -2.0457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 -3.4039 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2696 1.4120 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7855 0.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2362 -4.1282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2662 -5.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2275 -7.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9499 -0.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1499 0.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8713 -5.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END