MMs00383388 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 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 1.3028 0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 2.2434 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3497 1.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0152 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0228 4.4999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2878 5.6591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4014 4.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2892 3.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4137 2.5437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7892 3.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 2.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1012 3.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0936 4.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6647 4.9872 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3256 5.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3332 6.7433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6361 7.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9313 6.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9237 5.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6209 4.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 2.9868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6437 8.9867 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 -0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3028 -0.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9928 -1.0493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6342 -0.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9078 6.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4376 5.5760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 1.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0756 2.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0609 5.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2971 7.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9735 7.3249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9599 4.6249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END