MMs01432874 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 0.7431 -1.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 -1.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9862 -2.6139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4862 -2.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -1.3268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 -1.3348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4861 -2.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7293 -3.9328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9861 -2.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7292 -3.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2292 -3.9566 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9861 -2.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2430 -1.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4998 -0.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2429 -1.3745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4861 -2.6695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2567 1.2236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7567 1.2156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9723 -5.2596 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6693 -6.0027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2753 -4.5165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7154 -6.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2154 -6.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9585 -7.8735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2017 -9.1686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7017 -9.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9586 -7.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9448 -10.4557 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0424 0.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5945 1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0424 -0.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3867 -1.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9452 -2.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3807 -3.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0807 -3.6643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1054 1.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4055 1.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3485 -0.2987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 -1.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1159 -2.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5994 -4.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9314 -5.1315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0430 -1.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4053 0.9789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4429 -1.3808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0805 -3.7119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7503 0.0157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9566 1.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7630 2.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8209 -5.5345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1585 -7.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7962 -10.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7586 -7.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 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 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 57 1 0 0 0 0 M END