MMs01076488 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 1.5000 -0.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2489 -1.3009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7489 -1.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4978 -2.6018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7467 -3.9003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4956 -5.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9956 -5.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7467 -3.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9978 -2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7489 -1.3047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2489 -1.3060 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2502 0.1940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2477 -2.8060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7489 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4978 -2.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9978 -2.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7489 -1.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2489 -1.3110 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2926 1.1807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 0.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5467 -3.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8948 -6.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5948 -6.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9467 -3.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1498 -0.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8969 -3.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5969 -3.6479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6009 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9009 1.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 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 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M END