MMs01062928 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.2998 0.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8979 0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 0.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0956 2.2407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6921 0.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9888 -1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6890 -2.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3908 -1.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6875 -3.7619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9858 -4.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9842 -6.0133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2856 -3.7646 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2856 -4.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2871 -2.2646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5838 -4.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8837 -3.7673 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.1819 -4.5186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4817 -3.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4833 -2.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7831 -1.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0813 -2.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0798 -3.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7800 -4.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7785 -6.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5989 1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0398 -0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5989 -1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5294 1.6687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0721 1.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8258 -0.9211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3685 -0.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1275 1.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6702 1.6645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4239 -0.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9666 -0.9254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7255 1.6634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 1.6618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -1.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6933 1.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0302 0.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3509 -2.1096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6477 -4.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3270 -1.6657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8116 -5.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3543 -5.4360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4096 -5.4371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9523 -5.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4446 -1.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7843 -0.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1212 -1.6736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1184 -4.3736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5785 -6.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7772 -7.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9785 -6.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 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 21 1 0 0 0 0 19 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 M END