MMs01063747 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 -0.7523 -1.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 -1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0046 -2.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4954 -2.6008 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0080 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5027 -1.4920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4973 1.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7523 -1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2523 -1.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2477 1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7477 1.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2494 2.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6208 1.8226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4666 0.3306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3599 -0.4708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8327 2.7065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6733 4.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3019 4.8056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0899 3.9218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6019 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2046 -2.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8588 -4.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1588 -4.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3981 1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1542 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8542 -2.3225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1458 2.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3607 1.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9856 3.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8705 4.1164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9615 5.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9711 5.8017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4372 5.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 3.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5619 4.9994 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 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 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END