MMs01158721 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.3023 0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 0.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4984 0.7213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5051 2.2213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0344 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7549 -0.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -1.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0833 -2.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3856 -1.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 0.7099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6945 0.6984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0622 0.0823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0708 1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3265 2.4949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8579 2.1895 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5618 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4489 2.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8448 3.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7318 4.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2229 4.6580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8270 3.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9399 2.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1099 5.8677 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 -0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5954 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2631 1.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5089 2.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3142 3.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 2.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8227 -0.9273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3653 -0.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1331 1.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6758 1.6486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1908 -1.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6067 -1.3208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3721 -2.6602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3079 -3.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8505 -3.2127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 -2.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5683 -1.3427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3292 1.6325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8719 1.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2260 -0.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6381 0.4984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6519 3.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2486 5.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0198 3.1544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4232 0.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 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 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 M END