MMs01517435 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 0.7601 -1.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 -1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0202 -2.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2803 -3.8794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7804 -3.8911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0203 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4797 -2.6097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2195 -3.9146 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9147 -4.6544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5244 -3.1747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9594 -5.2194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1992 -6.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9391 -7.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -7.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1992 -6.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4593 -5.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6991 -6.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1789 -9.1340 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0405 -5.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3006 -6.4774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5404 -5.1609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3005 -6.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0345 0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6081 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 -0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8519 -0.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2201 -2.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1885 -4.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0878 -1.5752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9993 -6.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -8.8519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0674 -4.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7085 -5.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8991 -6.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6897 -7.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -7.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9086 -7.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -5.8459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END