MMs01149253 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 -0.0123 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2805 -2.2606 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2805 -1.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5857 -1.5213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2682 -3.7605 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5611 -4.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8662 -3.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0352 -2.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 -1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2443 -3.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2315 -4.4032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5313 -5.8729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -6.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0769 -5.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4997 -5.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7995 -7.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6766 -8.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2538 -7.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9764 -9.7628 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0369 -4.4998 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7024 -5.8050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7762 -3.1947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3421 -5.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6349 -4.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9401 -5.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9524 -6.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6595 -7.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3544 -6.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1923 -1.2819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -2.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1771 -2.5654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6298 -0.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9942 -0.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7822 -5.4341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3248 -5.4467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1501 -1.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 -0.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4366 -3.4320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3317 -5.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3545 -7.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8371 -4.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3980 -5.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9377 -7.6788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3555 -8.6135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6251 -3.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9743 -4.6093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9965 -7.3092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6694 -8.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3201 -7.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END