MMs00468490 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 64 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 1.3045 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3156 2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 0.7212 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9025 -0.4788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1849 -1.5383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5005 0.7021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 0.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 -0.5171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6966 0.6637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7076 2.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7469 1.5637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4142 2.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1096 2.1828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0122 2.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3056 2.1445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0232 4.4040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3278 5.1444 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2885 5.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6212 4.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9258 5.1253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2192 4.3657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9368 6.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3388 6.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6434 7.3848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5923 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 -0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5923 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2653 1.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5156 2.2315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3245 3.4403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1156 2.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8199 -0.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -0.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5094 1.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0159 -0.9710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5586 -0.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6139 -0.9902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1566 -1.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0987 -0.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8798 0.8634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1923 3.8368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6496 3.8482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9263 1.9832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7075 3.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9885 5.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8431 3.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3858 3.4599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9650 5.7253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6116 3.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2540 3.7580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8269 5.4005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1368 6.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9457 7.8252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7369 6.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9572 2.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0454 7.4040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9136 2.2212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8788 2.8288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0542 8.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 62 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 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 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 27 1 0 0 0 0 25 53 1 0 0 0 0 26 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 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 61 1 0 0 0 0 60 62 1 0 0 0 0 61 64 1 0 0 0 0 62 63 1 0 0 0 0 M END