MMs01928482 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.2953 -0.7565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2561 -1.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8933 -0.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8859 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5831 -3.0129 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5439 -3.6129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2878 -2.2564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5756 -4.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2036 1.4741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5063 2.2176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8016 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 -0.7823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0894 -0.7953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0819 -2.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3772 -3.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3698 -4.5517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1044 2.2047 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.3996 1.4482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1118 3.7047 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5138 3.7176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 -1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8313 0.9101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 0.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0687 -2.0669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2907 -3.3990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3756 -4.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5697 -5.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7756 -4.5189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1316 -0.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9012 -2.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 -3.4208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7933 -1.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5580 -3.2660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4060 -5.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 4.3124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4776 4.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 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 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END