MMs01459748 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 -0.8566 -1.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2184 -2.5889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9416 -3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0848 -4.9969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4423 -4.3588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2549 -2.8705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3487 -1.8442 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7845 -2.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8784 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5365 0.2086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3142 -1.6860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4081 -0.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8439 -1.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1858 -2.5543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9378 -0.0674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3736 -0.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4674 0.5248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9032 0.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2452 -1.3698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1513 -2.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7155 -1.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6810 -1.8039 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4299 -4.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6263 -5.1229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8137 -3.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4562 -2.9966 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9851 -0.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6853 0.9851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9851 0.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7077 -0.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8374 -1.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2431 -3.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7451 -2.9975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5878 -2.8545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4475 0.0595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9496 0.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6642 1.1010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1939 1.6932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7783 0.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4248 -3.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8404 -2.7832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6425 -6.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5014 -5.9440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8651 -3.0562 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 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 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 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 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 22 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 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 M END