MMs01575146 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3040 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -0.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9121 -2.2238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0349 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5001 -0.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7840 1.5523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4799 2.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0779 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0679 3.8110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3820 1.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6760 2.3285 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9800 1.5872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3462 2.2065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2605 -0.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3574 1.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6161 -0.2055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1468 0.0965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8481 1.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5893 2.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0586 2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2254 0.7767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8592 0.1574 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5389 -1.6657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0815 -1.6553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7349 -1.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2776 -1.6204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 -1.0725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9744 0.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2451 3.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7024 3.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0056 1.3186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 2.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6168 0.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1595 0.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0939 3.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9450 3.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2686 0.1837 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END