MMs01149585 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 68 0 0 0 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 1.5000 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7453 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7546 -1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2546 -1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5093 -2.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7453 1.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9907 2.6195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2453 1.3286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9906 2.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2360 3.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9813 5.2283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 3.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2453 1.3393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2546 -1.2588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5092 -2.5605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0092 -2.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2639 -3.8676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0185 -5.1639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7546 -1.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5092 -2.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9040 -3.9222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0223 -4.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3187 -4.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0015 -2.7012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0012 -1.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6416 2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3416 2.3538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -2.3227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4679 -1.9964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -3.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5507 -3.1890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6037 -1.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9127 1.8622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9071 3.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6360 4.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0227 4.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5776 6.2697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 5.8246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7317 5.1212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 3.9170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7403 2.7213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8738 -0.3822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1062 -0.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6383 -2.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3051 -3.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1113 -1.9746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8801 -2.1595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9815 -5.7676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6223 -6.2010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0556 -4.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5420 -0.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8807 -0.8389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7311 -4.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9012 -6.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4167 -4.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8959 -2.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8010 -0.6882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1066 -0.7831 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 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 28 29 2 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 M END