MMs03318979 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 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 1.2942 -0.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2846 -2.2583 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2846 -3.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 -2.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1768 -3.0332 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1768 -1.8332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4807 -2.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7749 -3.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0787 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0883 -0.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6863 -0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6767 -2.3248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3729 -3.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2843 -0.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2747 -2.3414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 -0.0998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8824 -0.8581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8728 -2.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1670 -3.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4708 -2.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4804 -0.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1862 -0.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1672 -4.5332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7118 0.3667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4746 -0.9742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 -1.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0622 -3.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5741 -4.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6598 -1.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1172 -1.3507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7152 -1.3673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 -1.3772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0529 -0.2015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3998 1.1335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7121 -2.9314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3652 -4.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9978 1.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5958 1.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8824 0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6923 -2.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4551 -3.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3898 -4.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9324 -4.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8740 -3.5049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6539 -2.1738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6608 -1.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8980 0.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4207 0.8078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9634 0.7979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2026 -5.1398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 -3.0166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5711 -4.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 58 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 58 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 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 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 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 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 58 59 1 0 0 0 0 M END