MMs00034936 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 60 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 0.7455 1.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 1.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 -1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7545 -1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2544 -1.2810 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.0355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5509 -0.5266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0089 -2.5775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5089 -2.5723 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9089 -3.6116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3864 -1.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8145 -1.8144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8197 -3.3144 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8589 -2.7144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3947 -3.7828 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5462 -4.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3998 -5.2828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8280 -5.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7055 -4.5249 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3055 -5.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2055 -4.5198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0913 -5.7303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5163 -5.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5112 -3.7619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0830 -3.3032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7329 -6.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1011 -5.5246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3176 -6.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6859 -5.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9024 -6.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7507 -8.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3825 -8.7719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1660 -7.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 2.3480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -2.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 1.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6262 0.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4124 -3.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3451 -0.7594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8707 -0.2579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3437 -6.8394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8693 -6.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7244 -6.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8725 -6.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4073 -7.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8072 -4.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9970 -6.1729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7240 -8.8591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2612 -9.9657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0714 -8.3862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 41 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 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 35 2 0 0 0 0 34 54 1 0 0 0 0 35 36 1 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 M END