MMs00525590 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 36 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 1.3046 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9026 0.7211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9418 1.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9137 2.2211 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6202 2.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6313 4.4807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3157 2.2403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3418 -1.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8066 -1.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5662 -0.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 0.5615 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0591 -0.4149 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5869 -1.5192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8804 -2.2788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2824 -2.2596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2713 -3.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5647 -4.5191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5923 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 -0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5923 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9573 2.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2809 2.8480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4441 -2.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2866 -2.9539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2713 -4.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6256 -3.4562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0769 -5.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -5.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -5.5539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5995 -5.1268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1724 -3.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END