MMs02509279 MOE2007 2D CORINA 3.40 0006 02.08.2006 76 77 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 1.5000 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2598 1.2820 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0598 1.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5196 2.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7597 1.2706 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1597 2.3098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5195 2.5639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0195 2.5526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7596 1.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7793 3.8459 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6202 4.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1796 5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3019 6.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5952 5.4562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2675 2.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7370 3.1699 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8961 3.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2113 4.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6809 4.8937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6761 3.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1456 4.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6199 5.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6247 6.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1552 6.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7322 2.0476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2579 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 0.3238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2531 -0.4977 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0940 -0.8083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7227 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7179 -1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1875 -1.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2436 -2.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2826 -1.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6244 -0.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5634 3.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9275 3.6304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4759 1.9945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9274 3.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1358 4.6287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4816 6.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4162 7.0257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0145 7.1815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0916 6.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1644 5.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7086 1.7531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 2.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6178 4.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1785 5.7925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2966 2.6330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9418 3.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7956 5.7358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 7.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3590 7.2145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9079 2.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2816 0.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7451 0.4312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5664 -2.1678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4281 -2.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3631 -0.7779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9469 0.1571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1052 -2.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8642 -3.8807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3820 -3.1217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6032 -2.1614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7401 -1.3274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2722 3.9914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7788 -1.9208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5750 -2.8186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3322 -2.3711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 72 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 73 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 17 73 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 73 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 74 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 71 74 1 0 0 0 0 72 76 1 0 0 0 0 74 75 1 0 0 0 0 M END