MMs00247448 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 1.2964 0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 0.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 2.2732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1854 3.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8891 2.2639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5874 3.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 4.5092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 2.2546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0107 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3071 2.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6088 2.9907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9051 2.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8998 0.7361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3017 0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0185 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7835 3.0278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 2.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0905 0.7825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3815 3.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7540 2.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7537 3.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9991 4.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 4.5294 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6037 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 -0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 -1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 -1.1814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5338 0.1769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1811 4.2185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7574 3.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7853 3.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6131 4.1907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9465 2.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5938 -1.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 0.4472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7792 4.2278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0077 1.2590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9476 3.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4833 5.9445 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 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 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 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 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 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 M END