MMs01392047 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2978 -0.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2954 -2.2521 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2562 -1.6521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5932 -3.0042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6325 -3.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8935 -2.2563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8959 -0.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5908 -4.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2906 -5.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2882 -6.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -7.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8862 -6.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8887 -5.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0072 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3027 -2.2479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6029 -2.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6053 -4.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9056 -5.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2034 -4.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -2.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9007 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4988 -2.2395 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7990 -2.9874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4964 -0.7395 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0019 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9317 -2.8579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 1.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7715 -4.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -7.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5841 -8.7042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9245 -7.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9289 -4.6579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3007 -1.0479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5671 -5.0975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9075 -6.4437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2436 -5.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8988 -1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 32 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 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END