MMs01185243 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3031 0.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3111 2.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0140 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9011 0.7290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 2.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4991 0.7150 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4991 -0.4850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5072 2.2150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9429 -1.5346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4084 -1.8543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1514 -3.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6514 -3.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4084 -1.8705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6654 -0.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1654 -0.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1677 0.5608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4875 2.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9165 2.4821 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0680 3.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3877 3.9062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8877 3.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3435 2.4690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1253 1.5939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3944 -4.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6374 -5.7635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5944 1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0424 -0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5944 -1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2638 1.3430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5111 2.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3176 3.4430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1112 2.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5916 -1.2140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1896 -1.2280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7072 2.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5137 3.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3072 2.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5458 -4.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6083 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 0.4686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2884 2.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3269 3.2155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2153 4.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5196 5.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7687 5.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0628 4.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4424 2.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9379 1.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8943 -4.4766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4887 -5.5191 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 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 52 53 1 0 0 0 0 M END