MMs00727076 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 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2415 1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 2.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2245 3.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7244 3.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4829 2.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7414 1.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9829 2.6373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7414 1.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0393 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2413 1.3530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -1.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2413 1.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7412 1.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4997 0.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7582 -1.2156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2583 -1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5167 -2.5097 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4659 5.2255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 -1.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6303 -0.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 2.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6177 4.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3482 0.2883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5761 3.6804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8345 2.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6345 2.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3344 2.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6997 0.0962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6651 -2.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8591 6.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 22 37 1 0 0 0 0 M END