MMs01413942 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 0.7477 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5046 -2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 -1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 -1.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8795 -3.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5102 -3.7084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2628 -4.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -0.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2604 -1.0597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9498 0.0994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4724 -0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4697 1.3241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6874 -1.0554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2264 -2.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1102 -3.6948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7264 -2.4855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1132 -0.5894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2297 -1.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9204 -3.0589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6555 -1.1251 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9647 0.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3905 0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6998 2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1256 2.7425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.3406 1.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5526 2.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0866 4.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5866 4.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7028 5.3819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9477 -1.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 -3.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0982 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9198 -3.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8861 0.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3945 0.4618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0228 -3.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 0.4691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0575 0.1511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5486 -1.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7654 0.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7956 1.5307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5596 -0.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5899 0.7689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5005 2.3162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5307 3.4645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5393 0.9698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1452 0.9726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1544 1.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.6480 3.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.2599 4.4241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9590 5.3658 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 M END