MMs00741593 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 0.7425 -1.3034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2424 -1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9849 -2.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4849 -2.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2273 -3.9275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4698 -5.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9698 -5.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2274 -3.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7274 -3.9014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0151 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0301 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5301 -5.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2726 -3.8840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2876 -6.4820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7876 -6.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6622 -5.2547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0915 -5.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1002 -7.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6763 -7.6817 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.3188 -8.0846 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0427 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 -0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0909 -1.5884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4273 -3.9344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0638 -6.2648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3638 -6.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0951 -5.6130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2453 -6.3766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6937 -7.5247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0582 -4.9990 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 12 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END