MMs01259338 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 64 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 1.2956 -0.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -0.7679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -0.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0478 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3922 -1.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6878 -0.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2858 -0.8157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2789 -2.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5745 -3.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8770 -2.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8839 -0.8276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1726 -3.0835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4166 -4.3791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9285 -1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4681 -3.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7706 -3.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0662 -3.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0593 -5.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7568 -6.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4612 -5.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 1.4522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3626 2.0570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6048 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 0.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6048 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0627 -1.6787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8309 0.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3736 0.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1181 -1.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6607 -1.6907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 0.8989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9717 0.8918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7161 -1.6955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2588 -1.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8568 -1.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3142 -1.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9122 -1.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4549 -1.7265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2370 -2.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5690 -4.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9258 -0.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5938 1.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3801 -3.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8118 -5.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4531 -4.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9650 -2.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5333 -0.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8921 -1.1832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7761 -1.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1082 -3.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0958 -5.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7513 -7.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4193 -5.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0358 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0270 0.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5697 0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 61 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 7 61 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 M CHG 1 61 1 M END