MMs01812596 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 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 1.0611 -1.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6734 -2.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5098 -0.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0468 0.7292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5448 0.6513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9336 -0.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6759 -1.6149 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3342 -1.3344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4995 -0.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2643 1.0914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9001 -0.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0654 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4660 -0.5195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7013 -2.0010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6314 0.4249 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0320 -0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2672 -1.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6678 -2.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8331 -1.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3148 -1.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9952 -0.0833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1214 2.1622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9341 0.9769 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5979 0.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1973 0.8324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8482 0.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8489 0.8482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8482 -0.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -1.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4858 -2.1992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3633 -3.6685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8327 -2.8194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5224 -2.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2825 -1.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8061 -1.7139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1595 0.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6831 1.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4432 1.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3349 -2.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8560 -3.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8600 -2.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0091 2.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 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 39 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 M END