MMs00889078 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -0.7586 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2585 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2414 -1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7242 -3.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2242 -3.9119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0343 -5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5343 -5.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0072 -6.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7996 -7.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4198 -6.6257 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2757 -3.8822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5171 -2.5881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 -1.2841 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7585 -1.2742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7413 1.3238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8735 1.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3031 0.8049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 -0.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8895 -1.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0171 2.5782 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1654 2.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1999 -0.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8345 -2.3570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1509 -6.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8075 -8.6993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5579 -2.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8888 -1.6772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8303 1.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3543 2.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5449 1.9803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4974 0.6873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5056 -0.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5703 -1.8672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8543 -1.7749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3849 -2.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 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 25 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END