MMs02883235 MOE2007 2D CORINA 3.40 0006 02.08.2006 75 78 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 0.0076 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0317 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2877 -2.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5905 -1.5131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8857 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8782 -3.7696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1885 -1.5262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4838 -2.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7866 -1.5393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 -2.2434 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4618 -3.0919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4747 -3.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9435 -4.0389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6869 -2.7361 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2869 -3.7753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6776 -1.6264 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1339 -0.1975 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4445 0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5995 0.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6089 -0.9879 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9194 0.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1525 -2.4168 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1618 -3.5264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6275 -3.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0838 -1.7783 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9323 -2.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0745 -0.6686 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5308 0.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9964 1.0795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0057 -0.0301 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3163 1.1290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5494 -1.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4714 0.2892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2788 -0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5401 -0.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6182 -2.0975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1246 0.9121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4897 2.0553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5754 -0.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0061 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5117 -3.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0544 -3.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8238 -0.5900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3664 -0.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1946 -0.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7078 -3.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2505 -3.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2747 -3.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3553 -4.9284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5784 -5.1820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0422 -4.5214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1444 1.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 0.7628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1474 -4.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -4.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6754 -4.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8166 -3.3682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3417 0.9213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4829 1.9593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5413 2.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0109 1.7206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5973 -2.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7386 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7955 -1.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1264 -0.2217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2847 0.8231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0219 -2.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 0.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6937 0.2050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7615 -1.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0818 -2.2958 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 10 11 2 0 0 0 0 10 75 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 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 34 1 0 0 0 0 29 30 1 0 0 0 0 29 37 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 35 36 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 39 40 1 0 0 0 0 41 72 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 M CHG 1 75 -1 M END