MMs00086070 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 29 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 0.0083 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0475 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2866 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5898 -1.5143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9567 -2.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4124 -3.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4026 -4.6702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8779 -3.8810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2424 -5.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8877 -2.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3532 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -1.3427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9665 -1.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2237 0.2804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7548 -0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6456 0.9864 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.4418 -0.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3114 -2.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5102 -3.1721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0529 -3.1806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5545 0.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2497 0.6538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3292 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -3.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 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 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M END