MMs01866931 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2961 -0.7550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2903 -2.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5864 -3.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8884 -2.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 -0.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0202 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4922 -0.7752 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7372 -2.0713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2473 0.5209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7883 -1.5302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0903 -0.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3864 -1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 -3.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0786 -3.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7825 -3.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6767 -3.7953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9786 -3.0504 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.2337 -1.7485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7236 -4.3523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2806 -2.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4432 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9116 -0.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6565 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6485 -2.9209 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.1477 -1.9726 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 0.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2487 -2.8510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5818 -4.2101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9252 -2.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 1.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2008 1.1798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0949 0.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -0.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0740 -4.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -3.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6720 -4.9953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5545 -0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4039 0.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END