MMs01405338 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 38 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 -1.5000 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4907 2.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0093 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7546 1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2546 1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2453 -1.3178 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -0.5725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9436 -2.0632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9907 -2.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4906 -2.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2360 -3.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4813 -5.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9814 -5.2176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 -3.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2267 -6.5247 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7453 1.3125 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 -0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 2.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2453 1.3178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1037 -1.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 3.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 3.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0505 2.4735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3837 1.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8709 -0.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2041 -1.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1037 1.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0944 -1.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4360 -3.9309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -3.9116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8416 2.3592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 0.2808 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END