MMs03068453 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.4999 -0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7606 1.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7391 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2392 -1.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0497 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3998 -1.0890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -1.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9783 -2.6477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7175 -3.9529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2174 -3.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9782 -2.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2389 -1.3674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 -0.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2604 1.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7603 1.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5211 2.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7819 3.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2819 3.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5212 2.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2536 1.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5776 2.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 3.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1618 2.6184 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8512 3.7775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6972 2.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6843 1.8360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0099 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0099 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6693 2.3245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3692 2.3021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3305 -2.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6306 -2.3519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7783 -2.6378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1089 -4.9872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8088 -5.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1781 -2.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2815 -1.2670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6238 -0.5068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3517 0.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7210 2.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3905 4.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6906 4.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9212 2.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4459 1.2521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2436 0.1875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1467 2.6619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0747 3.9442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9982 4.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3997 4.4231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7605 1.2430 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3605 0.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2455 4.3728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0739 4.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 55 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 55 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 55 1 M END