MMs00865786 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 -0.7526 1.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2526 1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7474 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1894 1.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3841 1.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8098 0.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0251 1.6154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8067 -0.7638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3792 -1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0185 -1.6479 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.1343 -2.8597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9026 -0.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2302 -2.5321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0704 -4.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2821 -4.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6537 -4.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8135 -2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6018 -1.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1850 -2.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3449 -0.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.3968 -3.0857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.7683 -2.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9801 -3.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4076 -2.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2868 -4.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4027 -5.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9770 -4.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1547 2.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8547 2.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8453 -2.3440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1453 -2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3461 1.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8744 2.2979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3388 -1.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8651 -2.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9731 -4.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1543 -6.1008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6231 -5.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7296 -0.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2689 -4.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0993 -1.4821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6332 -1.6465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7807 -1.7613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.4868 -4.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7712 -6.4709 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 M END